A0A3Q0KNN1_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KNN1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,657 aa.

						>A0A3Q0KNN1_SCHMA|A0A3Q0KNN1
MVVKNMKMYIKCKVCLCIGLFFCICIVNSIVSNELLEIYNLPKFIMEPIDRIYYSSNQSQFIPKFHLYALITPRNATIQLGAIHKDKPNMIIYIPTVHEYSTELYSMTFAQTHAKIQSLTIHENLAHLNYLISYISNINNNINIKENINLWLISVYNFLPDMKLLILATTNYGTVSSHLIDLKTSVLPAFPPHSDKYLSLLIGNTAVVICHLPLSQPSLPTVHFYHNNIKLDLTQTDRYRLIYIGGDDSGLPWEIYSQKPHFRQENFKKHKPGAVILLIHSLQLSDTGQYYCSVSLFDKTISSNQRTHLVVTKPNEKIWTHLKFSLDDPDLSYLYNNNNNNGNNNNNENSLNRIKEIKINENTNLTLFCIFESAPVVSTRWYYKDEFMENIEINQKFGVLIIKYARPENEGIYTCSVDNSHSKLIGKSFRIIVIRAPTTNLLNPKLITTEIGKQVTLNCNNNNNNNVINMNQIPFPKLPTPDEWNKWDYNKRINHSKYYIEKQYKKKKLNYSPYINQWIHNGQFITMNDDNNNYHFEDGLLKILKIEQSHTGIYQYMKSNQYTNSMDDNTNENEYDEESVNCKFYIQLNDEKFVHNETDQQLKTIFEHTSEGLTGHLNCNLSSLLLTESYQNTNQVNNQYQWSILWYRSVTSNEPLNIESVNKASGGIKYIISNVNEYTQILSIVNPRKITDDGQYICRVYNTTTGKLLGEQRFQLIIESINNDENIHKNFIKHETFLTKSSLSSISSEIPNKYELPSKRNEQNLVLKQTEKPQIKVSRPIVKRLANFTMAVHIKWTVYHSPIKELHYQLGIKHLGNIRQTKSIITFSNEYIHSRNKSNGEEFSILPNIYDNSSIIFDSRDLFQPQNSYSLRVLVLEHQLWSPWTEPVNFDNMLDTNLQIISIVTSNQTCLYIEWIYIQSRNHSFTTMNITDFNDLTFNIIYRNLSENLNERKSLLELWTEFIFNNEKQFSMDLSQMNQLGDLYIRRINGDHTLKGYLLDGLQPNVTYAVSVYIEVTKIYHYQSQKYFTRLSNEVVQKTLPKLISLSINENQFFVKNSTNENINQLMMVDSFVQSTSNMKSKMTGQVGNNKNDLTSKLTKNYQHDSYVLIVILGSLAGVLLIIFIVLITFCIWYRLHLKSQYPRGYFGGLNDSQLTETPKQRTITEWENFQTQPITTTDNHQTFPRTAGNLHLQSLSDQQNLITDINNFATLQHPTQWIQQSQIPCERKCRNSMVLDETLKTYWPIINSNDAKVTFMKNHNHGNIKHGSPLLPIYKDYLLKQAKHQSINGTLSDGQGENQFGSLDGIFQDITVGEQFNGANKLSNKDIQLTNDQSSSIYSHIDSDSTVNELSQFHLNRFNSTLSPTTLSDYSGIGKNILNSLQNNNNNNMNNRKEILRDLSQPTSLSYVANSIYPFMIKPDDLVSLPLIGNQDPIQYSIQSGLITSDTNSFYTTVPPLRHLQYPFNGNLPMNSLDQNALNQLKMSVNHQYNDETIIQQSDLIKNLQLFNRNQGFYGSNPLNYISTPLSTYADSLTATLTLQQWIEHMSKPELTKNIDIKLSKEGYKKIDSRSNLKQYDLQLNKTEQQNICNENKRHHKSPRENLSSSFADSGVDLPNTSNLESDIIEHNLNKNDSPIEIRTRISNIIRPIERVSSGP
					

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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	27.5	Very low	27.2	Very low	239 Å²	239	170.1 Å²	170.1	100%	1.177	83%	0.825	S	S	*	*				0	142.4	0	-84.3	157.3	131.4	0	0	109.3
2	V	30	Very low	26.9	Very low	133 Å²	133	165.4 Å²	165.4	81%	0.806	82%	0.821	S	S	*	*			trans	34.9	97.3	153.9	-166.4	0	0	0	0	118.9
3	V	24.2	Very low	26.8	Very low	146 Å²	146	167.5 Å²	167.5	89%	0.885	82%	0.822	S	S	*	*			trans	-114.8	120.5	138.4	172.1	0	0	0	0	106.7
4	K	33.3	Very low	27	Very low	173 Å²	173	165.6 Å²	165.6	75%	0.752	83%	0.825	S	S	*	*			trans	-156.3	147.3	169.8	-78.1	-158.2	173	179.3	0	108.6
5	N	31.6	Very low	27	Very low	144 Å²	144	161.7 Å²	161.7	77%	0.77	82%	0.817	S	S	*	*			cis	-148.5	166	0.4	-124.8	13.1	0	0	0	111
6	M	24.1	Very low	27.1	Very low	152 Å²	152	161 Å²	161	75%	0.749	82%	0.816	S	S	*	*			trans	-145.6	157.2	-174.5	-154.6	-155.6	-170	0	0	112.1
7	K	27.4	Very low	27.2	Very low	166 Å²	166	157.4 Å²	157.4	72%	0.722	81%	0.807	S	S	*	*			trans	73.6	118.4	159.8	-77.9	165.4	177	169.1	0	121
8	M	22.7	Very low	27.5	Very low	150 Å²	150	157.2 Å²	157.2	74%	0.739	81%	0.806	S	S	*	*				36.5	138.9	120.2	-78.4	-178.9	154	0	0	121.8
9	Y	27.2	Very low	27.6	Very low	221 Å²	221	152.5 Å²	152.5	87%	0.867	80%	0.801	S	S	*	*				-163.4	172.9	99.7	-118	-85.2	0	0	0	113.3
10	I	25.1	Very low	27.8	Very low	134 Å²	134	152.4 Å²	152.4	69%	0.687	80%	0.8	S	S	*	*			trans	-123	138.1	-167.4	-62.9	163	0	0	0	112
11	K	26.3	Very low	27.8	Very low	213 Å²	213	153.3 Å²	153.3	93%	0.926	80%	0.798	S	S	*	*			trans	-169.1	174.5	144.7	-107.9	163.7	-174.6	179.3	0	112.1
12	C	24	Very low	27.9	Very low	114 Å²	114	151 Å²	151	77%	0.77	78%	0.782	S	S	*	*			trans	-150.2	155.8	-148.5	-170.4	0	0	0	0	116.2
13	K	25	Very low	27.6	Very low	193 Å²	193	149.5 Å²	149.5	84%	0.839	78%	0.776	S	S	*	*			trans	87.3	154.1	153.2	-104.7	176.4	-178.1	-178.1	0	122
14	V	29.4	Very low	27.7	Very low	141 Å²	141	149.8 Å²	149.8	86%	0.855	77%	0.771	S	S	*	*			trans	85.1	141.4	167.8	-169.1	0	0	0	0	117.9
15	C	27.2	Very low	27.4	Very low	106 Å²	106	146.6 Å²	146.6	72%	0.716	77%	0.769	S	S	*	*				-171.2	167.8	-50.5	-138.1	0	0	0	0	112.1
16	L	29.1	Very low	27	Very low	151 Å²	151	146.3 Å²	146.3	79%	0.791	77%	0.766	S	S	*	*			trans	64.2	151.6	174.5	-75.9	73.8	0	0	0	115.2
17	C	28.9	Very low	27.2	Very low	100 Å²	100	144.7 Å²	144.7	68%	0.676	77%	0.765	S	S	*	*			cis	-167.7	167.4	-8.4	-104.5	0	0	0	0	107
18	I	32.2	Very low	27	Very low	154 Å²	154	143.2 Å²	143.2	79%	0.79	76%	0.764	S	S	*	*			cis	-154.6	138.4	-8.3	-125	161.3	0	0	0	107
19	G	29.9	Very low	27.1	Very low	68 Å²	68	140.4 Å²	140.4	70%	0.701	76%	0.76	S	S	*	*				114.7	151.3	106.6	0	0	0	0	0	111.7
20	L	30.2	Very low	27	Very low	149 Å²	149	137.7 Å²	137.7	78%	0.78	76%	0.758	S	S	*	*			cis	-155.6	156.4	-4.5	-110.1	170.6	0	0	0	109.9
21	F	28.4	Very low	27	Very low	172 Å²	172	136.3 Å²	136.3	75%	0.754	76%	0.756	S	S	*	*			trans	51.3	101.1	169.5	-72.8	-75	0	0	0	120.2
22	F	29.8	Very low	27	Very low	192 Å²	192	129.6 Å²	129.6	84%	0.842	74%	0.736	S	S	*	*				-161.2	168.9	93	-118.7	-90.3	0	0	0	110.9
23	C	24.8	Very low	27.1	Very low	101 Å²	101	131.8 Å²	131.8	68%	0.682	74%	0.74	S	S	*	*			trans	-75.6	136.4	-157	-59.1	0	0	0	0	116.4
24	I	24.6	Very low	27.1	Very low	152 Å²	152	131.2 Å²	131.2	78%	0.779	74%	0.74	S	S	*	*			trans	-85.9	113.7	154.3	-65.7	173.7	0	0	0	107.9	I26	I24-I26 HydrophobicContact CG2-CD1 4.29Å; I24-I26 HydrophobicContact CG2-CG1 3.9Å
25	C	26.9	Very low	26.9	Very low	106 Å²	106	131 Å²	131	72%	0.716	73%	0.734	S	S	*	*			trans	-101.4	83.8	168.2	-71.9	0	0	0	0	110.1	V27	C25-V27 HydrophobicContact CB-CG2 4.46Å; C25-V27 PolarHBondContact O-N 3.39Å; C25-V27 VanDerWaalsContact O-N 3.12Å
26	I	24	Very low	26.9	Very low	137 Å²	137	133.2 Å²	133.2	70%	0.703	74%	0.738	S	S	*	*			trans	-70.7	101.5	157.7	-66.9	169.1	0	0	0	105.9	I24 N28	I24-I26 HydrophobicContact CG2-CD1 4.29Å; I24-I26 HydrophobicContact CG2-CG1 3.9Å; I26-N28 VanDerWaalsContact C-N 3.25Å; I26-N28 PolarHBondContact O-N 3.42Å
27	V	28.3	Very low	26.8	Very low	119 Å²	119	134.5 Å²	134.5	72%	0.721	74%	0.74	S	S	*	*			trans	-75.8	83.9	176.6	-176.4	0	0	0	0	108.7	C25 S29	C25-V27 HydrophobicContact CB-CG2 4.46Å; C25-V27 PolarHBondContact O-N 3.39Å; C25-V27 VanDerWaalsContact O-N 3.12Å; V27-S29 PolarHBondContact O-N 3.27Å
28	N	23.4	Very low	26.7	Very low	134 Å²	134	136.2 Å²	136.2	72%	0.717	74%	0.74	S	S	*	*			trans	-62.1	88.2	154.1	-83.5	-14.6	0	0	0	107.5	I26 I30	I26-N28 VanDerWaalsContact C-N 3.25Å; I26-N28 PolarHBondContact O-N 3.42Å; N28-I30 VanDerWaalsContact C-N 3.28Å; N28-I30 PolarHBondContact O-N 2.95Å
29	S	24.3	Very low	26.6	Very low	92 Å²	92	136 Å²	136	64%	0.643	73%	0.731	S	S	*	*			trans	-73.9	88.2	171.6	-159.5	0	0	0	0	108.6	V27 V31	V27-S29 PolarHBondContact O-N 3.27Å; S29-V31 VanDerWaalsContact C-N 3.26Å; S29-V31 PolarHBondContact O-N 2.87Å; S29-V31 WeakPolarHBondContact OG-CG2 3.48Å
30	I	24.5	Very low	26.8	Very low	163 Å²	163	139.4 Å²	139.4	84%	0.836	73%	0.733	S	S	*	*			trans	-70.5	88.3	171.7	-59.2	174.6	0	0	0	107.2	N28	N28-I30 VanDerWaalsContact C-N 3.28Å; N28-I30 PolarHBondContact O-N 2.95Å
31	V	26.4	Very low	26.9	Very low	106 Å²	106	134.7 Å²	134.7	64%	0.642	71%	0.708	S	S	*	*			trans	-102.8	97.2	170.1	-176.8	0	0	0	0	107.7	S29 N33	S29-V31 VanDerWaalsContact C-N 3.26Å; S29-V31 PolarHBondContact O-N 2.87Å; S29-V31 WeakPolarHBondContact OG-CG2 3.48Å; V31-N33 PolarHBondContact O-N 3.03Å
32	S	26.2	Very low	27.2	Very low	72 Å²	72	127.3 Å²	127.3	50%	0.503	68%	0.677	S	S	.	*			trans	5.2	99.4	164.1	55.5	0	0	0	0	116.2	E34	S32-E34 PolarHBondContact O-N 3.04Å
33	N	25.7	Very low	27.7	Very low	160 Å²	160	123.3 Å²	123.3	86%	0.856	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	31.2	178.9	-147.2	32.1	0	0	0	112.8	V31	V31-N33 PolarHBondContact O-N 3.03Å
34	E	24.8	Very low	28.8	Very low	180 Å²	180	120.2 Å²	120.2	84%	0.841	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.7	12.3	-168	-67.9	-177.7	127.7	0	0	113	S32	S32-E34 PolarHBondContact O-N 3.04Å
35	L	24.9	Very low	29.7	Very low	138 Å²	138	113.2 Å²	113.2	72%	0.723	60%	0.599	S	S	*	*			trans	-128.5	22.2	-178.5	-99.5	168.6	0	0	0	113.9
36	L	27.8	Very low	30.5	Very low	152 Å²	152	110.9 Å²	110.9	80%	0.796	58%	0.578	S	S	*	*			trans	-103.1	11.9	177.3	-138.9	77	0	0	0	114.8	I38	L36-I38 PolarHBondContact O-N 2.82Å
37	E	26.5	Very low	31.6	Very low	178 Å²	178	105.9 Å²	105.9	83%	0.832	55%	0.552	S	S	*	*			trans	-76	44.6	161.2	-66.7	-160.6	137.4	0	0	111.8	Y39	E37-Y39 WeakPolarHBondContact O-CD2 3.41Å; E37-Y39 PolarHBondContact O-N 3.19Å
38	I	27.9	Very low	32.6	Very low	135 Å²	135	100.5 Å²	100.5	69%	0.692	52%	0.519	S	S	*	.			trans	-78.2	96.2	168.2	-58.7	-178.4	0	0	0	106.6	L36	L36-I38 PolarHBondContact O-N 2.82Å
39	Y	30	Very low	34	Very low	150 Å²	150	96.3 Å²	96.3	59%	0.588	50%	0.497	S	S	*	.			trans	-34.6	149.3	-178.2	-74.8	-98.5	0	0	0	115.3	E37 L41 L446	E37-Y39 WeakPolarHBondContact O-CD2 3.41Å; E37-Y39 PolarHBondContact O-N 3.19Å; Y39-L41 PolarHBondContact O-N 3.45Å; Y39-L446 HydrophobicContact CD2-CD2 4.28Å; Y39-L446 HydrophobicContact CG-CD2 4.46Å
40	N	32.8	Very low	35.3	Very low	140 Å²	140	92.9 Å²	92.9	75%	0.749	47%	0.471	S	S	*	.			trans	-65.5	48.2	-179.8	-73.6	-50.9	0	0	0	115.2	P42 Y172	N40-P42 WeakPolarHBondContact O-CD 3.35Å; N40-Y172 WeakPolarHBondContact O-CE2 3.43Å; N40-Y172 PolarHBondContact O-OH 2.76Å
41	L	32.4	Very low	36.9	Very low	50 Å²	50	88.4 Å²	88.4	26%	0.262	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-64.2	121	164.1	-67.3	157.5	0	0	0	107.9	Y39 K43 L446 Y585	Y39-L41 PolarHBondContact O-N 3.45Å; L41-K43 PolarHBondContact O-N 3.01Å; L41-L446 HydrophobicContact CD1-CB 3.99Å; L41-L446 HydrophobicContact CD2-CB 4.41Å; L41-Y585 HydrophobicContact CD2-CD1 3.65Å; L41-Y585 HydrophobicContact CD2-CE1 4.43Å; L41-Y585 HydrophobicContact CD2-CG 4.22Å
42	P	35.6	Very low	38.7	Very low	16 Å²	16	84.6 Å²	84.6	10%	0.104	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-64.5	142.8	176.2	-19.1	31.4	0	0	0	110.7	N40 F44 P73 Y172	N40-P42 WeakPolarHBondContact O-CD 3.35Å; P42-F44 HydrophobicContact CB-CD1 4.3Å; P42-F44 HydrophobicContact CB-CD2 4.08Å; P42-F44 HydrophobicContact CB-CE1 3.95Å; P42-F44 HydrophobicContact CB-CE2 3.69Å; P42-F44 HydrophobicContact CB-CG 4.38Å; P42-F44 HydrophobicContact CB-CZ 3.63Å; P42-F44 HydrophobicContact CG-CE1 4.18Å; P42-F44 HydrophobicContact CG-CE2 3.9Å; P42-F44 HydrophobicContact CG-CZ 3.58Å; P42-F44 WeakPolarHBondContact O-CD2 3.24Å; P42-F44 WeakPolarHBondContact O-CE2 3.45Å; P42-P73 HydrophobicContact CB-CB 4.39Å; P42-P73 HydrophobicContact CB-CG 4.08Å; P42-P73 HydrophobicContact CG-CG 4Å; P42-Y172 HydrophobicContact CG-CD2 3.7Å; P42-Y172 HydrophobicContact CG-CE2 3.79Å
43	K	40.5	Very low	40.6	Very low	108 Å²	108	82.5 Å²	82.5	47%	0.47	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-63.5	150.6	147.9	-61.8	177.3	-177.4	178.9	0	106.3	L41 T72	L41-K43 PolarHBondContact O-N 3.01Å; K43-T72 VanDerWaalsContact C-OG1 3.23Å; K43-T72 CarbonylContact O-C 3.49Å; K43-T72 VanDerWaalsContact O-C 3.29Å; K43-T72 WeakPolarHBondContact O-CB 3.48Å; K43-T72 PolarHBondContact O-OG1 3.23Å
44	F	48.3	Very low	42.7	Very low	36 Å²	36	76.9 Å²	76.9	16%	0.158	37%	0.367	C	S	.	.			trans	-137.6	159.3	-171.8	-78.5	-73.3	0	0	0	111.5	P42 M46 T72 T170 V175 I553	P42-F44 HydrophobicContact CB-CD1 4.3Å; P42-F44 HydrophobicContact CB-CD2 4.08Å; P42-F44 HydrophobicContact CB-CE1 3.95Å; P42-F44 HydrophobicContact CB-CE2 3.69Å; P42-F44 HydrophobicContact CB-CG 4.38Å; P42-F44 HydrophobicContact CB-CZ 3.63Å; P42-F44 HydrophobicContact CG-CE1 4.18Å; P42-F44 HydrophobicContact CG-CE2 3.9Å; P42-F44 HydrophobicContact CG-CZ 3.58Å; P42-F44 WeakPolarHBondContact O-CD2 3.24Å; P42-F44 WeakPolarHBondContact O-CE2 3.45Å; F44-M46 PolarHBondContact O-N 3.28Å; F44-T72 VanDerWaalsContact CD1-O 3.26Å; F44-T72 WeakPolarHBondContact CD1-O 3.49Å; F44-T170 HydrophobicContact CE1-CG2 3.7Å; F44-T170 HydrophobicContact CZ-CG2 4.28Å; F44-V175 HydrophobicContact CB-CG1 4.32Å; F44-V175 HydrophobicContact CB-CG2 4.44Å; F44-V175 HydrophobicContact CD1-CB 4.15Å; F44-V175 HydrophobicContact CD1-CG2 3.58Å; F44-V175 HydrophobicContact CD2-CG2 3.9Å; F44-V175 HydrophobicContact CE1-CB 4.42Å; F44-V175 HydrophobicContact CE1-CG2 3.56Å; F44-V175 HydrophobicContact CE2-CG2 3.89Å; F44-V175 HydrophobicContact CG-CB 4.42Å; F44-V175 HydrophobicContact CG-CG1 4.48Å; F44-V175 HydrophobicContact CG-CG2 3.74Å; F44-V175 HydrophobicContact CZ-CG2 3.71Å; F44-I553 HydrophobicContact CE2-CD1 4.09Å; F44-I553 HydrophobicContact CZ-CD1 3.82Å
45	I	43.3	Very low	44.6	Very low	5 Å²	5	69.9 Å²	69.9	3%	0.026	34%	0.338	C	S	.	.			trans	-2.9	106	179.5	-45.2	179.7	0	0	0	113.8	E47 L70 I71 A168	I45-E47 PolarHBondContact O-N 2.94Å; I45-E47 VanDerWaalsContact O-N 3.1Å; I45-L70 WeakPolarHBondContact CA-O 3.48Å; I45-I71 HydrophobicContact CG1-CD1 4.33Å; I45-I71 HydrophobicContact CG1-CG1 4.25Å; I45-I71 HydrophobicContact CG1-CG2 4.44Å; I45-I71 HydrophobicContact CG2-CG1 4.46Å; I45-A168 HydrophobicContact CD1-CB 3.7Å; I45-A168 HydrophobicContact CG1-CB 3.93Å
46	M	42.8	Very low	46.3	Very low	58 Å²	58	66.2 Å²	66.2	29%	0.286	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-64	115.2	164.3	-149	169.5	87	0	0	106.9	F44 L70 L131 F262	F44-M46 PolarHBondContact O-N 3.28Å; M46-L70 HydrophobicContact CB-CB 3.93Å; M46-L70 HydrophobicContact CE-CD1 3.59Å; M46-L70 PolarHBondContact N-O 2.78Å; M46-L70 HydrophobicContact SD-CD1 4.29Å; M46-L131 HydrophobicContact CE-CD2 3.85Å; M46-F262 HydrophobicContact CE-CE1 4.03Å; M46-F262 HydrophobicContact CE-CZ 3.81Å
47	E	47.3	Very low	47.5	Very low	32 Å²	32	62.8 Å²	62.8	15%	0.15	31%	0.307	C	S	.	.			trans	-60.9	138.1	-157.8	-79.4	173.5	179.2	0	0	112.2	I45 H178 R263 K583	I45-E47 PolarHBondContact O-N 2.94Å; I45-E47 VanDerWaalsContact O-N 3.1Å; E47-H178 WeakPolarHBondContact CB-NE2 3.47Å; E47-H178 IonicContact OE2-CE1 2.62Å; E47-H178 PolarHBondContact OE2-CE1 3.05Å; E47-H178 IonicContact OE2-ND1 2.69Å; E47-R263 VanDerWaalsContact CD-NH2 3.3Å; E47-R263 IonicContact OE1-NH2 2.7Å; E47-R263 PolarHBondContact OE1-NH2 2.94Å; E47-R263 IonicContact OE2-CZ 3.23Å; E47-R263 IonicContact OE2-NE 3.47Å; E47-R263 PolarHBondContact OE2-NE 3.05Å; E47-R263 IonicContact OE2-NH2 3.8Å; E47-R263 PolarHBondContact OE2-NH2 3.01Å; E47-K583 IonicContact OE1-NZ 2.69Å; E47-K583 PolarHBondContact OE1-NZ 3.28Å
48	P	48.4	Very low	48.7	Very low	5 Å²	5	64.1 Å²	64.1	3%	0.032	31%	0.313	C	S	.	.			trans	-71.8	-172.7	-176	31	-35.3	0	0	0	111.7	D50 I166 H178 I180	P48-D50 PolarHBondContact O-N 2.87Å; P48-I166 HydrophobicContact CB-CD1 4.15Å; P48-I166 HydrophobicContact CG-CD1 4.06Å; P48-H178 VanDerWaalsContact C-NE2 3.29Å; P48-H178 PolarHBondContact O-NE2 2.95Å; P48-I180 HydrophobicContact CB-CD1 4.02Å; P48-I180 HydrophobicContact CG-CD1 3.71Å; P48-I180 HydrophobicContact CG-CG1 4.1Å
49	I	52.7	Low	49.7	Very low	47 Å²	47	61 Å²	61	24%	0.241	30%	0.303	C	S	.	.			trans	-73.1	118	176.8	-67.3	174.4	0	0	0	109.8	R51 I180 P260 H261	I49-R51 WeakPolarHBondContact CG2-O 3.3Å; I49-R51 PolarHBondContact O-N 2.81Å; I49-R51 VanDerWaalsContact O-N 3.12Å; I49-I180 WeakPolarHBondContact O-CG2 3.41Å; I49-P260 HydrophobicContact CD1-CB 4.35Å; I49-P260 HydrophobicContact CG1-CB 4.04Å; I49-H261 HydrophobicContact CG2-CB 4.23Å
50	D	53	Low	51.1	Low	19 Å²	19	58.8 Å²	58.8	10%	0.102	30%	0.298	C	S	.	.	S	Bend	trans	-55.2	-29.7	-179.7	-44	-24.6	0	0	0	113.9	P48 H178 I180 D181	P48-D50 PolarHBondContact O-N 2.87Å; D50-H178 IonicContact OD1-CE1 2.7Å; D50-H178 IonicContact OD1-ND1 3.24Å; D50-H178 IonicContact OD1-NE2 3.36Å; D50-H178 PolarHBondContact OD1-NE2 3.45Å; D50-I180 WeakPolarHBondContact O-CA 3.4Å; D50-D181 PolarHBondContact O-N 3.18Å
51	R	58	Low	52.3	Low	70 Å²	70	53.5 Å²	53.5	26%	0.264	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	117.9	-170.9	-56.9	-177.6	-172.5	165.7	8.7	112.4	I49 Y53 D181 E265	I49-R51 WeakPolarHBondContact CG2-O 3.3Å; I49-R51 PolarHBondContact O-N 2.81Å; I49-R51 VanDerWaalsContact O-N 3.12Å; R51-Y53 HydrophobicContact CB-CD2 4.32Å; R51-Y53 HydrophobicContact CB-CE2 3.62Å; R51-D181 CarbonylContact C-O 3.58Å; R51-D181 WeakPolarHBondContact CA-O 3.15Å; R51-D181 HydrophobicContact CG-CB 4.29Å; R51-E265 IonicContact NH2-OE1 2.74Å
52	I	64.2	Low	53.8	Low	25 Å²	25	51.5 Å²	51.5	13%	0.128	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.3	175.8	-57.4	175	0	0	0	109.4	F65 L67 I180 D181 L182 K183	I52-F65 HydrophobicContact CD1-CD2 3.64Å; I52-F65 HydrophobicContact CD1-CE2 3.46Å; I52-F65 VanDerWaalsContact CD1-CE2 3.46Å; I52-F65 HydrophobicContact CD1-CZ 4.22Å; I52-L67 HydrophobicContact CD1-CD1 4.12Å; I52-L67 HydrophobicContact CD1-CD2 3.99Å; I52-L67 HydrophobicContact CD1-CG 4.01Å; I52-I180 HydrophobicContact CD1-CG2 3.76Å; I52-I180 HydrophobicContact CG1-CG2 3.81Å; I52-D181 PolarHBondContact N-O 3.04Å; I52-L182 HydrophobicContact CB-CD2 3.84Å; I52-L182 HydrophobicContact CB-CG 4.07Å; I52-L182 HydrophobicContact CD1-CD2 4.15Å; I52-L182 HydrophobicContact CG2-CD2 3.9Å; I52-L182 CarbonylContact O-C 3.55Å; I52-L182 VanDerWaalsContact O-CA 3.32Å; I52-L182 WeakPolarHBondContact O-CA 3.04Å; I52-K183 PolarHBondContact O-N 3.03Å
53	Y	65.6	Low	54.9	Low	28 Å²	28	54.7 Å²	54.7	11%	0.11	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137.2	-179.4	-71.8	-99.5	0	0	0	112	R51 K183 Q216 P217	R51-Y53 HydrophobicContact CB-CD2 4.32Å; R51-Y53 HydrophobicContact CB-CE2 3.62Å; Y53-K183 VanDerWaalsContact CA-O 3.29Å; Y53-K183 WeakPolarHBondContact CA-O 3.3Å; Y53-K183 HydrophobicContact CD1-CB 3.82Å; Y53-K183 HydrophobicContact CE1-CB 3.65Å; Y53-K183 HydrophobicContact CE1-CD 4.27Å; Y53-Q216 HydrophobicContact CE1-CB 3.93Å; Y53-P217 HydrophobicContact CD1-CB 3.83Å; Y53-P217 HydrophobicContact CD1-CG 4.25Å; Y53-P217 HydrophobicContact CD2-CB 3.62Å; Y53-P217 HydrophobicContact CD2-CG 4.28Å; Y53-P217 HydrophobicContact CE1-CB 3.95Å; Y53-P217 HydrophobicContact CE2-CB 3.74Å; Y53-P217 HydrophobicContact CG-CB 3.64Å; Y53-P217 HydrophobicContact CG-CG 3.95Å
54	Y	69.2	Low	56.4	Low	42 Å²	42	54.2 Å²	54.2	17%	0.165	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	148.2	-174.5	74.1	-85.2	0	0	0	114	S56 I62 P160 K183 T184 S185	Y54-S56 PolarHBondContact O-N 3.19Å; Y54-I62 HydrophobicContact CD1-CD1 3.53Å; Y54-I62 HydrophobicContact CD1-CG1 4.02Å; Y54-I62 HydrophobicContact CD2-CD1 4.31Å; Y54-I62 HydrophobicContact CD2-CG1 3.86Å; Y54-I62 HydrophobicContact CE1-CD1 3.6Å; Y54-I62 HydrophobicContact CE1-CG1 4.06Å; Y54-I62 HydrophobicContact CE2-CD1 4.37Å; Y54-I62 HydrophobicContact CE2-CG1 3.9Å; Y54-I62 HydrophobicContact CG-CD1 3.91Å; Y54-I62 HydrophobicContact CG-CG1 3.92Å; Y54-P160 HydrophobicContact CE1-CB 4.12Å; Y54-P160 WeakPolarHBondContact OH-CB 3.34Å; Y54-K183 WeakPolarHBondContact CD1-O 3.44Å; Y54-K183 PolarHBondContact N-O 2.77Å; Y54-T184 HydrophobicContact CE1-CG2 4Å; Y54-T184 HydrophobicContact CE2-CG2 3.94Å; Y54-T184 VanDerWaalsContact CZ-CG2 3.49Å; Y54-T184 VanDerWaalsContact OH-CG2 3.28Å; Y54-T184 WeakPolarHBondContact OH-CG2 3.31Å; Y54-S185 PolarHBondContact O-N 3.38Å; Y54-S185 PolarHBondContact O-OG 2.97Å
55	S	65.8	Low	57.6	Low	33 Å²	33	53.3 Å²	53.3	23%	0.231	27%	0.273	C	S	.	.			trans	-69.3	123.3	177.8	-170.7	0	0	0	0	111	N57 D298	S55-N57 PolarHBondContact O-N 3.15Å; S55-N57 PolarHBondContact OG-ND2 3.02Å; S55-D298 PolarHBondContact OG-OD2 3.31Å
56	S	60.1	Low	59	Low	61 Å²	61	58.4 Å²	58.4	43%	0.427	30%	0.296	S	S	.	.			trans	-81.5	55.5	-175.2	-175.2	0	0	0	0	112.7	Y54 Q58	Y54-S56 PolarHBondContact O-N 3.19Å; S56-Q58 PolarHBondContact O-N 2.64Å
57	N	53.9	Low	60.4	Low	81 Å²	81	55.9 Å²	55.9	43%	0.433	28%	0.284	S	S	.	.			trans	-95.7	84.2	-177.7	-69.7	-13.7	0	0	0	111.7	S55 S59 D298	S55-N57 PolarHBondContact O-N 3.15Å; S55-N57 PolarHBondContact OG-ND2 3.02Å; N57-S59 PolarHBondContact O-N 2.77Å; N57-D298 PolarHBondContact ND2-OD2 3.15Å
58	Q	50.5	Low	61.4	Low	206 Å²	206	60.1 Å²	60.1	96%	0.963	30%	0.299	S	S	*	.	S	Bend	trans	60.2	-13.4	162.6	-62.8	-177	-13.8	0	0	119.5	S56	S56-Q58 PolarHBondContact O-N 2.64Å
59	S	49.2	Very low	62.3	Low	69 Å²	69	59.9 Å²	59.9	48%	0.483	30%	0.298	S	S	.	.			trans	-88.1	137	176.9	61.3	0	0	0	0	112.8	N57 F61	N57-S59 PolarHBondContact O-N 2.77Å; S59-F61 WeakPolarHBondContact CB-O 3.33Å; S59-F61 PolarHBondContact O-N 2.97Å; S59-F61 PolarHBondContact OG-O 3.36Å
60	Q	58.8	Low	62.8	Low	103 Å²	103	58.6 Å²	58.6	48%	0.481	29%	0.291	S	S	.	.	S	Bend	trans	-80	3	176.1	-69.9	171.1	-66.9	0	0	113.7	V766	Q60-V766 HydrophobicContact CB-CG1 3.77Å; Q60-V766 VanDerWaalsContact CD-CG1 3.43Å; Q60-V766 HydrophobicContact CG-CG1 4.2Å
61	F	59.1	Low	63.5	Low	30 Å²	30	57.7 Å²	57.7	13%	0.132	29%	0.287	C	S	.	.	S	Bend	trans	-136.1	148.2	178.1	-64.4	-97.6	0	0	0	108.6	S59 N157 F158 L159 L765 V766	S59-F61 WeakPolarHBondContact CB-O 3.33Å; S59-F61 PolarHBondContact O-N 2.97Å; S59-F61 PolarHBondContact OG-O 3.36Å; F61-N157 WeakPolarHBondContact CD1-O 3.5Å; F61-F158 WeakPolarHBondContact CA-O 3.43Å; F61-L159 HydrophobicContact CD1-CD2 3.91Å; F61-L159 HydrophobicContact CD1-CG 4.02Å; F61-L159 HydrophobicContact CE1-CD1 4.38Å; F61-L159 HydrophobicContact CE1-CD2 3.4Å; F61-L159 HydrophobicContact CE1-CG 3.63Å; F61-L159 HydrophobicContact CZ-CD2 3.81Å; F61-L159 HydrophobicContact CZ-CG 4.49Å; F61-L765 HydrophobicContact CD2-CD1 3.69Å; F61-L765 HydrophobicContact CD2-CG 3.78Å; F61-L765 HydrophobicContact CE2-CD1 4.01Å; F61-L765 HydrophobicContact CE2-CG 3.71Å; F61-L765 HydrophobicContact CG-CD1 4.33Å; F61-V766 HydrophobicContact CE2-CB 4.01Å; F61-V766 HydrophobicContact CE2-CG1 3.76Å; F61-V766 HydrophobicContact CE2-CG2 4.16Å; F61-V766 HydrophobicContact CZ-CG1 4.36Å; F61-V766 VanDerWaalsContact CZ-N 3.3Å
62	I	62.7	Low	63.5	Low	8 Å²	8	55.4 Å²	55.4	4%	0.041	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	114.7	172.7	-57.9	167.2	0	0	0	106.7	Y54 K64 F65 N157 F158 P160 L182	Y54-I62 HydrophobicContact CD1-CD1 3.53Å; Y54-I62 HydrophobicContact CD1-CG1 4.02Å; Y54-I62 HydrophobicContact CD2-CD1 4.31Å; Y54-I62 HydrophobicContact CD2-CG1 3.86Å; Y54-I62 HydrophobicContact CE1-CD1 3.6Å; Y54-I62 HydrophobicContact CE1-CG1 4.06Å; Y54-I62 HydrophobicContact CE2-CD1 4.37Å; Y54-I62 HydrophobicContact CE2-CG1 3.9Å; Y54-I62 HydrophobicContact CG-CD1 3.91Å; Y54-I62 HydrophobicContact CG-CG1 3.92Å; I62-K64 PolarHBondContact O-N 3.07Å; I62-F65 HydrophobicContact CG2-CD1 3.91Å; I62-N157 CarbonylContact O-C 3.58Å; I62-N157 VanDerWaalsContact O-CA 3.27Å; I62-N157 WeakPolarHBondContact O-CA 3.19Å; I62-N157 PolarHBondContact O-N 3.16Å; I62-N157 VanDerWaalsContact O-N 3.12Å; I62-F158 PolarHBondContact N-O 3.37Å; I62-F158 PolarHBondContact O-N 2.79Å; I62-P160 HydrophobicContact CD1-CB 4.37Å; I62-L182 HydrophobicContact CD1-CB 4.03Å; I62-L182 HydrophobicContact CD1-CD2 3.54Å; I62-L182 HydrophobicContact CD1-CG 4.33Å
63	P	58.9	Low	63.2	Low	83 Å²	83	55 Å²	55	54%	0.539	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	-40.4	-165.6	24.6	-33.8	0	0	0	112.6	Y156 N157	P63-Y156 WeakPolarHBondContact O-CA 3.34Å; P63-N157 PolarHBondContact O-N 2.77Å; P63-N157 VanDerWaalsContact O-N 3.08Å
64	K	73.5	Confident	63.1	Low	97 Å²	97	59.8 Å²	59.8	42%	0.422	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	141.1	176.4	-171.5	-176.5	179	-169.9	0	110.8	I62 H66 V155 Y156	I62-K64 PolarHBondContact O-N 3.07Å; K64-H66 VanDerWaalsContact CE-CE1 3.42Å; K64-H66 WeakPolarHBondContact CE-CE1 3.16Å; K64-H66 PolarHBondContact NZ-NE2 2.78Å; K64-V155 CarbonylContact C-O 3.58Å; K64-V155 VanDerWaalsContact CA-O 3.27Å; K64-V155 WeakPolarHBondContact CA-O 3.17Å; K64-Y156 HydrophobicContact CB-CD1 4.27Å; K64-Y156 HydrophobicContact CD-CD1 4.37Å; K64-Y156 HydrophobicContact CD-CE1 3.83Å; K64-Y156 HydrophobicContact CG-CD1 4Å; K64-Y156 HydrophobicContact CG-CE1 3.88Å
65	F	73	Confident	63	Low	18 Å²	18	63.4 Å²	63.4	8%	0.079	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	166.5	161.6	64.8	-94.1	0	0	0	111.5	I52 I62 L67 S154 V155 F158 L164 L182	I52-F65 HydrophobicContact CD1-CD2 3.64Å; I52-F65 HydrophobicContact CD1-CE2 3.46Å; I52-F65 VanDerWaalsContact CD1-CE2 3.46Å; I52-F65 HydrophobicContact CD1-CZ 4.22Å; I62-F65 HydrophobicContact CG2-CD1 3.91Å; F65-L67 HydrophobicContact CD2-CG 4.42Å; F65-L67 HydrophobicContact CE2-CD1 3.94Å; F65-L67 HydrophobicContact CE2-CG 4.25Å; F65-S154 WeakPolarHBondContact O-CA 3.48Å; F65-V155 HydrophobicContact CD1-CB 4.21Å; F65-V155 HydrophobicContact CD2-CB 4.25Å; F65-V155 HydrophobicContact CD2-CG2 4.4Å; F65-V155 HydrophobicContact CE1-CB 3.76Å; F65-V155 HydrophobicContact CE1-CG1 3.86Å; F65-V155 HydrophobicContact CE2-CB 3.81Å; F65-V155 HydrophobicContact CE2-CG2 3.73Å; F65-V155 HydrophobicContact CG-CB 4.45Å; F65-V155 HydrophobicContact CZ-CB 3.55Å; F65-V155 HydrophobicContact CZ-CG1 3.78Å; F65-V155 HydrophobicContact CZ-CG2 3.81Å; F65-V155 PolarHBondContact N-O 3.14Å; F65-V155 PolarHBondContact O-N 2.93Å; F65-F158 HydrophobicContact CE1-CB 3.76Å; F65-F158 HydrophobicContact CE1-CD1 4.3Å; F65-F158 HydrophobicContact CE1-CG 4.05Å; F65-F158 HydrophobicContact CZ-CG 4.45Å; F65-L164 HydrophobicContact CE2-CD2 4.13Å; F65-L164 HydrophobicContact CZ-CD2 4.15Å; F65-L182 HydrophobicContact CD1-CD2 4.05Å; F65-L182 HydrophobicContact CE1-CD2 3.62Å; F65-L182 HydrophobicContact CE2-CD2 4.46Å; F65-L182 HydrophobicContact CZ-CD2 3.85Å
66	H	72	Confident	63	Low	112 Å²	112	62.1 Å²	62.1	52%	0.519	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	144.3	-179.3	-69.4	-69	0	0	0	111.2	K64 L152 I153 S154	K64-H66 VanDerWaalsContact CE-CE1 3.42Å; K64-H66 WeakPolarHBondContact CE-CE1 3.16Å; K64-H66 PolarHBondContact NZ-NE2 2.78Å; H66-L152 HydrophobicContact CB-CD1 4.11Å; H66-I153 CarbonylContact C-O 3.55Å; H66-I153 WeakPolarHBondContact CA-O 3.15Å; H66-S154 PolarHBondContact CE1-OG 3.06Å; H66-S154 PolarHBondContact ND1-OG 2.97Å
67	L	72.4	Confident	63.5	Low	4 Å²	4	62.6 Å²	62.6	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146.3	176.4	-89.2	171.1	0	0	0	109.8	I52 F65 I153 L164 I180	I52-L67 HydrophobicContact CD1-CD1 4.12Å; I52-L67 HydrophobicContact CD1-CD2 3.99Å; I52-L67 HydrophobicContact CD1-CG 4.01Å; F65-L67 HydrophobicContact CD2-CG 4.42Å; F65-L67 HydrophobicContact CE2-CD1 3.94Å; F65-L67 HydrophobicContact CE2-CG 4.25Å; L67-I153 HydrophobicContact CB-CB 4.08Å; L67-I153 PolarHBondContact N-O 3.01Å; L67-I153 PolarHBondContact O-N 2.95Å; L67-L164 HydrophobicContact CD1-CD2 3.47Å; L67-L164 VanDerWaalsContact CD1-CD2 3.47Å; L67-I180 HydrophobicContact CD1-CD1 3.88Å; L67-I180 HydrophobicContact CD2-CD1 4.33Å
68	Y	67.8	Low	64.4	Low	122 Å²	122	58.8 Å²	58.8	48%	0.478	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.8	173.2	-66.3	-82.5	0	0	0	109.7	L119 L150 W151 L152	Y68-L119 HydrophobicContact CD1-CD1 4.27Å; Y68-L119 HydrophobicContact CE1-CD1 3.92Å; Y68-L150 HydrophobicContact CD1-CD1 4.4Å; Y68-W151 WeakPolarHBondContact CA-O 3.25Å; Y68-L152 HydrophobicContact CD1-CD1 4.27Å; Y68-L152 HydrophobicContact CE1-CB 4.42Å; Y68-L152 HydrophobicContact CE1-CD1 3.78Å
69	A	67.3	Low	65.5	Low	0 Å²	0	53 Å²	53	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	129	176.8	0	0	0	0	0	110.9	I71 W151 I153 I166	A69-I71 HydrophobicContact CB-CD1 4.06Å; A69-I71 HydrophobicContact CB-CG1 4Å; A69-W151 PolarHBondContact N-O 2.93Å; A69-W151 PolarHBondContact O-N 2.9Å; A69-I153 HydrophobicContact CB-CD1 4.49Å; A69-I166 HydrophobicContact CB-CD1 4.07Å
70	L	64.7	Low	66.7	Low	19 Å²	19	49.8 Å²	49.8	10%	0.099	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	106.7	173.4	-80.8	161.1	0	0	0	108.5	I45 M46 L131 I148 L150	I45-L70 WeakPolarHBondContact CA-O 3.48Å; M46-L70 HydrophobicContact CB-CB 3.93Å; M46-L70 HydrophobicContact CE-CD1 3.59Å; M46-L70 PolarHBondContact N-O 2.78Å; M46-L70 HydrophobicContact SD-CD1 4.29Å; L70-L131 HydrophobicContact CD1-CD1 4.11Å; L70-I148 HydrophobicContact CB-CG2 4.38Å; L70-I148 HydrophobicContact CD2-CG2 3.68Å; L70-L150 HydrophobicContact CD2-CB 3.94Å; L70-L150 HydrophobicContact CD2-CD1 3.87Å; L70-L150 HydrophobicContact CD2-CG 4.49Å; L70-L150 HydrophobicContact CG-CD1 3.86Å
71	I	66.7	Low	67.2	Low	1 Å²	1	44.9 Å²	44.9	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	138.8	-169.2	-54.6	-167.8	0	0	0	110.9	I45 A69 A76 I78 I148 N149 I166 A168	I45-I71 HydrophobicContact CG1-CD1 4.33Å; I45-I71 HydrophobicContact CG1-CG1 4.25Å; I45-I71 HydrophobicContact CG1-CG2 4.44Å; I45-I71 HydrophobicContact CG2-CG1 4.46Å; A69-I71 HydrophobicContact CB-CD1 4.06Å; A69-I71 HydrophobicContact CB-CG1 4Å; I71-A76 HydrophobicContact CG2-CB 3.86Å; I71-I78 HydrophobicContact CD1-CD1 3.54Å; I71-I78 HydrophobicContact CD1-CG1 3.78Å; I71-I148 WeakPolarHBondContact O-CA 3.33Å; I71-N149 PolarHBondContact N-O 3.04Å; I71-N149 PolarHBondContact O-N 3.34Å; I71-I166 HydrophobicContact CD1-CG2 4.45Å; I71-A168 HydrophobicContact CD1-CB 4.33Å; I71-A168 HydrophobicContact CG2-CB 3.97Å
72	T	58.1	Low	67.8	Low	22 Å²	22	43.7 Å²	43.7	14%	0.135	21%	0.213	C	C	.	.	S	Bend	trans	-130.7	146.3	174.6	18.9	0	0	0	0	107.4	K43 F44 N147 I148	K43-T72 VanDerWaalsContact C-OG1 3.23Å; K43-T72 CarbonylContact O-C 3.49Å; K43-T72 VanDerWaalsContact O-C 3.29Å; K43-T72 WeakPolarHBondContact O-CB 3.48Å; K43-T72 PolarHBondContact O-OG1 3.23Å; F44-T72 VanDerWaalsContact CD1-O 3.26Å; F44-T72 WeakPolarHBondContact CD1-O 3.49Å; T72-N147 WeakPolarHBondContact CG2-O 3.49Å; T72-I148 HydrophobicContact CG2-CB 4.23Å; T72-I148 HydrophobicContact CG2-CG1 3.52Å
73	P	58.9	Low	68	Low	15 Å²	15	43.3 Å²	43.3	10%	0.097	21%	0.212	C	C	.	.	S	Bend	cis	-72	168	-9.2	35	-31.1	0	0	0	111.1	P42 N75 A76 N147 T170	P42-P73 HydrophobicContact CB-CB 4.39Å; P42-P73 HydrophobicContact CB-CG 4.08Å; P42-P73 HydrophobicContact CG-CG 4Å; P73-N75 WeakPolarHBondContact CB-OD1 3.5Å; P73-N75 WeakPolarHBondContact CG-OD1 3.29Å; P73-N75 PolarHBondContact O-N 2.81Å; P73-N75 VanDerWaalsContact O-N 3.09Å; P73-A76 WeakPolarHBondContact O-CB 3.2Å; P73-A76 PolarHBondContact O-N 2.92Å; P73-A76 VanDerWaalsContact O-N 3.08Å; P73-N147 CarbonylContact C-O 3.12Å; P73-T170 HydrophobicContact CG-CG2 3.86Å
74	R	63.4	Low	68.4	Low	130 Å²	130	41.6 Å²	41.6	49%	0.491	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.5	-167.7	-156.8	165.5	-179.7	-163.2	-5.3	115	E146 N147 N149	R74-E146 VanDerWaalsContact CD-O 3.26Å; R74-E146 WeakPolarHBondContact CD-O 3.21Å; R74-E146 PolarHBondContact NH1-O 2.69Å; R74-N147 WeakPolarHBondContact CB-O 3.49Å; R74-N147 PolarHBondContact N-O 2.72Å; R74-N147 PolarHBondContact N-OD1 2.88Å; R74-N149 HydrophobicContact CG-CB 4.16Å; R74-N149 VanDerWaalsContact CG-CG 3.4Å; R74-N149 WeakPolarHBondContact CG-ND2 3.24Å; R74-N149 WeakPolarHBondContact CG-OD1 3.32Å; R74-N149 PolarHBondContact NE-OD1 2.75Å; R74-N149 PolarHBondContact O-ND2 3.26Å; R74-N149 VanDerWaalsContact O-ND2 3.15Å
75	N	65.7	Low	67.8	Low	118 Å²	118	43.2 Å²	43.2	63%	0.631	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.5	8.6	179.7	60.9	-31	0	0	0	114.3	P73	P73-N75 WeakPolarHBondContact CB-OD1 3.5Å; P73-N75 WeakPolarHBondContact CG-OD1 3.29Å; P73-N75 PolarHBondContact O-N 2.81Å; P73-N75 VanDerWaalsContact O-N 3.09Å
76	A	66.3	Low	67.2	Low	5 Å²	5	46.1 Å²	46.1	4%	0.041	22%	0.22	C	C	.	.			trans	-65.6	136.4	173.1	0	0	0	0	0	111.8	I71 P73 A168 T169 T170	I71-A76 HydrophobicContact CG2-CB 3.86Å; P73-A76 WeakPolarHBondContact O-CB 3.2Å; P73-A76 PolarHBondContact O-N 2.92Å; P73-A76 VanDerWaalsContact O-N 3.08Å; A76-A168 HydrophobicContact CB-CB 4.43Å; A76-T169 VanDerWaalsContact CA-O 3.3Å; A76-T169 WeakPolarHBondContact CA-O 3.28Å; A76-T170 HydrophobicContact CB-CG2 3.88Å
77	T	70.5	Confident	66.9	Low	71 Å²	71	42.4 Å²	42.4	44%	0.436	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	147.6	171.5	55.7	0	0	0	0	110.5	A168 T169	T77-A168 CarbonylContact O-C 3.54Å; T77-A168 WeakPolarHBondContact O-CA 3.36Å; T77-T169 PolarHBondContact N-O 3.22Å; T77-T169 PolarHBondContact O-N 3.38Å
78	I	73.2	Confident	66.3	Low	2 Å²	2	43.5 Å²	43.5	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	136.5	-175.7	-54.6	177.8	0	0	0	110.4	I71 H98 I116 W151 I153 I166 L167	I71-I78 HydrophobicContact CD1-CD1 3.54Å; I71-I78 HydrophobicContact CD1-CG1 3.78Å; I78-H98 PolarHBondContact O-CE1 3.05Å; I78-H98 PolarHBondContact O-NE2 3.26Å; I78-I116 HydrophobicContact CB-CD1 4.19Å; I78-I116 HydrophobicContact CD1-CG2 4.29Å; I78-I116 HydrophobicContact CG2-CD1 3.89Å; I78-W151 HydrophobicContact CD1-CB 3.84Å; I78-W151 HydrophobicContact CD1-CD2 3.37Å; I78-W151 HydrophobicContact CD1-CE3 3.94Å; I78-W151 HydrophobicContact CD1-CG 3.33Å; I78-W151 HydrophobicContact CD1-CZ2 4.29Å; I78-I153 HydrophobicContact CG2-CD1 4.45Å; I78-I166 HydrophobicContact CG2-CG2 3.84Å; I78-L167 CarbonylContact C-O 3.53Å; I78-L167 WeakPolarHBondContact CA-O 3.48Å
79	Q	73.8	Confident	66	Low	85 Å²	85	41.4 Å²	41.4	40%	0.397	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	157.5	163.1	-66.7	-177.7	-12.1	0	0	110.3	L167	Q79-L167 HydrophobicContact CB-CB 4.27Å; Q79-L167 PolarHBondContact N-O 2.82Å; Q79-L167 PolarHBondContact O-N 3.14Å
80	L	74.7	Confident	65.8	Low	1 Å²	1	45.6 Å²	45.6	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.6	173.6	-73.8	171.4	0	0	0	110.2	I94 T96 A114 I153 V155 L164 I166	L80-I94 HydrophobicContact CB-CB 4.07Å; L80-I94 HydrophobicContact CB-CD1 4.01Å; L80-I94 HydrophobicContact CB-CG1 4.22Å; L80-I94 PolarHBondContact O-N 3.29Å; L80-T96 HydrophobicContact CB-CG2 4.2Å; L80-T96 HydrophobicContact CD1-CG2 3.94Å; L80-T96 HydrophobicContact CG-CG2 4.18Å; L80-A114 HydrophobicContact CD1-CB 3.52Å; L80-I153 HydrophobicContact CD1-CG2 3.75Å; L80-I153 HydrophobicContact CD2-CD1 4.42Å; L80-I153 HydrophobicContact CD2-CG2 4.23Å; L80-I153 HydrophobicContact CG-CG2 4.42Å; L80-V155 HydrophobicContact CD1-CG2 4.11Å; L80-L164 HydrophobicContact CD2-CD1 4.49Å; L80-L164 HydrophobicContact CD2-CD2 4.19Å; L80-L164 HydrophobicContact CD2-CG 4.38Å; L80-I166 HydrophobicContact CD2-CG1 4.12Å
81	G	69.2	Low	65.8	Low	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	149.5	167.7	0	0	0	0	0	111.2	I92 L164 L165	G81-I92 CarbonylContact C-O 3.57Å; G81-I92 WeakPolarHBondContact CA-O 3.02Å; G81-L164 CarbonylContact O-C 3.48Å; G81-L165 PolarHBondContact N-O 2.93Å; G81-L165 PolarHBondContact O-N 3.12Å
82	A	71.6	Confident	65.7	Low	4 Å²	4	49 Å²	49	3%	0.033	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	137.7	163.6	0	0	0	0	0	109.5	I92 I94 F158 M162 K163	A82-I92 PolarHBondContact N-O 3Å; A82-I92 WeakPolarHBondContact O-CB 3.19Å; A82-I92 PolarHBondContact O-N 2.87Å; A82-I94 HydrophobicContact CB-CD1 4.21Å; A82-I94 HydrophobicContact CB-CG1 4.31Å; A82-F158 HydrophobicContact CB-CE2 4.14Å; A82-F158 HydrophobicContact CB-CZ 4.07Å; A82-M162 HydrophobicContact CB-CB 4.41Å; A82-M162 HydrophobicContact CB-SD 4.31Å; A82-K163 CarbonylContact C-O 3.48Å; A82-K163 VanDerWaalsContact CA-O 3.27Å; A82-K163 WeakPolarHBondContact CA-O 2.78Å
83	I	65.7	Low	66.3	Low	1 Å²	1	52.6 Å²	52.6	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.5	172.7	-63.3	-174.4	0	0	0	108.2	P88 I91 M162 K163 L165 L179 F524	I83-P88 WeakPolarHBondContact CG2-O 3.36Å; I83-I91 HydrophobicContact CD1-CG1 4.08Å; I83-I91 HydrophobicContact CG1-CG1 4.08Å; I83-M162 WeakPolarHBondContact O-CA 3.38Å; I83-K163 PolarHBondContact N-O 2.99Å; I83-K163 PolarHBondContact O-N 2.95Å; I83-L165 HydrophobicContact CD1-CD2 3.69Å; I83-L165 HydrophobicContact CG1-CD2 3.87Å; I83-L179 HydrophobicContact CD1-CD2 3.72Å; I83-L179 HydrophobicContact CG1-CD2 4.43Å; I83-F524 HydrophobicContact CD1-CE2 3.74Å; I83-F524 HydrophobicContact CD1-CZ 3.7Å
84	H	67.4	Low	66.5	Low	47 Å²	47	52.9 Å²	52.9	22%	0.218	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	131.3	174	-166.4	-86	0	0	0	109.3	D86 K87 M162	H84-D86 IonicContact CE1-OD2 2.64Å; H84-D86 PolarHBondContact CE1-OD2 2.97Å; H84-D86 PolarHBondContact ND1-N 2.92Å; H84-D86 IonicContact ND1-OD2 3.79Å; H84-D86 PolarHBondContact O-N 3.09Å; H84-K87 CarbonylContact O-C 3.58Å; H84-K87 VanDerWaalsContact O-C 3.23Å; H84-K87 PolarHBondContact O-N 2.84Å; H84-M162 VanDerWaalsContact CA-SD 3.5Å; H84-M162 HydrophobicContact CB-CE 4.34Å; H84-M162 HydrophobicContact CB-SD 3.66Å
85	K	61.7	Low	66.1	Low	130 Å²	130	50.4 Å²	50.4	57%	0.565	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.6	-46.1	179.9	-178.4	-178.7	178.7	-177.7	0	113.2	D161	K85-D161 PolarHBondContact N-O 2.62Å
86	D	59.9	Low	66	Low	79 Å²	79	46.6 Å²	46.6	42%	0.422	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-21.7	-176.4	-45.5	-19	0	0	0	114	H84 P88 H800	H84-D86 IonicContact CE1-OD2 2.64Å; H84-D86 PolarHBondContact CE1-OD2 2.97Å; H84-D86 PolarHBondContact ND1-N 2.92Å; H84-D86 IonicContact ND1-OD2 3.79Å; H84-D86 PolarHBondContact O-N 3.09Å; D86-P88 WeakPolarHBondContact O-CD 3.46Å; D86-H800 VanDerWaalsContact CA-NE2 3.33Å; D86-H800 WeakPolarHBondContact CA-NE2 3.21Å; D86-H800 WeakPolarHBondContact CB-CE1 3.49Å; D86-H800 WeakPolarHBondContact CB-NE2 3.36Å; D86-H800 CovalentContact O-NE2 1.76Å; D86-H800 PolarHBondContact O-NE2 2.97Å
87	K	65.2	Low	65.6	Low	34 Å²	34	48.2 Å²	48.2	15%	0.148	25%	0.248	C	C	.	.			trans	-118.7	70.7	174.8	-80.7	-168.1	179.5	168.5	0	110.4	H84 N89 M90 V798 Y799 H800	H84-K87 CarbonylContact O-C 3.58Å; H84-K87 VanDerWaalsContact O-C 3.23Å; H84-K87 PolarHBondContact O-N 2.84Å; K87-N89 VanDerWaalsContact C-N 3.26Å; K87-N89 PolarHBondContact O-N 2.84Å; K87-M90 HydrophobicContact CB-CB 4.41Å; K87-M90 HydrophobicContact CD-SD 4.36Å; K87-M90 PolarHBondContact O-N 3.45Å; K87-V798 WeakPolarHBondContact CE-O 3.07Å; K87-V798 PolarHBondContact NZ-O 3.41Å; K87-Y799 HydrophobicContact CD-CD1 3.55Å; K87-Y799 HydrophobicContact CD-CE1 3.66Å; K87-Y799 HydrophobicContact CD-CG 4.46Å; K87-Y799 HydrophobicContact CG-CD1 4.22Å; K87-H800 WeakPolarHBondContact CG-CE1 3.37Å; K87-H800 VanDerWaalsContact CG-NE2 3.33Å; K87-H800 WeakPolarHBondContact CG-NE2 3.26Å; K87-H800 PolarHBondContact N-NE2 3.24Å
88	P	60.6	Low	65.1	Low	28 Å²	28	47.1 Å²	47.1	18%	0.182	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-33.2	-176.2	20.1	-30	0	0	0	113.8	I83 D86 M90 I515 F524	I83-P88 WeakPolarHBondContact CG2-O 3.36Å; D86-P88 WeakPolarHBondContact O-CD 3.46Å; P88-M90 PolarHBondContact O-N 2.91Å; P88-M90 VanDerWaalsContact O-N 3.16Å; P88-I515 HydrophobicContact CB-CD1 3.54Å; P88-I515 HydrophobicContact CB-CG1 3.68Å; P88-F524 VanDerWaalsContact O-CE2 3.23Å; P88-F524 WeakPolarHBondContact O-CE2 3.16Å; P88-F524 WeakPolarHBondContact O-CZ 3.43Å
89	N	62	Low	64.3	Low	77 Å²	77	49.6 Å²	49.6	41%	0.412	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	11	-177.2	-51.7	44.1	0	0	0	114.3	K87 Q517 F524	K87-N89 VanDerWaalsContact C-N 3.26Å; K87-N89 PolarHBondContact O-N 2.84Å; N89-Q517 VanDerWaalsContact CG-OE1 3.28Å; N89-Q517 PolarHBondContact ND2-NE2 2.89Å; N89-Q517 PolarHBondContact ND2-OE1 2.79Å; N89-Q517 PolarHBondContact OD1-NE2 2.85Å; N89-F524 WeakPolarHBondContact O-CD2 3.34Å
90	M	62.8	Low	63	Low	88 Å²	88	52.1 Å²	52.1	43%	0.433	26%	0.256	S	S	.	.			trans	-135.2	115.4	-172.9	-175.1	173.7	-75.7	0	0	112	K87 P88	K87-M90 HydrophobicContact CB-CB 4.41Å; K87-M90 HydrophobicContact CD-SD 4.36Å; K87-M90 PolarHBondContact O-N 3.45Å; P88-M90 PolarHBondContact O-N 2.91Å; P88-M90 VanDerWaalsContact O-N 3.16Å
91	I	64.3	Low	60.9	Low	23 Å²	23	53.2 Å²	53.2	12%	0.118	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	121.1	175.7	-56.1	175.3	0	0	0	109.2	I83 Y93 L165 G522 F524	I83-I91 HydrophobicContact CD1-CG1 4.08Å; I83-I91 HydrophobicContact CG1-CG1 4.08Å; I91-Y93 HydrophobicContact CB-CE2 4.32Å; I91-Y93 HydrophobicContact CG2-CD2 4.37Å; I91-Y93 HydrophobicContact CG2-CE2 4.11Å; I91-L165 HydrophobicContact CD1-CD2 4.17Å; I91-L165 HydrophobicContact CG1-CD2 4.27Å; I91-L165 HydrophobicContact CG2-CD2 4.49Å; I91-G522 WeakPolarHBondContact CD1-O 3.3Å; I91-F524 HydrophobicContact CD1-CD2 4.35Å; I91-F524 HydrophobicContact CD1-CE2 4.03Å; I91-F524 HydrophobicContact CG1-CD2 4.12Å; I91-F524 HydrophobicContact CG1-CE2 3.67Å
92	I	63.9	Low	59.2	Low	69 Å²	69	60.1 Å²	60.1	35%	0.354	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	112.7	173.3	-57.5	170.9	0	0	0	107.4	G81 A82 M162	G81-I92 CarbonylContact C-O 3.57Å; G81-I92 WeakPolarHBondContact CA-O 3.02Å; A82-I92 PolarHBondContact N-O 3Å; A82-I92 WeakPolarHBondContact O-CB 3.19Å; A82-I92 PolarHBondContact O-N 2.87Å; I92-M162 HydrophobicContact CD1-CE 3.81Å; I92-M162 HydrophobicContact CD1-SD 4.32Å
93	Y	71.8	Confident	57	Low	98 Å²	98	65.5 Å²	65.5	38%	0.384	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	125.9	179.6	-68.5	-104.4	0	0	0	110.1	I91 L167 G522	I91-Y93 HydrophobicContact CB-CE2 4.32Å; I91-Y93 HydrophobicContact CG2-CD2 4.37Å; I91-Y93 HydrophobicContact CG2-CE2 4.11Å; Y93-L167 HydrophobicContact CD1-CD1 4.19Å; Y93-L167 HydrophobicContact CE1-CD1 3.39Å; Y93-G522 PolarHBondContact OH-O 2.79Å
94	I	63.7	Low	55.1	Low	21 Å²	21	73.7 Å²	73.7	11%	0.108	37%	0.373	C	S	.	.			trans	-85	135	-177.3	-53	-178.5	0	0	0	109.7	L80 A82 T96 H113 A114 F158 L164	L80-I94 HydrophobicContact CB-CB 4.07Å; L80-I94 HydrophobicContact CB-CD1 4.01Å; L80-I94 HydrophobicContact CB-CG1 4.22Å; L80-I94 PolarHBondContact O-N 3.29Å; A82-I94 HydrophobicContact CB-CD1 4.21Å; A82-I94 HydrophobicContact CB-CG1 4.31Å; I94-T96 PolarHBondContact O-N 2.99Å; I94-T96 VanDerWaalsContact O-N 3.07Å; I94-H113 HydrophobicContact CG2-CB 3.6Å; I94-A114 HydrophobicContact CG2-CB 4.19Å; I94-F158 HydrophobicContact CD1-CD2 4.36Å; I94-F158 HydrophobicContact CD1-CE2 3.74Å; I94-L164 HydrophobicContact CD1-CD1 3.49Å; I94-L164 VanDerWaalsContact CD1-CD1 3.49Å
95	P	54.9	Low	53.2	Low	78 Å²	78	77.7 Å²	77.7	51%	0.506	39%	0.388	S	S	.	.			trans	-60.9	110	172	-23.9	34.8	0	0	0	112.3	A114	P95-A114 PolarHBondContact O-N 3.31Å
96	T	63.5	Low	51.5	Low	38 Å²	38	75.8 Å²	75.8	23%	0.233	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132	-177.8	44.4	0	0	0	0	112.3	L80 I94 A114 I116	L80-T96 HydrophobicContact CB-CG2 4.2Å; L80-T96 HydrophobicContact CD1-CG2 3.94Å; L80-T96 HydrophobicContact CG-CG2 4.18Å; I94-T96 PolarHBondContact O-N 2.99Å; I94-T96 VanDerWaalsContact O-N 3.07Å; T96-A114 WeakPolarHBondContact CA-O 3.39Å; T96-A114 HydrophobicContact CG2-CB 3.88Å; T96-I116 HydrophobicContact CG2-CD1 3.66Å; T96-I116 HydrophobicContact CG2-CG1 4.23Å
97	V	57.6	Low	50	Low	38 Å²	38	73.7 Å²	73.7	23%	0.23	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.8	165.9	179.8	0	0	0	0	109.2	M107 T112 A114 K115 I116	V97-M107 HydrophobicContact CG1-CE 4.14Å; V97-M107 HydrophobicContact CG2-CE 4.48Å; V97-T112 HydrophobicContact CG2-CG2 3.53Å; V97-A114 PolarHBondContact N-O 2.72Å; V97-K115 WeakPolarHBondContact O-CA 3.45Å; V97-I116 PolarHBondContact O-N 2.9Å
98	H	59.3	Low	48.3	Very low	48 Å²	48	76.1 Å²	76.1	22%	0.222	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	126	169.1	-62.7	-99	0	0	0	109.7	I78 Y100 I116	I78-H98 PolarHBondContact O-CE1 3.05Å; I78-H98 PolarHBondContact O-NE2 3.26Å; H98-Y100 HydrophobicContact CB-CD2 4.03Å; H98-Y100 HydrophobicContact CB-CE2 3.41Å; H98-Y100 VanDerWaalsContact CB-CE2 3.41Å; H98-I116 WeakPolarHBondContact CA-O 3.45Å
99	E	56.6	Low	46.7	Very low	55 Å²	55	81 Å²	81	26%	0.257	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	119.3	164.8	-84.4	171.5	-146.3	0	0	109.3	K115 I116	E99-K115 VanDerWaalsContact CD-CE 3.41Å; E99-K115 VanDerWaalsContact OE1-CE 3.28Å; E99-K115 WeakPolarHBondContact OE1-CE 3.35Å; E99-K115 IonicContact OE1-NZ 3.11Å; E99-K115 PolarHBondContact OE1-NZ 2.9Å; E99-K115 VanDerWaalsContact OE2-CE 3.23Å; E99-K115 WeakPolarHBondContact OE2-CE 3.34Å; E99-K115 IonicContact OE2-NZ 2.96Å; E99-K115 PolarHBondContact OE2-NZ 3.09Å; E99-I116 PolarHBondContact N-O 2.94Å; E99-I116 VanDerWaalsContact N-O 3.11Å
100	Y	46.5	Very low	45.2	Very low	138 Å²	138	80.6 Å²	80.6	54%	0.541	42%	0.422	S	S	.	.			trans	-102.7	-12.9	178.3	-70.7	-75.5	0	0	0	113.4	H98 W151	H98-Y100 HydrophobicContact CB-CD2 4.03Å; H98-Y100 HydrophobicContact CB-CE2 3.41Å; H98-Y100 VanDerWaalsContact CB-CE2 3.41Å; Y100-W151 HydrophobicContact CE1-CH2 4Å
101	S	30.6	Very low	44.3	Very low	23 Å²	23	80.3 Å²	80.3	16%	0.161	42%	0.42	C	S	.	.	S	Bend	trans	-113.8	159.9	-173.8	63.9	0	0	0	0	113.5	L756	S101-L756 WeakPolarHBondContact OG-CD1 3.5Å; S101-L756 WeakPolarHBondContact OG-CD2 3.43Å
102	T	33.3	Very low	43.3	Very low	145 Å²	145	81 Å²	81	89%	0.89	43%	0.426	S	S	*	.	S	Bend	trans	-83.1	-2.6	173.7	46.8	0	0	0	0	115.1
103	E	26.3	Very low	43.2	Very low	117 Å²	117	80.3 Å²	80.3	55%	0.547	42%	0.421	S	S	.	.			trans	-91.1	123.7	-175.2	-61.8	-163.2	158.5	0	0	113.8	Y105	E103-Y105 HydrophobicContact CB-CD2 4.1Å; E103-Y105 HydrophobicContact CB-CE2 4.02Å; E103-Y105 PolarHBondContact O-N 3.07Å
104	L	26	Very low	43	Very low	174 Å²	174	75.7 Å²	75.7	91%	0.911	40%	0.403	S	S	*	.			trans	-78.6	67.6	-172.5	-88.5	150.3	0	0	0	114.1	S106	L104-S106 PolarHBondContact O-N 3.03Å
105	Y	26.4	Very low	43.1	Very low	131 Å²	131	77.1 Å²	77.1	51%	0.514	41%	0.408	S	S	.	.			trans	-76.1	113.5	172.2	-78.8	-79.1	0	0	0	112.7	E103 M107 L756	E103-Y105 HydrophobicContact CB-CD2 4.1Å; E103-Y105 HydrophobicContact CB-CE2 4.02Å; E103-Y105 PolarHBondContact O-N 3.07Å; Y105-M107 WeakPolarHBondContact O-CG 3.36Å; Y105-L756 HydrophobicContact CD2-CD1 4.42Å; Y105-L756 HydrophobicContact CE2-CD1 4.29Å
106	S	27	Very low	44.1	Very low	90 Å²	90	73.4 Å²	73.4	63%	0.629	38%	0.384	S	S	*	.			trans	-78.2	141.7	-170.8	67.1	0	0	0	0	116.4	L104 K759 R760	L104-S106 PolarHBondContact O-N 3.03Å; S106-K759 WeakPolarHBondContact O-CE 3.48Å; S106-R760 PolarHBondContact O-NE 3.14Å; S106-R760 PolarHBondContact O-NH2 3.11Å
107	M	28.1	Very low	44.6	Very low	35 Å²	35	75.1 Å²	75.1	17%	0.172	39%	0.389	C	S	.	.			trans	-141.4	62.2	-158.9	-74.3	-176.2	38.2	0	0	120.4	V97 Y105 S758 K759 R760 N761	V97-M107 HydrophobicContact CG1-CE 4.14Å; V97-M107 HydrophobicContact CG2-CE 4.48Å; Y105-M107 WeakPolarHBondContact O-CG 3.36Å; M107-S758 VanDerWaalsContact SD-CB 3.52Å; M107-K759 HydrophobicContact CG-CG 3.78Å; M107-R760 VanDerWaalsContact CA-CG 3.49Å; M107-R760 HydrophobicContact CB-CG 4.02Å; M107-R760 HydrophobicContact CG-CG 4.49Å; M107-R760 CarbonylContact O-C 3.59Å; M107-R760 WeakPolarHBondContact O-CA 2.99Å; M107-R760 WeakPolarHBondContact O-CG 3.2Å; M107-N761 PolarHBondContact O-N 2.92Å; M107-N761 PolarHBondContact O-OD1 3.23Å
108	T	28.8	Very low	45.3	Very low	85 Å²	85	75.5 Å²	75.5	52%	0.521	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-94.6	125.1	163.7	45.3	0	0	0	0	119	R760 N761	T108-R760 VanDerWaalsContact N-CG 3.35Å; T108-R760 WeakPolarHBondContact O-CD 3.3Å; T108-R760 VanDerWaalsContact O-CG 3.27Å; T108-R760 WeakPolarHBondContact O-CG 3.44Å; T108-R760 PolarHBondContact O-NH1 3.01Å; T108-R760 PolarHBondContact OG1-NH1 3.01Å; T108-N761 CarbonylContact C-O 3.55Å
109	F	27.2	Very low	45.7	Very low	131 Å²	131	74.5 Å²	74.5	58%	0.575	39%	0.39	S	S	*	.	S	Bend	trans	-179.6	-41.5	165.9	-58.2	147.1	0	0	0	115.9	R760 N761 E762	F109-R760 HydrophobicContact CB-CB 3.47Å; F109-R760 VanDerWaalsContact CB-CB 3.47Å; F109-R760 HydrophobicContact CB-CG 4.23Å; F109-R760 HydrophobicContact CD1-CB 3.53Å; F109-R760 HydrophobicContact CD1-CG 3.84Å; F109-R760 HydrophobicContact CE1-CB 4.49Å; F109-R760 HydrophobicContact CE1-CG 4.42Å; F109-R760 HydrophobicContact CG-CB 3.66Å; F109-R760 HydrophobicContact CG-CG 3.98Å; F109-N761 CarbonylContact C-O 3.52Å; F109-N761 VanDerWaalsContact N-C 3.31Å; F109-N761 PolarHBondContact N-O 3.16Å; F109-E762 WeakPolarHBondContact O-CB 3.38Å; F109-E762 WeakPolarHBondContact O-CG 3.4Å
110	A	31.3	Very low	45.9	Very low	68 Å²	68	75.6 Å²	75.6	56%	0.562	40%	0.4	S	S	*	.	S	Bend	trans	-143.8	84.9	-162.1	0	0	0	0	0	116.6	T112 R760 N761	A110-T112 PolarHBondContact O-N 2.93Å; A110-R760 CarbonylContact C-O 3.57Å; A110-R760 VanDerWaalsContact CA-O 3.29Å; A110-R760 WeakPolarHBondContact CA-O 3.2Å; A110-R760 WeakPolarHBondContact CB-O 3.26Å; A110-R760 PolarHBondContact N-O 2.93Å; A110-N761 VanDerWaalsContact N-N 3.14Å
111	Q	43	Very low	46.4	Very low	81 Å²	81	71.5 Å²	71.5	38%	0.379	39%	0.387	S	S	.	.			trans	9.1	79.1	-175.4	-138.4	164.7	79	0	0	122	H113 E762 Q763	Q111-H113 WeakPolarHBondContact CG-CE1 3.06Å; Q111-H113 PolarHBondContact O-N 3Å; Q111-H113 PolarHBondContact O-ND1 3.16Å; Q111-H113 VanDerWaalsContact O-ND1 3.08Å; Q111-H113 PolarHBondContact OE1-CE1 3.44Å; Q111-H113 PolarHBondContact OE1-NE2 2.97Å; Q111-E762 WeakPolarHBondContact CB-O 3.49Å; Q111-E762 WeakPolarHBondContact CG-O 3.5Å; Q111-E762 PolarHBondContact NE2-O 2.81Å; Q111-Q763 PolarHBondContact NE2-O 2.71Å
112	T	43.9	Very low	47.3	Very low	39 Å²	39	78.1 Å²	78.1	24%	0.239	42%	0.415	C	S	.	.			trans	-77.3	113.5	166.9	62.2	0	0	0	0	111.7	V97 A110 N761	V97-T112 HydrophobicContact CG2-CG2 3.53Å; A110-T112 PolarHBondContact O-N 2.93Å; T112-N761 HydrophobicContact CG2-CB 3.7Å; T112-N761 WeakPolarHBondContact OG1-CB 3.4Å
113	H	61.4	Low	48	Very low	54 Å²	54	78.6 Å²	78.6	25%	0.25	41%	0.407	C	S	.	.			trans	-90.9	-23.6	-179.1	-70.8	84.3	0	0	0	113.4	I94 Q111 Y156	I94-H113 HydrophobicContact CG2-CB 3.6Å; Q111-H113 WeakPolarHBondContact CG-CE1 3.06Å; Q111-H113 PolarHBondContact O-N 3Å; Q111-H113 PolarHBondContact O-ND1 3.16Å; Q111-H113 VanDerWaalsContact O-ND1 3.08Å; Q111-H113 PolarHBondContact OE1-CE1 3.44Å; Q111-H113 PolarHBondContact OE1-NE2 2.97Å; H113-Y156 PolarHBondContact O-N 3.32Å
114	A	66.8	Low	49.1	Very low	1 Å²	1	75 Å²	75	1%	0.008	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	148.9	174.8	0	0	0	0	0	112.7	L80 I94 P95 T96 V97 S154	L80-A114 HydrophobicContact CD1-CB 3.52Å; I94-A114 HydrophobicContact CG2-CB 4.19Å; P95-A114 PolarHBondContact O-N 3.31Å; T96-A114 WeakPolarHBondContact CA-O 3.39Å; T96-A114 HydrophobicContact CG2-CB 3.88Å; V97-A114 PolarHBondContact N-O 2.72Å; A114-S154 CarbonylContact C-O 3.6Å; A114-S154 VanDerWaalsContact CA-O 3.29Å; A114-S154 WeakPolarHBondContact CA-O 3.1Å
115	K	67.5	Low	50	Low	51 Å²	51	70.1 Å²	70.1	22%	0.222	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135	173.6	170.8	172.1	170	161	0	109.3	V97 E99 S154 Y156	V97-K115 WeakPolarHBondContact O-CA 3.45Å; E99-K115 VanDerWaalsContact CD-CE 3.41Å; E99-K115 VanDerWaalsContact OE1-CE 3.28Å; E99-K115 WeakPolarHBondContact OE1-CE 3.35Å; E99-K115 IonicContact OE1-NZ 3.11Å; E99-K115 PolarHBondContact OE1-NZ 2.9Å; E99-K115 VanDerWaalsContact OE2-CE 3.23Å; E99-K115 WeakPolarHBondContact OE2-CE 3.34Å; E99-K115 IonicContact OE2-NZ 2.96Å; E99-K115 PolarHBondContact OE2-NZ 3.09Å; K115-S154 PolarHBondContact N-O 2.62Å; K115-S154 PolarHBondContact O-N 3.02Å; K115-Y156 HydrophobicContact CB-CE2 4.25Å
116	I	75.1	Confident	50.8	Low	0 Å²	0	68 Å²	68	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128	-179.4	-60	-178.6	0	0	0	108.4	I78 T96 V97 H98 E99 W151 I153	I78-I116 HydrophobicContact CB-CD1 4.19Å; I78-I116 HydrophobicContact CD1-CG2 4.29Å; I78-I116 HydrophobicContact CG2-CD1 3.89Å; T96-I116 HydrophobicContact CG2-CD1 3.66Å; T96-I116 HydrophobicContact CG2-CG1 4.23Å; V97-I116 PolarHBondContact O-N 2.9Å; H98-I116 WeakPolarHBondContact CA-O 3.45Å; E99-I116 PolarHBondContact N-O 2.94Å; E99-I116 VanDerWaalsContact N-O 3.11Å; I116-W151 HydrophobicContact CG2-CD2 4.44Å; I116-W151 HydrophobicContact CG2-CE3 3.5Å; I116-W151 VanDerWaalsContact CG2-CE3 3.5Å; I116-W151 HydrophobicContact CG2-CZ3 3.77Å; I116-I153 HydrophobicContact CG1-CG1 4.36Å; I116-I153 HydrophobicContact CG1-CG2 4.48Å
117	Q	74.8	Confident	51.5	Low	73 Å²	73	70.8 Å²	70.8	34%	0.341	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	130.9	-177.3	-176.7	177.2	-1.7	0	0	109.7	L152	Q117-L152 PolarHBondContact N-O 2.88Å; Q117-L152 PolarHBondContact O-N 3.36Å
118	S	72.4	Confident	52.1	Low	47 Å²	47	69.5 Å²	69.5	33%	0.329	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	141.7	174.3	83.6	0	0	0	0	110.5
119	L	67.7	Low	52.6	Low	27 Å²	27	69.9 Å²	69.9	14%	0.141	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.5	178.7	-73.9	174.9	0	0	0	111.5	Y68 I121 L150 L152	Y68-L119 HydrophobicContact CD1-CD1 4.27Å; Y68-L119 HydrophobicContact CE1-CD1 3.92Å; L119-I121 PolarHBondContact O-N 3.49Å; L119-L150 HydrophobicContact CB-CB 4.22Å; L119-L150 HydrophobicContact CB-CD2 3.91Å; L119-L150 HydrophobicContact CB-CG 4.02Å; L119-L150 HydrophobicContact CD1-CD2 3.84Å; L119-L150 HydrophobicContact CD1-CG 4.17Å; L119-L150 PolarHBondContact N-O 3.12Å; L119-L152 HydrophobicContact CD1-CB 3.82Å; L119-L152 HydrophobicContact CG-CB 4.16Å
120	T	58.9	Low	53.3	Low	77 Å²	77	71.2 Å²	71.2	47%	0.472	37%	0.374	S	S	.	.			trans	-65.7	115	168.2	36.7	0	0	0	0	110.4	H122 E123 N124	T120-H122 PolarHBondContact O-N 2.96Å; T120-E123 WeakPolarHBondContact CB-OE2 3.47Å; T120-E123 PolarHBondContact O-N 3.31Å; T120-E123 PolarHBondContact OG1-OE2 3.08Å; T120-N124 PolarHBondContact O-N 2.95Å; T120-N124 PolarHBondContact O-ND2 3.04Å
121	I	57	Low	53.6	Low	52 Å²	52	69.1 Å²	69.1	27%	0.267	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-34.2	-178.2	-64.3	175.1	0	0	0	111.5	L119 L128 I148 L150	L119-I121 PolarHBondContact O-N 3.49Å; I121-L128 HydrophobicContact CB-CD1 4.46Å; I121-L128 HydrophobicContact CG2-CD1 3.98Å; I121-I148 HydrophobicContact CD1-CB 4.34Å; I121-I148 HydrophobicContact CD1-CG2 4.33Å; I121-L150 HydrophobicContact CG1-CB 4.22Å
122	H	50.1	Low	53.4	Low	162 Å²	162	68.3 Å²	68.3	75%	0.75	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-40.3	-176.8	-120	53.1	0	0	0	113.9	T120	T120-H122 PolarHBondContact O-N 2.96Å
123	E	48.1	Very low	53	Low	155 Å²	155	69.7 Å²	69.7	72%	0.724	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-26	-174.7	-65.4	169	129.1	0	0	111.8	T120	T120-E123 WeakPolarHBondContact CB-OE2 3.47Å; T120-E123 PolarHBondContact O-N 3.31Å; T120-E123 PolarHBondContact OG1-OE2 3.08Å
124	N	49.5	Very low	51.7	Low	43 Å²	43	74.1 Å²	74.1	23%	0.23	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	17.8	-178.5	-66.4	-84.4	0	0	0	113.4	T120 A126 H127 L128	T120-N124 PolarHBondContact O-N 2.95Å; T120-N124 PolarHBondContact O-ND2 3.04Å; N124-A126 PolarHBondContact O-N 3.37Å; N124-A126 VanDerWaalsContact O-N 3.11Å; N124-H127 PolarHBondContact O-N 2.9Å; N124-L128 HydrophobicContact CB-CD1 4.49Å; N124-L128 PolarHBondContact O-N 3.34Å
125	L	44.3	Very low	50.3	Low	70 Å²	70	76.5 Å²	76.5	37%	0.366	39%	0.389	S	S	.	.	H	α-helix	trans	-56.4	-32.5	-174	-131.7	99.8	0	0	0	113.1	H127 L128 N129 I132	L125-H127 VanDerWaalsContact C-N 3.33Å; L125-H127 PolarHBondContact O-N 3.49Å; L125-L128 CarbonylContact O-C 3.53Å; L125-L128 PolarHBondContact O-N 3Å; L125-N129 PolarHBondContact O-N 2.75Å; L125-N129 PolarHBondContact O-OD1 3.07Å; L125-I132 HydrophobicContact CD1-CD1 4.46Å; L125-I132 HydrophobicContact CD2-CD1 4.42Å; L125-I132 HydrophobicContact CG-CD1 4.05Å
126	A	43.2	Very low	48.7	Very low	86 Å²	86	77.1 Å²	77.1	71%	0.711	40%	0.4	S	S	*	.	H	α-helix	trans	-59.1	-38.6	177.2	0	0	0	0	0	113.3	N124	N124-A126 PolarHBondContact O-N 3.37Å; N124-A126 VanDerWaalsContact O-N 3.11Å
127	H	42	Very low	46.8	Very low	149 Å²	149	83.6 Å²	83.6	69%	0.69	44%	0.435	S	S	*	.	H	α-helix	trans	-79.8	-25.8	173.5	-72.4	-70.8	0	0	0	112.6	N124 L125	N124-H127 PolarHBondContact O-N 2.9Å; L125-H127 VanDerWaalsContact C-N 3.33Å; L125-H127 PolarHBondContact O-N 3.49Å
128	L	41.3	Very low	45	Very low	8 Å²	8	84 Å²	84	4%	0.042	44%	0.439	C	S	.	.	H	α-helix	trans	-86.8	-15.1	-177.1	-86.4	157.3	0	0	0	114.8	I121 N124 L125 Y130 L131 I132 L150	I121-L128 HydrophobicContact CB-CD1 4.46Å; I121-L128 HydrophobicContact CG2-CD1 3.98Å; N124-L128 HydrophobicContact CB-CD1 4.49Å; N124-L128 PolarHBondContact O-N 3.34Å; L125-L128 CarbonylContact O-C 3.53Å; L125-L128 PolarHBondContact O-N 3Å; L128-Y130 PolarHBondContact O-N 2.7Å; L128-Y130 VanDerWaalsContact O-N 3.11Å; L128-L131 HydrophobicContact CD2-CB 4.3Å; L128-L131 HydrophobicContact CD2-CD1 3.93Å; L128-L131 WeakPolarHBondContact O-CA 3.42Å; L128-L131 WeakPolarHBondContact O-CB 3.35Å; L128-L131 PolarHBondContact O-N 2.72Å; L128-I132 HydrophobicContact CB-CD1 3.94Å; L128-I132 HydrophobicContact CB-CG1 4.37Å; L128-I132 WeakPolarHBondContact O-CG1 3.49Å; L128-I132 PolarHBondContact O-N 3.17Å; L128-L150 HydrophobicContact CD1-CD2 4.03Å; L128-L150 HydrophobicContact CG-CD2 4.37Å
129	N	39.8	Very low	43	Very low	93 Å²	93	87.6 Å²	87.6	50%	0.497	45%	0.454	S	S	.	.	H	α-helix	trans	-56.3	-31.4	-175.4	-81.2	-23.4	0	0	0	114.1	L125 L131	L125-N129 PolarHBondContact O-N 2.75Å; L125-N129 PolarHBondContact O-OD1 3.07Å; N129-L131 VanDerWaalsContact C-N 3.33Å
130	Y	42	Very low	41.3	Very low	160 Å²	160	93.7 Å²	93.7	63%	0.627	49%	0.487	S	S	*	.	H	α-helix	trans	-75.8	-15.3	174.2	-89	-75.5	0	0	0	114.8	L128 S133	L128-Y130 PolarHBondContact O-N 2.7Å; L128-Y130 VanDerWaalsContact O-N 3.11Å; Y130-S133 PolarHBondContact O-OG 3.05Å
131	L	37.5	Very low	40	Very low	24 Å²	24	97.4 Å²	97.4	13%	0.126	50%	0.504	C	S	.	.	H	α-helix	trans	-95.3	-33.5	175.4	-68	172.9	0	0	0	111.7	M46 L70 L128 N129 S133 Y134 I135 P260 F262	M46-L131 HydrophobicContact CE-CD2 3.85Å; L70-L131 HydrophobicContact CD1-CD1 4.11Å; L128-L131 HydrophobicContact CD2-CB 4.3Å; L128-L131 HydrophobicContact CD2-CD1 3.93Å; L128-L131 WeakPolarHBondContact O-CA 3.42Å; L128-L131 WeakPolarHBondContact O-CB 3.35Å; L128-L131 PolarHBondContact O-N 2.72Å; N129-L131 VanDerWaalsContact C-N 3.33Å; L131-S133 VanDerWaalsContact C-N 3.28Å; L131-S133 PolarHBondContact O-N 3.27Å; L131-Y134 PolarHBondContact O-N 3.23Å; L131-I135 PolarHBondContact O-N 2.69Å; L131-P260 HydrophobicContact CD2-CG 4.21Å; L131-F262 HydrophobicContact CD2-CE2 3.47Å; L131-F262 VanDerWaalsContact CD2-CE2 3.47Å; L131-F262 HydrophobicContact CD2-CZ 3.37Å
132	I	38.2	Very low	39	Very low	64 Å²	64	99 Å²	99	33%	0.328	51%	0.512	S	S	.	.	H	α-helix	trans	-64.2	-32.3	-178.9	-69.3	166.3	0	0	0	111.7	L125 L128 Y134 I135 S136	L125-I132 HydrophobicContact CD1-CD1 4.46Å; L125-I132 HydrophobicContact CD2-CD1 4.42Å; L125-I132 HydrophobicContact CG-CD1 4.05Å; L128-I132 HydrophobicContact CB-CD1 3.94Å; L128-I132 HydrophobicContact CB-CG1 4.37Å; L128-I132 WeakPolarHBondContact O-CG1 3.49Å; L128-I132 PolarHBondContact O-N 3.17Å; I132-Y134 VanDerWaalsContact C-N 3.26Å; I132-Y134 PolarHBondContact O-N 2.96Å; I132-I135 PolarHBondContact O-N 3.04Å; I132-I135 VanDerWaalsContact O-N 3.14Å; I132-S136 PolarHBondContact O-N 2.99Å; I132-S136 PolarHBondContact O-OG 3.43Å
133	S	35.3	Very low	38.3	Very low	67 Å²	67	98.3 Å²	98.3	47%	0.469	51%	0.513	S	S	.	.	H	α-helix	trans	-62.5	-28.5	175.7	56.8	0	0	0	0	114	Y130 L131 S136	Y130-S133 PolarHBondContact O-OG 3.05Å; L131-S133 VanDerWaalsContact C-N 3.28Å; L131-S133 PolarHBondContact O-N 3.27Å; S133-S136 WeakPolarHBondContact CA-OG 3.27Å; S133-S136 PolarHBondContact O-OG 2.02Å
134	Y	35.4	Very low	38.1	Very low	147 Å²	147	92.9 Å²	92.9	58%	0.576	49%	0.489	S	S	*	.	H	α-helix	trans	-78.5	-40.4	172.3	-163	-104.4	0	0	0	111	L131 I132 S136 N137 I138	L131-Y134 PolarHBondContact O-N 3.23Å; I132-Y134 VanDerWaalsContact C-N 3.26Å; I132-Y134 PolarHBondContact O-N 2.96Å; Y134-S136 VanDerWaalsContact C-N 3.29Å; Y134-S136 PolarHBondContact O-N 2.74Å; Y134-N137 PolarHBondContact O-N 3.35Å; Y134-N137 VanDerWaalsContact O-N 3.08Å; Y134-I138 HydrophobicContact CD1-CD1 3.98Å; Y134-I138 HydrophobicContact CE1-CD1 3.88Å
135	I	37.1	Very low	37.9	Very low	51 Å²	51	99.8 Å²	99.8	26%	0.262	52%	0.517	S	S	.	.	H	α-helix	trans	-61.6	-36	177.1	-62	172.1	0	0	0	111.2	L131 I132 N137 I138 I144	L131-I135 PolarHBondContact O-N 2.69Å; I132-I135 PolarHBondContact O-N 3.04Å; I132-I135 VanDerWaalsContact O-N 3.14Å; I135-N137 PolarHBondContact O-N 3.34Å; I135-I138 PolarHBondContact O-N 3.25Å; I135-I144 HydrophobicContact CG2-CG2 4.4Å
136	S	34.1	Very low	38.1	Very low	65 Å²	65	103.2 Å²	103.2	46%	0.455	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.7	175.2	47.4	0	0	0	0	114.8	I132 S133 Y134	I132-S136 PolarHBondContact O-N 2.99Å; I132-S136 PolarHBondContact O-OG 3.43Å; S133-S136 WeakPolarHBondContact CA-OG 3.27Å; S133-S136 PolarHBondContact O-OG 2.02Å; Y134-S136 VanDerWaalsContact C-N 3.29Å; Y134-S136 PolarHBondContact O-N 2.74Å
137	N	34.1	Very low	38.8	Very low	135 Å²	135	103.5 Å²	103.5	72%	0.722	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-12.9	172.4	-79.5	-5.7	0	0	0	112.9	Y134 I135 N139	Y134-N137 PolarHBondContact O-N 3.35Å; Y134-N137 VanDerWaalsContact O-N 3.08Å; I135-N137 PolarHBondContact O-N 3.34Å; N137-N139 VanDerWaalsContact C-N 3.34Å; N137-N139 PolarHBondContact O-N 3.21Å; N137-N139 VanDerWaalsContact O-N 3.16Å
138	I	37.3	Very low	39.7	Very low	83 Å²	83	97.9 Å²	97.9	43%	0.426	50%	0.495	S	S	.	.	S	Bend	trans	-91.8	68.4	179	-51.9	177	0	0	0	110.1	Y134 I135	Y134-I138 HydrophobicContact CD1-CD1 3.98Å; Y134-I138 HydrophobicContact CE1-CD1 3.88Å; I135-I138 PolarHBondContact O-N 3.25Å
139	N	31	Very low	40.9	Very low	121 Å²	121	98.6 Å²	98.6	65%	0.647	50%	0.499	S	S	*	.			trans	55.7	117.4	172.7	-79.1	-21.3	0	0	0	117.6	N137 N141	N137-N139 VanDerWaalsContact C-N 3.34Å; N137-N139 PolarHBondContact O-N 3.21Å; N137-N139 VanDerWaalsContact O-N 3.16Å; N139-N141 PolarHBondContact O-N 2.94Å
140	N	30.6	Very low	42.4	Very low	156 Å²	156	94.6 Å²	94.6	83%	0.834	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	12.7	172.8	-72	-38.4	0	0	0	116.3
141	N	32.3	Very low	43.8	Very low	155 Å²	155	87.5 Å²	87.5	83%	0.829	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	16.4	-169.6	-82.7	-0.4	0	0	0	114.7	N139	N139-N141 PolarHBondContact O-N 2.94Å
142	I	35.3	Very low	45.6	Very low	86 Å²	86	87.4 Å²	87.4	44%	0.441	45%	0.449	S	S	.	.	S	Bend	trans	-133.6	131.1	-179.3	-51.4	179.5	0	0	0	111	I144	I142-I144 HydrophobicContact CB-CD1 4.16Å; I142-I144 HydrophobicContact CB-CG1 3.82Å; I142-I144 HydrophobicContact CG2-CD1 4.44Å; I142-I144 HydrophobicContact CG2-CG1 3.67Å; I142-I144 PolarHBondContact O-N 3.08Å
143	N	35.2	Very low	47.5	Very low	146 Å²	146	84.3 Å²	84.3	78%	0.781	43%	0.434	S	S	*	.			trans	-71.9	66.3	172.2	-89.1	-4.3	0	0	0	111.9	K145	N143-K145 PolarHBondContact O-N 2.9Å
144	I	44.4	Very low	49.4	Very low	42 Å²	42	81.3 Å²	81.3	22%	0.215	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-67.4	-22.8	-174.8	-68.5	171.4	0	0	0	112.6	I135 I142 E146 I148	I135-I144 HydrophobicContact CG2-CG2 4.4Å; I142-I144 HydrophobicContact CB-CD1 4.16Å; I142-I144 HydrophobicContact CB-CG1 3.82Å; I142-I144 HydrophobicContact CG2-CD1 4.44Å; I142-I144 HydrophobicContact CG2-CG1 3.67Å; I142-I144 PolarHBondContact O-N 3.08Å; I144-E146 PolarHBondContact O-N 2.83Å; I144-I148 HydrophobicContact CG2-CD1 3.47Å; I144-I148 VanDerWaalsContact CG2-CD1 3.47Å
145	K	46.6	Very low	51.3	Low	188 Å²	188	74.4 Å²	74.4	82%	0.817	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-67.5	-23.8	-169.4	-72.9	-176.1	176.2	177.1	0	116	N143	N143-K145 PolarHBondContact O-N 2.9Å
146	E	48.3	Very low	53.1	Low	142 Å²	142	75.4 Å²	75.4	66%	0.664	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-90.9	-23.5	-167.4	-64	-174.2	149.4	0	0	114.4	R74 I144	R74-E146 VanDerWaalsContact CD-O 3.26Å; R74-E146 WeakPolarHBondContact CD-O 3.21Å; R74-E146 PolarHBondContact NH1-O 2.69Å; I144-E146 PolarHBondContact O-N 2.83Å
147	N	56.7	Low	54.8	Low	92 Å²	92	74.8 Å²	74.8	49%	0.492	38%	0.378	S	S	.	.	S	Bend	trans	-110.6	5.3	-166.4	-142.9	-15.6	0	0	0	114.6	T72 P73 R74	T72-N147 WeakPolarHBondContact CG2-O 3.49Å; P73-N147 CarbonylContact C-O 3.12Å; R74-N147 WeakPolarHBondContact CB-O 3.49Å; R74-N147 PolarHBondContact N-O 2.72Å; R74-N147 PolarHBondContact N-OD1 2.88Å
148	I	62.4	Low	56.5	Low	30 Å²	30	69 Å²	69	15%	0.154	35%	0.347	C	S	.	.			trans	-101	141.2	175.3	-57.1	163.2	0	0	0	110.2	L70 I71 T72 I121 I144	L70-I148 HydrophobicContact CB-CG2 4.38Å; L70-I148 HydrophobicContact CD2-CG2 3.68Å; I71-I148 WeakPolarHBondContact O-CA 3.33Å; T72-I148 HydrophobicContact CG2-CB 4.23Å; T72-I148 HydrophobicContact CG2-CG1 3.52Å; I121-I148 HydrophobicContact CD1-CB 4.34Å; I121-I148 HydrophobicContact CD1-CG2 4.33Å; I144-I148 HydrophobicContact CG2-CD1 3.47Å; I144-I148 VanDerWaalsContact CG2-CD1 3.47Å
149	N	66	Low	58.2	Low	23 Å²	23	68.3 Å²	68.3	12%	0.123	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	138.3	158.4	-94	-16.2	0	0	0	110.3	I71 R74	I71-N149 PolarHBondContact N-O 3.04Å; I71-N149 PolarHBondContact O-N 3.34Å; R74-N149 HydrophobicContact CG-CB 4.16Å; R74-N149 VanDerWaalsContact CG-CG 3.4Å; R74-N149 WeakPolarHBondContact CG-ND2 3.24Å; R74-N149 WeakPolarHBondContact CG-OD1 3.32Å; R74-N149 PolarHBondContact NE-OD1 2.75Å; R74-N149 PolarHBondContact O-ND2 3.26Å; R74-N149 VanDerWaalsContact O-ND2 3.15Å
150	L	70.5	Confident	59.9	Low	9 Å²	9	64.1 Å²	64.1	5%	0.047	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	139.5	163.6	177.2	66.1	0	0	0	108.6	Y68 L70 L119 I121 L128	Y68-L150 HydrophobicContact CD1-CD1 4.4Å; L70-L150 HydrophobicContact CD2-CB 3.94Å; L70-L150 HydrophobicContact CD2-CD1 3.87Å; L70-L150 HydrophobicContact CD2-CG 4.49Å; L70-L150 HydrophobicContact CG-CD1 3.86Å; L119-L150 HydrophobicContact CB-CB 4.22Å; L119-L150 HydrophobicContact CB-CD2 3.91Å; L119-L150 HydrophobicContact CB-CG 4.02Å; L119-L150 HydrophobicContact CD1-CD2 3.84Å; L119-L150 HydrophobicContact CD1-CG 4.17Å; L119-L150 PolarHBondContact N-O 3.12Å; I121-L150 HydrophobicContact CG1-CB 4.22Å; L128-L150 HydrophobicContact CD1-CD2 4.03Å; L128-L150 HydrophobicContact CG-CD2 4.37Å
151	W	71.2	Confident	61.7	Low	11 Å²	11	61.8 Å²	61.8	4%	0.042	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.8	177.6	-66.7	89.6	0	0	0	111	Y68 A69 I78 Y100 I116	Y68-W151 WeakPolarHBondContact CA-O 3.25Å; A69-W151 PolarHBondContact N-O 2.93Å; A69-W151 PolarHBondContact O-N 2.9Å; I78-W151 HydrophobicContact CD1-CB 3.84Å; I78-W151 HydrophobicContact CD1-CD2 3.37Å; I78-W151 HydrophobicContact CD1-CE3 3.94Å; I78-W151 HydrophobicContact CD1-CG 3.33Å; I78-W151 HydrophobicContact CD1-CZ2 4.29Å; Y100-W151 HydrophobicContact CE1-CH2 4Å; I116-W151 HydrophobicContact CG2-CD2 4.44Å; I116-W151 HydrophobicContact CG2-CE3 3.5Å; I116-W151 VanDerWaalsContact CG2-CE3 3.5Å; I116-W151 HydrophobicContact CG2-CZ3 3.77Å
152	L	76.8	Confident	63.5	Low	22 Å²	22	55.6 Å²	55.6	12%	0.115	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126.2	165.8	174.3	61.9	0	0	0	108.6	H66 Y68 Q117 L119	H66-L152 HydrophobicContact CB-CD1 4.11Å; Y68-L152 HydrophobicContact CD1-CD1 4.27Å; Y68-L152 HydrophobicContact CE1-CB 4.42Å; Y68-L152 HydrophobicContact CE1-CD1 3.78Å; Q117-L152 PolarHBondContact N-O 2.88Å; Q117-L152 PolarHBondContact O-N 3.36Å; L119-L152 HydrophobicContact CD1-CB 3.82Å; L119-L152 HydrophobicContact CG-CB 4.16Å
153	I	77.4	Confident	65.4	Low	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	121.7	177.9	-60.5	175.7	0	0	0	107.4	H66 L67 A69 I78 L80 I116 V155 I166	H66-I153 CarbonylContact C-O 3.55Å; H66-I153 WeakPolarHBondContact CA-O 3.15Å; L67-I153 HydrophobicContact CB-CB 4.08Å; L67-I153 PolarHBondContact N-O 3.01Å; L67-I153 PolarHBondContact O-N 2.95Å; A69-I153 HydrophobicContact CB-CD1 4.49Å; I78-I153 HydrophobicContact CG2-CD1 4.45Å; L80-I153 HydrophobicContact CD1-CG2 3.75Å; L80-I153 HydrophobicContact CD2-CD1 4.42Å; L80-I153 HydrophobicContact CD2-CG2 4.23Å; L80-I153 HydrophobicContact CG-CG2 4.42Å; I116-I153 HydrophobicContact CG1-CG1 4.36Å; I116-I153 HydrophobicContact CG1-CG2 4.48Å; I153-V155 HydrophobicContact CG2-CG2 3.99Å; I153-I166 HydrophobicContact CD1-CD1 3.91Å; I153-I166 HydrophobicContact CD1-CG1 4.41Å; I153-I166 HydrophobicContact CD1-CG2 4.47Å
154	S	75.3	Confident	67.3	Low	4 Å²	4	45.7 Å²	45.7	3%	0.028	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	116.9	175.3	-55.6	0	0	0	0	109.4	F65 H66 A114 K115 Y156	F65-S154 WeakPolarHBondContact O-CA 3.48Å; H66-S154 PolarHBondContact CE1-OG 3.06Å; H66-S154 PolarHBondContact ND1-OG 2.97Å; A114-S154 CarbonylContact C-O 3.6Å; A114-S154 VanDerWaalsContact CA-O 3.29Å; A114-S154 WeakPolarHBondContact CA-O 3.1Å; K115-S154 PolarHBondContact N-O 2.62Å; K115-S154 PolarHBondContact O-N 3.02Å; S154-Y156 WeakPolarHBondContact O-CE2 3.49Å
155	V	74.7	Confident	68.9	Low	1 Å²	1	43.8 Å²	43.8	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	139.8	179.7	-171.5	0	0	0	0	109.1	K64 F65 L80 I153 F158 L164	K64-V155 CarbonylContact C-O 3.58Å; K64-V155 VanDerWaalsContact CA-O 3.27Å; K64-V155 WeakPolarHBondContact CA-O 3.17Å; F65-V155 HydrophobicContact CD1-CB 4.21Å; F65-V155 HydrophobicContact CD2-CB 4.25Å; F65-V155 HydrophobicContact CD2-CG2 4.4Å; F65-V155 HydrophobicContact CE1-CB 3.76Å; F65-V155 HydrophobicContact CE1-CG1 3.86Å; F65-V155 HydrophobicContact CE2-CB 3.81Å; F65-V155 HydrophobicContact CE2-CG2 3.73Å; F65-V155 HydrophobicContact CG-CB 4.45Å; F65-V155 HydrophobicContact CZ-CB 3.55Å; F65-V155 HydrophobicContact CZ-CG1 3.78Å; F65-V155 HydrophobicContact CZ-CG2 3.81Å; F65-V155 PolarHBondContact N-O 3.14Å; F65-V155 PolarHBondContact O-N 2.93Å; L80-V155 HydrophobicContact CD1-CG2 4.11Å; I153-V155 HydrophobicContact CG2-CG2 3.99Å; V155-F158 HydrophobicContact CG1-CB 4.12Å; V155-F158 HydrophobicContact CG1-CD2 3.83Å; V155-F158 HydrophobicContact CG1-CG 4.24Å; V155-L164 HydrophobicContact CG2-CD2 4.37Å
156	Y	75.5	Confident	70.4	Confident	72 Å²	72	34.9 Å²	34.9	28%	0.282	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.3	-173.7	-59.3	-98.1	0	0	0	110.9	P63 K64 H113 K115 S154 F158	P63-Y156 WeakPolarHBondContact O-CA 3.34Å; K64-Y156 HydrophobicContact CB-CD1 4.27Å; K64-Y156 HydrophobicContact CD-CD1 4.37Å; K64-Y156 HydrophobicContact CD-CE1 3.83Å; K64-Y156 HydrophobicContact CG-CD1 4Å; K64-Y156 HydrophobicContact CG-CE1 3.88Å; H113-Y156 PolarHBondContact O-N 3.32Å; K115-Y156 HydrophobicContact CB-CE2 4.25Å; S154-Y156 WeakPolarHBondContact O-CE2 3.49Å; Y156-F158 VanDerWaalsContact C-N 3.3Å; Y156-F158 PolarHBondContact O-N 3.3Å
157	N	69.5	Low	71.8	Confident	53 Å²	53	28.2 Å²	28.2	28%	0.283	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	47.5	45.6	175.7	-69.9	-12.8	0	0	0	114.3	F61 I62 P63 N764	F61-N157 WeakPolarHBondContact CD1-O 3.5Å; I62-N157 CarbonylContact O-C 3.58Å; I62-N157 VanDerWaalsContact O-CA 3.27Å; I62-N157 WeakPolarHBondContact O-CA 3.19Å; I62-N157 PolarHBondContact O-N 3.16Å; I62-N157 VanDerWaalsContact O-N 3.12Å; P63-N157 PolarHBondContact O-N 2.77Å; P63-N157 VanDerWaalsContact O-N 3.08Å; N157-N764 PolarHBondContact ND2-OD1 3.41Å
158	F	70.7	Confident	72.6	Confident	14 Å²	14	23.8 Å²	23.8	6%	0.061	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	145.5	-174.8	-161.3	-101.3	0	0	0	112.5	F61 I62 F65 A82 I94 V155 Y156 M162 L164 L182	F61-F158 WeakPolarHBondContact CA-O 3.43Å; I62-F158 PolarHBondContact N-O 3.37Å; I62-F158 PolarHBondContact O-N 2.79Å; F65-F158 HydrophobicContact CE1-CB 3.76Å; F65-F158 HydrophobicContact CE1-CD1 4.3Å; F65-F158 HydrophobicContact CE1-CG 4.05Å; F65-F158 HydrophobicContact CZ-CG 4.45Å; A82-F158 HydrophobicContact CB-CE2 4.14Å; A82-F158 HydrophobicContact CB-CZ 4.07Å; I94-F158 HydrophobicContact CD1-CD2 4.36Å; I94-F158 HydrophobicContact CD1-CE2 3.74Å; V155-F158 HydrophobicContact CG1-CB 4.12Å; V155-F158 HydrophobicContact CG1-CD2 3.83Å; V155-F158 HydrophobicContact CG1-CG 4.24Å; Y156-F158 VanDerWaalsContact C-N 3.3Å; Y156-F158 PolarHBondContact O-N 3.3Å; F158-M162 HydrophobicContact CE1-CB 3.6Å; F158-M162 HydrophobicContact CZ-CB 3.53Å; F158-M162 HydrophobicContact CZ-CG 4.41Å; F158-L164 HydrophobicContact CD2-CD1 4.39Å; F158-L164 HydrophobicContact CE2-CD1 3.59Å; F158-L164 HydrophobicContact CZ-CB 4.27Å; F158-L164 HydrophobicContact CZ-CD1 3.74Å; F158-L182 HydrophobicContact CD1-CD1 3.64Å; F158-L182 HydrophobicContact CE1-CD1 3.41Å; F158-L182 VanDerWaalsContact CE1-CD1 3.41Å; F158-L182 HydrophobicContact CZ-CD1 4.47Å
159	L	71.9	Confident	73.3	Confident	68 Å²	68	24.3 Å²	24.3	36%	0.356	13%	0.125	S	C	.	.			trans	-84.5	125.4	177.3	-79.1	162.6	0	0	0	110.7	F61 D161 M162	F61-L159 HydrophobicContact CD1-CD2 3.91Å; F61-L159 HydrophobicContact CD1-CG 4.02Å; F61-L159 HydrophobicContact CE1-CD1 4.38Å; F61-L159 HydrophobicContact CE1-CD2 3.4Å; F61-L159 HydrophobicContact CE1-CG 3.63Å; F61-L159 HydrophobicContact CZ-CD2 3.81Å; F61-L159 HydrophobicContact CZ-CG 4.49Å; L159-D161 VanDerWaalsContact C-N 3.28Å; L159-D161 PolarHBondContact O-N 3.09Å; L159-M162 HydrophobicContact CB-CG 3.87Å; L159-M162 HydrophobicContact CD1-CE 4.23Å; L159-M162 WeakPolarHBondContact O-CB 3.32Å; L159-M162 PolarHBondContact O-N 3.45Å
160	P	67	Low	73.5	Confident	32 Å²	32	24.1 Å²	24.1	21%	0.208	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-18.1	-175.9	28.3	-35.4	0	0	0	114.7	Y54 I62 M162	Y54-P160 HydrophobicContact CE1-CB 4.12Å; Y54-P160 WeakPolarHBondContact OH-CB 3.34Å; I62-P160 HydrophobicContact CD1-CB 4.37Å; P160-M162 PolarHBondContact O-N 3.27Å
161	D	68.9	Low	73.3	Confident	107 Å²	107	29.2 Å²	29.2	57%	0.572	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	0	174.9	-62.1	-51.6	0	0	0	113.7	K85 L159	K85-D161 PolarHBondContact N-O 2.62Å; L159-D161 VanDerWaalsContact C-N 3.28Å; L159-D161 PolarHBondContact O-N 3.09Å
162	M	70.2	Confident	73.1	Confident	26 Å²	26	31.9 Å²	31.9	13%	0.128	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	142.2	175.4	-63.8	-79.7	-161.7	0	0	110.9	A82 I83 H84 I92 F158 L159 P160	A82-M162 HydrophobicContact CB-CB 4.41Å; A82-M162 HydrophobicContact CB-SD 4.31Å; I83-M162 WeakPolarHBondContact O-CA 3.38Å; H84-M162 VanDerWaalsContact CA-SD 3.5Å; H84-M162 HydrophobicContact CB-CE 4.34Å; H84-M162 HydrophobicContact CB-SD 3.66Å; I92-M162 HydrophobicContact CD1-CE 3.81Å; I92-M162 HydrophobicContact CD1-SD 4.32Å; F158-M162 HydrophobicContact CE1-CB 3.6Å; F158-M162 HydrophobicContact CZ-CB 3.53Å; F158-M162 HydrophobicContact CZ-CG 4.41Å; L159-M162 HydrophobicContact CB-CG 3.87Å; L159-M162 HydrophobicContact CD1-CE 4.23Å; L159-M162 WeakPolarHBondContact O-CB 3.32Å; L159-M162 PolarHBondContact O-N 3.45Å; P160-M162 PolarHBondContact O-N 3.27Å
163	K	74.2	Confident	72.8	Confident	24 Å²	24	31.4 Å²	31.4	10%	0.104	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	136.7	165.2	-60.7	175.9	178.1	-89.4	0	109.1	A82 I83 L179 I180 D181 Q561	A82-K163 CarbonylContact C-O 3.48Å; A82-K163 VanDerWaalsContact CA-O 3.27Å; A82-K163 WeakPolarHBondContact CA-O 2.78Å; I83-K163 PolarHBondContact N-O 2.99Å; I83-K163 PolarHBondContact O-N 2.95Å; K163-L179 HydrophobicContact CB-CB 4.34Å; K163-L179 HydrophobicContact CD-CB 4.19Å; K163-L179 HydrophobicContact CD-CD1 3.78Å; K163-I180 WeakPolarHBondContact CA-O 3.3Å; K163-D181 WeakPolarHBondContact CG-OD1 3.03Å; K163-D181 IonicContact NZ-OD1 2.74Å; K163-D181 PolarHBondContact NZ-OD1 3.03Å; K163-D181 IonicContact NZ-OD2 2.71Å; K163-Q561 VanDerWaalsContact NZ-CD 3.32Å
164	L	75.6	Confident	72.5	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	150.5	177.2	-164.9	81.2	0	0	0	110.4	F65 L67 L80 G81 I94 V155 F158 I180	F65-L164 HydrophobicContact CE2-CD2 4.13Å; F65-L164 HydrophobicContact CZ-CD2 4.15Å; L67-L164 HydrophobicContact CD1-CD2 3.47Å; L67-L164 VanDerWaalsContact CD1-CD2 3.47Å; L80-L164 HydrophobicContact CD2-CD1 4.49Å; L80-L164 HydrophobicContact CD2-CD2 4.19Å; L80-L164 HydrophobicContact CD2-CG 4.38Å; G81-L164 CarbonylContact O-C 3.48Å; I94-L164 HydrophobicContact CD1-CD1 3.49Å; I94-L164 VanDerWaalsContact CD1-CD1 3.49Å; V155-L164 HydrophobicContact CG2-CD2 4.37Å; F158-L164 HydrophobicContact CD2-CD1 4.39Å; F158-L164 HydrophobicContact CE2-CD1 3.59Å; F158-L164 HydrophobicContact CZ-CB 4.27Å; F158-L164 HydrophobicContact CZ-CD1 3.74Å; L164-I180 HydrophobicContact CB-CB 4.2Å; L164-I180 HydrophobicContact CD2-CD1 4.41Å; L164-I180 PolarHBondContact N-O 2.82Å; L164-I180 WeakPolarHBondContact O-CB 3.43Å; L164-I180 PolarHBondContact O-N 3.33Å
165	L	77.9	Confident	72.3	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	150.3	167	68.2	92.8	0	0	0	111.3	G81 I83 I91 L167 L179	G81-L165 PolarHBondContact N-O 2.93Å; G81-L165 PolarHBondContact O-N 3.12Å; I83-L165 HydrophobicContact CD1-CD2 3.69Å; I83-L165 HydrophobicContact CG1-CD2 3.87Å; I91-L165 HydrophobicContact CD1-CD2 4.17Å; I91-L165 HydrophobicContact CG1-CD2 4.27Å; I91-L165 HydrophobicContact CG2-CD2 4.49Å; L165-L167 HydrophobicContact CD1-CD1 4.36Å; L165-L167 HydrophobicContact CD1-CD2 3.53Å; L165-L167 HydrophobicContact CD1-CG 3.59Å; L165-L179 HydrophobicContact CB-CD2 4.14Å; L165-L179 HydrophobicContact CD2-CD2 3.69Å
166	I	77.7	Confident	72.3	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.2	177.9	-52.7	179	0	0	0	108.1	P48 A69 I71 I78 L80 I153 S176 S177 I180	P48-I166 HydrophobicContact CB-CD1 4.15Å; P48-I166 HydrophobicContact CG-CD1 4.06Å; A69-I166 HydrophobicContact CB-CD1 4.07Å; I71-I166 HydrophobicContact CD1-CG2 4.45Å; I78-I166 HydrophobicContact CG2-CG2 3.84Å; L80-I166 HydrophobicContact CD2-CG1 4.12Å; I153-I166 HydrophobicContact CD1-CD1 3.91Å; I153-I166 HydrophobicContact CD1-CG1 4.41Å; I153-I166 HydrophobicContact CD1-CG2 4.47Å; I166-S176 CarbonylContact O-C 3.56Å; I166-S176 WeakPolarHBondContact O-CA 3.48Å; I166-S177 PolarHBondContact N-OG 2.68Å; I166-S177 PolarHBondContact O-N 2.95Å; I166-I180 HydrophobicContact CG1-CD1 4.44Å
167	L	77.3	Confident	72.1	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.01	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.1	171.4	-65	174.2	0	0	0	108.9	I78 Q79 Y93 L165 T174 V175	I78-L167 CarbonylContact C-O 3.53Å; I78-L167 WeakPolarHBondContact CA-O 3.48Å; Q79-L167 HydrophobicContact CB-CB 4.27Å; Q79-L167 PolarHBondContact N-O 2.82Å; Q79-L167 PolarHBondContact O-N 3.14Å; Y93-L167 HydrophobicContact CD1-CD1 4.19Å; Y93-L167 HydrophobicContact CE1-CD1 3.39Å; L165-L167 HydrophobicContact CD1-CD1 4.36Å; L165-L167 HydrophobicContact CD1-CD2 3.53Å; L165-L167 HydrophobicContact CD1-CG 3.59Å; L167-T174 HydrophobicContact CB-CG2 3.89Å; L167-T174 HydrophobicContact CD2-CG2 4.06Å; L167-T174 HydrophobicContact CG-CG2 4.44Å; L167-V175 CarbonylContact C-O 2.81Å; L167-V175 WeakPolarHBondContact CA-O 2.9Å
168	A	75	Confident	72	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	112.2	169.8	0	0	0	0	0	109.6	I45 I71 A76 T77 T174 V175	I45-A168 HydrophobicContact CD1-CB 3.7Å; I45-A168 HydrophobicContact CG1-CB 3.93Å; I71-A168 HydrophobicContact CD1-CB 4.33Å; I71-A168 HydrophobicContact CG2-CB 3.97Å; A76-A168 HydrophobicContact CB-CB 4.43Å; T77-A168 CarbonylContact O-C 3.54Å; T77-A168 WeakPolarHBondContact O-CA 3.36Å; A168-T174 WeakPolarHBondContact O-CA 3.23Å; A168-V175 PolarHBondContact N-O 2.6Å; A168-V175 PolarHBondContact O-N 3.21Å
169	T	76	Confident	71.9	Confident	41 Å²	41	27.8 Å²	27.8	25%	0.252	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	135.2	-178.5	-48	0	0	0	0	110.7	A76 T77 T174	A76-T169 VanDerWaalsContact CA-O 3.3Å; A76-T169 WeakPolarHBondContact CA-O 3.28Å; T77-T169 PolarHBondContact N-O 3.22Å; T77-T169 PolarHBondContact O-N 3.38Å; T169-T174 WeakPolarHBondContact OG1-CG2 3.43Å
170	T	69.7	Low	71.9	Confident	19 Å²	19	24.6 Å²	24.6	12%	0.117	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	173.1	176.6	63.4	0	0	0	0	111.2	F44 P73 A76 Y172 G173	F44-T170 HydrophobicContact CE1-CG2 3.7Å; F44-T170 HydrophobicContact CZ-CG2 4.28Å; P73-T170 HydrophobicContact CG-CG2 3.86Å; A76-T170 HydrophobicContact CB-CG2 3.88Å; T170-Y172 PolarHBondContact O-N 2.97Å; T170-Y172 VanDerWaalsContact O-N 3.11Å; T170-Y172 PolarHBondContact OG1-N 3.49Å; T170-G173 PolarHBondContact N-O 2.91Å; T170-G173 PolarHBondContact O-N 2.72Å; T170-G173 PolarHBondContact OG1-O 2.8Å
171	N	67.4	Low	71.8	Confident	115 Å²	115	23.8 Å²	23.8	62%	0.615	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-15.1	169.9	63.1	-61.3	0	0	0	114.2
172	Y	66.4	Low	71.7	Confident	68 Å²	68	19.4 Å²	19.4	27%	0.267	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-4.3	175.8	-54.4	-69.6	0	0	0	113.6	N40 P42 T170 G552 Y585	N40-Y172 WeakPolarHBondContact O-CE2 3.43Å; N40-Y172 PolarHBondContact O-OH 2.76Å; P42-Y172 HydrophobicContact CG-CD2 3.7Å; P42-Y172 HydrophobicContact CG-CE2 3.79Å; T170-Y172 PolarHBondContact O-N 2.97Å; T170-Y172 VanDerWaalsContact O-N 3.11Å; T170-Y172 PolarHBondContact OG1-N 3.49Å; Y172-G552 WeakPolarHBondContact O-CA 3.48Å; Y172-Y585 HydrophobicContact CD1-CE2 4.5Å; Y172-Y585 AromaticContact CD1-CZ 4Å; Y172-Y585 WeakPolarHBondContact O-CE2 3.44Å
173	G	69.5	Low	71.6	Confident	12 Å²	12	21 Å²	21	12%	0.124	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	122.2	-174.2	-172.7	0	0	0	0	0	113.5	T170 N521	T170-G173 PolarHBondContact N-O 2.91Å; T170-G173 PolarHBondContact O-N 2.72Å; T170-G173 PolarHBondContact OG1-O 2.8Å; G173-N521 WeakPolarHBondContact CA-OD1 3.12Å
174	T	72	Confident	71.2	Confident	18 Å²	18	22.4 Å²	22.4	11%	0.11	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	132.9	-176.1	-36.6	0	0	0	0	111.6	L167 A168 T169 N521	L167-T174 HydrophobicContact CB-CG2 3.89Å; L167-T174 HydrophobicContact CD2-CG2 4.06Å; L167-T174 HydrophobicContact CG-CG2 4.44Å; A168-T174 WeakPolarHBondContact O-CA 3.23Å; T169-T174 WeakPolarHBondContact OG1-CG2 3.43Å; T174-N521 VanDerWaalsContact CB-C 3.44Å; T174-N521 WeakPolarHBondContact CB-O 3.41Å; T174-N521 PolarHBondContact OG1-O 2.9Å
175	V	72	Confident	71	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.006	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.6	171.3	-179.9	0	0	0	0	110.1	F44 L167 A168 I553	F44-V175 HydrophobicContact CB-CG1 4.32Å; F44-V175 HydrophobicContact CB-CG2 4.44Å; F44-V175 HydrophobicContact CD1-CB 4.15Å; F44-V175 HydrophobicContact CD1-CG2 3.58Å; F44-V175 HydrophobicContact CD2-CG2 3.9Å; F44-V175 HydrophobicContact CE1-CB 4.42Å; F44-V175 HydrophobicContact CE1-CG2 3.56Å; F44-V175 HydrophobicContact CE2-CG2 3.89Å; F44-V175 HydrophobicContact CG-CB 4.42Å; F44-V175 HydrophobicContact CG-CG1 4.48Å; F44-V175 HydrophobicContact CG-CG2 3.74Å; F44-V175 HydrophobicContact CZ-CG2 3.71Å; L167-V175 CarbonylContact C-O 2.81Å; L167-V175 WeakPolarHBondContact CA-O 2.9Å; A168-V175 PolarHBondContact N-O 2.6Å; A168-V175 PolarHBondContact O-N 3.21Å; V175-I553 HydrophobicContact CG2-CD1 3.47Å; V175-I553 VanDerWaalsContact CG2-CD1 3.47Å; V175-I553 HydrophobicContact CG2-CG2 4.3Å
176	S	73.2	Confident	70.7	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.007	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	147.3	166.9	73	0	0	0	0	112.1	I166 Q555	I166-S176 CarbonylContact O-C 3.56Å; I166-S176 WeakPolarHBondContact O-CA 3.48Å; S176-Q555 PolarHBondContact O-NE2 2.78Å; S176-Q555 PolarHBondContact OG-NE2 2.79Å; S176-Q555 PolarHBondContact OG-OE1 3.24Å
177	S	71.4	Confident	70.8	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.007	15%	0.147	C	C	.	.			trans	-64.2	175.3	156.7	66.6	0	0	0	0	111.2	I166	I166-S177 PolarHBondContact N-OG 2.68Å; I166-S177 PolarHBondContact O-N 2.95Å
178	H	68.3	Low	70.7	Confident	22 Å²	22	29.4 Å²	29.4	10%	0.102	16%	0.162	C	C	.	.			trans	-61.4	173.2	155.7	57.8	-121.7	0	0	0	111	E47 P48 D50	E47-H178 WeakPolarHBondContact CB-NE2 3.47Å; E47-H178 IonicContact OE2-CE1 2.62Å; E47-H178 PolarHBondContact OE2-CE1 3.05Å; E47-H178 IonicContact OE2-ND1 2.69Å; P48-H178 VanDerWaalsContact C-NE2 3.29Å; P48-H178 PolarHBondContact O-NE2 2.95Å; D50-H178 IonicContact OD1-CE1 2.7Å; D50-H178 IonicContact OD1-ND1 3.24Å; D50-H178 IonicContact OD1-NE2 3.36Å; D50-H178 PolarHBondContact OD1-NE2 3.45Å
179	L	68.5	Low	71	Confident	25 Å²	25	33.5 Å²	33.5	13%	0.131	20%	0.196	C	C	.	.			trans	-80.8	122.5	172.7	-61	177.9	0	0	0	110.7	I83 K163 L165 I515 M557	I83-L179 HydrophobicContact CD1-CD2 3.72Å; I83-L179 HydrophobicContact CG1-CD2 4.43Å; K163-L179 HydrophobicContact CB-CB 4.34Å; K163-L179 HydrophobicContact CD-CB 4.19Å; K163-L179 HydrophobicContact CD-CD1 3.78Å; L165-L179 HydrophobicContact CB-CD2 4.14Å; L165-L179 HydrophobicContact CD2-CD2 3.69Å; L179-I515 HydrophobicContact CD1-CD1 4.04Å; L179-M557 HydrophobicContact CD1-CE 3.65Å; L179-M557 HydrophobicContact CD2-CE 3.96Å; L179-M557 HydrophobicContact CG-CE 3.68Å; L179-M557 HydrophobicContact CG-SD 4.29Å
180	I	71.3	Confident	71.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-87.5	114.6	174.7	-57.9	168.2	0	0	0	108.1	P48 I49 D50 I52 L67 K163 L164 I166	P48-I180 HydrophobicContact CB-CD1 4.02Å; P48-I180 HydrophobicContact CG-CD1 3.71Å; P48-I180 HydrophobicContact CG-CG1 4.1Å; I49-I180 WeakPolarHBondContact O-CG2 3.41Å; D50-I180 WeakPolarHBondContact O-CA 3.4Å; I52-I180 HydrophobicContact CD1-CG2 3.76Å; I52-I180 HydrophobicContact CG1-CG2 3.81Å; L67-I180 HydrophobicContact CD1-CD1 3.88Å; L67-I180 HydrophobicContact CD2-CD1 4.33Å; K163-I180 WeakPolarHBondContact CA-O 3.3Å; L164-I180 HydrophobicContact CB-CB 4.2Å; L164-I180 HydrophobicContact CD2-CD1 4.41Å; L164-I180 PolarHBondContact N-O 2.82Å; L164-I180 WeakPolarHBondContact O-CB 3.43Å; L164-I180 PolarHBondContact O-N 3.33Å; I166-I180 HydrophobicContact CG1-CD1 4.44Å
181	D	64.7	Low	71.9	Confident	15 Å²	15	34.3 Å²	34.3	8%	0.08	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	148.4	172.5	-84	1.7	0	0	0	111	D50 R51 I52 K163 K183 Q561	D50-D181 PolarHBondContact O-N 3.18Å; R51-D181 CarbonylContact C-O 3.58Å; R51-D181 WeakPolarHBondContact CA-O 3.15Å; R51-D181 HydrophobicContact CG-CB 4.29Å; I52-D181 PolarHBondContact N-O 3.04Å; K163-D181 WeakPolarHBondContact CG-OD1 3.03Å; K163-D181 IonicContact NZ-OD1 2.74Å; K163-D181 PolarHBondContact NZ-OD1 3.03Å; K163-D181 IonicContact NZ-OD2 2.71Å; D181-K183 IonicContact OD2-NZ 3.99Å; D181-Q561 PolarHBondContact OD2-NE2 3.11Å
182	L	67.8	Low	72.4	Confident	15 Å²	15	35 Å²	35	8%	0.079	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.9	162.6	-62.8	109	0	0	0	110	I52 I62 F65 F158	I52-L182 HydrophobicContact CB-CD2 3.84Å; I52-L182 HydrophobicContact CB-CG 4.07Å; I52-L182 HydrophobicContact CD1-CD2 4.15Å; I52-L182 HydrophobicContact CG2-CD2 3.9Å; I52-L182 CarbonylContact O-C 3.55Å; I52-L182 VanDerWaalsContact O-CA 3.32Å; I52-L182 WeakPolarHBondContact O-CA 3.04Å; I62-L182 HydrophobicContact CD1-CB 4.03Å; I62-L182 HydrophobicContact CD1-CD2 3.54Å; I62-L182 HydrophobicContact CD1-CG 4.33Å; F65-L182 HydrophobicContact CD1-CD2 4.05Å; F65-L182 HydrophobicContact CE1-CD2 3.62Å; F65-L182 HydrophobicContact CE2-CD2 4.46Å; F65-L182 HydrophobicContact CZ-CD2 3.85Å; F158-L182 HydrophobicContact CD1-CD1 3.64Å; F158-L182 HydrophobicContact CE1-CD1 3.41Å; F158-L182 VanDerWaalsContact CE1-CD1 3.41Å; F158-L182 HydrophobicContact CZ-CD1 4.47Å
183	K	67	Low	73	Confident	61 Å²	61	35.6 Å²	35.6	27%	0.265	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	142.9	-176.3	-66.7	-170.5	177.2	-175.5	0	111.4	I52 Y53 Y54 D181	I52-K183 PolarHBondContact O-N 3.03Å; Y53-K183 VanDerWaalsContact CA-O 3.29Å; Y53-K183 WeakPolarHBondContact CA-O 3.3Å; Y53-K183 HydrophobicContact CD1-CB 3.82Å; Y53-K183 HydrophobicContact CE1-CB 3.65Å; Y53-K183 HydrophobicContact CE1-CD 4.27Å; Y54-K183 WeakPolarHBondContact CD1-O 3.44Å; Y54-K183 PolarHBondContact N-O 2.77Å; D181-K183 IonicContact OD2-NZ 3.99Å
184	T	66.6	Low	73.6	Confident	52 Å²	52	39.8 Å²	39.8	32%	0.319	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	139.6	171.6	42.7	0	0	0	0	110.2	Y54 V186	Y54-T184 HydrophobicContact CE1-CG2 4Å; Y54-T184 HydrophobicContact CE2-CG2 3.94Å; Y54-T184 VanDerWaalsContact CZ-CG2 3.49Å; Y54-T184 VanDerWaalsContact OH-CG2 3.28Å; Y54-T184 WeakPolarHBondContact OH-CG2 3.31Å; T184-V186 PolarHBondContact O-N 3.27Å
185	S	72.2	Confident	74.3	Confident	10 Å²	10	42.1 Å²	42.1	7%	0.07	25%	0.254	C	S	.	.			trans	-70.3	127.2	165.6	65.6	0	0	0	0	109.3	Y54 Q216 F297	Y54-S185 PolarHBondContact O-N 3.38Å; Y54-S185 PolarHBondContact O-OG 2.97Å; S185-Q216 WeakPolarHBondContact CA-O 3.02Å; S185-F297 VanDerWaalsContact CB-CE2 3.48Å
186	V	71.1	Confident	74.9	Confident	64 Å²	64	43.7 Å²	43.7	39%	0.388	26%	0.261	S	S	.	.	B	Isolated β-bridge	trans	-119.6	125.7	-179.4	-173.8	0	0	0	0	108.9	T184 S215 Q216	T184-V186 PolarHBondContact O-N 3.27Å; V186-S215 CarbonylContact O-C 3.59Å; V186-S215 WeakPolarHBondContact O-CA 3.41Å; V186-S215 VanDerWaalsContact O-CB 3.31Å; V186-S215 WeakPolarHBondContact O-CB 3.31Å; V186-Q216 PolarHBondContact N-O 2.83Å; V186-Q216 VanDerWaalsContact N-O 3.08Å; V186-Q216 PolarHBondContact O-N 2.95Å
187	L	78.6	Confident	75.7	Confident	28 Å²	28	51.7 Å²	51.7	15%	0.147	29%	0.292	C	S	.	.			trans	-121.7	92.1	170.7	-174.8	65.1	0	0	0	107.3	P213 P220 V294 L296 K299 I301	L187-P213 HydrophobicContact CD1-CG 4.1Å; L187-P220 HydrophobicContact CD1-CB 4.1Å; L187-P220 HydrophobicContact CD1-CG 4.41Å; L187-V294 HydrophobicContact CD1-CG2 3.99Å; L187-V294 HydrophobicContact CD2-CG2 4.47Å; L187-L296 HydrophobicContact CB-CB 4.31Å; L187-L296 HydrophobicContact CB-CD2 4.28Å; L187-L296 HydrophobicContact CD1-CB 4.22Å; L187-L296 HydrophobicContact CD2-CB 4.02Å; L187-L296 HydrophobicContact CG-CB 4.42Å; L187-K299 HydrophobicContact CD2-CB 4.14Å; L187-K299 WeakPolarHBondContact CD2-O 3.4Å; L187-I301 HydrophobicContact CD2-CD1 4.4Å; L187-I301 HydrophobicContact CD2-CG1 4.07Å; L187-I301 HydrophobicContact CG-CD1 4.03Å; L187-I301 HydrophobicContact CG-CG1 4.25Å
188	P	76.8	Confident	76.4	Confident	49 Å²	49	52.8 Å²	52.8	32%	0.318	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-78.5	168.1	179.4	31.4	-29.2	0	0	0	110.9	P213 L214 I301	P188-P213 HydrophobicContact CG-CB 4.01Å; P188-P213 WeakPolarHBondContact O-CB 3.49Å; P188-L214 WeakPolarHBondContact CG-O 3.45Å; P188-I301 WeakPolarHBondContact O-CD1 3.02Å
189	A	81.2	Confident	77.4	Confident	86 Å²	86	55.7 Å²	55.7	71%	0.711	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-60.4	155.1	175.6	0	0	0	0	0	112.2
190	F	85	Confident	78.3	Confident	33 Å²	33	55.7 Å²	55.7	15%	0.145	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-56.7	146.2	176.6	-85	-94.2	0	0	0	112.5	H211 V294 I301 S302 S303	F190-H211 VanDerWaalsContact CD1-O 3.26Å; F190-H211 WeakPolarHBondContact CD1-O 3.47Å; F190-V294 HydrophobicContact CE1-CG1 4.39Å; F190-V294 HydrophobicContact CE2-CG2 3.73Å; F190-V294 HydrophobicContact CZ-CB 4.36Å; F190-V294 HydrophobicContact CZ-CG1 3.77Å; F190-V294 HydrophobicContact CZ-CG2 3.79Å; F190-I301 HydrophobicContact CD2-CD1 4.06Å; F190-I301 HydrophobicContact CD2-CG1 4.27Å; F190-I301 HydrophobicContact CE2-CD1 4.22Å; F190-I301 HydrophobicContact CE2-CG1 4Å; F190-S302 WeakPolarHBondContact CD2-O 3.46Å; F190-S302 WeakPolarHBondContact CE2-O 3.29Å; F190-S303 VanDerWaalsContact CE2-N 3.27Å
191	P	78.9	Confident	79.1	Confident	45 Å²	45	56.3 Å²	56.3	29%	0.292	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-60.8	143.8	170.8	27.3	-34.3	0	0	0	110.9	H193 H211	P191-H193 PolarHBondContact O-N 3.32Å; P191-H211 HydrophobicContact CG-CB 4.16Å
192	P	77.3	Confident	80.3	Confident	130 Å²	130	58.3 Å²	58.3	84%	0.844	33%	0.334	S	S	*	.			trans	-73.3	110.5	-179.9	28.8	-33.4	0	0	0	110.6
193	H	78.7	Confident	81.2	Confident	80 Å²	80	58.5 Å²	58.5	37%	0.37	34%	0.339	S	S	.	.			trans	-132.2	150	176.5	-74.7	2.4	0	0	0	111	P191 H211 Q305	P191-H193 PolarHBondContact O-N 3.32Å; H193-H211 AromaticContact CD2-CD2 3.42Å; H193-H211 PolarHBondContact CD2-CD2 3.49Å; H193-H211 VanDerWaalsContact CD2-CD2 3.42Å; H193-H211 AromaticContact CD2-CG 3.29Å; H193-H211 AromaticContact CD2-ND1 3.74Å; H193-H211 AromaticContact CD2-NE2 3.94Å; H193-H211 AromaticContact NE2-CD2 3.17Å; H193-H211 PolarHBondContact NE2-CD2 2.96Å; H193-H211 AromaticContact NE2-CG 3.47Å; H193-H211 AromaticContact NE2-NE2 3.9Å; H193-Q305 HydrophobicContact CB-CG 4.29Å
194	S	82.2	Confident	82.3	Confident	100 Å²	100	55.8 Å²	55.8	70%	0.699	33%	0.328	S	S	*	.			trans	-78.5	151	177.9	52.9	0	0	0	0	112.5	Q305	S194-Q305 WeakPolarHBondContact O-CG 3.5Å; S194-Q305 PolarHBondContact O-NE2 2.96Å
195	D	86.6	Confident	83.4	Confident	66 Å²	66	54.1 Å²	54.1	35%	0.353	32%	0.318	S	S	.	.			trans	-58.4	141.9	173.4	-70.4	-10.1	0	0	0	111.5	Q305 R306	D195-Q305 WeakPolarHBondContact OD1-CA 3.34Å; D195-R306 CarbonylContact C-O 3.6Å; D195-R306 VanDerWaalsContact CA-O 3.26Å; D195-R306 WeakPolarHBondContact CA-O 3.26Å; D195-R306 WeakPolarHBondContact CB-O 3.5Å; D195-R306 PolarHBondContact OD1-N 3.11Å
196	K	86.5	Confident	84.2	Confident	35 Å²	35	53.7 Å²	53.7	15%	0.152	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.8	-172	-173.2	169.7	-174	168.8	0	110.7	R306 T307 H308 D330	K196-R306 PolarHBondContact N-O 3.31Å; K196-T307 CarbonylContact O-C 3.42Å; K196-T307 VanDerWaalsContact O-CA 3.29Å; K196-T307 WeakPolarHBondContact O-CA 3.41Å; K196-H308 PolarHBondContact O-N 2.96Å; K196-D330 WeakPolarHBondContact CE-OD2 3.4Å; K196-D330 IonicContact NZ-OD2 2.63Å; K196-D330 PolarHBondContact NZ-OD2 2.8Å
197	Y	89.5	Confident	85.1	Confident	168 Å²	168	51 Å²	51	66%	0.659	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.6	176.5	-65.3	-92	0	0	0	110.1	H308	Y197-H308 HydrophobicContact CD1-CB 3.53Å; Y197-H308 HydrophobicContact CE1-CB 3.64Å; Y197-H308 AromaticContact CE1-CD2 3.74Å; Y197-H308 AromaticContact CE1-CG 3.62Å; Y197-H308 HydrophobicContact CG-CB 4.34Å; Y197-H308 AromaticContact CZ-CD2 3.85Å
198	L	85.9	Confident	85.7	Confident	25 Å²	25	49.8 Å²	49.8	13%	0.131	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	117.2	177.6	-67.6	176.8	0	0	0	108.8	T307 H308 L309 V310	L198-T307 HydrophobicContact CD1-CG2 3.68Å; L198-T307 HydrophobicContact CG-CG2 4.16Å; L198-H308 PolarHBondContact N-O 2.71Å; L198-L309 HydrophobicContact CB-CD1 3.91Å; L198-L309 CarbonylContact O-C 3.58Å; L198-L309 WeakPolarHBondContact O-CA 3.3Å; L198-V310 PolarHBondContact O-N 2.83Å
199	S	88.1	Confident	86.3	Confident	83 Å²	83	47.8 Å²	47.8	58%	0.58	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.6	162.1	-173.7	0	0	0	0	107.2	V310	S199-V310 WeakPolarHBondContact CA-O 3.49Å
200	L	87.5	Confident	86.8	Confident	24 Å²	24	43.8 Å²	43.8	13%	0.126	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	152.6	-176.7	-68.1	176.2	0	0	0	111.8	A206 L282 L309 V310 V311 T312 E372	L200-A206 HydrophobicContact CD1-CB 3.64Å; L200-L282 HydrophobicContact CB-CD1 3.81Å; L200-L282 HydrophobicContact CD1-CD1 4.06Å; L200-L309 HydrophobicContact CB-CD1 4.35Å; L200-L309 HydrophobicContact CD1-CD1 3.9Å; L200-L309 HydrophobicContact CG-CD1 4.27Å; L200-V310 PolarHBondContact N-O 3.15Å; L200-V311 WeakPolarHBondContact O-CA 3.46Å; L200-T312 PolarHBondContact O-N 3.07Å; L200-T312 PolarHBondContact O-OG1 3.11Å; L200-E372 VanDerWaalsContact CA-OE1 3.26Å; L200-E372 WeakPolarHBondContact CA-OE1 3.39Å; L200-E372 WeakPolarHBondContact CD2-OE1 3.35Å; L200-E372 WeakPolarHBondContact CD2-OE2 3.25Å
201	L	88.9	Confident	86.8	Confident	14 Å²	14	42.6 Å²	42.6	7%	0.073	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.3	-179.1	-61.6	177.2	0	0	0	112.3	N204 P314 I318 E372 A374	L201-N204 WeakPolarHBondContact CB-ND2 3.27Å; L201-N204 WeakPolarHBondContact O-CB 2.9Å; L201-N204 PolarHBondContact O-N 3.24Å; L201-N204 PolarHBondContact O-ND2 3.28Å; L201-N204 VanDerWaalsContact O-ND2 3.1Å; L201-P314 HydrophobicContact CD2-CB 3.94Å; L201-P314 HydrophobicContact CD2-CG 4.12Å; L201-I318 HydrophobicContact CD1-CB 4.13Å; L201-I318 HydrophobicContact CD1-CD1 3.71Å; L201-I318 HydrophobicContact CD1-CG1 4.48Å; L201-I318 HydrophobicContact CD1-CG2 4.17Å; L201-I318 HydrophobicContact CD2-CD1 3.83Å; L201-I318 HydrophobicContact CG-CD1 4.4Å; L201-E372 HydrophobicContact CB-CG 4.42Å; L201-E372 HydrophobicContact CD1-CG 3.93Å; L201-E372 HydrophobicContact CG-CG 4.19Å; L201-E372 WeakPolarHBondContact CG-OE1 3.45Å; L201-E372 PolarHBondContact N-OE1 3.48Å; L201-A374 HydrophobicContact CD1-CB 4.32Å
202	I	89.7	Confident	87.1	Confident	56 Å²	56	40.7 Å²	40.7	29%	0.287	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	140.4	176.1	-162.1	178.8	0	0	0	112.1	N204 L282 L284 V311 T312 K313	I202-N204 VanDerWaalsContact C-N 3.27Å; I202-N204 PolarHBondContact O-N 3.4Å; I202-N204 PolarHBondContact O-ND2 3.31Å; I202-L282 WeakPolarHBondContact CG1-O 3.28Å; I202-L284 HydrophobicContact CD1-CD1 4.36Å; I202-L284 HydrophobicContact CD1-CG 4.02Å; I202-V311 HydrophobicContact CB-CG1 3.91Å; I202-V311 HydrophobicContact CG1-CG1 4.12Å; I202-T312 PolarHBondContact N-O 3.31Å; I202-K313 HydrophobicContact CG2-CB 4.36Å; I202-K313 HydrophobicContact CG2-CG 4.26Å
203	G	87	Confident	87.3	Confident	19 Å²	19	34.8 Å²	34.8	20%	0.196	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	-21	-178.3	0	0	0	0	0	115.7	S281 L282	G203-S281 VanDerWaalsContact O-CB 3.31Å; G203-S281 WeakPolarHBondContact O-CB 3.45Å; G203-L282 PolarHBondContact N-O 3.3Å
204	N	89.5	Confident	87.1	Confident	5 Å²	5	35.6 Å²	35.6	3%	0.027	20%	0.196	C	C	.	.	S	Bend	trans	-76	-174.6	176.2	-65.5	-93.3	0	0	0	111.6	L201 I202 L282 F371 E372 S373	L201-N204 WeakPolarHBondContact CB-ND2 3.27Å; L201-N204 WeakPolarHBondContact O-CB 2.9Å; L201-N204 PolarHBondContact O-N 3.24Å; L201-N204 PolarHBondContact O-ND2 3.28Å; L201-N204 VanDerWaalsContact O-ND2 3.1Å; I202-N204 VanDerWaalsContact C-N 3.27Å; I202-N204 PolarHBondContact O-N 3.4Å; I202-N204 PolarHBondContact O-ND2 3.31Å; N204-L282 WeakPolarHBondContact O-CB 3.24Å; N204-L282 VanDerWaalsContact O-CG 3.28Å; N204-L282 WeakPolarHBondContact O-CG 3.29Å; N204-L282 PolarHBondContact O-N 3.12Å; N204-F371 PolarHBondContact OD1-O 2.85Å; N204-E372 WeakPolarHBondContact OD1-CA 3.36Å; N204-S373 PolarHBondContact ND2-O 2.99Å; N204-S373 PolarHBondContact OD1-N 3.33Å; N204-S373 PolarHBondContact OD1-O 3.25Å; N204-S373 PolarHBondContact OD1-OG 2.79Å
205	T	89.7	Confident	86.5	Confident	17 Å²	17	31.2 Å²	31.2	10%	0.104	17%	0.165	C	C	.	.			trans	-104.9	122	-179.3	-55.1	0	0	0	0	111.3	L278 I279 H280 I370 F397	T205-L278 HydrophobicContact CG2-CB 4.27Å; T205-L278 HydrophobicContact CG2-CD2 4.49Å; T205-I279 CarbonylContact C-O 3.48Å; T205-I279 VanDerWaalsContact CA-O 3.28Å; T205-I279 WeakPolarHBondContact CA-O 3.02Å; T205-H280 HydrophobicContact CG2-CB 4.19Å; T205-H280 PolarHBondContact OG1-ND1 3.45Å; T205-I370 HydrophobicContact CG2-CD1 4.03Å; T205-F397 HydrophobicContact CG2-CD1 4.26Å
206	A	90.3	Very high	85.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	155.1	171.4	0	0	0	0	0	112.8	L200 L278 I279 L282 L309	L200-A206 HydrophobicContact CD1-CB 3.64Å; A206-L278 WeakPolarHBondContact O-CA 3.49Å; A206-I279 HydrophobicContact CB-CB 4.26Å; A206-I279 PolarHBondContact N-O 3.39Å; A206-I279 PolarHBondContact O-N 2.76Å; A206-L282 HydrophobicContact CB-CD1 3.96Å; A206-L282 HydrophobicContact CB-CD2 3.75Å; A206-L282 HydrophobicContact CB-CG 4.16Å; A206-L309 HydrophobicContact CB-CD1 4.48Å; A206-L309 HydrophobicContact CB-CD2 4.15Å
207	V	89.7	Confident	83.6	Confident	7 Å²	7	30.1 Å²	30.1	4%	0.042	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	91.9	177.8	-173.3	0	0	0	0	108.6	I209 I276 L278 F368 I370	V207-I209 HydrophobicContact CG1-CG1 4.22Å; V207-I276 HydrophobicContact CG1-CD1 4.5Å; V207-I276 HydrophobicContact CG1-CG2 3.65Å; V207-L278 HydrophobicContact CB-CD2 4.27Å; V207-L278 HydrophobicContact CG1-CD2 4.22Å; V207-L278 HydrophobicContact CG2-CD2 3.84Å; V207-F368 HydrophobicContact CG1-CE2 4.34Å; V207-F368 HydrophobicContact CG1-CZ 4.06Å; V207-F368 HydrophobicContact CG2-CE2 4.38Å; V207-I370 HydrophobicContact CG2-CD1 3.56Å
208	V	91.5	Very high	82.3	Confident	3 Å²	3	22.5 Å²	22.5	2%	0.018	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	126.4	173.8	178.5	0	0	0	0	108.3	F224 I276 L277 I279 Y290 T307	V208-F224 HydrophobicContact CG1-CD1 4.47Å; V208-F224 HydrophobicContact CG1-CE1 4.14Å; V208-I276 CarbonylContact O-C 3.48Å; V208-I276 WeakPolarHBondContact O-CA 3.46Å; V208-L277 HydrophobicContact CB-CB 4.31Å; V208-L277 PolarHBondContact N-O 3.07Å; V208-L277 PolarHBondContact O-N 3.09Å; V208-I279 HydrophobicContact CG2-CD1 4.43Å; V208-Y290 HydrophobicContact CG1-CG 4.47Å; V208-Y290 HydrophobicContact CG2-CG 4.34Å; V208-T307 HydrophobicContact CG1-CG2 4.25Å; V208-T307 HydrophobicContact CG2-CG2 4.25Å
209	I	89.1	Confident	81.4	Confident	8 Å²	8	21.5 Å²	21.5	4%	0.041	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.5	-174.5	-48.9	169	0	0	0	109.2	V207 H211 A274 I276 D330 L331	V207-I209 HydrophobicContact CG1-CG1 4.22Å; I209-H211 WeakPolarHBondContact CG2-CE1 3Å; I209-A274 HydrophobicContact CG2-CB 4.25Å; I209-I276 HydrophobicContact CG1-CG1 4.32Å; I209-I276 HydrophobicContact CG2-CG1 4.33Å; I209-D330 HydrophobicContact CD1-CB 4.03Å; I209-L331 HydrophobicContact CD1-CD1 4.23Å; I209-L331 HydrophobicContact CD1-CD2 3.93Å; I209-L331 HydrophobicContact CD1-CG 3.96Å; I209-L331 HydrophobicContact CG1-CD2 4.4Å; I209-L331 HydrophobicContact CG2-CD2 3.88Å
210	C	90.2	Very high	80.9	Confident	2 Å²	2	17.5 Å²	17.5	1%	0.014	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	101.1	171.7	174.3	0	0	0	0	108.1	L212 F224 A274 V275 C292	C210-L212 PolarHBondContact O-N 3.4Å; C210-F224 HydrophobicContact CB-CE1 3.86Å; C210-F224 HydrophobicContact CB-CZ 3.7Å; C210-A274 WeakPolarHBondContact O-CA 3.42Å; C210-V275 WeakPolarHBondContact CB-O 3.27Å; C210-V275 PolarHBondContact N-O 2.95Å; C210-V275 PolarHBondContact O-N 3.26Å; C210-C292 HydrophobicContact CB-CB 3.73Å; C210-C292 WeakPolarHBondContact CB-SG 3.41Å; C210-C292 WeakPolarHBondContact SG-CB 3.47Å; C210-C292 CovalentContact SG-SG 2.03Å; C210-C292 PolarHBondContact SG-SG 2.88Å
211	H	86.9	Confident	80.6	Confident	7 Å²	7	17.1 Å²	17.1	3%	0.032	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	117.2	177.3	-63.4	68.8	0	0	0	109.4	F190 P191 H193 I209 D330 Y333	F190-H211 VanDerWaalsContact CD1-O 3.26Å; F190-H211 WeakPolarHBondContact CD1-O 3.47Å; P191-H211 HydrophobicContact CG-CB 4.16Å; H193-H211 AromaticContact CD2-CD2 3.42Å; H193-H211 PolarHBondContact CD2-CD2 3.49Å; H193-H211 VanDerWaalsContact CD2-CD2 3.42Å; H193-H211 AromaticContact CD2-CG 3.29Å; H193-H211 AromaticContact CD2-ND1 3.74Å; H193-H211 AromaticContact CD2-NE2 3.94Å; H193-H211 AromaticContact NE2-CD2 3.17Å; H193-H211 PolarHBondContact NE2-CD2 2.96Å; H193-H211 AromaticContact NE2-CG 3.47Å; H193-H211 AromaticContact NE2-NE2 3.9Å; I209-H211 WeakPolarHBondContact CG2-CE1 3Å; H211-D330 PolarHBondContact NE2-O 3.13Å; H211-Y333 AromaticContact CD2-CE1 3.84Å; H211-Y333 AromaticContact CD2-CZ 3.88Å; H211-Y333 PolarHBondContact CD2-OH 3.02Å
212	L	84.6	Confident	80.5	Confident	6 Å²	6	16.7 Å²	16.7	3%	0.031	9%	0.094	C	C	.	.	P	Polyproline II helix	trans	-88.4	147	-167.1	-62.8	175.8	0	0	0	112.7	C210 L219 P220 V222 G273 V275 V294	C210-L212 PolarHBondContact O-N 3.4Å; L212-L219 HydrophobicContact CD1-CD2 3.59Å; L212-P220 HydrophobicContact CD2-CG 4.45Å; L212-V222 HydrophobicContact CD2-CG2 3.85Å; L212-G273 WeakPolarHBondContact CB-O 3.35Å; L212-G273 PolarHBondContact N-O 3.3Å; L212-V275 HydrophobicContact CD1-CB 4.5Å; L212-V275 HydrophobicContact CD1-CG2 3.84Å; L212-V294 HydrophobicContact CD2-CG1 3.56Å
213	P	80.7	Confident	80.6	Confident	6 Å²	6	16.7 Å²	16.7	4%	0.039	9%	0.093	C	C	.	.	P	Polyproline II helix	trans	-62.9	151.8	166.2	28.7	-34.9	0	0	0	111.5	L187 P188 S215 V294 I301	L187-P213 HydrophobicContact CD1-CG 4.1Å; P188-P213 HydrophobicContact CG-CB 4.01Å; P188-P213 WeakPolarHBondContact O-CB 3.49Å; P213-S215 VanDerWaalsContact C-N 3.27Å; P213-S215 PolarHBondContact O-N 3.45Å; P213-V294 HydrophobicContact CG-CG2 4.04Å; P213-I301 HydrophobicContact CG-CD1 4.43Å
214	L	74.4	Confident	80.9	Confident	97 Å²	97	16 Å²	16	51%	0.508	8%	0.084	S	C	.	.			trans	-74.5	76.3	175.1	-74.6	167.4	0	0	0	111	P188 H270 P272	P188-L214 WeakPolarHBondContact CG-O 3.45Å; L214-H270 HydrophobicContact CD2-CB 4.28Å; L214-H270 WeakPolarHBondContact CD2-O 3.35Å; L214-P272 HydrophobicContact CD2-CB 4.29Å
215	S	69.4	Low	81.1	Confident	8 Å²	8	18.1 Å²	18.1	6%	0.056	9%	0.092	C	C	.	.			trans	-78.9	158.9	177	52.4	0	0	0	0	113.7	V186 P213 S218 P220	V186-S215 CarbonylContact O-C 3.59Å; V186-S215 WeakPolarHBondContact O-CA 3.41Å; V186-S215 VanDerWaalsContact O-CB 3.31Å; V186-S215 WeakPolarHBondContact O-CB 3.31Å; P213-S215 VanDerWaalsContact C-N 3.27Å; P213-S215 PolarHBondContact O-N 3.45Å; S215-S218 PolarHBondContact OG-O 2.97Å; S215-P220 WeakPolarHBondContact OG-CD 3.38Å
216	Q	62.2	Low	81.3	Confident	70 Å²	70	18.7 Å²	18.7	33%	0.327	9%	0.094	S	C	.	.	B	Isolated β-bridge	trans	-130	137.8	169	-55.3	-166.3	6.1	0	0	109.4	Y53 S185 V186 L296	Y53-Q216 HydrophobicContact CE1-CB 3.93Å; S185-Q216 WeakPolarHBondContact CA-O 3.02Å; V186-Q216 PolarHBondContact N-O 2.83Å; V186-Q216 VanDerWaalsContact N-O 3.08Å; V186-Q216 PolarHBondContact O-N 2.95Å; Q216-L296 WeakPolarHBondContact O-CD2 3.47Å
217	P	50.9	Low	81.4	Confident	8 Å²	8	22.5 Å²	22.5	5%	0.052	11%	0.114	C	C	.	.	S	Bend	cis	-72.9	-41.5	12.5	22.9	-32.7	0	0	0	116.7	Y53 W253	Y53-P217 HydrophobicContact CD1-CB 3.83Å; Y53-P217 HydrophobicContact CD1-CG 4.25Å; Y53-P217 HydrophobicContact CD2-CB 3.62Å; Y53-P217 HydrophobicContact CD2-CG 4.28Å; Y53-P217 HydrophobicContact CE1-CB 3.95Å; Y53-P217 HydrophobicContact CE2-CB 3.74Å; Y53-P217 HydrophobicContact CG-CB 3.64Å; Y53-P217 HydrophobicContact CG-CG 3.95Å; P217-W253 HydrophobicContact CB-CD2 4.46Å; P217-W253 HydrophobicContact CB-CE3 3.94Å; P217-W253 HydrophobicContact CB-CH2 4.38Å; P217-W253 HydrophobicContact CB-CZ3 3.89Å; P217-W253 HydrophobicContact CG-CD2 3.38Å; P217-W253 HydrophobicContact CG-CE3 3.32Å; P217-W253 HydrophobicContact CG-CG 3.99Å; P217-W253 HydrophobicContact CG-CH2 3.91Å; P217-W253 HydrophobicContact CG-CZ2 3.97Å; P217-W253 HydrophobicContact CG-CZ3 3.6Å
218	S	62.3	Low	81.4	Confident	7 Å²	7	27.4 Å²	27.4	5%	0.049	14%	0.14	C	C	.	.	S	Bend	trans	-145.1	-160	-172.9	69.3	0	0	0	0	111.2	S215 D247	S215-S218 PolarHBondContact OG-O 2.97Å; S218-D247 WeakPolarHBondContact CB-OD2 3.49Å
219	L	66.8	Low	81.4	Confident	4 Å²	4	33.2 Å²	33.2	2%	0.021	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-57.3	131.7	179.7	-67.8	157.3	0	0	0	110.7	L212 Y243 P252 W253	L212-L219 HydrophobicContact CD1-CD2 3.59Å; L219-Y243 HydrophobicContact CB-CD1 4.18Å; L219-Y243 HydrophobicContact CD1-CD1 4.07Å; L219-P252 CarbonylContact O-C 3.57Å; L219-P252 VanDerWaalsContact O-CA 3.3Å; L219-P252 WeakPolarHBondContact O-CA 3.48Å; L219-W253 PolarHBondContact O-N 2.87Å
220	P	76.6	Confident	81.5	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-75.4	158.5	176.2	34.8	-31.5	0	0	0	109.6	L187 L212 S215 V222 V294 S295 L296	L187-P220 HydrophobicContact CD1-CB 4.1Å; L187-P220 HydrophobicContact CD1-CG 4.41Å; L212-P220 HydrophobicContact CD2-CG 4.45Å; S215-P220 WeakPolarHBondContact OG-CD 3.38Å; P220-V222 WeakPolarHBondContact O-CG2 3.43Å; P220-V294 HydrophobicContact CB-CB 3.98Å; P220-V294 HydrophobicContact CG-CB 3.77Å; P220-V294 HydrophobicContact CG-CG1 3.84Å; P220-V294 HydrophobicContact CG-CG2 4.43Å; P220-S295 VanDerWaalsContact CB-O 3.27Å; P220-S295 WeakPolarHBondContact CB-O 3.5Å; P220-L296 HydrophobicContact CB-CB 4.38Å
221	T	81.9	Confident	81.5	Confident	16 Å²	16	38.9 Å²	38.9	10%	0.098	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	139	169.9	31	0	0	0	0	109.7	P252 E254 V294 S295	T221-P252 HydrophobicContact CG2-CB 3.74Å; T221-P252 HydrophobicContact CG2-CG 4.02Å; T221-E254 WeakPolarHBondContact CB-OE1 3.41Å; T221-E254 HydrophobicContact CG2-CB 4.03Å; T221-E254 HydrophobicContact CG2-CG 3.88Å; T221-E254 VanDerWaalsContact CG2-OE1 3.25Å; T221-E254 WeakPolarHBondContact CG2-OE1 3.32Å; T221-E254 PolarHBondContact OG1-OE1 3.11Å; T221-V294 CarbonylContact O-C 3.51Å; T221-V294 VanDerWaalsContact O-CA 3.29Å; T221-V294 WeakPolarHBondContact O-CA 3.47Å; T221-S295 WeakPolarHBondContact CB-OG 3.48Å; T221-S295 PolarHBondContact N-O 2.86Å; T221-S295 PolarHBondContact O-N 2.97Å; T221-S295 PolarHBondContact O-OG 2.91Å; T221-S295 PolarHBondContact OG1-O 3.04Å; T221-S295 VanDerWaalsContact OG1-O 3.09Å; T221-S295 PolarHBondContact OG1-OG 2.85Å
222	V	87.7	Confident	81.4	Confident	5 Å²	5	42.7 Å²	42.7	3%	0.03	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	140.4	-172.2	-167.7	0	0	0	0	111	L212 P220 F224 Y243 V275 C292 V294	L212-V222 HydrophobicContact CD2-CG2 3.85Å; P220-V222 WeakPolarHBondContact O-CG2 3.43Å; V222-F224 HydrophobicContact CG1-CD2 4.46Å; V222-F224 HydrophobicContact CG1-CE2 4.01Å; V222-F224 HydrophobicContact CG1-CZ 4.45Å; V222-Y243 HydrophobicContact CG2-CE1 3.89Å; V222-V275 HydrophobicContact CB-CB 4.48Å; V222-V275 HydrophobicContact CB-CG1 4.27Å; V222-V275 HydrophobicContact CB-CG2 4.49Å; V222-V275 HydrophobicContact CG1-CB 4.36Å; V222-V275 HydrophobicContact CG1-CG1 4.21Å; V222-V275 HydrophobicContact CG2-CB 4.1Å; V222-V275 HydrophobicContact CG2-CG1 4.37Å; V222-V275 HydrophobicContact CG2-CG2 3.74Å; V222-C292 HydrophobicContact CG1-CB 4.07Å; V222-V294 HydrophobicContact CG1-CG1 4.38Å; V222-V294 HydrophobicContact CG2-CG1 4.13Å
223	H	91	Very high	81.4	Confident	56 Å²	56	44.8 Å²	44.8	26%	0.259	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	133.2	175.2	-65.3	-17.8	0	0	0	109.7	Y225 K230 C292 S293	H223-Y225 HydrophobicContact CB-CE2 4.05Å; H223-K230 VanDerWaalsContact CD2-CE 3.44Å; H223-K230 WeakPolarHBondContact CD2-CE 3.19Å; H223-K230 PolarHBondContact CD2-NZ 3.06Å; H223-K230 PolarHBondContact CE1-NZ 2.83Å; H223-K230 VanDerWaalsContact CG-CE 3.46Å; H223-K230 PolarHBondContact NE2-NZ 3.02Å; H223-C292 CarbonylContact O-C 3.57Å; H223-C292 WeakPolarHBondContact O-CA 3.32Å; H223-S293 PolarHBondContact N-O 2.87Å; H223-S293 PolarHBondContact O-N 2.85Å
224	F	93.3	Very high	81.4	Confident	3 Å²	3	49.5 Å²	49.5	1%	0.013	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	146.8	174.1	-74.4	-91.1	0	0	0	111.2	V208 C210 V222 L231 L241 V275 L277 C292	V208-F224 HydrophobicContact CG1-CD1 4.47Å; V208-F224 HydrophobicContact CG1-CE1 4.14Å; C210-F224 HydrophobicContact CB-CE1 3.86Å; C210-F224 HydrophobicContact CB-CZ 3.7Å; V222-F224 HydrophobicContact CG1-CD2 4.46Å; V222-F224 HydrophobicContact CG1-CE2 4.01Å; V222-F224 HydrophobicContact CG1-CZ 4.45Å; F224-L231 HydrophobicContact CB-CD1 3.9Å; F224-L231 PolarHBondContact O-N 3.03Å; F224-L241 HydrophobicContact CD2-CD1 4.23Å; F224-L241 HydrophobicContact CE2-CD1 4.23Å; F224-L241 HydrophobicContact CE2-CD2 4.27Å; F224-L241 HydrophobicContact CE2-CG 4.17Å; F224-V275 HydrophobicContact CE2-CG1 3.65Å; F224-V275 HydrophobicContact CZ-CG1 3.92Å; F224-L277 HydrophobicContact CB-CD2 4.03Å; F224-L277 HydrophobicContact CD1-CB 4.11Å; F224-L277 HydrophobicContact CD1-CD2 4.03Å; F224-L277 HydrophobicContact CD2-CB 4.01Å; F224-L277 HydrophobicContact CD2-CD2 4.36Å; F224-L277 HydrophobicContact CE1-CB 3.9Å; F224-L277 HydrophobicContact CE2-CB 3.79Å; F224-L277 HydrophobicContact CG-CB 4.16Å; F224-L277 HydrophobicContact CG-CD2 3.88Å; F224-L277 HydrophobicContact CZ-CB 3.73Å; F224-C292 HydrophobicContact CD1-CB 4.16Å; F224-C292 HydrophobicContact CE1-CB 4.09Å
225	Y	94.2	Very high	81.7	Confident	50 Å²	50	48.9 Å²	48.9	20%	0.196	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.4	176.5	-67.6	-105.9	0	0	0	108.8	H223 I229 K230 Y290 Y291 S293	H223-Y225 HydrophobicContact CB-CE2 4.05Å; Y225-I229 CarbonylContact C-O 3.49Å; Y225-I229 WeakPolarHBondContact CA-O 3.47Å; Y225-K230 HydrophobicContact CD1-CB 4.02Å; Y225-K230 HydrophobicContact CE1-CB 3.71Å; Y225-K230 HydrophobicContact CE1-CG 4.31Å; Y225-Y290 VanDerWaalsContact O-CA 3.26Å; Y225-Y290 WeakPolarHBondContact O-CA 3.43Å; Y225-Y291 VanDerWaalsContact CB-CE1 3.48Å; Y225-Y291 HydrophobicContact CD1-CE2 4.34Å; Y225-Y291 AromaticContact CD1-CZ 3.94Å; Y225-Y291 WeakPolarHBondContact CD1-OH 3.46Å; Y225-Y291 HydrophobicContact CD2-CD2 4.25Å; Y225-Y291 AromaticContact CD2-CE2 3.67Å; Y225-Y291 HydrophobicContact CD2-CE2 3.67Å; Y225-Y291 HydrophobicContact CE2-CE2 4.39Å; Y225-Y291 HydrophobicContact CG-CD2 4.43Å; Y225-Y291 HydrophobicContact CG-CE1 4.18Å; Y225-Y291 AromaticContact CG-CE2 3.67Å; Y225-Y291 HydrophobicContact CG-CE2 3.67Å; Y225-Y291 AromaticContact CG-CZ 3.52Å; Y225-Y291 PolarHBondContact N-O 3.08Å; Y225-Y291 PolarHBondContact O-N 3.16Å; Y225-Y291 VanDerWaalsContact O-N 3.14Å; Y225-S293 WeakPolarHBondContact CE2-OG 3.34Å
226	H	94.4	Very high	82.2	Confident	30 Å²	30	53.2 Å²	53.2	14%	0.139	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121.6	171.1	173.3	-125.9	0	0	0	107.8	N228 I229 L231 S285 D286 T287 Y290	H226-N228 PolarHBondContact O-N 2.97Å; H226-N228 VanDerWaalsContact O-N 3.15Å; H226-I229 PolarHBondContact N-O 3.06Å; H226-I229 WeakPolarHBondContact O-CB 3.49Å; H226-I229 PolarHBondContact O-N 3.14Å; H226-L231 HydrophobicContact CB-CD1 4.32Å; H226-L231 HydrophobicContact CB-CD2 3.74Å; H226-L231 HydrophobicContact CB-CG 4.06Å; H226-S285 PolarHBondContact CE1-O 3.45Å; H226-D286 PolarHBondContact NE2-O 2.91Å; H226-T287 PolarHBondContact NE2-O 3.41Å; H226-Y290 HydrophobicContact CB-CD1 4.14Å; H226-Y290 HydrophobicContact CB-CE1 3.82Å; H226-Y290 AromaticContact CD2-CE1 3.78Å; H226-Y290 AromaticContact CD2-CE2 3.43Å; H226-Y290 VanDerWaalsContact CD2-CE2 3.43Å; H226-Y290 WeakPolarHBondContact CD2-CE2 3.43Å; H226-Y290 AromaticContact CD2-CZ 3.28Å; H226-Y290 PolarHBondContact CD2-OH 3.07Å; H226-Y290 AromaticContact CG-CZ 3.91Å; H226-Y290 AromaticContact NE2-CE2 3.98Å; H226-Y290 AromaticContact NE2-CZ 3.88Å
227	N	91.9	Very high	83.3	Confident	80 Å²	80	55.3 Å²	55.3	43%	0.428	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	42.1	-177.1	-59.2	-31.2	0	0	0	112.9	I229 G288 Q289	N227-I229 PolarHBondContact O-N 3.19Å; N227-G288 WeakPolarHBondContact OD1-CA 3.27Å; N227-Q289 PolarHBondContact N-O 3Å; N227-Q289 PolarHBondContact OD1-N 2.9Å
228	N	90.1	Very high	85	Confident	110 Å²	110	58.3 Å²	58.3	59%	0.588	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	1.5	-175	-47.7	-30.8	0	0	0	116.6	H226 Y291	H226-N228 PolarHBondContact O-N 2.97Å; H226-N228 VanDerWaalsContact O-N 3.15Å; N228-Y291 WeakPolarHBondContact OD1-CE1 3.42Å
229	I	91.9	Very high	86.3	Confident	125 Å²	125	58.8 Å²	58.8	64%	0.641	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	128.9	173.4	-56.9	176	0	0	0	108.9	Y225 H226 N227 L231	Y225-I229 CarbonylContact C-O 3.49Å; Y225-I229 WeakPolarHBondContact CA-O 3.47Å; H226-I229 PolarHBondContact N-O 3.06Å; H226-I229 WeakPolarHBondContact O-CB 3.49Å; H226-I229 PolarHBondContact O-N 3.14Å; N227-I229 PolarHBondContact O-N 3.19Å; I229-L231 PolarHBondContact O-N 3.04Å
230	K	90.4	Very high	87.3	Confident	107 Å²	107	61.8 Å²	61.8	47%	0.465	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	126.3	175.3	-172.7	179.4	-178	176.6	0	109.5	H223 Y225	H223-K230 VanDerWaalsContact CD2-CE 3.44Å; H223-K230 WeakPolarHBondContact CD2-CE 3.19Å; H223-K230 PolarHBondContact CD2-NZ 3.06Å; H223-K230 PolarHBondContact CE1-NZ 2.83Å; H223-K230 VanDerWaalsContact CG-CE 3.46Å; H223-K230 PolarHBondContact NE2-NZ 3.02Å; Y225-K230 HydrophobicContact CD1-CB 4.02Å; Y225-K230 HydrophobicContact CE1-CB 3.71Å; Y225-K230 HydrophobicContact CE1-CG 4.31Å
231	L	89.9	Confident	87.7	Confident	22 Å²	22	64 Å²	64	12%	0.115	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-71.2	136.8	178.1	-71.4	172.4	0	0	0	111.3	F224 H226 I229 L233 L277 Y290	F224-L231 HydrophobicContact CB-CD1 3.9Å; F224-L231 PolarHBondContact O-N 3.03Å; H226-L231 HydrophobicContact CB-CD1 4.32Å; H226-L231 HydrophobicContact CB-CD2 3.74Å; H226-L231 HydrophobicContact CB-CG 4.06Å; I229-L231 PolarHBondContact O-N 3.04Å; L231-L233 HydrophobicContact CB-CD2 4.28Å; L231-L233 PolarHBondContact O-N 3.33Å; L231-L277 HydrophobicContact CD1-CD2 3.71Å; L231-Y290 HydrophobicContact CD1-CD1 4.18Å; L231-Y290 HydrophobicContact CD1-CE1 3.91Å
232	D	85.6	Confident	87.6	Confident	87 Å²	87	63.5 Å²	63.5	47%	0.465	32%	0.32	S	S	.	.			trans	-81.5	102.6	168.3	-176.6	1.8	0	0	0	110	T234	D232-T234 VanDerWaalsContact C-N 3.28Å; D232-T234 PolarHBondContact O-N 3.48Å; D232-T234 VanDerWaalsContact OD1-CB 3.29Å; D232-T234 WeakPolarHBondContact OD1-CB 3.44Å; D232-T234 VanDerWaalsContact OD1-CG2 3.27Å; D232-T234 WeakPolarHBondContact OD1-CG2 3.48Å; D232-T234 PolarHBondContact OD1-N 3.18Å; D232-T234 PolarHBondContact OD1-OG1 2.84Å; D232-T234 PolarHBondContact OD2-OG1 3.34Å
233	L	83.5	Confident	87.2	Confident	49 Å²	49	64.8 Å²	64.8	26%	0.257	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	4.7	-177.9	-60.2	170.4	0	0	0	112.9	L231 Q235 Y239 L241 L277	L231-L233 HydrophobicContact CB-CD2 4.28Å; L231-L233 PolarHBondContact O-N 3.33Å; L233-Q235 PolarHBondContact O-N 3.16Å; L233-Y239 HydrophobicContact CD2-CG 4.34Å; L233-L241 HydrophobicContact CD1-CD1 3.73Å; L233-L241 HydrophobicContact CD1-CD2 4.35Å; L233-L241 HydrophobicContact CD2-CD1 3.77Å; L233-L241 HydrophobicContact CG-CD1 4.3Å; L233-L277 HydrophobicContact CD2-CD1 3.89Å
234	T	80.4	Confident	86.2	Confident	105 Å²	105	62.7 Å²	62.7	64%	0.644	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-20.4	172.7	63.7	0	0	0	0	112.7	D232 T236	D232-T234 VanDerWaalsContact C-N 3.28Å; D232-T234 PolarHBondContact O-N 3.48Å; D232-T234 VanDerWaalsContact OD1-CB 3.29Å; D232-T234 WeakPolarHBondContact OD1-CB 3.44Å; D232-T234 VanDerWaalsContact OD1-CG2 3.27Å; D232-T234 WeakPolarHBondContact OD1-CG2 3.48Å; D232-T234 PolarHBondContact OD1-N 3.18Å; D232-T234 PolarHBondContact OD1-OG1 2.84Å; D232-T234 PolarHBondContact OD2-OG1 3.34Å; T234-T236 PolarHBondContact O-N 3.03Å
235	Q	82	Confident	84.7	Confident	85 Å²	85	63 Å²	63	40%	0.397	32%	0.319	S	S	.	.			trans	-75.4	67.1	174.6	-60.1	-173.3	5.2	0	0	111.2	L233 D237 R238 Y239	L233-Q235 PolarHBondContact O-N 3.16Å; Q235-D237 PolarHBondContact O-N 3.31Å; Q235-R238 HydrophobicContact CB-CB 4.37Å; Q235-R238 PolarHBondContact O-N 2.93Å; Q235-Y239 HydrophobicContact CB-CD2 4.23Å; Q235-Y239 PolarHBondContact O-N 3.01Å
236	T	80.4	Confident	83.2	Confident	99 Å²	99	61 Å²	61	61%	0.607	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-19.9	-177.8	55.1	0	0	0	0	114.4	T234 Y239	T234-T236 PolarHBondContact O-N 3.03Å; T236-Y239 WeakPolarHBondContact CA-O 3.14Å
237	D	83.4	Confident	81.3	Confident	114 Å²	114	60.8 Å²	60.8	61%	0.61	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-30.6	171.5	-109.5	-50.3	0	0	0	113.3	Q235 K396	Q235-D237 PolarHBondContact O-N 3.31Å; D237-K396 PolarHBondContact O-NZ 2.93Å; D237-K396 IonicContact OD1-NZ 2.67Å; D237-K396 PolarHBondContact OD1-NZ 2.88Å
238	R	87.8	Confident	79.3	Confident	71 Å²	71	58.1 Å²	58.1	27%	0.268	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-34.2	-174.9	-144.9	-139.8	-52.7	-164.5	8.5	113.4	Q235 H280 D286	Q235-R238 HydrophobicContact CB-CB 4.37Å; Q235-R238 PolarHBondContact O-N 2.93Å; R238-H280 WeakPolarHBondContact CA-O 3.27Å; R238-H280 WeakPolarHBondContact CG-O 3.35Å; R238-H280 PolarHBondContact O-N 2.95Å; R238-D286 IonicContact NH1-OD1 3.94Å
239	Y	90.3	Very high	77.2	Confident	16 Å²	16	53.1 Å²	53.1	6%	0.063	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	134.3	-178.8	-57	-61.2	0	0	0	110.4	L233 Q235 T236 L277 L278 I279	L233-Y239 HydrophobicContact CD2-CG 4.34Å; Q235-Y239 HydrophobicContact CB-CD2 4.23Å; Q235-Y239 PolarHBondContact O-N 3.01Å; T236-Y239 WeakPolarHBondContact CA-O 3.14Å; Y239-L277 HydrophobicContact CD1-CD1 4.1Å; Y239-L277 HydrophobicContact CG-CD1 4.42Å; Y239-L278 WeakPolarHBondContact CA-O 3.41Å; Y239-I279 HydrophobicContact CD1-CB 4.4Å; Y239-I279 HydrophobicContact CD1-CG1 4.05Å; Y239-I279 HydrophobicContact CD1-CG2 4.12Å; Y239-I279 HydrophobicContact CE1-CB 4.43Å; Y239-I279 HydrophobicContact CE1-CD1 4.48Å; Y239-I279 HydrophobicContact CE1-CG1 4.13Å; Y239-I279 HydrophobicContact CE1-CG2 3.77Å
240	R	86.7	Confident	75.1	Confident	68 Å²	68	48 Å²	48	26%	0.257	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	120.1	172	-165.9	168.1	-178.6	108.9	-3	110.3	L278 N394 F397	R240-L278 PolarHBondContact N-O 2.85Å; R240-L278 PolarHBondContact O-N 3.1Å; R240-N394 PolarHBondContact NH1-ND2 3.48Å; R240-F397 HydrophobicContact CB-CD1 4.12Å; R240-F397 HydrophobicContact CB-CD2 4.07Å; R240-F397 HydrophobicContact CB-CE1 3.98Å; R240-F397 HydrophobicContact CB-CE2 3.95Å; R240-F397 HydrophobicContact CB-CG 4.15Å; R240-F397 HydrophobicContact CB-CZ 3.9Å
241	L	86.1	Confident	73.4	Confident	46 Å²	46	45.4 Å²	45.4	24%	0.241	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	143.9	169.2	-96.6	67.3	0	0	0	110.4	F224 L233 Y243 V275 I276 L277	F224-L241 HydrophobicContact CD2-CD1 4.23Å; F224-L241 HydrophobicContact CE2-CD1 4.23Å; F224-L241 HydrophobicContact CE2-CD2 4.27Å; F224-L241 HydrophobicContact CE2-CG 4.17Å; L233-L241 HydrophobicContact CD1-CD1 3.73Å; L233-L241 HydrophobicContact CD1-CD2 4.35Å; L233-L241 HydrophobicContact CD2-CD1 3.77Å; L233-L241 HydrophobicContact CG-CD1 4.3Å; L241-Y243 HydrophobicContact CB-CE2 4.3Å; L241-Y243 HydrophobicContact CD2-CE2 3.95Å; L241-V275 HydrophobicContact CD2-CG1 3.78Å; L241-V275 HydrophobicContact CG-CG1 3.86Å; L241-I276 CarbonylContact C-O 3.42Å; L241-I276 WeakPolarHBondContact CA-O 3.11Å; L241-L277 HydrophobicContact CD1-CD1 3.84Å
242	I	79.5	Confident	71.6	Confident	6 Å²	6	44.6 Å²	44.6	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131.3	165	-59.8	173.3	0	0	0	107.4	I244 V275 I276 L278 T366 F368 V399	I242-I244 HydrophobicContact CG2-CD1 4.05Å; I242-I244 HydrophobicContact CG2-CG1 3.66Å; I242-V275 CarbonylContact O-C 3.57Å; I242-V275 VanDerWaalsContact O-CA 3.31Å; I242-V275 WeakPolarHBondContact O-CA 3.31Å; I242-I276 HydrophobicContact CB-CB 4.4Å; I242-I276 PolarHBondContact N-O 3.25Å; I242-I276 PolarHBondContact O-N 2.94Å; I242-L278 HydrophobicContact CD1-CD1 3.67Å; I242-L278 HydrophobicContact CD1-CG 4.23Å; I242-L278 HydrophobicContact CG1-CD1 4.49Å; I242-T366 HydrophobicContact CB-CG2 4.48Å; I242-T366 HydrophobicContact CD1-CG2 4.13Å; I242-T366 HydrophobicContact CG1-CG2 4.29Å; I242-T366 HydrophobicContact CG2-CG2 3.42Å; I242-T366 VanDerWaalsContact CG2-CG2 3.42Å; I242-F368 HydrophobicContact CD1-CB 4.43Å; I242-F368 HydrophobicContact CD1-CD1 4.36Å; I242-V399 HydrophobicContact CD1-CB 4.49Å; I242-V399 HydrophobicContact CD1-CG1 3.78Å; I242-V399 HydrophobicContact CD1-CG2 3.79Å; I242-V399 HydrophobicContact CG1-CG1 4.42Å
243	Y	77.7	Confident	70.1	Confident	32 Å²	32	42.1 Å²	42.1	13%	0.125	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.3	169.4	-70.2	-109.9	0	0	0	108.6	L219 V222 L241 G250 P252 V275	L219-Y243 HydrophobicContact CB-CD1 4.18Å; L219-Y243 HydrophobicContact CD1-CD1 4.07Å; V222-Y243 HydrophobicContact CG2-CE1 3.89Å; L241-Y243 HydrophobicContact CB-CE2 4.3Å; L241-Y243 HydrophobicContact CD2-CE2 3.95Å; Y243-G250 WeakPolarHBondContact CB-O 3.39Å; Y243-P252 HydrophobicContact CE1-CB 3.8Å; Y243-P252 HydrophobicContact CE1-CG 3.95Å; Y243-P252 HydrophobicContact CE2-CG 4.39Å; Y243-V275 HydrophobicContact CD1-CG2 3.18Å; Y243-V275 HydrophobicContact CD2-CG2 4.02Å; Y243-V275 HydrophobicContact CE1-CG2 3.37Å; Y243-V275 HydrophobicContact CE2-CG2 4.16Å; Y243-V275 HydrophobicContact CG-CG2 3.52Å
244	I	70.9	Confident	68.6	Low	11 Å²	11	45 Å²	45	6%	0.056	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	137.9	-178.2	-47.9	-178.7	0	0	0	108.8	I242 G273 A274 I276 L334 Y335	I242-I244 HydrophobicContact CG2-CD1 4.05Å; I242-I244 HydrophobicContact CG2-CG1 3.66Å; I244-G273 CarbonylContact O-C 3.57Å; I244-G273 WeakPolarHBondContact O-CA 3.43Å; I244-A274 PolarHBondContact N-O 2.95Å; I244-A274 PolarHBondContact O-N 2.9Å; I244-I276 HydrophobicContact CD1-CD1 3.57Å; I244-I276 HydrophobicContact CD1-CG1 4.27Å; I244-L334 HydrophobicContact CB-CD1 4.12Å; I244-L334 HydrophobicContact CG2-CB 4.02Å; I244-L334 HydrophobicContact CG2-CD1 3.83Å; I244-L334 HydrophobicContact CG2-CG 4.4Å; I244-Y335 HydrophobicContact CG2-CE1 4.23Å
245	G	62.5	Low	67.1	Low	10 Å²	10	44.3 Å²	44.3	10%	0.103	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80.2	-157.2	-174.8	0	0	0	0	0	112.9
246	G	62.4	Low	65.3	Low	9 Å²	9	42.1 Å²	42.1	9%	0.093	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.1	-133.9	-174	0	0	0	0	0	113.2	D248 K271	G246-D248 PolarHBondContact O-N 2.83Å; G246-K271 WeakPolarHBondContact CA-O 3.39Å; G246-K271 PolarHBondContact N-O 3.16Å
247	D	53.8	Low	63.5	Low	25 Å²	25	40.7 Å²	40.7	13%	0.134	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	32.4	178	61.9	-10.7	0	0	0	112.5	S218 S249 F267	S218-D247 WeakPolarHBondContact CB-OD2 3.49Å; D247-S249 PolarHBondContact O-N 3.25Å; D247-S249 VanDerWaalsContact OD1-CB 3.27Å; D247-S249 WeakPolarHBondContact OD1-CB 3.42Å; D247-S249 PolarHBondContact OD1-OG 3.48Å; D247-F267 VanDerWaalsContact C-CZ 3.44Å; D247-F267 HydrophobicContact CB-CD1 4.48Å; D247-F267 HydrophobicContact CB-CE1 4.31Å; D247-F267 HydrophobicContact CB-CE2 4.49Å; D247-F267 HydrophobicContact CB-CZ 4.32Å; D247-F267 WeakPolarHBondContact O-CE1 3.4Å; D247-F267 WeakPolarHBondContact O-CZ 3.42Å
248	D	49.6	Very low	61.2	Low	24 Å²	24	43.3 Å²	43.3	13%	0.128	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.6	17.3	-175	-63	-32.8	0	0	0	115.6	G246 F267 K271 T363 N364	G246-D248 PolarHBondContact O-N 2.83Å; D248-F267 HydrophobicContact CB-CE1 3.9Å; D248-F267 HydrophobicContact CB-CZ 4.33Å; D248-K271 IonicContact OD1-NZ 3.35Å; D248-K271 PolarHBondContact OD1-NZ 3.01Å; D248-K271 IonicContact OD2-NZ 3.3Å; D248-K271 PolarHBondContact OD2-NZ 3.21Å; D248-T363 HydrophobicContact CB-CG2 3.66Å; D248-N364 PolarHBondContact O-N 2.76Å
249	S	47.5	Very low	58.8	Low	5 Å²	5	42 Å²	42	4%	0.035	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-23.3	-178.5	79.1	0	0	0	0	112.8	D247 L251 N364	D247-S249 PolarHBondContact O-N 3.25Å; D247-S249 VanDerWaalsContact OD1-CB 3.27Å; D247-S249 WeakPolarHBondContact OD1-CB 3.42Å; D247-S249 PolarHBondContact OD1-OG 3.48Å; S249-L251 PolarHBondContact O-N 3.03Å; S249-L251 PolarHBondContact OG-N 2.81Å; S249-N364 PolarHBondContact O-ND2 3.08Å
250	G	47.7	Very low	56	Low	18 Å²	18	43.4 Å²	43.4	19%	0.186	22%	0.224	C	C	.	.			trans	61.6	23.7	-177.4	0	0	0	0	0	114.4	Y243	Y243-G250 WeakPolarHBondContact CB-O 3.39Å
251	L	54.3	Low	53.5	Low	51 Å²	51	43 Å²	43	27%	0.267	23%	0.225	S	C	.	.	S	Bend	trans	-135.3	140	179.5	-67.5	173.6	0	0	0	111.7	S249 I255 Y256	S249-L251 PolarHBondContact O-N 3.03Å; S249-L251 PolarHBondContact OG-N 2.81Å; L251-I255 HydrophobicContact CD1-CG2 4.24Å; L251-I255 HydrophobicContact CD2-CD1 4.32Å; L251-Y256 HydrophobicContact CB-CD2 3.89Å; L251-Y256 HydrophobicContact CB-CE2 3.98Å; L251-Y256 HydrophobicContact CD1-CD2 4.41Å; L251-Y256 HydrophobicContact CD1-CE2 4.01Å
252	P	52.1	Low	51	Low	5 Å²	5	45.4 Å²	45.4	3%	0.032	23%	0.234	C	C	.	.			trans	-71	153.2	176.3	29.4	-36	0	0	0	112.9	L219 T221 Y243 E254 I255 Y256	L219-P252 CarbonylContact O-C 3.57Å; L219-P252 VanDerWaalsContact O-CA 3.3Å; L219-P252 WeakPolarHBondContact O-CA 3.48Å; T221-P252 HydrophobicContact CG2-CB 3.74Å; T221-P252 HydrophobicContact CG2-CG 4.02Å; Y243-P252 HydrophobicContact CE1-CB 3.8Å; Y243-P252 HydrophobicContact CE1-CG 3.95Å; Y243-P252 HydrophobicContact CE2-CG 4.39Å; P252-E254 VanDerWaalsContact C-N 3.28Å; P252-E254 PolarHBondContact O-N 2.81Å; P252-E254 VanDerWaalsContact O-N 3.1Å; P252-I255 HydrophobicContact CG-CD1 3.94Å; P252-I255 HydrophobicContact CG-CG1 4.2Å; P252-I255 PolarHBondContact O-N 2.97Å; P252-Y256 PolarHBondContact O-N 3.04Å
253	W	54.3	Low	48.7	Very low	35 Å²	35	51 Å²	51	13%	0.133	26%	0.255	C	S	.	.	H	α-helix	trans	-49.9	-39	-173.2	174.4	-113.4	0	0	0	115.1	P217 L219 I255 Y256 S257 H261 L296 F297	P217-W253 HydrophobicContact CB-CD2 4.46Å; P217-W253 HydrophobicContact CB-CE3 3.94Å; P217-W253 HydrophobicContact CB-CH2 4.38Å; P217-W253 HydrophobicContact CB-CZ3 3.89Å; P217-W253 HydrophobicContact CG-CD2 3.38Å; P217-W253 HydrophobicContact CG-CE3 3.32Å; P217-W253 HydrophobicContact CG-CG 3.99Å; P217-W253 HydrophobicContact CG-CH2 3.91Å; P217-W253 HydrophobicContact CG-CZ2 3.97Å; P217-W253 HydrophobicContact CG-CZ3 3.6Å; L219-W253 PolarHBondContact O-N 2.87Å; W253-I255 PolarHBondContact O-N 2.86Å; W253-Y256 CarbonylContact O-C 3.56Å; W253-Y256 WeakPolarHBondContact O-CA 3.46Å; W253-Y256 PolarHBondContact O-N 3.08Å; W253-S257 PolarHBondContact O-N 3.09Å; W253-H261 AromaticContact CZ3-NE2 3.69Å; W253-L296 HydrophobicContact CB-CD1 4Å; W253-L296 HydrophobicContact CG-CD1 4.25Å; W253-F297 AromaticContact CD1-CZ 3.96Å; W253-F297 HydrophobicContact CZ2-CZ 4.43Å; W253-F297 AromaticContact NE1-CE1 3.72Å; W253-F297 AromaticContact NE1-CE2 3.85Å; W253-F297 AromaticContact NE1-CZ 3.21Å
254	E	51.4	Low	46.7	Very low	109 Å²	109	52.8 Å²	52.8	51%	0.509	26%	0.264	S	S	.	.	H	α-helix	trans	-57.6	-37.2	-179.8	-71	172.6	-146.7	0	0	112.4	T221 P252 Y256 S257	T221-E254 WeakPolarHBondContact CB-OE1 3.41Å; T221-E254 HydrophobicContact CG2-CB 4.03Å; T221-E254 HydrophobicContact CG2-CG 3.88Å; T221-E254 VanDerWaalsContact CG2-OE1 3.25Å; T221-E254 WeakPolarHBondContact CG2-OE1 3.32Å; T221-E254 PolarHBondContact OG1-OE1 3.11Å; P252-E254 VanDerWaalsContact C-N 3.28Å; P252-E254 PolarHBondContact O-N 2.81Å; P252-E254 VanDerWaalsContact O-N 3.1Å; E254-Y256 VanDerWaalsContact C-N 3.35Å; E254-S257 PolarHBondContact O-OG 3.29Å
255	I	49.6	Very low	45	Very low	92 Å²	92	56.4 Å²	56.4	47%	0.472	28%	0.281	S	S	.	.	H	α-helix	trans	-74.7	-27.1	176.2	-55.1	-177.9	0	0	0	111.3	L251 P252 W253	L251-I255 HydrophobicContact CD1-CG2 4.24Å; L251-I255 HydrophobicContact CD2-CD1 4.32Å; P252-I255 HydrophobicContact CG-CD1 3.94Å; P252-I255 HydrophobicContact CG-CG1 4.2Å; P252-I255 PolarHBondContact O-N 2.97Å; W253-I255 PolarHBondContact O-N 2.86Å
256	Y	43.5	Very low	43.6	Very low	38 Å²	38	59.3 Å²	59.3	15%	0.149	29%	0.294	C	S	.	.	H	α-helix	trans	-85.7	-25.3	179.9	-112.2	-89.6	0	0	0	114.4	L251 P252 W253 E254 Q258 K259	L251-Y256 HydrophobicContact CB-CD2 3.89Å; L251-Y256 HydrophobicContact CB-CE2 3.98Å; L251-Y256 HydrophobicContact CD1-CD2 4.41Å; L251-Y256 HydrophobicContact CD1-CE2 4.01Å; P252-Y256 PolarHBondContact O-N 3.04Å; W253-Y256 CarbonylContact O-C 3.56Å; W253-Y256 WeakPolarHBondContact O-CA 3.46Å; W253-Y256 PolarHBondContact O-N 3.08Å; E254-Y256 VanDerWaalsContact C-N 3.35Å; Y256-Q258 PolarHBondContact O-N 3.04Å; Y256-K259 PolarHBondContact O-N 2.83Å
257	S	41.8	Very low	42.4	Very low	69 Å²	69	61.6 Å²	61.6	48%	0.483	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-14.5	-175.1	68.3	0	0	0	0	115.8	W253 E254	W253-S257 PolarHBondContact O-N 3.09Å; E254-S257 PolarHBondContact O-OG 3.29Å
258	Q	35.8	Very low	41.7	Very low	169 Å²	169	65 Å²	65	79%	0.79	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-5	177.8	-58.5	-175.7	2.8	0	0	113.9	Y256	Y256-Q258 PolarHBondContact O-N 3.04Å
259	K	36.4	Very low	41.3	Very low	44 Å²	44	72.2 Å²	72.2	19%	0.191	35%	0.345	C	S	.	.	S	Bend	trans	-108.2	130.4	-179.4	-65.8	-178.6	179.7	178.8	0	110	Y256 Y404	Y256-K259 PolarHBondContact O-N 2.83Å; K259-Y404 PolarHBondContact NZ-OH 2.87Å
260	P	33	Very low	41.5	Very low	46 Å²	46	74.5 Å²	74.5	30%	0.299	36%	0.355	S	S	.	.			trans	-63.4	137.8	170.1	-21.8	35	0	0	0	110.9	I49 L131 F262	I49-P260 HydrophobicContact CD1-CB 4.35Å; I49-P260 HydrophobicContact CG1-CB 4.04Å; L131-P260 HydrophobicContact CD2-CG 4.21Å; P260-F262 HydrophobicContact CB-CD2 4.29Å; P260-F262 HydrophobicContact CB-CE2 3.75Å; P260-F262 HydrophobicContact CB-CZ 4.2Å; P260-F262 HydrophobicContact CG-CE2 4.15Å; P260-F262 WeakPolarHBondContact O-CD2 3.38Å; P260-F262 PolarHBondContact O-N 3.15Å; P260-F262 VanDerWaalsContact O-N 3.14Å
261	H	33.3	Very low	41.7	Very low	58 Å²	58	76.1 Å²	76.1	27%	0.269	36%	0.357	S	S	.	.			trans	-64.5	110.5	168.2	-75.8	-83.2	0	0	0	109.1	I49 W253	I49-H261 HydrophobicContact CG2-CB 4.23Å; W253-H261 AromaticContact CZ3-NE2 3.69Å
262	F	33.5	Very low	41.8	Very low	97 Å²	97	76.3 Å²	76.3	43%	0.425	36%	0.361	S	S	.	.			trans	-99	112.1	172.4	-80.4	-75	0	0	0	110.6	M46 L131 P260 Q264	M46-F262 HydrophobicContact CE-CE1 4.03Å; M46-F262 HydrophobicContact CE-CZ 3.81Å; L131-F262 HydrophobicContact CD2-CE2 3.47Å; L131-F262 VanDerWaalsContact CD2-CE2 3.47Å; L131-F262 HydrophobicContact CD2-CZ 3.37Å; P260-F262 HydrophobicContact CB-CD2 4.29Å; P260-F262 HydrophobicContact CB-CE2 3.75Å; P260-F262 HydrophobicContact CB-CZ 4.2Å; P260-F262 HydrophobicContact CG-CE2 4.15Å; P260-F262 WeakPolarHBondContact O-CD2 3.38Å; P260-F262 PolarHBondContact O-N 3.15Å; P260-F262 VanDerWaalsContact O-N 3.14Å; F262-Q264 PolarHBondContact O-N 2.86Å
263	R	32.5	Very low	42.8	Very low	125 Å²	125	76.3 Å²	76.3	47%	0.472	36%	0.362	S	S	.	.	S	Bend	trans	24	67.5	159.4	-73.9	-174.5	167.2	-150.1	-0.5	115.8	E47	E47-R263 VanDerWaalsContact CD-NH2 3.3Å; E47-R263 IonicContact OE1-NH2 2.7Å; E47-R263 PolarHBondContact OE1-NH2 2.94Å; E47-R263 IonicContact OE2-CZ 3.23Å; E47-R263 IonicContact OE2-NE 3.47Å; E47-R263 PolarHBondContact OE2-NE 3.05Å; E47-R263 IonicContact OE2-NH2 3.8Å; E47-R263 PolarHBondContact OE2-NH2 3.01Å
264	Q	35.8	Very low	44.2	Very low	69 Å²	69	74.6 Å²	74.6	32%	0.322	36%	0.356	S	S	.	.			trans	-134.2	68.7	160.2	-69.7	-155.1	-45	0	0	109.3	F262 N266 F267 E361	F262-Q264 PolarHBondContact O-N 2.86Å; Q264-N266 PolarHBondContact O-N 2.95Å; Q264-N266 VanDerWaalsContact O-N 3.09Å; Q264-F267 HydrophobicContact CB-CE2 4.18Å; Q264-F267 VanDerWaalsContact O-CD2 3.26Å; Q264-F267 WeakPolarHBondContact O-CD2 3.48Å; Q264-F267 WeakPolarHBondContact O-CE2 3.34Å; Q264-E361 PolarHBondContact NE2-O 2.92Å
265	E	34.4	Very low	45.8	Very low	86 Å²	86	69.4 Å²	69.4	40%	0.402	33%	0.332	S	S	.	.			trans	-65.7	-7.3	177.6	-63.9	-154.2	85.9	0	0	113.8	R51 F267 S579	R51-E265 IonicContact NH2-OE1 2.74Å; E265-F267 PolarHBondContact O-N 2.83Å; E265-S579 WeakPolarHBondContact OE2-CB 3.4Å; E265-S579 PolarHBondContact OE2-OG 3.02Å
266	N	33	Very low	47.6	Very low	71 Å²	71	65 Å²	65	38%	0.38	31%	0.309	S	S	.	.			trans	-65.5	14.7	-174.9	-74.3	-23	0	0	0	116.5	Q264 K268	Q264-N266 PolarHBondContact O-N 2.95Å; Q264-N266 VanDerWaalsContact O-N 3.09Å; N266-K268 PolarHBondContact O-N 2.81Å
267	F	37.8	Very low	49.9	Very low	58 Å²	58	63.2 Å²	63.2	25%	0.254	30%	0.302	S	S	.	.			trans	-81	59.6	178	-70.7	-64.5	0	0	0	113.7	D247 D248 Q264 E265 K269	D247-F267 VanDerWaalsContact C-CZ 3.44Å; D247-F267 HydrophobicContact CB-CD1 4.48Å; D247-F267 HydrophobicContact CB-CE1 4.31Å; D247-F267 HydrophobicContact CB-CE2 4.49Å; D247-F267 HydrophobicContact CB-CZ 4.32Å; D247-F267 WeakPolarHBondContact O-CE1 3.4Å; D247-F267 WeakPolarHBondContact O-CZ 3.42Å; D248-F267 HydrophobicContact CB-CE1 3.9Å; D248-F267 HydrophobicContact CB-CZ 4.33Å; Q264-F267 HydrophobicContact CB-CE2 4.18Å; Q264-F267 VanDerWaalsContact O-CD2 3.26Å; Q264-F267 WeakPolarHBondContact O-CD2 3.48Å; Q264-F267 WeakPolarHBondContact O-CE2 3.34Å; E265-F267 PolarHBondContact O-N 2.83Å; F267-K269 PolarHBondContact O-N 2.82Å; F267-K269 VanDerWaalsContact O-N 3.12Å
268	K	38.4	Very low	52.3	Low	95 Å²	95	60 Å²	60	41%	0.413	28%	0.279	S	S	.	.			trans	-59.2	107.4	166.2	-65.5	-163.7	175.9	-171.8	0	110.5	N266 E574 D576	N266-K268 PolarHBondContact O-N 2.81Å; K268-E574 PolarHBondContact NZ-O 2.9Å; K268-D576 VanDerWaalsContact CE-OD2 3.31Å; K268-D576 WeakPolarHBondContact CE-OD2 3.37Å; K268-D576 WeakPolarHBondContact CG-OD2 3.26Å
269	K	41.9	Very low	55	Low	176 Å²	176	51.9 Å²	51.9	77%	0.765	24%	0.241	S	C	*	.	S	Bend	trans	56.5	110.5	-174.9	-59.6	177.5	-180	176.5	0	111.6	F267 K271	F267-K269 PolarHBondContact O-N 2.82Å; F267-K269 VanDerWaalsContact O-N 3.12Å; K269-K271 PolarHBondContact O-N 2.89Å
270	H	50.6	Low	57.5	Low	54 Å²	54	51.3 Å²	51.3	25%	0.25	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-51.5	117.4	172	-69.7	9.8	0	0	0	109	L214	L214-H270 HydrophobicContact CD2-CB 4.28Å; L214-H270 WeakPolarHBondContact CD2-O 3.35Å
271	K	52.6	Low	60.2	Low	52 Å²	52	51.8 Å²	51.8	23%	0.226	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	132.6	-180	-67.7	177	-166.9	157.2	0	107.4	G246 D248 K269 G273	G246-K271 WeakPolarHBondContact CA-O 3.39Å; G246-K271 PolarHBondContact N-O 3.16Å; D248-K271 IonicContact OD1-NZ 3.35Å; D248-K271 PolarHBondContact OD1-NZ 3.01Å; D248-K271 IonicContact OD2-NZ 3.3Å; D248-K271 PolarHBondContact OD2-NZ 3.21Å; K269-K271 PolarHBondContact O-N 2.89Å; K271-G273 PolarHBondContact O-N 2.93Å
272	P	56	Low	63	Low	54 Å²	54	49.1 Å²	49.1	35%	0.351	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-51	132	173.1	22.7	-34	0	0	0	109.3	L214 Y333 L334	L214-P272 HydrophobicContact CD2-CB 4.29Å; P272-Y333 HydrophobicContact CB-CD2 4.4Å; P272-Y333 HydrophobicContact CB-CE2 3.8Å; P272-Y333 HydrophobicContact CG-CD2 3.64Å; P272-Y333 HydrophobicContact CG-CE2 3.53Å; P272-L334 WeakPolarHBondContact O-CD2 3.48Å
273	G	74	Confident	65.8	Low	5 Å²	5	48.8 Å²	48.8	5%	0.052	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	156.7	-178	0	0	0	0	0	111.6	L212 I244 K271	L212-G273 WeakPolarHBondContact CB-O 3.35Å; L212-G273 PolarHBondContact N-O 3.3Å; I244-G273 CarbonylContact O-C 3.57Å; I244-G273 WeakPolarHBondContact O-CA 3.43Å; K271-G273 PolarHBondContact O-N 2.93Å
274	A	82	Confident	68.4	Low	0 Å²	0	48 Å²	48	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	145.4	159.5	0	0	0	0	0	109.3	I209 C210 I244 L331 L334	I209-A274 HydrophobicContact CG2-CB 4.25Å; C210-A274 WeakPolarHBondContact O-CA 3.42Å; I244-A274 PolarHBondContact N-O 2.95Å; I244-A274 PolarHBondContact O-N 2.9Å; A274-L331 HydrophobicContact CB-CD2 4.38Å; A274-L334 HydrophobicContact CB-CD1 3.72Å; A274-L334 HydrophobicContact CB-CD2 4.13Å
275	V	86.7	Confident	71.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	131.1	165.1	165.2	0	0	0	0	109.4	C210 L212 V222 F224 L241 I242 Y243	C210-V275 WeakPolarHBondContact CB-O 3.27Å; C210-V275 PolarHBondContact N-O 2.95Å; C210-V275 PolarHBondContact O-N 3.26Å; L212-V275 HydrophobicContact CD1-CB 4.5Å; L212-V275 HydrophobicContact CD1-CG2 3.84Å; V222-V275 HydrophobicContact CB-CB 4.48Å; V222-V275 HydrophobicContact CB-CG1 4.27Å; V222-V275 HydrophobicContact CB-CG2 4.49Å; V222-V275 HydrophobicContact CG1-CB 4.36Å; V222-V275 HydrophobicContact CG1-CG1 4.21Å; V222-V275 HydrophobicContact CG2-CB 4.1Å; V222-V275 HydrophobicContact CG2-CG1 4.37Å; V222-V275 HydrophobicContact CG2-CG2 3.74Å; F224-V275 HydrophobicContact CE2-CG1 3.65Å; F224-V275 HydrophobicContact CZ-CG1 3.92Å; L241-V275 HydrophobicContact CD2-CG1 3.78Å; L241-V275 HydrophobicContact CG-CG1 3.86Å; I242-V275 CarbonylContact O-C 3.57Å; I242-V275 VanDerWaalsContact O-CA 3.31Å; I242-V275 WeakPolarHBondContact O-CA 3.31Å; Y243-V275 HydrophobicContact CD1-CG2 3.18Å; Y243-V275 HydrophobicContact CD2-CG2 4.02Å; Y243-V275 HydrophobicContact CE1-CG2 3.37Å; Y243-V275 HydrophobicContact CE2-CG2 4.16Å; Y243-V275 HydrophobicContact CG-CG2 3.52Å
276	I	87.1	Confident	73.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	124.7	178.8	-59.6	-177.1	0	0	0	108.2	V207 V208 I209 L241 I242 I244 L278 L331 F368	V207-I276 HydrophobicContact CG1-CD1 4.5Å; V207-I276 HydrophobicContact CG1-CG2 3.65Å; V208-I276 CarbonylContact O-C 3.48Å; V208-I276 WeakPolarHBondContact O-CA 3.46Å; I209-I276 HydrophobicContact CG1-CG1 4.32Å; I209-I276 HydrophobicContact CG2-CG1 4.33Å; L241-I276 CarbonylContact C-O 3.42Å; L241-I276 WeakPolarHBondContact CA-O 3.11Å; I242-I276 HydrophobicContact CB-CB 4.4Å; I242-I276 PolarHBondContact N-O 3.25Å; I242-I276 PolarHBondContact O-N 2.94Å; I244-I276 HydrophobicContact CD1-CD1 3.57Å; I244-I276 HydrophobicContact CD1-CG1 4.27Å; I276-L278 HydrophobicContact CG2-CD2 3.64Å; I276-L278 HydrophobicContact CG2-CG 4.15Å; I276-L331 HydrophobicContact CD1-CD1 3.59Å; I276-L331 HydrophobicContact CD1-CD2 3.84Å; I276-L331 HydrophobicContact CD1-CG 4.4Å; I276-L331 HydrophobicContact CG1-CD2 4.42Å; I276-F368 HydrophobicContact CD1-CD1 4.2Å; I276-F368 HydrophobicContact CD1-CE1 3.37Å; I276-F368 HydrophobicContact CD1-CZ 4.05Å
277	L	92.2	Very high	76.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	114.1	163.4	171.2	67.2	0	0	0	108	V208 F224 L231 L233 Y239 L241 I279 Y290	V208-L277 HydrophobicContact CB-CB 4.31Å; V208-L277 PolarHBondContact N-O 3.07Å; V208-L277 PolarHBondContact O-N 3.09Å; F224-L277 HydrophobicContact CB-CD2 4.03Å; F224-L277 HydrophobicContact CD1-CB 4.11Å; F224-L277 HydrophobicContact CD1-CD2 4.03Å; F224-L277 HydrophobicContact CD2-CB 4.01Å; F224-L277 HydrophobicContact CD2-CD2 4.36Å; F224-L277 HydrophobicContact CE1-CB 3.9Å; F224-L277 HydrophobicContact CE2-CB 3.79Å; F224-L277 HydrophobicContact CG-CB 4.16Å; F224-L277 HydrophobicContact CG-CD2 3.88Å; F224-L277 HydrophobicContact CZ-CB 3.73Å; L231-L277 HydrophobicContact CD1-CD2 3.71Å; L233-L277 HydrophobicContact CD2-CD1 3.89Å; Y239-L277 HydrophobicContact CD1-CD1 4.1Å; Y239-L277 HydrophobicContact CG-CD1 4.42Å; L241-L277 HydrophobicContact CD1-CD1 3.84Å; L277-I279 HydrophobicContact CD2-CD1 4.13Å; L277-I279 HydrophobicContact CD2-CG1 4.14Å; L277-I279 HydrophobicContact CG-CD1 4.46Å; L277-I279 HydrophobicContact CG-CG1 3.95Å; L277-Y290 HydrophobicContact CD2-CD1 4.29Å; L277-Y290 HydrophobicContact CD2-CE1 4.36Å
278	L	90.5	Very high	79.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	134.5	165.4	-58.8	-176.1	0	0	0	109.9	T205 A206 V207 Y239 R240 I242 I276 I370 F397 V399	T205-L278 HydrophobicContact CG2-CB 4.27Å; T205-L278 HydrophobicContact CG2-CD2 4.49Å; A206-L278 WeakPolarHBondContact O-CA 3.49Å; V207-L278 HydrophobicContact CB-CD2 4.27Å; V207-L278 HydrophobicContact CG1-CD2 4.22Å; V207-L278 HydrophobicContact CG2-CD2 3.84Å; Y239-L278 WeakPolarHBondContact CA-O 3.41Å; R240-L278 PolarHBondContact N-O 2.85Å; R240-L278 PolarHBondContact O-N 3.1Å; I242-L278 HydrophobicContact CD1-CD1 3.67Å; I242-L278 HydrophobicContact CD1-CG 4.23Å; I242-L278 HydrophobicContact CG1-CD1 4.49Å; I276-L278 HydrophobicContact CG2-CD2 3.64Å; I276-L278 HydrophobicContact CG2-CG 4.15Å; L278-I370 HydrophobicContact CD1-CD1 4.29Å; L278-I370 HydrophobicContact CD2-CD1 3.73Å; L278-F397 HydrophobicContact CB-CD1 3.64Å; L278-F397 HydrophobicContact CB-CE1 4.06Å; L278-F397 HydrophobicContact CD1-CB 3.97Å; L278-F397 HydrophobicContact CD1-CD1 4.21Å; L278-F397 HydrophobicContact CD1-CG 4.49Å; L278-V399 HydrophobicContact CD1-CG2 3.63Å
279	I	92.9	Very high	82	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	121.5	178.3	-49.3	177.2	0	0	0	108	T205 A206 V208 Y239 L277 L282 Y290 L309	T205-I279 CarbonylContact C-O 3.48Å; T205-I279 VanDerWaalsContact CA-O 3.28Å; T205-I279 WeakPolarHBondContact CA-O 3.02Å; A206-I279 HydrophobicContact CB-CB 4.26Å; A206-I279 PolarHBondContact N-O 3.39Å; A206-I279 PolarHBondContact O-N 2.76Å; V208-I279 HydrophobicContact CG2-CD1 4.43Å; Y239-I279 HydrophobicContact CD1-CB 4.4Å; Y239-I279 HydrophobicContact CD1-CG1 4.05Å; Y239-I279 HydrophobicContact CD1-CG2 4.12Å; Y239-I279 HydrophobicContact CE1-CB 4.43Å; Y239-I279 HydrophobicContact CE1-CD1 4.48Å; Y239-I279 HydrophobicContact CE1-CG1 4.13Å; Y239-I279 HydrophobicContact CE1-CG2 3.77Å; L277-I279 HydrophobicContact CD2-CD1 4.13Å; L277-I279 HydrophobicContact CD2-CG1 4.14Å; L277-I279 HydrophobicContact CG-CD1 4.46Å; L277-I279 HydrophobicContact CG-CG1 3.95Å; I279-L282 HydrophobicContact CB-CD2 4.43Å; I279-L282 HydrophobicContact CG2-CD2 4.23Å; I279-Y290 HydrophobicContact CD1-CE1 3.71Å; I279-L309 HydrophobicContact CD1-CD2 4.47Å
280	H	89.3	Confident	84.6	Confident	32 Å²	32	30 Å²	30	15%	0.148	17%	0.171	C	C	.	.			trans	-147.9	137.2	178.9	179.2	100.1	0	0	0	111.8	T205 R238 F397	T205-H280 HydrophobicContact CG2-CB 4.19Å; T205-H280 PolarHBondContact OG1-ND1 3.45Å; R238-H280 WeakPolarHBondContact CA-O 3.27Å; R238-H280 WeakPolarHBondContact CG-O 3.35Å; R238-H280 PolarHBondContact O-N 2.95Å; H280-F397 HydrophobicContact CB-CD1 3.85Å; H280-F397 HydrophobicContact CB-CE1 3.54Å; H280-F397 HydrophobicContact CB-CZ 4.15Å
281	S	89.8	Confident	86.7	Confident	55 Å²	55	29.5 Å²	29.5	39%	0.385	17%	0.167	S	C	.	.	S	Bend	cis	-90	137.5	-6.6	48.7	0	0	0	0	109.8	G203 Q283	G203-S281 VanDerWaalsContact O-CB 3.31Å; G203-S281 WeakPolarHBondContact O-CB 3.45Å; S281-Q283 PolarHBondContact O-N 2.64Å
282	L	91.7	Very high	88.6	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.016	16%	0.157	C	C	.	.			trans	-59.2	132.6	-172.9	-82.1	169.6	0	0	0	113.5	L200 I202 G203 N204 A206 I279 D286 L309 V311	L200-L282 HydrophobicContact CB-CD1 3.81Å; L200-L282 HydrophobicContact CD1-CD1 4.06Å; I202-L282 WeakPolarHBondContact CG1-O 3.28Å; G203-L282 PolarHBondContact N-O 3.3Å; N204-L282 WeakPolarHBondContact O-CB 3.24Å; N204-L282 VanDerWaalsContact O-CG 3.28Å; N204-L282 WeakPolarHBondContact O-CG 3.29Å; N204-L282 PolarHBondContact O-N 3.12Å; A206-L282 HydrophobicContact CB-CD1 3.96Å; A206-L282 HydrophobicContact CB-CD2 3.75Å; A206-L282 HydrophobicContact CB-CG 4.16Å; I279-L282 HydrophobicContact CB-CD2 4.43Å; I279-L282 HydrophobicContact CG2-CD2 4.23Å; L282-D286 HydrophobicContact CD2-CB 4.15Å; L282-L309 HydrophobicContact CD2-CD2 3.97Å; L282-V311 HydrophobicContact CB-CG1 4.17Å; L282-V311 HydrophobicContact CB-CG2 4.46Å; L282-V311 HydrophobicContact CD2-CG2 3.95Å
283	Q	92.2	Very high	90.3	Very high	90 Å²	90	25.1 Å²	25.1	42%	0.421	14%	0.144	S	C	.	.			trans	-114.8	155.3	177.3	-56.5	-175.2	-8.1	0	0	110.6	S281 S285 D286 V311	S281-Q283 PolarHBondContact O-N 2.64Å; Q283-S285 WeakPolarHBondContact CB-OG 3.42Å; Q283-S285 PolarHBondContact O-N 2.85Å; Q283-S285 VanDerWaalsContact O-N 3.14Å; Q283-S285 PolarHBondContact OE1-OG 3.08Å; Q283-D286 PolarHBondContact N-OD2 2.81Å; Q283-D286 WeakPolarHBondContact O-CB 3.42Å; Q283-D286 PolarHBondContact O-N 2.81Å; Q283-V311 WeakPolarHBondContact O-CG2 3.39Å
284	L	88.8	Confident	91.1	Very high	107 Å²	107	24.9 Å²	24.9	56%	0.56	14%	0.142	S	C	*	.	G	3₁₀ helix	trans	-55.9	-32.7	176.1	-74.4	161.8	0	0	0	112.5	I202 D286 T287 V311	I202-L284 HydrophobicContact CD1-CD1 4.36Å; I202-L284 HydrophobicContact CD1-CG 4.02Å; L284-D286 VanDerWaalsContact C-N 3.29Å; L284-D286 PolarHBondContact O-N 2.82Å; L284-T287 WeakPolarHBondContact O-CB 3.49Å; L284-T287 PolarHBondContact O-N 3.16Å; L284-T287 PolarHBondContact O-OG1 2.89Å; L284-V311 WeakPolarHBondContact CD2-O 3.46Å
285	S	90.5	Very high	91.2	Very high	74 Å²	74	25.5 Å²	25.5	52%	0.517	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-68.4	-17.5	175.5	47.5	0	0	0	0	115.2	H226 Q283 T287	H226-S285 PolarHBondContact CE1-O 3.45Å; Q283-S285 WeakPolarHBondContact CB-OG 3.42Å; Q283-S285 PolarHBondContact O-N 2.85Å; Q283-S285 VanDerWaalsContact O-N 3.14Å; Q283-S285 PolarHBondContact OE1-OG 3.08Å; S285-T287 PolarHBondContact O-N 2.86Å
286	D	92.6	Very high	90.7	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.021	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-76.7	-8.5	173.6	-57.4	-42.4	0	0	0	111.3	H226 R238 L282 Q283 L284 G288 Y290 L309 V311	H226-D286 PolarHBondContact NE2-O 2.91Å; R238-D286 IonicContact NH1-OD1 3.94Å; L282-D286 HydrophobicContact CD2-CB 4.15Å; Q283-D286 PolarHBondContact N-OD2 2.81Å; Q283-D286 WeakPolarHBondContact O-CB 3.42Å; Q283-D286 PolarHBondContact O-N 2.81Å; L284-D286 VanDerWaalsContact C-N 3.29Å; L284-D286 PolarHBondContact O-N 2.82Å; D286-G288 PolarHBondContact O-N 2.86Å; D286-Y290 WeakPolarHBondContact O-CE2 3.35Å; D286-Y290 PolarHBondContact O-OH 3.3Å; D286-L309 HydrophobicContact CB-CD2 4.46Å; D286-V311 HydrophobicContact CB-CG2 4.32Å
287	T	93.4	Very high	89.9	Confident	56 Å²	56	29.8 Å²	29.8	34%	0.344	17%	0.165	S	C	.	.			trans	-56.7	133.5	169.4	-60.3	0	0	0	0	110.6	H226 L284 S285 L309 V311	H226-T287 PolarHBondContact NE2-O 3.41Å; L284-T287 WeakPolarHBondContact O-CB 3.49Å; L284-T287 PolarHBondContact O-N 3.16Å; L284-T287 PolarHBondContact O-OG1 2.89Å; S285-T287 PolarHBondContact O-N 2.86Å; T287-L309 CarbonylContact C-O 3.55Å; T287-L309 WeakPolarHBondContact CA-O 3.44Å; T287-V311 PolarHBondContact OG1-N 3.11Å; T287-V311 VanDerWaalsContact OG1-N 3.13Å
288	G	93.6	Very high	88.9	Confident	16 Å²	16	35.2 Å²	35.2	17%	0.165	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.7	-165.3	-179.8	0	0	0	0	0	113.8	N227 D286 L309	N227-G288 WeakPolarHBondContact OD1-CA 3.27Å; D286-G288 PolarHBondContact O-N 2.86Å; G288-L309 PolarHBondContact N-O 3.42Å; G288-L309 PolarHBondContact O-N 3.42Å
289	Q	94.2	Very high	88.1	Confident	29 Å²	29	39.7 Å²	39.7	14%	0.136	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.3	-178.8	-170	-158.5	-81.7	0	0	110.7	N227 R306	N227-Q289 PolarHBondContact N-O 3Å; N227-Q289 PolarHBondContact OD1-N 2.9Å; Q289-R306 HydrophobicContact CG-CB 3.87Å; Q289-R306 HydrophobicContact CG-CG 4.11Å
290	Y	95.8	Very high	87.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	142.1	175.3	-66.2	-100.7	0	0	0	111.1	V208 Y225 H226 L231 L277 I279 D286 R306 T307 L309	V208-Y290 HydrophobicContact CG1-CG 4.47Å; V208-Y290 HydrophobicContact CG2-CG 4.34Å; Y225-Y290 VanDerWaalsContact O-CA 3.26Å; Y225-Y290 WeakPolarHBondContact O-CA 3.43Å; H226-Y290 HydrophobicContact CB-CD1 4.14Å; H226-Y290 HydrophobicContact CB-CE1 3.82Å; H226-Y290 AromaticContact CD2-CE1 3.78Å; H226-Y290 AromaticContact CD2-CE2 3.43Å; H226-Y290 VanDerWaalsContact CD2-CE2 3.43Å; H226-Y290 WeakPolarHBondContact CD2-CE2 3.43Å; H226-Y290 AromaticContact CD2-CZ 3.28Å; H226-Y290 PolarHBondContact CD2-OH 3.07Å; H226-Y290 AromaticContact CG-CZ 3.91Å; H226-Y290 AromaticContact NE2-CE2 3.98Å; H226-Y290 AromaticContact NE2-CZ 3.88Å; L231-Y290 HydrophobicContact CD1-CD1 4.18Å; L231-Y290 HydrophobicContact CD1-CE1 3.91Å; L277-Y290 HydrophobicContact CD2-CD1 4.29Å; L277-Y290 HydrophobicContact CD2-CE1 4.36Å; I279-Y290 HydrophobicContact CD1-CE1 3.71Å; D286-Y290 WeakPolarHBondContact O-CE2 3.35Å; D286-Y290 PolarHBondContact O-OH 3.3Å; Y290-R306 CarbonylContact O-C 2.91Å; Y290-R306 WeakPolarHBondContact O-CA 3.14Å; Y290-T307 PolarHBondContact N-O 3.31Å; Y290-T307 PolarHBondContact O-N 3.26Å; Y290-L309 HydrophobicContact CD2-CB 4.09Å; Y290-L309 HydrophobicContact CE2-CB 3.83Å; Y290-L309 HydrophobicContact CE2-CD2 3.81Å; Y290-L309 HydrophobicContact CE2-CG 4.44Å
291	Y	94.4	Very high	87.6	Confident	42 Å²	42	45.5 Å²	45.5	17%	0.165	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	169.1	166	67.7	-88.5	0	0	0	109.4	Y225 N228	Y225-Y291 VanDerWaalsContact CB-CE1 3.48Å; Y225-Y291 HydrophobicContact CD1-CE2 4.34Å; Y225-Y291 AromaticContact CD1-CZ 3.94Å; Y225-Y291 WeakPolarHBondContact CD1-OH 3.46Å; Y225-Y291 HydrophobicContact CD2-CD2 4.25Å; Y225-Y291 AromaticContact CD2-CE2 3.67Å; Y225-Y291 HydrophobicContact CD2-CE2 3.67Å; Y225-Y291 HydrophobicContact CE2-CE2 4.39Å; Y225-Y291 HydrophobicContact CG-CD2 4.43Å; Y225-Y291 HydrophobicContact CG-CE1 4.18Å; Y225-Y291 AromaticContact CG-CE2 3.67Å; Y225-Y291 HydrophobicContact CG-CE2 3.67Å; Y225-Y291 AromaticContact CG-CZ 3.52Å; Y225-Y291 PolarHBondContact N-O 3.08Å; Y225-Y291 PolarHBondContact O-N 3.16Å; Y225-Y291 VanDerWaalsContact O-N 3.14Å; N228-Y291 WeakPolarHBondContact OD1-CE1 3.42Å
292	C	93.9	Very high	87.6	Confident	4 Å²	4	46.3 Å²	46.3	3%	0.027	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	156.3	176.6	57.4	0	0	0	0	112.2	C210 V222 H223 F224 S303	C210-C292 HydrophobicContact CB-CB 3.73Å; C210-C292 WeakPolarHBondContact CB-SG 3.41Å; C210-C292 WeakPolarHBondContact SG-CB 3.47Å; C210-C292 CovalentContact SG-SG 2.03Å; C210-C292 PolarHBondContact SG-SG 2.88Å; V222-C292 HydrophobicContact CG1-CB 4.07Å; H223-C292 CarbonylContact O-C 3.57Å; H223-C292 WeakPolarHBondContact O-CA 3.32Å; F224-C292 HydrophobicContact CD1-CB 4.16Å; F224-C292 HydrophobicContact CE1-CB 4.09Å; C292-S303 PolarHBondContact N-OG 3.14Å; C292-S303 VanDerWaalsContact N-OG 3.12Å; C292-S303 PolarHBondContact O-N 3.37Å; C292-S303 PolarHBondContact O-OG 3.39Å
293	S	91.9	Very high	87.5	Confident	10 Å²	10	46.8 Å²	46.8	7%	0.07	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	155	158	70.6	0	0	0	0	109.8	H223 Y225 I301	H223-S293 PolarHBondContact N-O 2.87Å; H223-S293 PolarHBondContact O-N 2.85Å; Y225-S293 WeakPolarHBondContact CE2-OG 3.34Å; S293-I301 CarbonylContact C-O 3.55Å; S293-I301 WeakPolarHBondContact CA-O 3.38Å; S293-I301 VanDerWaalsContact CB-O 3.25Å; S293-I301 WeakPolarHBondContact CB-O 3.34Å
294	V	89.7	Confident	87.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	140.9	178.1	-65.5	0	0	0	0	110.3	L187 F190 L212 P213 P220 T221 V222 T300 I301	L187-V294 HydrophobicContact CD1-CG2 3.99Å; L187-V294 HydrophobicContact CD2-CG2 4.47Å; F190-V294 HydrophobicContact CE1-CG1 4.39Å; F190-V294 HydrophobicContact CE2-CG2 3.73Å; F190-V294 HydrophobicContact CZ-CB 4.36Å; F190-V294 HydrophobicContact CZ-CG1 3.77Å; F190-V294 HydrophobicContact CZ-CG2 3.79Å; L212-V294 HydrophobicContact CD2-CG1 3.56Å; P213-V294 HydrophobicContact CG-CG2 4.04Å; P220-V294 HydrophobicContact CB-CB 3.98Å; P220-V294 HydrophobicContact CG-CB 3.77Å; P220-V294 HydrophobicContact CG-CG1 3.84Å; P220-V294 HydrophobicContact CG-CG2 4.43Å; T221-V294 CarbonylContact O-C 3.51Å; T221-V294 VanDerWaalsContact O-CA 3.29Å; T221-V294 WeakPolarHBondContact O-CA 3.47Å; V222-V294 HydrophobicContact CG1-CG1 4.38Å; V222-V294 HydrophobicContact CG2-CG1 4.13Å; V294-T300 VanDerWaalsContact O-CA 3.31Å; V294-T300 WeakPolarHBondContact O-CA 3.08Å; V294-I301 HydrophobicContact CG2-CD1 3.98Å; V294-I301 HydrophobicContact CG2-CG1 3.45Å; V294-I301 VanDerWaalsContact CG2-CG1 3.45Å; V294-I301 PolarHBondContact N-O 2.89Å; V294-I301 PolarHBondContact O-N 2.92Å
295	S	83.4	Confident	87	Confident	13 Å²	13	45.6 Å²	45.6	9%	0.091	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	139.2	178.9	38.7	0	0	0	0	110.9	P220 T221 K299	P220-S295 VanDerWaalsContact CB-O 3.27Å; P220-S295 WeakPolarHBondContact CB-O 3.5Å; T221-S295 WeakPolarHBondContact CB-OG 3.48Å; T221-S295 PolarHBondContact N-O 2.86Å; T221-S295 PolarHBondContact O-N 2.97Å; T221-S295 PolarHBondContact O-OG 2.91Å; T221-S295 PolarHBondContact OG1-O 3.04Å; T221-S295 VanDerWaalsContact OG1-O 3.09Å; T221-S295 PolarHBondContact OG1-OG 2.85Å; S295-K299 WeakPolarHBondContact CA-O 3.44Å
296	L	76.5	Confident	87	Confident	7 Å²	7	47.1 Å²	47.1	4%	0.037	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	112.5	171.3	-169.9	73.4	0	0	0	109.1	L187 Q216 P220 W253 D298 K299	L187-L296 HydrophobicContact CB-CB 4.31Å; L187-L296 HydrophobicContact CB-CD2 4.28Å; L187-L296 HydrophobicContact CD1-CB 4.22Å; L187-L296 HydrophobicContact CD2-CB 4.02Å; L187-L296 HydrophobicContact CG-CB 4.42Å; Q216-L296 WeakPolarHBondContact O-CD2 3.47Å; P220-L296 HydrophobicContact CB-CB 4.38Å; W253-L296 HydrophobicContact CB-CD1 4Å; W253-L296 HydrophobicContact CG-CD1 4.25Å; L296-D298 PolarHBondContact O-N 3.21Å; L296-K299 PolarHBondContact N-O 3.35Å; L296-K299 PolarHBondContact O-N 2.97Å
297	F	71.6	Confident	87	Confident	84 Å²	84	47.2 Å²	47.2	37%	0.368	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	-130.6	-165.2	-55.7	-83.5	0	0	0	110.3	S185 W253 K299	S185-F297 VanDerWaalsContact CB-CE2 3.48Å; W253-F297 AromaticContact CD1-CZ 3.96Å; W253-F297 HydrophobicContact CZ2-CZ 4.43Å; W253-F297 AromaticContact NE1-CE1 3.72Å; W253-F297 AromaticContact NE1-CE2 3.85Å; W253-F297 AromaticContact NE1-CZ 3.21Å; F297-K299 PolarHBondContact O-N 3.29Å
298	D	69.6	Low	87	Confident	113 Å²	113	46.8 Å²	46.8	60%	0.604	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-1.7	-174.2	-31.6	-70.9	0	0	0	113.8	S55 N57 L296	S55-D298 PolarHBondContact OG-OD2 3.31Å; N57-D298 PolarHBondContact ND2-OD2 3.15Å; L296-D298 PolarHBondContact O-N 3.21Å
299	K	75.2	Confident	87	Confident	94 Å²	94	46.1 Å²	46.1	41%	0.409	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.4	-172.5	-66.6	-176.7	-178.7	177.6	0	111.5	L187 S295 L296 F297	L187-K299 HydrophobicContact CD2-CB 4.14Å; L187-K299 WeakPolarHBondContact CD2-O 3.4Å; S295-K299 WeakPolarHBondContact CA-O 3.44Å; L296-K299 PolarHBondContact N-O 3.35Å; L296-K299 PolarHBondContact O-N 2.97Å; F297-K299 PolarHBondContact O-N 3.29Å
300	T	83.8	Confident	87	Confident	102 Å²	102	48.1 Å²	48.1	63%	0.626	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	139.1	175.9	64.3	0	0	0	0	110.4	V294	V294-T300 VanDerWaalsContact O-CA 3.31Å; V294-T300 WeakPolarHBondContact O-CA 3.08Å
301	I	87.2	Confident	86.8	Confident	53 Å²	53	48.4 Å²	48.4	27%	0.272	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	152.5	176.1	57.2	171	0	0	0	110.6	L187 P188 F190 P213 S293 V294	L187-I301 HydrophobicContact CD2-CD1 4.4Å; L187-I301 HydrophobicContact CD2-CG1 4.07Å; L187-I301 HydrophobicContact CG-CD1 4.03Å; L187-I301 HydrophobicContact CG-CG1 4.25Å; P188-I301 WeakPolarHBondContact O-CD1 3.02Å; F190-I301 HydrophobicContact CD2-CD1 4.06Å; F190-I301 HydrophobicContact CD2-CG1 4.27Å; F190-I301 HydrophobicContact CE2-CD1 4.22Å; F190-I301 HydrophobicContact CE2-CG1 4Å; P213-I301 HydrophobicContact CG-CD1 4.43Å; S293-I301 CarbonylContact C-O 3.55Å; S293-I301 WeakPolarHBondContact CA-O 3.38Å; S293-I301 VanDerWaalsContact CB-O 3.25Å; S293-I301 WeakPolarHBondContact CB-O 3.34Å; V294-I301 HydrophobicContact CG2-CD1 3.98Å; V294-I301 HydrophobicContact CG2-CG1 3.45Å; V294-I301 VanDerWaalsContact CG2-CG1 3.45Å; V294-I301 PolarHBondContact N-O 2.89Å; V294-I301 PolarHBondContact O-N 2.92Å
302	S	89.2	Confident	86.6	Confident	72 Å²	72	48.8 Å²	48.8	50%	0.503	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	149.6	-177.8	-55.1	0	0	0	0	112	F190	F190-S302 WeakPolarHBondContact CD2-O 3.46Å; F190-S302 WeakPolarHBondContact CE2-O 3.29Å
303	S	90.1	Very high	86.2	Confident	13 Å²	13	56.2 Å²	56.2	9%	0.091	29%	0.291	C	S	.	.			trans	-72.1	133.8	170.5	69	0	0	0	0	110.1	F190 C292 Q305	F190-S303 VanDerWaalsContact CE2-N 3.27Å; C292-S303 PolarHBondContact N-OG 3.14Å; C292-S303 VanDerWaalsContact N-OG 3.12Å; C292-S303 PolarHBondContact O-N 3.37Å; C292-S303 PolarHBondContact O-OG 3.39Å; S303-Q305 VanDerWaalsContact C-N 3.34Å; S303-Q305 PolarHBondContact OG-O 2.69Å
304	N	85	Confident	85.7	Confident	145 Å²	145	57.4 Å²	57.4	78%	0.775	30%	0.298	S	S	*	.	S	Bend	trans	-71.1	-37	168.4	-70.2	-11.4	0	0	0	110.6
305	Q	85.5	Confident	85.1	Confident	26 Å²	26	65.3 Å²	65.3	12%	0.121	34%	0.34	C	S	.	.			trans	-61.6	135.8	176.7	-172	-176.7	23.6	0	0	111.7	H193 S194 D195 S303	H193-Q305 HydrophobicContact CB-CG 4.29Å; S194-Q305 WeakPolarHBondContact O-CG 3.5Å; S194-Q305 PolarHBondContact O-NE2 2.96Å; D195-Q305 WeakPolarHBondContact OD1-CA 3.34Å; S303-Q305 VanDerWaalsContact C-N 3.34Å; S303-Q305 PolarHBondContact OG-O 2.69Å
306	R	90.5	Very high	84.9	Confident	107 Å²	107	72.5 Å²	72.5	40%	0.404	37%	0.372	S	S	.	.			trans	-119.6	140.2	177.5	-64.8	160.6	179	-129.9	1.7	110.2	D195 K196 Q289 Y290	D195-R306 CarbonylContact C-O 3.6Å; D195-R306 VanDerWaalsContact CA-O 3.26Å; D195-R306 WeakPolarHBondContact CA-O 3.26Å; D195-R306 WeakPolarHBondContact CB-O 3.5Å; D195-R306 PolarHBondContact OD1-N 3.11Å; K196-R306 PolarHBondContact N-O 3.31Å; Q289-R306 HydrophobicContact CG-CB 3.87Å; Q289-R306 HydrophobicContact CG-CG 4.11Å; Y290-R306 CarbonylContact O-C 2.91Å; Y290-R306 WeakPolarHBondContact O-CA 3.14Å
307	T	93.1	Very high	84.7	Confident	5 Å²	5	80.5 Å²	80.5	3%	0.031	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	114.8	168.4	-63.4	0	0	0	0	109.2	K196 L198 V208 Y290	K196-T307 CarbonylContact O-C 3.42Å; K196-T307 VanDerWaalsContact O-CA 3.29Å; K196-T307 WeakPolarHBondContact O-CA 3.41Å; L198-T307 HydrophobicContact CD1-CG2 3.68Å; L198-T307 HydrophobicContact CG-CG2 4.16Å; V208-T307 HydrophobicContact CG1-CG2 4.25Å; V208-T307 HydrophobicContact CG2-CG2 4.25Å; Y290-T307 PolarHBondContact N-O 3.31Å; Y290-T307 PolarHBondContact O-N 3.26Å
308	H	93.4	Very high	84.7	Confident	47 Å²	47	79.6 Å²	79.6	22%	0.218	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	109.2	174.2	-68.4	-92.3	0	0	0	109.2	K196 Y197 L198	K196-H308 PolarHBondContact O-N 2.96Å; Y197-H308 HydrophobicContact CD1-CB 3.53Å; Y197-H308 HydrophobicContact CE1-CB 3.64Å; Y197-H308 AromaticContact CE1-CD2 3.74Å; Y197-H308 AromaticContact CE1-CG 3.62Å; Y197-H308 HydrophobicContact CG-CB 4.34Å; Y197-H308 AromaticContact CZ-CD2 3.85Å; L198-H308 PolarHBondContact N-O 2.71Å
309	L	93.7	Very high	84.6	Confident	2 Å²	2	84.9 Å²	84.9	1%	0.01	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.4	177.3	177.8	60	0	0	0	109.9	L198 L200 A206 I279 L282 D286 T287 G288 Y290 V311	L198-L309 HydrophobicContact CB-CD1 3.91Å; L198-L309 CarbonylContact O-C 3.58Å; L198-L309 WeakPolarHBondContact O-CA 3.3Å; L200-L309 HydrophobicContact CB-CD1 4.35Å; L200-L309 HydrophobicContact CD1-CD1 3.9Å; L200-L309 HydrophobicContact CG-CD1 4.27Å; A206-L309 HydrophobicContact CB-CD1 4.48Å; A206-L309 HydrophobicContact CB-CD2 4.15Å; I279-L309 HydrophobicContact CD1-CD2 4.47Å; L282-L309 HydrophobicContact CD2-CD2 3.97Å; D286-L309 HydrophobicContact CB-CD2 4.46Å; T287-L309 CarbonylContact C-O 3.55Å; T287-L309 WeakPolarHBondContact CA-O 3.44Å; G288-L309 PolarHBondContact N-O 3.42Å; G288-L309 PolarHBondContact O-N 3.42Å; Y290-L309 HydrophobicContact CD2-CB 4.09Å; Y290-L309 HydrophobicContact CE2-CB 3.83Å; Y290-L309 HydrophobicContact CE2-CD2 3.81Å; Y290-L309 HydrophobicContact CE2-CG 4.44Å; L309-V311 HydrophobicContact CD1-CG2 4.48Å; L309-V311 HydrophobicContact CD2-CG2 4.33Å; L309-V311 HydrophobicContact CG-CG2 4.15Å
310	V	93.2	Very high	84.4	Confident	72 Å²	72	81.2 Å²	81.2	44%	0.436	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	116.8	172.2	-177.4	0	0	0	0	108.1	L198 S199 L200 T312	L198-V310 PolarHBondContact O-N 2.83Å; S199-V310 WeakPolarHBondContact CA-O 3.49Å; L200-V310 PolarHBondContact N-O 3.15Å; V310-T312 HydrophobicContact CG1-CG2 4.11Å
311	V	92.4	Very high	84	Confident	6 Å²	6	82.1 Å²	82.1	4%	0.036	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.7	177.4	-176.4	0	0	0	0	109	L200 I202 L282 Q283 L284 D286 T287 L309	L200-V311 WeakPolarHBondContact O-CA 3.46Å; I202-V311 HydrophobicContact CB-CG1 3.91Å; I202-V311 HydrophobicContact CG1-CG1 4.12Å; L282-V311 HydrophobicContact CB-CG1 4.17Å; L282-V311 HydrophobicContact CB-CG2 4.46Å; L282-V311 HydrophobicContact CD2-CG2 3.95Å; Q283-V311 WeakPolarHBondContact O-CG2 3.39Å; L284-V311 WeakPolarHBondContact CD2-O 3.46Å; D286-V311 HydrophobicContact CB-CG2 4.32Å; T287-V311 PolarHBondContact OG1-N 3.11Å; T287-V311 VanDerWaalsContact OG1-N 3.13Å; L309-V311 HydrophobicContact CD1-CG2 4.48Å; L309-V311 HydrophobicContact CD2-CG2 4.33Å; L309-V311 HydrophobicContact CG-CG2 4.15Å
312	T	90	Very high	83.5	Confident	50 Å²	50	82.2 Å²	82.2	31%	0.307	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	151.7	-176.8	61.3	0	0	0	0	111.4	L200 I202 V310	L200-T312 PolarHBondContact O-N 3.07Å; L200-T312 PolarHBondContact O-OG1 3.11Å; I202-T312 PolarHBondContact N-O 3.31Å; V310-T312 HydrophobicContact CG1-CG2 4.11Å
313	K	85.1	Confident	82.9	Confident	160 Å²	160	81.9 Å²	81.9	70%	0.696	39%	0.39	S	S	*	.			trans	-101.2	123.3	170.9	-173.6	178.7	179.2	-175.2	0	108.7	I202	I202-K313 HydrophobicContact CG2-CB 4.36Å; I202-K313 HydrophobicContact CG2-CG 4.26Å
314	P	81.8	Confident	82.1	Confident	35 Å²	35	81.4 Å²	81.4	23%	0.227	39%	0.386	C	S	.	.			trans	-73.6	141.5	178.2	28.3	-31.5	0	0	0	111.3	L201 I318 A374	L201-P314 HydrophobicContact CD2-CB 3.94Å; L201-P314 HydrophobicContact CD2-CG 4.12Å; P314-I318 HydrophobicContact CB-CD1 3.81Å; P314-A374 HydrophobicContact CB-CB 4.19Å; P314-A374 HydrophobicContact CG-CB 3.68Å
315	N	77.5	Confident	81.5	Confident	166 Å²	166	74.5 Å²	74.5	89%	0.888	35%	0.349	S	S	*	.	S	Bend	trans	-88.6	-20.5	173.8	-67.3	-19.6	0	0	0	112.6
316	E	77.9	Confident	80.7	Confident	163 Å²	163	74.4 Å²	74.4	76%	0.762	35%	0.349	S	S	*	.	S	Bend	trans	-133	171	-178.2	-63.8	-172.1	172.5	0	0	111
317	K	72.5	Confident	79.7	Confident	176 Å²	176	72.3 Å²	72.3	77%	0.765	35%	0.346	S	S	*	.			trans	-74.2	129.5	175.4	-67.7	-178.1	-179.2	179	0	110.2	A374	K317-A374 WeakPolarHBondContact CA-O 3.18Å
318	I	72.2	Confident	78.7	Confident	65 Å²	65	72.5 Å²	72.5	33%	0.333	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.5	-177.4	-64.7	173.5	0	0	0	109.2	L201 P314 A374	L201-I318 HydrophobicContact CD1-CB 4.13Å; L201-I318 HydrophobicContact CD1-CD1 3.71Å; L201-I318 HydrophobicContact CD1-CG1 4.48Å; L201-I318 HydrophobicContact CD1-CG2 4.17Å; L201-I318 HydrophobicContact CD2-CD1 3.83Å; L201-I318 HydrophobicContact CG-CD1 4.4Å; P314-I318 HydrophobicContact CB-CD1 3.81Å; I318-A374 HydrophobicContact CB-CB 4.22Å; I318-A374 PolarHBondContact N-O 2.91Å; I318-A374 VanDerWaalsContact N-O 3.16Å; I318-A374 PolarHBondContact O-N 3.33Å
319	W	67.1	Low	77.6	Confident	223 Å²	223	74.7 Å²	74.7	85%	0.845	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.3	147.7	-178.3	-75.6	43.3	0	0	0	111	H321	W319-H321 PolarHBondContact O-CD2 3.03Å; W319-H321 PolarHBondContact O-N 3.09Å; W319-H321 VanDerWaalsContact O-N 3.13Å
320	T	71	Confident	76.6	Confident	18 Å²	18	77.2 Å²	77.2	11%	0.11	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	106.6	-176.9	46.9	0	0	0	0	111.5	E372 V377 I425	T320-E372 WeakPolarHBondContact CA-O 3.15Å; T320-V377 HydrophobicContact CG2-CG1 4.35Å; T320-I425 WeakPolarHBondContact OG1-CD1 3.46Å
321	H	75.4	Confident	75.6	Confident	120 Å²	120	73.8 Å²	73.8	56%	0.556	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	120.6	173.7	-72.3	-86.4	0	0	0	110.6	W319 F371 E372	W319-H321 PolarHBondContact O-CD2 3.03Å; W319-H321 PolarHBondContact O-N 3.09Å; W319-H321 VanDerWaalsContact O-N 3.13Å; H321-F371 CarbonylContact O-C 3.59Å; H321-F371 WeakPolarHBondContact O-CA 3.29Å; H321-E372 PolarHBondContact N-O 2.02Å; H321-E372 PolarHBondContact O-N 2.88Å
322	L	76.4	Confident	74.4	Confident	55 Å²	55	76.1 Å²	76.1	29%	0.288	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	126.8	174.3	166.6	60.1	0	0	0	110.9	F324 C369 F371 I425 K427	L322-F324 HydrophobicContact CD1-CB 4.29Å; L322-C369 WeakPolarHBondContact CD1-SG 3.32Å; L322-F371 HydrophobicContact CB-CD1 4.02Å; L322-F371 HydrophobicContact CB-CE1 3.83Å; L322-F371 HydrophobicContact CD1-CD1 4.2Å; L322-F371 HydrophobicContact CD1-CE1 3.69Å; L322-F371 HydrophobicContact CD1-CE2 4.12Å; L322-F371 HydrophobicContact CD1-CZ 3.64Å; L322-F371 HydrophobicContact CD2-CE1 4.5Å; L322-F371 HydrophobicContact CG-CE1 4.19Å; L322-I425 HydrophobicContact CB-CG2 4.12Å; L322-I425 HydrophobicContact CD2-CG2 4.47Å; L322-K427 HydrophobicContact CD2-CB 3.92Å; L322-K427 HydrophobicContact CD2-CD 4.47Å
323	K	76.7	Confident	73.5	Confident	65 Å²	65	77.7 Å²	77.7	28%	0.283	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	116.7	164.7	-165.9	178.7	-175.9	-166.9	0	110.6	D328 I370	K323-D328 WeakPolarHBondContact CE-OD2 3.44Å; K323-D328 IonicContact NZ-OD2 2.67Å; K323-D328 PolarHBondContact NZ-OD2 2.71Å; K323-I370 PolarHBondContact N-O 2.84Å; K323-I370 PolarHBondContact O-N 2.83Å; K323-I370 VanDerWaalsContact O-O 3.11Å
324	F	73.2	Confident	72.4	Confident	3 Å²	3	70.6 Å²	70.6	1%	0.013	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140	-177.6	-175.4	-120	0	0	0	111.6	L322 L326 D327 D328 F368 C369 W381 K427 F429	L322-F324 HydrophobicContact CD1-CB 4.29Å; F324-L326 HydrophobicContact CD1-CB 3.8Å; F324-L326 HydrophobicContact CE1-CB 3.47Å; F324-L326 VanDerWaalsContact CE1-CB 3.47Å; F324-L326 HydrophobicContact CE1-CD1 4.38Å; F324-L326 HydrophobicContact CZ-CB 4.31Å; F324-L326 PolarHBondContact O-N 2.84Å; F324-L326 VanDerWaalsContact O-N 3.1Å; F324-D327 WeakPolarHBondContact CB-OD2 3.42Å; F324-D327 WeakPolarHBondContact CD1-OD2 3.37Å; F324-D327 PolarHBondContact O-N 2.96Å; F324-D328 PolarHBondContact O-N 3.42Å; F324-F368 WeakPolarHBondContact CD2-O 3.47Å; F324-C369 HydrophobicContact CD2-CB 3.81Å; F324-C369 HydrophobicContact CE2-CB 4.24Å; F324-W381 HydrophobicContact CE2-CH2 4.07Å; F324-K427 HydrophobicContact CD1-CD 4.1Å; F324-F429 AromaticContact CE1-CD1 3.99Å; F324-F429 HydrophobicContact CE1-CD1 3.99Å; F324-F429 HydrophobicContact CE1-CE1 4.34Å; F324-F429 HydrophobicContact CE2-CD1 4.2Å; F324-F429 AromaticContact CE2-CE1 3.74Å; F324-F429 HydrophobicContact CE2-CE1 3.74Å; F324-F429 AromaticContact CZ-CD1 3.42Å; F324-F429 HydrophobicContact CZ-CD1 3.42Å; F324-F429 VanDerWaalsContact CZ-CD1 3.42Å; F324-F429 AromaticContact CZ-CE1 3.35Å; F324-F429 HydrophobicContact CZ-CE1 3.35Å; F324-F429 HydrophobicContact CZ-CG 4.27Å; F324-F429 HydrophobicContact CZ-CZ 4.15Å
325	S	73.2	Confident	71.6	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.6	-170.9	71.6	0	0	0	0	114.7	Y335 F368	S325-Y335 WeakPolarHBondContact CB-OH 3.39Å; S325-Y335 WeakPolarHBondContact O-CE2 3.27Å; S325-Y335 PolarHBondContact OG-OH 2.53Å; S325-F368 VanDerWaalsContact CB-CD1 3.44Å; S325-F368 PolarHBondContact N-O 2.74Å
326	L	67.5	Low	70.6	Confident	24 Å²	24	68 Å²	68	13%	0.126	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	3.5	-178.5	-117.1	153.7	0	0	0	113.8	F324 Y335 K355 I357 L367	F324-L326 HydrophobicContact CD1-CB 3.8Å; F324-L326 HydrophobicContact CE1-CB 3.47Å; F324-L326 VanDerWaalsContact CE1-CB 3.47Å; F324-L326 HydrophobicContact CE1-CD1 4.38Å; F324-L326 HydrophobicContact CZ-CB 4.31Å; F324-L326 PolarHBondContact O-N 2.84Å; F324-L326 VanDerWaalsContact O-N 3.1Å; L326-Y335 HydrophobicContact CD1-CD1 4.37Å; L326-Y335 HydrophobicContact CD1-CG 4.28Å; L326-Y335 HydrophobicContact CD2-CD2 4.42Å; L326-Y335 HydrophobicContact CD2-CG 4.21Å; L326-Y335 HydrophobicContact CG-CD1 4.37Å; L326-Y335 HydrophobicContact CG-CD2 3.84Å; L326-Y335 HydrophobicContact CG-CE2 4.37Å; L326-Y335 HydrophobicContact CG-CG 3.81Å; L326-K355 HydrophobicContact CD2-CD 4.42Å; L326-K355 PolarHBondContact O-NZ 2.92Å; L326-I357 HydrophobicContact CD1-CD1 3.29Å; L326-I357 HydrophobicContact CD1-CG1 3.59Å; L326-L367 HydrophobicContact CD1-CD2 4.08Å
327	D	70.2	Confident	69.1	Low	63 Å²	63	64.5 Å²	64.5	34%	0.337	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-11.4	173.4	-53.8	-60.3	0	0	0	113.4	F324 P329 K355 K427	F324-D327 WeakPolarHBondContact CB-OD2 3.42Å; F324-D327 WeakPolarHBondContact CD1-OD2 3.37Å; F324-D327 PolarHBondContact O-N 2.96Å; D327-P329 WeakPolarHBondContact O-CD 3.2Å; D327-K355 IonicContact OD1-NZ 2.7Å; D327-K355 PolarHBondContact OD1-NZ 2.96Å; D327-K427 IonicContact OD1-NZ 3.59Å; D327-K427 PolarHBondContact OD1-NZ 3.36Å; D327-K427 WeakPolarHBondContact OD2-CD 3.38Å; D327-K427 VanDerWaalsContact OD2-CE 3.31Å; D327-K427 WeakPolarHBondContact OD2-CE 3.44Å; D327-K427 IonicContact OD2-NZ 3.71Å; D327-K427 PolarHBondContact OD2-NZ 2.9Å
328	D	72.7	Confident	67.5	Low	9 Å²	9	63.3 Å²	63.3	5%	0.048	32%	0.315	C	S	.	.			trans	-65.8	119.6	170.4	-169	-24.7	0	0	0	108.8	K323 F324 D330 L331 S332	K323-D328 WeakPolarHBondContact CE-OD2 3.44Å; K323-D328 IonicContact NZ-OD2 2.67Å; K323-D328 PolarHBondContact NZ-OD2 2.71Å; F324-D328 PolarHBondContact O-N 3.42Å; D328-D330 PolarHBondContact O-N 3.32Å; D328-D330 PolarHBondContact OD1-N 2.88Å; D328-L331 HydrophobicContact CB-CB 4.23Å; D328-L331 HydrophobicContact CB-CD1 4.02Å; D328-L331 HydrophobicContact CB-CG 4.21Å; D328-L331 PolarHBondContact O-N 2.97Å; D328-S332 PolarHBondContact O-N 2.98Å
329	P	70.6	Confident	65.8	Low	94 Å²	94	66.5 Å²	66.5	61%	0.61	33%	0.333	S	S	*	.	H	α-helix	trans	-56.4	-37.2	-178.3	22.5	-33.6	0	0	0	111.6	D327 L331 S332	D327-P329 WeakPolarHBondContact O-CD 3.2Å; P329-L331 PolarHBondContact O-N 2.85Å; P329-L331 VanDerWaalsContact O-N 3.14Å; P329-S332 PolarHBondContact O-N 2.7Å; P329-S332 PolarHBondContact O-OG 3.04Å
330	D	72.2	Confident	64.2	Low	55 Å²	55	63 Å²	63	29%	0.294	33%	0.331	S	S	.	.	H	α-helix	trans	-72.8	-4	-177.7	-63.2	1.7	0	0	0	113.7	K196 I209 H211 D328 Y333	K196-D330 WeakPolarHBondContact CE-OD2 3.4Å; K196-D330 IonicContact NZ-OD2 2.63Å; K196-D330 PolarHBondContact NZ-OD2 2.8Å; I209-D330 HydrophobicContact CD1-CB 4.03Å; H211-D330 PolarHBondContact NE2-O 3.13Å; D328-D330 PolarHBondContact O-N 3.32Å; D328-D330 PolarHBondContact OD1-N 2.88Å; D330-Y333 WeakPolarHBondContact O-CE1 3.23Å
331	L	72.4	Confident	62.1	Low	0 Å²	0	67 Å²	67	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-125.6	-14.3	177.1	-59.3	174.7	0	0	0	112.6	I209 A274 I276 D328 P329 Y333 L334 F368	I209-L331 HydrophobicContact CD1-CD1 4.23Å; I209-L331 HydrophobicContact CD1-CD2 3.93Å; I209-L331 HydrophobicContact CD1-CG 3.96Å; I209-L331 HydrophobicContact CG1-CD2 4.4Å; I209-L331 HydrophobicContact CG2-CD2 3.88Å; A274-L331 HydrophobicContact CB-CD2 4.38Å; I276-L331 HydrophobicContact CD1-CD1 3.59Å; I276-L331 HydrophobicContact CD1-CD2 3.84Å; I276-L331 HydrophobicContact CD1-CG 4.4Å; I276-L331 HydrophobicContact CG1-CD2 4.42Å; D328-L331 HydrophobicContact CB-CB 4.23Å; D328-L331 HydrophobicContact CB-CD1 4.02Å; D328-L331 HydrophobicContact CB-CG 4.21Å; D328-L331 PolarHBondContact O-N 2.97Å; P329-L331 PolarHBondContact O-N 2.85Å; P329-L331 VanDerWaalsContact O-N 3.14Å; L331-Y333 PolarHBondContact O-N 2.87Å; L331-Y333 VanDerWaalsContact O-N 3.12Å; L331-L334 HydrophobicContact CB-CD1 3.99Å; L331-L334 HydrophobicContact CD2-CD1 3.47Å; L331-L334 VanDerWaalsContact CD2-CD1 3.47Å; L331-L334 HydrophobicContact CG-CD1 4.34Å; L331-L334 VanDerWaalsContact O-CB 3.26Å; L331-L334 WeakPolarHBondContact O-CB 3.45Å; L331-L334 PolarHBondContact O-N 2.96Å; L331-F368 HydrophobicContact CD1-CE1 3.64Å; L331-F368 HydrophobicContact CD1-CZ 3.48Å; L331-F368 VanDerWaalsContact CD1-CZ 3.48Å
332	S	67.9	Low	59.7	Low	55 Å²	55	64.1 Å²	64.1	39%	0.385	35%	0.354	S	S	.	.	H	α-helix	trans	-53.6	-34.6	-176.7	66.1	0	0	0	0	113.6	D328 P329 L334	D328-S332 PolarHBondContact O-N 2.98Å; P329-S332 PolarHBondContact O-N 2.7Å; P329-S332 PolarHBondContact O-OG 3.04Å; S332-L334 VanDerWaalsContact C-N 3.31Å; S332-L334 PolarHBondContact O-N 3.36Å
333	Y	69.1	Low	57.4	Low	83 Å²	83	68.1 Å²	68.1	33%	0.325	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-23	178.4	74.7	-97.2	0	0	0	113.7	H211 P272 D330 L331 Y335	H211-Y333 AromaticContact CD2-CE1 3.84Å; H211-Y333 AromaticContact CD2-CZ 3.88Å; H211-Y333 PolarHBondContact CD2-OH 3.02Å; P272-Y333 HydrophobicContact CB-CD2 4.4Å; P272-Y333 HydrophobicContact CB-CE2 3.8Å; P272-Y333 HydrophobicContact CG-CD2 3.64Å; P272-Y333 HydrophobicContact CG-CE2 3.53Å; D330-Y333 WeakPolarHBondContact O-CE1 3.23Å; L331-Y333 PolarHBondContact O-N 2.87Å; L331-Y333 VanDerWaalsContact O-N 3.12Å; Y333-Y335 VanDerWaalsContact C-N 3.34Å
334	L	63.6	Low	55	Low	10 Å²	10	73 Å²	73	5%	0.052	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-31.2	-178.2	-62.5	165.6	0	0	0	112.3	I244 P272 A274 L331 S332	I244-L334 HydrophobicContact CB-CD1 4.12Å; I244-L334 HydrophobicContact CG2-CB 4.02Å; I244-L334 HydrophobicContact CG2-CD1 3.83Å; I244-L334 HydrophobicContact CG2-CG 4.4Å; P272-L334 WeakPolarHBondContact O-CD2 3.48Å; A274-L334 HydrophobicContact CB-CD1 3.72Å; A274-L334 HydrophobicContact CB-CD2 4.13Å; L331-L334 HydrophobicContact CB-CD1 3.99Å; L331-L334 HydrophobicContact CD2-CD1 3.47Å; L331-L334 VanDerWaalsContact CD2-CD1 3.47Å; L331-L334 HydrophobicContact CG-CD1 4.34Å; L331-L334 VanDerWaalsContact O-CB 3.26Å; L331-L334 WeakPolarHBondContact O-CB 3.45Å; L331-L334 PolarHBondContact O-N 2.96Å; S332-L334 VanDerWaalsContact C-N 3.31Å; S332-L334 PolarHBondContact O-N 3.36Å
335	Y	63.9	Low	52.7	Low	41 Å²	41	79.1 Å²	79.1	16%	0.161	44%	0.438	C	S	.	.	S	Bend	trans	-99.7	-6.2	-172.6	-63.5	-74.4	0	0	0	113.4	I244 S325 L326 Y333 L365 T366 L367	I244-Y335 HydrophobicContact CG2-CE1 4.23Å; S325-Y335 WeakPolarHBondContact CB-OH 3.39Å; S325-Y335 WeakPolarHBondContact O-CE2 3.27Å; S325-Y335 PolarHBondContact OG-OH 2.53Å; L326-Y335 HydrophobicContact CD1-CD1 4.37Å; L326-Y335 HydrophobicContact CD1-CG 4.28Å; L326-Y335 HydrophobicContact CD2-CD2 4.42Å; L326-Y335 HydrophobicContact CD2-CG 4.21Å; L326-Y335 HydrophobicContact CG-CD1 4.37Å; L326-Y335 HydrophobicContact CG-CD2 3.84Å; L326-Y335 HydrophobicContact CG-CE2 4.37Å; L326-Y335 HydrophobicContact CG-CG 3.81Å; Y333-Y335 VanDerWaalsContact C-N 3.34Å; Y335-L365 HydrophobicContact CE1-CD1 4.32Å; Y335-T366 PolarHBondContact OH-O 2.91Å; Y335-L367 HydrophobicContact CD1-CD2 4.41Å; Y335-L367 HydrophobicContact CE1-CD2 3.62Å
336	N	56.4	Low	50.6	Low	107 Å²	107	85.2 Å²	85.2	57%	0.572	47%	0.47	S	S	*	.			trans	-105.2	97	-168.8	-153.8	16.7	0	0	0	111.5	N338	N336-N338 PolarHBondContact O-N 3.49Å
337	N	47.4	Very low	48.8	Very low	88 Å²	88	91.6 Å²	91.6	47%	0.471	51%	0.505	S	S	.	.			trans	-69.1	111.5	174.6	-106.8	6.7	0	0	0	110	N339	N337-N339 PolarHBondContact O-N 3.04Å
338	N	38.8	Very low	46.8	Very low	151 Å²	151	97.3 Å²	97.3	81%	0.807	53%	0.529	S	S	*	.			trans	-71.2	68.8	176.5	-85.3	-13.6	0	0	0	112.7	N336	N336-N338 PolarHBondContact O-N 3.49Å
339	N	36.1	Very low	44.7	Very low	133 Å²	133	104.5 Å²	104.5	71%	0.711	57%	0.568	S	S	*	*			trans	-103.8	4.6	167.3	-86.8	9	0	0	0	112.6	N337 N341	N337-N339 PolarHBondContact O-N 3.04Å; N339-N341 PolarHBondContact O-N 3.01Å
340	N	32.8	Very low	42.9	Very low	148 Å²	148	104.8 Å²	104.8	79%	0.791	57%	0.572	S	S	*	*			trans	-79.2	50.6	178	-73.2	-2.3	0	0	0	112.7	G342	N340-G342 PolarHBondContact O-N 3.01Å
341	N	27.1	Very low	41.2	Very low	104 Å²	104	110.7 Å²	110.7	56%	0.556	60%	0.603	S	S	*	*			trans	-72.7	75.9	157.9	-102.5	-16.7	0	0	0	107.7	N339 N573	N339-N341 PolarHBondContact O-N 3.01Å; N341-N573 PolarHBondContact ND2-OD1 2.89Å
342	G	26.1	Very low	39.7	Very low	59 Å²	59	118.7 Å²	118.7	61%	0.608	65%	0.645	S	S	*	*			trans	-166.4	80.9	-167.7	0	0	0	0	0	114.4	N340	N340-G342 PolarHBondContact O-N 3.01Å
343	N	27.1	Very low	38.9	Very low	138 Å²	138	126.7 Å²	126.7	74%	0.738	67%	0.667	S	S	*	*			trans	53.9	118.6	164.4	-65.5	-23.1	0	0	0	118.7	N345	N343-N345 VanDerWaalsContact C-N 3.31Å; N343-N345 HydrophobicContact CB-CB 4.38Å; N343-N345 PolarHBondContact O-N 2.88Å
344	N	25.9	Very low	38.7	Very low	168 Å²	168	126.5 Å²	126.5	90%	0.898	67%	0.671	S	S	*	*			trans	-58	97	143.4	-74	-17.6	0	0	0	108.7
345	N	26.8	Very low	39.1	Very low	132 Å²	132	130.1 Å²	130.1	71%	0.706	69%	0.686	S	S	*	*			trans	-148.5	103.1	165.5	-98	-45.6	0	0	0	110	N343	N343-N345 VanDerWaalsContact C-N 3.31Å; N343-N345 HydrophobicContact CB-CB 4.38Å; N343-N345 PolarHBondContact O-N 2.88Å
346	N	29.2	Very low	39.7	Very low	127 Å²	127	133 Å²	133	68%	0.679	70%	0.701	S	S	*	*			trans	-26.2	133.9	172.9	-47	-17.8	0	0	0	115.1
347	N	28	Very low	40.7	Very low	158 Å²	158	128.3 Å²	128.3	85%	0.845	68%	0.676	S	S	*	*				-172.9	115.6	129	-94.4	-41.9	0	0	0	111	N349	N347-N349 PolarHBondContact O-N 2.89Å
348	E	29.4	Very low	42.1	Very low	183 Å²	183	130.2 Å²	130.2	86%	0.855	68%	0.68	S	S	*	*			trans	-73.6	103.4	170.2	-61.2	-178.9	127.4	0	0	109.7
349	N	29.1	Very low	43.7	Very low	161 Å²	161	123.7 Å²	123.7	86%	0.861	65%	0.645	S	S	*	*			trans	-167.7	68.3	169.3	-103.3	-59.1	0	0	0	111	N347	N347-N349 PolarHBondContact O-N 2.89Å
350	S	31	Very low	45.2	Very low	99 Å²	99	119.2 Å²	119.2	69%	0.692	62%	0.621	S	S	*	*			trans	-122.7	2	-170.8	56	0	0	0	0	115.8	N352	S350-N352 PolarHBondContact O-N 3.01Å
351	L	36.5	Very low	46.8	Very low	180 Å²	180	114.4 Å²	114.4	94%	0.942	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-5.3	-172.5	-149.4	82.8	0	0	0	115.5
352	N	41.8	Very low	48.6	Very low	167 Å²	167	113.3 Å²	113.3	89%	0.893	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.6	19.3	-172.2	-131.1	2.1	0	0	0	114.3	S350	S350-N352 PolarHBondContact O-N 3.01Å
353	R	50.9	Low	50.3	Low	224 Å²	224	110.8 Å²	110.8	85%	0.845	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-99.6	117.4	178.5	-155.8	173.2	-169.8	176	2.6	110	K355	R353-K355 PolarHBondContact O-N 3.38Å
354	I	65.7	Low	52.5	Low	79 Å²	79	105.7 Å²	105.7	41%	0.405	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-52.9	125.2	174.3	-62.2	178.5	0	0	0	108.5	E356 I412 R430	I354-E356 PolarHBondContact O-N 2.99Å; I354-I412 HydrophobicContact CD1-CD1 4.21Å; I354-R430 HydrophobicContact CG2-CB 4.22Å
355	K	70.7	Confident	55	Low	85 Å²	85	98.4 Å²	98.4	37%	0.37	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	127.8	176.6	-87.8	-176.8	167.6	176.5	0	109	L326 D327 R353 F429 R430	L326-K355 HydrophobicContact CD2-CD 4.42Å; L326-K355 PolarHBondContact O-NZ 2.92Å; D327-K355 IonicContact OD1-NZ 2.7Å; D327-K355 PolarHBondContact OD1-NZ 2.96Å; R353-K355 PolarHBondContact O-N 3.38Å; K355-F429 CarbonylContact O-C 3.56Å; K355-F429 WeakPolarHBondContact O-CA 3.12Å; K355-F429 WeakPolarHBondContact O-CB 2.91Å; K355-R430 PolarHBondContact O-N 2.73Å
356	E	77	Confident	57.6	Low	102 Å²	102	93.1 Å²	93.1	48%	0.477	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	132.1	174	-59	-164.4	136	0	0	110.2	I354 R430 I432	I354-E356 PolarHBondContact O-N 2.99Å; E356-R430 CarbonylContact C-O 3.55Å; E356-R430 WeakPolarHBondContact CA-O 3.37Å; E356-R430 HydrophobicContact CG-CB 4.37Å; E356-R430 WeakPolarHBondContact OE1-CD 3.42Å; E356-R430 IonicContact OE1-CZ 3.25Å; E356-R430 IonicContact OE1-NE 2.59Å; E356-R430 IonicContact OE1-NH1 2.86Å; E356-R430 PolarHBondContact OE1-NH1 2.97Å; E356-I432 HydrophobicContact CB-CD1 4.21Å; E356-I432 HydrophobicContact CG-CD1 4.36Å
357	I	77.8	Confident	60.2	Low	9 Å²	9	87.1 Å²	87.1	5%	0.046	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120.6	176.1	-46.4	177.9	0	0	0	107	L326 I359 L365 L367 F429 R430 I431 I432	L326-I357 HydrophobicContact CD1-CD1 3.29Å; L326-I357 HydrophobicContact CD1-CG1 3.59Å; I357-I359 HydrophobicContact CG2-CG2 4.09Å; I357-L365 HydrophobicContact CG2-CD1 4.47Å; I357-L365 HydrophobicContact CG2-CD2 4.44Å; I357-L367 HydrophobicContact CD1-CD1 3.64Å; I357-L367 HydrophobicContact CD1-CD2 4.16Å; I357-F429 HydrophobicContact CD1-CB 4.34Å; I357-F429 HydrophobicContact CD1-CD2 3.37Å; I357-F429 HydrophobicContact CD1-CE2 3.84Å; I357-F429 HydrophobicContact CD1-CG 3.98Å; I357-F429 HydrophobicContact CG1-CD2 4.22Å; I357-R430 PolarHBondContact N-O 2.88Å; I357-I431 HydrophobicContact CB-CG1 4.45Å; I357-I431 HydrophobicContact CD1-CG1 4.37Å; I357-I431 WeakPolarHBondContact O-CA 3.43Å; I357-I432 PolarHBondContact O-N 3.17Å
358	K	75.3	Confident	62.9	Low	127 Å²	127	79.6 Å²	79.6	55%	0.552	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	117.5	177.9	-70.9	175.3	-178.9	178.6	0	109.1	I432 I434	K358-I432 HydrophobicContact CG-CB 4.32Å; K358-I434 HydrophobicContact CB-CD1 3.94Å; K358-I434 HydrophobicContact CD-CD1 4.34Å; K358-I434 HydrophobicContact CG-CD1 4.37Å
359	I	73.9	Confident	65.7	Low	15 Å²	15	70.9 Å²	70.9	8%	0.077	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	156.2	177.1	64.9	-179.4	0	0	0	109.6	I357 L365 A405 I431 I432 V433 I434	I357-I359 HydrophobicContact CG2-CG2 4.09Å; I359-L365 HydrophobicContact CD1-CB 4.21Å; I359-L365 HydrophobicContact CD1-CD2 4.23Å; I359-L365 HydrophobicContact CG2-CB 4.32Å; I359-L365 HydrophobicContact CG2-CD1 4.05Å; I359-L365 HydrophobicContact CG2-CD2 4.06Å; I359-L365 HydrophobicContact CG2-CG 4.36Å; I359-A405 HydrophobicContact CD1-CB 3.48Å; I359-A405 VanDerWaalsContact CD1-CB 3.48Å; I359-A405 HydrophobicContact CG1-CB 4.26Å; I359-I431 HydrophobicContact CD1-CG2 3.59Å; I359-I431 HydrophobicContact CG1-CG2 4.01Å; I359-I432 PolarHBondContact N-O 2.98Å; I359-V433 HydrophobicContact CD1-CG2 4.13Å; I359-V433 HydrophobicContact CG1-CG2 3.98Å; I359-V433 WeakPolarHBondContact O-CA 3.37Å; I359-I434 PolarHBondContact O-N 2.84Å
360	N	66.9	Low	68.4	Low	38 Å²	38	63.7 Å²	63.7	20%	0.203	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	153.1	177.3	-67	-19.9	0	0	0	110.1	T363 I434	N360-T363 HydrophobicContact CB-CG2 3.75Å; N360-T363 PolarHBondContact N-OG1 3.36Å; N360-T363 PolarHBondContact O-N 3.49Å; N360-T363 PolarHBondContact O-OG1 2.7Å; N360-I434 CarbonylContact C-O 3.56Å; N360-I434 WeakPolarHBondContact CA-O 3.38Å
361	E	65.8	Low	70.8	Confident	47 Å²	47	59.3 Å²	59.3	22%	0.22	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	139.6	174.1	-167.7	170.2	-142	0	0	111	Q264 T363 A405 P407 V433 I434 R435	Q264-E361 PolarHBondContact NE2-O 2.92Å; E361-T363 PolarHBondContact O-N 3.26Å; E361-A405 CarbonylContact C-O 3.6Å; E361-A405 WeakPolarHBondContact CA-O 3.31Å; E361-P407 WeakPolarHBondContact OE1-CD 3.25Å; E361-P407 WeakPolarHBondContact OE1-CG 3.37Å; E361-V433 HydrophobicContact CB-CG1 4.15Å; E361-I434 PolarHBondContact N-O 2.87Å; E361-R435 HydrophobicContact CB-CG 4.41Å; E361-R435 VanDerWaalsContact OE2-CB 3.28Å; E361-R435 WeakPolarHBondContact OE2-CB 3.03Å; E361-R435 VanDerWaalsContact OE2-CG 3.28Å; E361-R435 WeakPolarHBondContact OE2-CG 3.21Å
362	N	65.1	Low	73.2	Confident	81 Å²	81	53.2 Å²	53.2	43%	0.433	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	4.3	-172	-53.3	-64.1	0	0	0	116.9	Y404 A405	N362-Y404 WeakPolarHBondContact O-CD1 3.2Å; N362-A405 PolarHBondContact N-O 2.85Å
363	T	62.9	Low	75	Confident	7 Å²	7	45.3 Å²	45.3	4%	0.043	21%	0.209	C	C	.	.			trans	-80.7	162.3	171.9	68.6	0	0	0	0	112.6	D248 N360 E361 A405	D248-T363 HydrophobicContact CB-CG2 3.66Å; N360-T363 HydrophobicContact CB-CG2 3.75Å; N360-T363 PolarHBondContact N-OG1 3.36Å; N360-T363 PolarHBondContact O-N 3.49Å; N360-T363 PolarHBondContact O-OG1 2.7Å; E361-T363 PolarHBondContact O-N 3.26Å; T363-A405 WeakPolarHBondContact O-CB 3.29Å; T363-A405 PolarHBondContact O-N 3.07Å
364	N	71.9	Confident	76.5	Confident	30 Å²	30	35.4 Å²	35.4	16%	0.16	17%	0.174	C	C	.	.			trans	-99.1	127.2	176.5	-70	-21.5	0	0	0	110.3	D248 S249 I402 K403 Y404	D248-N364 PolarHBondContact O-N 2.76Å; S249-N364 PolarHBondContact O-ND2 3.08Å; N364-I402 WeakPolarHBondContact CA-O 3.47Å; N364-K403 VanDerWaalsContact OD1-CA 3.31Å; N364-K403 WeakPolarHBondContact OD1-CA 3.49Å; N364-Y404 PolarHBondContact OD1-N 3.01Å
365	L	78.4	Confident	77.1	Confident	15 Å²	15	35.4 Å²	35.4	8%	0.079	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	128.8	174.4	178.8	66.3	0	0	0	109.9	Y335 I357 I359 L367 I401 I402 I431	Y335-L365 HydrophobicContact CE1-CD1 4.32Å; I357-L365 HydrophobicContact CG2-CD1 4.47Å; I357-L365 HydrophobicContact CG2-CD2 4.44Å; I359-L365 HydrophobicContact CD1-CB 4.21Å; I359-L365 HydrophobicContact CD1-CD2 4.23Å; I359-L365 HydrophobicContact CG2-CB 4.32Å; I359-L365 HydrophobicContact CG2-CD1 4.05Å; I359-L365 HydrophobicContact CG2-CD2 4.06Å; I359-L365 HydrophobicContact CG2-CG 4.36Å; L365-L367 HydrophobicContact CD1-CD2 4.25Å; L365-L367 HydrophobicContact CD1-CG 4.3Å; L365-L367 HydrophobicContact CD2-CD1 3.99Å; L365-L367 HydrophobicContact CD2-CG 4.21Å; L365-L367 HydrophobicContact CG-CD1 4.46Å; L365-L367 HydrophobicContact CG-CG 4.14Å; L365-I401 CarbonylContact O-C 3.57Å; L365-I401 WeakPolarHBondContact O-CA 3.41Å; L365-I402 HydrophobicContact CB-CB 4.48Å; L365-I402 PolarHBondContact N-O 2.84Å; L365-I402 PolarHBondContact O-N 2.87Å; L365-I431 HydrophobicContact CD2-CD1 3.45Å; L365-I431 VanDerWaalsContact CD2-CD1 3.45Å; L365-I431 HydrophobicContact CD2-CG1 4.12Å
366	T	81.2	Confident	77.5	Confident	21 Å²	21	34.7 Å²	34.7	13%	0.129	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	133	166	-53.5	0	0	0	0	111.5	I242 Y335 V399 L400 I401	I242-T366 HydrophobicContact CB-CG2 4.48Å; I242-T366 HydrophobicContact CD1-CG2 4.13Å; I242-T366 HydrophobicContact CG1-CG2 4.29Å; I242-T366 HydrophobicContact CG2-CG2 3.42Å; I242-T366 VanDerWaalsContact CG2-CG2 3.42Å; Y335-T366 PolarHBondContact OH-O 2.91Å; T366-V399 HydrophobicContact CG2-CG1 3.55Å; T366-L400 WeakPolarHBondContact CA-O 3.27Å; T366-I401 HydrophobicContact CG2-CG1 3.89Å
367	L	84.5	Confident	77.6	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	151.3	174.8	-62.3	174.1	0	0	0	109.3	L326 Y335 I357 L365 W381 V399 L400 F429	L326-L367 HydrophobicContact CD1-CD2 4.08Å; Y335-L367 HydrophobicContact CD1-CD2 4.41Å; Y335-L367 HydrophobicContact CE1-CD2 3.62Å; I357-L367 HydrophobicContact CD1-CD1 3.64Å; I357-L367 HydrophobicContact CD1-CD2 4.16Å; L365-L367 HydrophobicContact CD1-CD2 4.25Å; L365-L367 HydrophobicContact CD1-CG 4.3Å; L365-L367 HydrophobicContact CD2-CD1 3.99Å; L365-L367 HydrophobicContact CD2-CG 4.21Å; L365-L367 HydrophobicContact CG-CD1 4.46Å; L365-L367 HydrophobicContact CG-CG 4.14Å; L367-W381 HydrophobicContact CB-CH2 4.48Å; L367-V399 WeakPolarHBondContact O-CA 3.34Å; L367-V399 WeakPolarHBondContact O-CG1 3.42Å; L367-L400 PolarHBondContact N-O 2.97Å; L367-L400 PolarHBondContact O-N 3.34Å; L367-F429 HydrophobicContact CD1-CD2 4.08Å; L367-F429 HydrophobicContact CD1-CE1 4.23Å; L367-F429 HydrophobicContact CD1-CE2 3.21Å; L367-F429 HydrophobicContact CD1-CZ 3.3Å
368	F	85.4	Confident	77.5	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.1	171.3	67.9	-95.8	0	0	0	111	V207 I242 I276 F324 S325 L331 I370 G398 V399	V207-F368 HydrophobicContact CG1-CE2 4.34Å; V207-F368 HydrophobicContact CG1-CZ 4.06Å; V207-F368 HydrophobicContact CG2-CE2 4.38Å; I242-F368 HydrophobicContact CD1-CB 4.43Å; I242-F368 HydrophobicContact CD1-CD1 4.36Å; I276-F368 HydrophobicContact CD1-CD1 4.2Å; I276-F368 HydrophobicContact CD1-CE1 3.37Å; I276-F368 HydrophobicContact CD1-CZ 4.05Å; F324-F368 WeakPolarHBondContact CD2-O 3.47Å; S325-F368 VanDerWaalsContact CB-CD1 3.44Å; S325-F368 PolarHBondContact N-O 2.74Å; L331-F368 HydrophobicContact CD1-CE1 3.64Å; L331-F368 HydrophobicContact CD1-CZ 3.48Å; L331-F368 VanDerWaalsContact CD1-CZ 3.48Å; F368-I370 HydrophobicContact CB-CD1 4.46Å; F368-I370 HydrophobicContact CD2-CD1 3.59Å; F368-I370 HydrophobicContact CD2-CG1 3.98Å; F368-I370 HydrophobicContact CE2-CD1 4.19Å; F368-I370 HydrophobicContact CG-CD1 4.26Å; F368-G398 WeakPolarHBondContact CA-O 3.33Å; F368-V399 HydrophobicContact CB-CG2 4.39Å
369	C	87.2	Confident	77.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	105.3	179.1	-175	0	0	0	0	107.3	L322 F324 T379 W381 G398 C415	L322-C369 WeakPolarHBondContact CD1-SG 3.32Å; F324-C369 HydrophobicContact CD2-CB 3.81Å; F324-C369 HydrophobicContact CE2-CB 4.24Å; C369-T379 HydrophobicContact CB-CG2 4.19Å; C369-T379 WeakPolarHBondContact O-CB 3.33Å; C369-T379 VanDerWaalsContact O-CG2 3.29Å; C369-T379 WeakPolarHBondContact O-CG2 3.42Å; C369-T379 PolarHBondContact O-OG1 3.03Å; C369-W381 HydrophobicContact CB-CH2 4.11Å; C369-W381 HydrophobicContact CB-CZ2 3.64Å; C369-G398 PolarHBondContact N-O 3.26Å; C369-G398 WeakPolarHBondContact O-CA 3.27Å; C369-C415 HydrophobicContact CB-CB 3.43Å; C369-C415 VanDerWaalsContact CB-CB 3.43Å; C369-C415 WeakPolarHBondContact CB-SG 2.92Å; C369-C415 WeakPolarHBondContact SG-CB 3.49Å; C369-C415 CovalentContact SG-SG 2.03Å; C369-C415 PolarHBondContact SG-SG 2.98Å
370	I	85.4	Confident	78.3	Confident	10 Å²	10	32.3 Å²	32.3	5%	0.051	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	142	-169.8	-67.4	168.3	0	0	0	107.9	T205 V207 L278 K323 F368	T205-I370 HydrophobicContact CG2-CD1 4.03Å; V207-I370 HydrophobicContact CG2-CD1 3.56Å; L278-I370 HydrophobicContact CD1-CD1 4.29Å; L278-I370 HydrophobicContact CD2-CD1 3.73Å; K323-I370 PolarHBondContact N-O 2.84Å; K323-I370 PolarHBondContact O-N 2.83Å; K323-I370 VanDerWaalsContact O-O 3.11Å; F368-I370 HydrophobicContact CB-CD1 4.46Å; F368-I370 HydrophobicContact CD2-CD1 3.59Å; F368-I370 HydrophobicContact CD2-CG1 3.98Å; F368-I370 HydrophobicContact CE2-CD1 4.19Å; F368-I370 HydrophobicContact CG-CD1 4.26Å
371	F	83.4	Confident	79.1	Confident	8 Å²	8	31 Å²	31	4%	0.035	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.9	-179.4	-61.7	-100.1	0	0	0	109.1	N204 H321 L322 V377 T379 V417 I425	N204-F371 PolarHBondContact OD1-O 2.85Å; H321-F371 CarbonylContact O-C 3.59Å; H321-F371 WeakPolarHBondContact O-CA 3.29Å; L322-F371 HydrophobicContact CB-CD1 4.02Å; L322-F371 HydrophobicContact CB-CE1 3.83Å; L322-F371 HydrophobicContact CD1-CD1 4.2Å; L322-F371 HydrophobicContact CD1-CE1 3.69Å; L322-F371 HydrophobicContact CD1-CE2 4.12Å; L322-F371 HydrophobicContact CD1-CZ 3.64Å; L322-F371 HydrophobicContact CD2-CE1 4.5Å; L322-F371 HydrophobicContact CG-CE1 4.19Å; F371-V377 HydrophobicContact CB-CG2 3.7Å; F371-V377 HydrophobicContact CG-CG2 4.38Å; F371-T379 WeakPolarHBondContact CD2-OG1 3.26Å; F371-T379 HydrophobicContact CE2-CG2 4.12Å; F371-V417 HydrophobicContact CB-CG2 4.2Å; F371-V417 HydrophobicContact CD1-CG2 3.6Å; F371-V417 HydrophobicContact CD2-CG2 3.35Å; F371-V417 HydrophobicContact CE1-CG2 3.66Å; F371-V417 HydrophobicContact CE2-CG2 3.46Å; F371-V417 VanDerWaalsContact CE2-CG2 3.46Å; F371-V417 HydrophobicContact CG-CG2 3.43Å; F371-V417 VanDerWaalsContact CG-CG2 3.43Å; F371-V417 HydrophobicContact CZ-CG2 3.61Å; F371-I425 HydrophobicContact CE1-CG2 4.08Å
372	E	85	Confident	79.9	Confident	52 Å²	52	33.3 Å²	33.3	24%	0.243	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	130	170.1	177.5	159.7	-138.4	0	0	109.5	L200 L201 N204 T320 H321	L200-E372 VanDerWaalsContact CA-OE1 3.26Å; L200-E372 WeakPolarHBondContact CA-OE1 3.39Å; L200-E372 WeakPolarHBondContact CD2-OE1 3.35Å; L200-E372 WeakPolarHBondContact CD2-OE2 3.25Å; L201-E372 HydrophobicContact CB-CG 4.42Å; L201-E372 HydrophobicContact CD1-CG 3.93Å; L201-E372 HydrophobicContact CG-CG 4.19Å; L201-E372 WeakPolarHBondContact CG-OE1 3.45Å; L201-E372 PolarHBondContact N-OE1 3.48Å; N204-E372 WeakPolarHBondContact OD1-CA 3.36Å; T320-E372 WeakPolarHBondContact CA-O 3.15Å; H321-E372 PolarHBondContact N-O 2.02Å; H321-E372 PolarHBondContact O-N 2.88Å
373	S	81	Confident	80.6	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.007	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	156.1	-166.7	52.1	0	0	0	0	113.4	N204 P375 V376 V377	N204-S373 PolarHBondContact ND2-O 2.99Å; N204-S373 PolarHBondContact OD1-N 3.33Å; N204-S373 PolarHBondContact OD1-O 3.25Å; N204-S373 PolarHBondContact OD1-OG 2.79Å; S373-P375 CarbonylContact C-O 3.54Å; S373-P375 VanDerWaalsContact CB-O 3.23Å; S373-P375 WeakPolarHBondContact CB-O 3.4Å; S373-P375 PolarHBondContact OG-O 3.47Å; S373-P375 VanDerWaalsContact OG-O 3.14Å; S373-V376 WeakPolarHBondContact OG-CA 3.48Å; S373-V377 PolarHBondContact OG-N 3.04Å
374	A	82.3	Confident	80.9	Confident	15 Å²	15	38.1 Å²	38.1	12%	0.124	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	105	167.8	0	0	0	0	0	109.5	L201 P314 K317 I318	L201-A374 HydrophobicContact CD1-CB 4.32Å; P314-A374 HydrophobicContact CB-CB 4.19Å; P314-A374 HydrophobicContact CG-CB 3.68Å; K317-A374 WeakPolarHBondContact CA-O 3.18Å; I318-A374 HydrophobicContact CB-CB 4.22Å; I318-A374 PolarHBondContact N-O 2.91Å; I318-A374 VanDerWaalsContact N-O 3.16Å; I318-A374 PolarHBondContact O-N 3.33Å
375	P	78.6	Confident	80.3	Confident	80 Å²	80	41.3 Å²	41.3	52%	0.519	21%	0.212	S	C	.	.	S	Bend	cis	-68.9	157.7	7.3	30.9	-37.6	0	0	0	114.1	S373	S373-P375 CarbonylContact C-O 3.54Å; S373-P375 VanDerWaalsContact CB-O 3.23Å; S373-P375 WeakPolarHBondContact CB-O 3.4Å; S373-P375 PolarHBondContact OG-O 3.47Å; S373-P375 VanDerWaalsContact OG-O 3.14Å
376	V	78.5	Confident	79.7	Confident	70 Å²	70	48.7 Å²	48.7	42%	0.424	25%	0.246	S	C	.	.			trans	-67.2	141.3	177.6	-174.6	0	0	0	0	110.8	S373	S373-V376 WeakPolarHBondContact OG-CA 3.48Å
377	V	78.5	Confident	79.2	Confident	31 Å²	31	51.2 Å²	51.2	19%	0.188	26%	0.255	C	S	.	.			trans	-123.6	160.7	-179.3	-56.4	0	0	0	0	112.4	T320 F371 S373 V417 N419	T320-V377 HydrophobicContact CG2-CG1 4.35Å; F371-V377 HydrophobicContact CB-CG2 3.7Å; F371-V377 HydrophobicContact CG-CG2 4.38Å; S373-V377 PolarHBondContact OG-N 3.04Å; V377-V417 HydrophobicContact CB-CG1 3.54Å; V377-V417 HydrophobicContact CB-CG2 4.48Å; V377-V417 HydrophobicContact CG1-CG1 3.97Å; V377-V417 HydrophobicContact CG2-CB 4.36Å; V377-V417 HydrophobicContact CG2-CG1 3.66Å; V377-V417 HydrophobicContact CG2-CG2 3.76Å; V377-N419 HydrophobicContact CG1-CB 4.26Å
378	S	75.4	Confident	78.7	Confident	70 Å²	70	54.5 Å²	54.5	49%	0.49	27%	0.271	S	S	.	.			trans	-106.1	142.1	174.6	56.3	0	0	0	0	112.3
379	T	83.3	Confident	78.2	Confident	8 Å²	8	64.3 Å²	64.3	5%	0.049	32%	0.317	C	S	.	.			trans	-78.2	129.5	177.1	-60.7	0	0	0	0	110.6	C369 F371 Q395 C415	C369-T379 HydrophobicContact CB-CG2 4.19Å; C369-T379 WeakPolarHBondContact O-CB 3.33Å; C369-T379 VanDerWaalsContact O-CG2 3.29Å; C369-T379 WeakPolarHBondContact O-CG2 3.42Å; C369-T379 PolarHBondContact O-OG1 3.03Å; F371-T379 WeakPolarHBondContact CD2-OG1 3.26Å; F371-T379 HydrophobicContact CE2-CG2 4.12Å; T379-Q395 WeakPolarHBondContact O-CB 3.29Å; T379-C415 HydrophobicContact CG2-CB 4.19Å
380	R	83	Confident	77.7	Confident	94 Å²	94	65.4 Å²	65.4	36%	0.355	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	148.5	164.2	-63.9	-170.3	-167.5	158.1	13.1	111	Y382 C415 S416 D418	R380-Y382 HydrophobicContact CB-CD2 4.49Å; R380-Y382 HydrophobicContact CB-CE2 3.62Å; R380-Y382 WeakPolarHBondContact CD-OH 3.44Å; R380-C415 VanDerWaalsContact O-CA 3.3Å; R380-C415 WeakPolarHBondContact O-CA 3.05Å; R380-S416 PolarHBondContact N-O 3.21Å; R380-S416 PolarHBondContact O-N 3.13Å; R380-D418 IonicContact CZ-OD2 2.65Å; R380-D418 VanDerWaalsContact CZ-OD2 3.3Å; R380-D418 IonicContact NH1-OD2 2.71Å; R380-D418 PolarHBondContact NH1-OD2 2.62Å; R380-D418 IonicContact NH2-OD2 2.86Å; R380-D418 PolarHBondContact NH2-OD2 2.68Å
381	W	84.7	Confident	77.6	Confident	11 Å²	11	65.7 Å²	65.7	4%	0.042	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.8	179.3	-82.4	106.7	0	0	0	108.9	F324 L367 C369 F387 I393 G398 L400 C415 F429	F324-W381 HydrophobicContact CE2-CH2 4.07Å; L367-W381 HydrophobicContact CB-CH2 4.48Å; C369-W381 HydrophobicContact CB-CH2 4.11Å; C369-W381 HydrophobicContact CB-CZ2 3.64Å; W381-F387 HydrophobicContact CB-CZ 4.16Å; W381-F387 WeakPolarHBondContact O-CE2 3.36Å; W381-I393 HydrophobicContact CB-CD1 4.22Å; W381-I393 HydrophobicContact CB-CG2 4.02Å; W381-I393 HydrophobicContact CG-CG2 4.16Å; W381-G398 PolarHBondContact NE1-O 3.33Å; W381-L400 HydrophobicContact CD2-CB 4Å; W381-L400 HydrophobicContact CD2-CD2 4.37Å; W381-L400 HydrophobicContact CE3-CB 4.41Å; W381-L400 HydrophobicContact CE3-CD2 3.98Å; W381-L400 HydrophobicContact CG-CB 4.5Å; W381-L400 HydrophobicContact CH2-CB 4.17Å; W381-L400 HydrophobicContact CH2-CD2 4.13Å; W381-L400 HydrophobicContact CZ2-CB 3.75Å; W381-L400 HydrophobicContact CZ3-CD2 3.87Å; W381-C415 HydrophobicContact CD2-CB 3.93Å; W381-C415 HydrophobicContact CE3-CB 3.75Å; W381-C415 HydrophobicContact CH2-CB 3.87Å; W381-C415 HydrophobicContact CZ2-CB 4.02Å; W381-C415 HydrophobicContact CZ3-CB 3.7Å; W381-F429 AromaticContact CH2-CE1 3.63Å; W381-F429 HydrophobicContact CH2-CE1 3.63Å; W381-F429 AromaticContact CH2-CZ 3.6Å; W381-F429 HydrophobicContact CH2-CZ 3.6Å; W381-F429 AromaticContact CZ3-CE1 3.48Å; W381-F429 HydrophobicContact CZ3-CE1 3.48Å; W381-F429 VanDerWaalsContact CZ3-CE1 3.48Å; W381-F429 AromaticContact CZ3-CZ 3.4Å; W381-F429 HydrophobicContact CZ3-CZ 3.4Å; W381-F429 VanDerWaalsContact CZ3-CZ 3.4Å
382	Y	82.2	Confident	77.6	Confident	95 Å²	95	69.1 Å²	69.1	37%	0.373	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	133.7	-178	-59.4	-91.5	0	0	0	109.9	R380 Y413 T414 S416	R380-Y382 HydrophobicContact CB-CD2 4.49Å; R380-Y382 HydrophobicContact CB-CE2 3.62Å; R380-Y382 WeakPolarHBondContact CD-OH 3.44Å; Y382-Y413 WeakPolarHBondContact O-CA 3.47Å; Y382-T414 PolarHBondContact N-O 2.82Å; Y382-T414 PolarHBondContact O-N 2.82Å; Y382-S416 VanDerWaalsContact CE2-OG 3.25Å; Y382-S416 WeakPolarHBondContact CE2-OG 3.35Å
383	Y	79.9	Confident	77.5	Confident	27 Å²	27	69.4 Å²	69.4	11%	0.106	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.7	169.4	179.3	-104.7	0	0	0	107.9	D385 E386 F387 E408 E410 Y413	Y383-D385 HydrophobicContact CE1-CB 4.33Å; Y383-E386 VanDerWaalsContact CD1-O 3.25Å; Y383-E386 WeakPolarHBondContact CD1-O 3.19Å; Y383-F387 HydrophobicContact CG-CE1 4.44Å; Y383-E408 PolarHBondContact OH-O 3.21Å; Y383-E410 PolarHBondContact OH-O 3.11Å; Y383-Y413 AromaticContact CD2-CD1 3.69Å; Y383-Y413 HydrophobicContact CD2-CD1 3.69Å; Y383-Y413 AromaticContact CD2-CD2 3.77Å; Y383-Y413 HydrophobicContact CD2-CD2 3.77Å; Y383-Y413 AromaticContact CD2-CE1 3.42Å; Y383-Y413 HydrophobicContact CD2-CE1 3.42Å; Y383-Y413 VanDerWaalsContact CD2-CE1 3.42Å; Y383-Y413 AromaticContact CD2-CE2 3.48Å; Y383-Y413 HydrophobicContact CD2-CE2 3.48Å; Y383-Y413 VanDerWaalsContact CD2-CE2 3.48Å; Y383-Y413 AromaticContact CD2-CG 3.86Å; Y383-Y413 HydrophobicContact CD2-CG 3.86Å; Y383-Y413 AromaticContact CD2-CZ 3.31Å; Y383-Y413 HydrophobicContact CE2-CD2 4Å; Y383-Y413 AromaticContact CE2-CE1 3.97Å; Y383-Y413 HydrophobicContact CE2-CE1 3.97Å; Y383-Y413 AromaticContact CE2-CE2 3.35Å; Y383-Y413 HydrophobicContact CE2-CE2 3.35Å; Y383-Y413 AromaticContact CE2-CZ 3.35Å; Y383-Y413 HydrophobicContact CG-CD1 4.24Å; Y383-Y413 AromaticContact CG-CE1 3.91Å; Y383-Y413 HydrophobicContact CG-CE1 3.91Å
384	K	68.1	Low	77.6	Confident	161 Å²	161	71 Å²	71	70%	0.7	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-36.6	-162.8	-172.9	178.4	158.8	-76.2	0	113.9
385	D	59.8	Low	77.6	Confident	98 Å²	98	75.3 Å²	75.3	52%	0.524	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	44	-164.3	-48.8	-65.5	0	0	0	111	Y383	Y383-D385 HydrophobicContact CE1-CB 4.33Å
386	E	65.9	Low	77.7	Confident	170 Å²	170	75.6 Å²	75.6	79%	0.794	36%	0.362	S	S	*	.			trans	59.8	158.6	-172.2	-64.9	-166.2	153.5	0	0	116.5	Y383	Y383-E386 VanDerWaalsContact CD1-O 3.25Å; Y383-E386 WeakPolarHBondContact CD1-O 3.19Å
387	F	71.1	Confident	77.9	Confident	74 Å²	74	72.3 Å²	72.3	33%	0.325	34%	0.342	S	S	.	.			trans	-87.5	117.8	-177.2	-73.5	-71	0	0	0	111.7	W381 Y383 I391 I393 L400 Y413	W381-F387 HydrophobicContact CB-CZ 4.16Å; W381-F387 WeakPolarHBondContact O-CE2 3.36Å; Y383-F387 HydrophobicContact CG-CE1 4.44Å; F387-I391 HydrophobicContact CD1-CB 4.47Å; F387-I391 HydrophobicContact CD1-CD1 4.2Å; F387-I391 HydrophobicContact CD1-CG2 3.97Å; F387-I391 HydrophobicContact CE1-CG2 4.45Å; F387-I393 HydrophobicContact CD1-CD1 3.74Å; F387-I393 HydrophobicContact CD2-CD1 3.56Å; F387-I393 HydrophobicContact CE1-CD1 3.66Å; F387-I393 HydrophobicContact CE2-CD1 3.49Å; F387-I393 VanDerWaalsContact CE2-CD1 3.49Å; F387-I393 HydrophobicContact CG-CD1 3.68Å; F387-I393 HydrophobicContact CZ-CD1 3.53Å; F387-L400 HydrophobicContact CE1-CD1 4.41Å; F387-Y413 HydrophobicContact CE1-CD1 4.32Å; F387-Y413 HydrophobicContact CE1-CE1 4.27Å
388	M	73.8	Confident	78.2	Confident	69 Å²	69	70.9 Å²	70.9	34%	0.34	33%	0.334	S	S	.	.			trans	-71.9	154.7	178.3	-62.6	-179.7	178	0	0	112.4	N390 I391 E408	M388-N390 PolarHBondContact O-N 3.28Å; M388-I391 HydrophobicContact CB-CD1 4.47Å; M388-I391 WeakPolarHBondContact O-CB 3.4Å; M388-I391 PolarHBondContact O-N 3Å; M388-E408 HydrophobicContact CE-CB 4.02Å; M388-E408 HydrophobicContact SD-CB 3.77Å
389	E	74.1	Confident	78.8	Confident	206 Å²	206	67.6 Å²	67.6	96%	0.963	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-23.4	-176.7	-61.8	-174.2	150.4	0	0	114.9	I391	E389-I391 VanDerWaalsContact C-N 3.26Å; E389-I391 PolarHBondContact O-N 3.24Å
390	N	78.3	Confident	79	Confident	24 Å²	24	67.4 Å²	67.4	13%	0.128	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	4.4	178.3	79.9	-51.8	0	0	0	114.1	M388 K403 N409	M388-N390 PolarHBondContact O-N 3.28Å; N390-K403 WeakPolarHBondContact CB-O 3.46Å; N390-K403 PolarHBondContact ND2-O 3.02Å; N390-K403 PolarHBondContact O-N 3.33Å; N390-N409 PolarHBondContact ND2-OD1 3.38Å; N390-N409 PolarHBondContact OD1-ND2 3.23Å
391	I	81.9	Confident	79.1	Confident	15 Å²	15	64.1 Å²	64.1	8%	0.077	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	111.9	-179.1	-51.9	-179.5	0	0	0	110	F387 M388 E389 I393 L400 I401 I402 Y413	F387-I391 HydrophobicContact CD1-CB 4.47Å; F387-I391 HydrophobicContact CD1-CD1 4.2Å; F387-I391 HydrophobicContact CD1-CG2 3.97Å; F387-I391 HydrophobicContact CE1-CG2 4.45Å; M388-I391 HydrophobicContact CB-CD1 4.47Å; M388-I391 WeakPolarHBondContact O-CB 3.4Å; M388-I391 PolarHBondContact O-N 3Å; E389-I391 VanDerWaalsContact C-N 3.26Å; E389-I391 PolarHBondContact O-N 3.24Å; I391-I393 HydrophobicContact CG2-CG1 4.37Å; I391-L400 HydrophobicContact CG2-CD1 3.44Å; I391-L400 VanDerWaalsContact CG2-CD1 3.44Å; I391-I401 CarbonylContact C-O 3.57Å; I391-I401 WeakPolarHBondContact CA-O 3.46Å; I391-I402 HydrophobicContact CG1-CG1 4.3Å; I391-I402 HydrophobicContact CG2-CG1 4.36Å; I391-Y413 HydrophobicContact CD1-CE1 4.21Å
392	E	83.1	Confident	79	Confident	81 Å²	81	63.7 Å²	63.7	38%	0.379	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126.2	174.2	-72.1	-179.7	176	0	0	111	I401 K403	E392-I401 HydrophobicContact CB-CB 4.27Å; E392-I401 PolarHBondContact N-O 2.91Å; E392-I401 PolarHBondContact O-N 3.4Å; E392-K403 VanDerWaalsContact CD-CE 3.43Å; E392-K403 WeakPolarHBondContact OE1-CE 3.28Å; E392-K403 IonicContact OE1-NZ 3.21Å; E392-K403 PolarHBondContact OE1-NZ 2.92Å; E392-K403 WeakPolarHBondContact OE2-CE 3.33Å; E392-K403 IonicContact OE2-NZ 3.85Å; E392-K403 PolarHBondContact OE2-NZ 3.11Å
393	I	83.8	Confident	78.8	Confident	58 Å²	58	62.8 Å²	62.8	30%	0.297	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.7	177.5	-54.9	174.2	0	0	0	109.1	W381 F387 I391 Q395 L400	W381-I393 HydrophobicContact CB-CD1 4.22Å; W381-I393 HydrophobicContact CB-CG2 4.02Å; W381-I393 HydrophobicContact CG-CG2 4.16Å; F387-I393 HydrophobicContact CD1-CD1 3.74Å; F387-I393 HydrophobicContact CD2-CD1 3.56Å; F387-I393 HydrophobicContact CE1-CD1 3.66Å; F387-I393 HydrophobicContact CE2-CD1 3.49Å; F387-I393 VanDerWaalsContact CE2-CD1 3.49Å; F387-I393 HydrophobicContact CG-CD1 3.68Å; F387-I393 HydrophobicContact CZ-CD1 3.53Å; I391-I393 HydrophobicContact CG2-CG1 4.37Å; I393-Q395 HydrophobicContact CG2-CG 4.02Å; I393-L400 HydrophobicContact CG1-CD1 3.95Å
394	N	83.6	Confident	78.5	Confident	33 Å²	33	66.2 Å²	66.2	18%	0.176	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	95.5	169	-169.8	-50.4	0	0	0	109.7	R240 K396 F397 G398 V399	R240-N394 PolarHBondContact NH1-ND2 3.48Å; N394-K396 VanDerWaalsContact C-N 3.3Å; N394-K396 PolarHBondContact O-N 3.35Å; N394-K396 WeakPolarHBondContact OD1-CB 3.42Å; N394-K396 PolarHBondContact OD1-N 3.1Å; N394-F397 PolarHBondContact O-N 2.84Å; N394-F397 WeakPolarHBondContact OD1-CD2 3.21Å; N394-F397 PolarHBondContact OD1-N 3.48Å; N394-G398 CarbonylContact O-C 3.53Å; N394-G398 WeakPolarHBondContact O-CA 3.41Å; N394-G398 PolarHBondContact O-N 2.9Å; N394-V399 HydrophobicContact CB-CB 4.31Å; N394-V399 PolarHBondContact N-O 3.14Å; N394-V399 PolarHBondContact O-N 3.2Å
395	Q	81.5	Confident	78.7	Confident	107 Å²	107	58.6 Å²	58.6	50%	0.5	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-32.4	-178.6	-63.4	-179.2	3.5	0	0	112.9	T379 I393 G398	T379-Q395 WeakPolarHBondContact O-CB 3.29Å; I393-Q395 HydrophobicContact CG2-CG 4.02Å; Q395-G398 PolarHBondContact O-N 2.79Å
396	K	81.2	Confident	79.6	Confident	85 Å²	85	59.7 Å²	59.7	37%	0.37	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-43.9	178.9	-169	-171.8	-162.1	-169.5	0	112.2	D237 N394	D237-K396 PolarHBondContact O-NZ 2.93Å; D237-K396 IonicContact OD1-NZ 2.67Å; D237-K396 PolarHBondContact OD1-NZ 2.88Å; N394-K396 VanDerWaalsContact C-N 3.3Å; N394-K396 PolarHBondContact O-N 3.35Å; N394-K396 WeakPolarHBondContact OD1-CB 3.42Å; N394-K396 PolarHBondContact OD1-N 3.1Å
397	F	83.1	Confident	80	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.009	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-1.8	177.6	-71.4	-81.2	0	0	0	113.7	T205 R240 L278 H280 N394 V399	T205-F397 HydrophobicContact CG2-CD1 4.26Å; R240-F397 HydrophobicContact CB-CD1 4.12Å; R240-F397 HydrophobicContact CB-CD2 4.07Å; R240-F397 HydrophobicContact CB-CE1 3.98Å; R240-F397 HydrophobicContact CB-CE2 3.95Å; R240-F397 HydrophobicContact CB-CG 4.15Å; R240-F397 HydrophobicContact CB-CZ 3.9Å; L278-F397 HydrophobicContact CB-CD1 3.64Å; L278-F397 HydrophobicContact CB-CE1 4.06Å; L278-F397 HydrophobicContact CD1-CB 3.97Å; L278-F397 HydrophobicContact CD1-CD1 4.21Å; L278-F397 HydrophobicContact CD1-CG 4.49Å; H280-F397 HydrophobicContact CB-CD1 3.85Å; H280-F397 HydrophobicContact CB-CE1 3.54Å; H280-F397 HydrophobicContact CB-CZ 4.15Å; N394-F397 PolarHBondContact O-N 2.84Å; N394-F397 WeakPolarHBondContact OD1-CD2 3.21Å; N394-F397 PolarHBondContact OD1-N 3.48Å; F397-V399 VanDerWaalsContact C-N 3.35Å; F397-V399 HydrophobicContact CB-CG2 3.68Å; F397-V399 WeakPolarHBondContact O-CG2 3.48Å; F397-V399 PolarHBondContact O-N 3.37Å
398	G	85.3	Confident	80.5	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.01	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	23.7	-177.9	0	0	0	0	0	115.8	F368 C369 W381 N394 Q395	F368-G398 WeakPolarHBondContact CA-O 3.33Å; C369-G398 PolarHBondContact N-O 3.26Å; C369-G398 WeakPolarHBondContact O-CA 3.27Å; W381-G398 PolarHBondContact NE1-O 3.33Å; N394-G398 CarbonylContact O-C 3.53Å; N394-G398 WeakPolarHBondContact O-CA 3.41Å; N394-G398 PolarHBondContact O-N 2.9Å; Q395-G398 PolarHBondContact O-N 2.79Å
399	V	86.8	Confident	80.9	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	140.5	-170.3	-167.3	0	0	0	0	112	I242 L278 T366 L367 F368 N394 F397 I401	I242-V399 HydrophobicContact CD1-CB 4.49Å; I242-V399 HydrophobicContact CD1-CG1 3.78Å; I242-V399 HydrophobicContact CD1-CG2 3.79Å; I242-V399 HydrophobicContact CG1-CG1 4.42Å; L278-V399 HydrophobicContact CD1-CG2 3.63Å; T366-V399 HydrophobicContact CG2-CG1 3.55Å; L367-V399 WeakPolarHBondContact O-CA 3.34Å; L367-V399 WeakPolarHBondContact O-CG1 3.42Å; F368-V399 HydrophobicContact CB-CG2 4.39Å; N394-V399 HydrophobicContact CB-CB 4.31Å; N394-V399 PolarHBondContact N-O 3.14Å; N394-V399 PolarHBondContact O-N 3.2Å; F397-V399 VanDerWaalsContact C-N 3.35Å; F397-V399 HydrophobicContact CB-CG2 3.68Å; F397-V399 WeakPolarHBondContact O-CG2 3.48Å; F397-V399 PolarHBondContact O-N 3.37Å; V399-I401 HydrophobicContact CG1-CD1 4.44Å; V399-I401 HydrophobicContact CG1-CG1 3.92Å
400	L	87.5	Confident	81.4	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.016	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.8	169.1	175.3	70.5	0	0	0	108.5	T366 L367 W381 F387 I391 I393 Y413 F429	T366-L400 WeakPolarHBondContact CA-O 3.27Å; L367-L400 PolarHBondContact N-O 2.97Å; L367-L400 PolarHBondContact O-N 3.34Å; W381-L400 HydrophobicContact CD2-CB 4Å; W381-L400 HydrophobicContact CD2-CD2 4.37Å; W381-L400 HydrophobicContact CE3-CB 4.41Å; W381-L400 HydrophobicContact CE3-CD2 3.98Å; W381-L400 HydrophobicContact CG-CB 4.5Å; W381-L400 HydrophobicContact CH2-CB 4.17Å; W381-L400 HydrophobicContact CH2-CD2 4.13Å; W381-L400 HydrophobicContact CZ2-CB 3.75Å; W381-L400 HydrophobicContact CZ3-CD2 3.87Å; F387-L400 HydrophobicContact CE1-CD1 4.41Å; I391-L400 HydrophobicContact CG2-CD1 3.44Å; I391-L400 VanDerWaalsContact CG2-CD1 3.44Å; I393-L400 HydrophobicContact CG1-CD1 3.95Å; L400-Y413 HydrophobicContact CD2-CD1 3.69Å; L400-Y413 HydrophobicContact CD2-CE1 4.26Å; L400-Y413 HydrophobicContact CD2-CG 4.3Å; L400-F429 HydrophobicContact CD2-CZ 4.32Å
401	I	84.7	Confident	81.7	Confident	26 Å²	26	44.6 Å²	44.6	13%	0.133	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	122.2	176.6	-51.2	174.6	0	0	0	108.4	L365 T366 I391 E392 V399 K403	L365-I401 CarbonylContact O-C 3.57Å; L365-I401 WeakPolarHBondContact O-CA 3.41Å; T366-I401 HydrophobicContact CG2-CG1 3.89Å; I391-I401 CarbonylContact C-O 3.57Å; I391-I401 WeakPolarHBondContact CA-O 3.46Å; E392-I401 HydrophobicContact CB-CB 4.27Å; E392-I401 PolarHBondContact N-O 2.91Å; E392-I401 PolarHBondContact O-N 3.4Å; V399-I401 HydrophobicContact CG1-CD1 4.44Å; V399-I401 HydrophobicContact CG1-CG1 3.92Å; I401-K403 HydrophobicContact CG2-CG 4.11Å
402	I	83.6	Confident	81.9	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118.4	168.4	-55.4	179.8	0	0	0	107.4	N364 L365 I391 A405 N409 Y413 I431	N364-I402 WeakPolarHBondContact CA-O 3.47Å; L365-I402 HydrophobicContact CB-CB 4.48Å; L365-I402 PolarHBondContact N-O 2.84Å; L365-I402 PolarHBondContact O-N 2.87Å; I391-I402 HydrophobicContact CG1-CG1 4.3Å; I391-I402 HydrophobicContact CG2-CG1 4.36Å; I402-A405 HydrophobicContact CG2-CB 4.1Å; I402-N409 HydrophobicContact CG2-CB 4.26Å; I402-Y413 HydrophobicContact CD1-CE1 4.18Å; I402-Y413 HydrophobicContact CD1-CE2 4.44Å; I402-I431 HydrophobicContact CD1-CD1 3.51Å
403	K	77.3	Confident	82.2	Confident	76 Å²	76	43.7 Å²	43.7	33%	0.33	21%	0.206	S	C	.	.	S	Bend	trans	-94.9	130.9	178.1	-66.5	-178.2	177.6	175.9	0	110.3	N364 N390 E392 I401	N364-K403 VanDerWaalsContact OD1-CA 3.31Å; N364-K403 WeakPolarHBondContact OD1-CA 3.49Å; N390-K403 WeakPolarHBondContact CB-O 3.46Å; N390-K403 PolarHBondContact ND2-O 3.02Å; N390-K403 PolarHBondContact O-N 3.33Å; E392-K403 VanDerWaalsContact CD-CE 3.43Å; E392-K403 WeakPolarHBondContact OE1-CE 3.28Å; E392-K403 IonicContact OE1-NZ 3.21Å; E392-K403 PolarHBondContact OE1-NZ 2.92Å; E392-K403 WeakPolarHBondContact OE2-CE 3.33Å; E392-K403 IonicContact OE2-NZ 3.85Å; E392-K403 PolarHBondContact OE2-NZ 3.11Å; I401-K403 HydrophobicContact CG2-CG 4.11Å
404	Y	73.5	Confident	82.3	Confident	100 Å²	100	42.7 Å²	42.7	39%	0.392	20%	0.202	S	C	.	.	S	Bend	trans	48.5	65.2	179.4	-57.8	-69.6	0	0	0	111.9	K259 N362 N364 R406	K259-Y404 PolarHBondContact NZ-OH 2.87Å; N362-Y404 WeakPolarHBondContact O-CD1 3.2Å; N364-Y404 PolarHBondContact OD1-N 3.01Å; Y404-R406 WeakPolarHBondContact O-CG 3.06Å; Y404-R406 PolarHBondContact O-N 2.81Å
405	A	72.3	Confident	82.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.194	C	C	.	.			trans	-53.6	123.2	-170.1	0	0	0	0	0	113	I359 E361 N362 T363 I402	I359-A405 HydrophobicContact CD1-CB 3.48Å; I359-A405 VanDerWaalsContact CD1-CB 3.48Å; I359-A405 HydrophobicContact CG1-CB 4.26Å; E361-A405 CarbonylContact C-O 3.6Å; E361-A405 WeakPolarHBondContact CA-O 3.31Å; N362-A405 PolarHBondContact N-O 2.85Å; T363-A405 WeakPolarHBondContact O-CB 3.29Å; T363-A405 PolarHBondContact O-N 3.07Å; I402-A405 HydrophobicContact CG2-CB 4.1Å
406	R	78.6	Confident	82.7	Confident	121 Å²	121	36.5 Å²	36.5	46%	0.457	17%	0.174	S	C	.	.			trans	-102.5	162.1	-179.6	-61.1	-176	-175.8	175	3.1	111.1	Y404 E408 N409 V433	Y404-R406 WeakPolarHBondContact O-CG 3.06Å; Y404-R406 PolarHBondContact O-N 2.81Å; R406-E408 HydrophobicContact CB-CB 4.06Å; R406-E408 HydrophobicContact CB-CG 4.49Å; R406-E408 WeakPolarHBondContact CD-OE2 3.43Å; R406-E408 IonicContact CZ-OE2 2.67Å; R406-E408 IonicContact NE-OE2 3.67Å; R406-E408 IonicContact NH1-OE2 3.74Å; R406-E408 PolarHBondContact NH1-OE2 2.99Å; R406-E408 PolarHBondContact O-N 3.01Å; R406-E408 VanDerWaalsContact O-N 3.11Å; R406-N409 PolarHBondContact N-OD1 3.04Å; R406-N409 WeakPolarHBondContact O-CB 3.35Å; R406-N409 PolarHBondContact O-N 3.13Å; R406-V433 WeakPolarHBondContact O-CG2 3.44Å
407	P	75.5	Confident	82.5	Confident	39 Å²	39	32.9 Å²	32.9	25%	0.253	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-56.5	-27.3	170.1	-23.6	35.8	0	0	0	112.8	E361 N409 E410 R435	E361-P407 WeakPolarHBondContact OE1-CD 3.25Å; E361-P407 WeakPolarHBondContact OE1-CG 3.37Å; P407-N409 PolarHBondContact O-N 3.29Å; P407-E410 PolarHBondContact O-N 2.95Å; P407-R435 HydrophobicContact CG-CG 4.27Å; P407-R435 VanDerWaalsContact CG-NE 3.29Å
408	E	80.7	Confident	81.6	Confident	101 Å²	101	37 Å²	37	47%	0.472	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-60.3	-21.7	172.7	-66.1	152.4	-157.9	0	0	114	Y383 M388 R406	Y383-E408 PolarHBondContact OH-O 3.21Å; M388-E408 HydrophobicContact CE-CB 4.02Å; M388-E408 HydrophobicContact SD-CB 3.77Å; R406-E408 HydrophobicContact CB-CB 4.06Å; R406-E408 HydrophobicContact CB-CG 4.49Å; R406-E408 WeakPolarHBondContact CD-OE2 3.43Å; R406-E408 IonicContact CZ-OE2 2.67Å; R406-E408 IonicContact NE-OE2 3.67Å; R406-E408 IonicContact NH1-OE2 3.74Å; R406-E408 PolarHBondContact NH1-OE2 2.99Å; R406-E408 PolarHBondContact O-N 3.01Å; R406-E408 VanDerWaalsContact O-N 3.11Å
409	N	83.1	Confident	80.3	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-94.9	1.8	-179.5	-51.8	132.1	0	0	0	113.7	N390 I402 R406 P407 Y413	N390-N409 PolarHBondContact ND2-OD1 3.38Å; N390-N409 PolarHBondContact OD1-ND2 3.23Å; I402-N409 HydrophobicContact CG2-CB 4.26Å; R406-N409 PolarHBondContact N-OD1 3.04Å; R406-N409 WeakPolarHBondContact O-CB 3.35Å; R406-N409 PolarHBondContact O-N 3.13Å; P407-N409 PolarHBondContact O-N 3.29Å; N409-Y413 WeakPolarHBondContact O-CE2 3.33Å; N409-Y413 PolarHBondContact O-OH 3.07Å
410	E	84	Confident	78.9	Confident	69 Å²	69	43 Å²	43	32%	0.322	22%	0.22	S	C	.	.			trans	-70.2	126.5	172.1	164.7	152.4	178.8	0	0	110.9	Y383 P407 R430 I431 V433	Y383-E410 PolarHBondContact OH-O 3.11Å; P407-E410 PolarHBondContact O-N 2.95Å; E410-R430 IonicContact OE1-CZ 2.72Å; E410-R430 IonicContact OE1-NE 3.91Å; E410-R430 IonicContact OE1-NH2 2.9Å; E410-R430 PolarHBondContact OE1-NH2 2.74Å; E410-I431 WeakPolarHBondContact CG-O 3.46Å; E410-V433 HydrophobicContact CB-CG2 4.37Å; E410-V433 PolarHBondContact OE2-N 2.86Å
411	G	85.5	Confident	77.3	Confident	17 Å²	17	50 Å²	50	18%	0.175	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169	-168.6	179.6	0	0	0	0	0	113.2	R430 I431	G411-R430 CarbonylContact O-C 3.56Å; G411-R430 WeakPolarHBondContact O-CA 3.34Å; G411-I431 PolarHBondContact N-O 2.93Å; G411-I431 PolarHBondContact O-N 2.84Å
412	I	86.1	Confident	75.7	Confident	78 Å²	78	51 Å²	51	40%	0.4	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	121.9	178.6	-58.8	175.3	0	0	0	109	I354 F429 R430	I354-I412 HydrophobicContact CD1-CD1 4.21Å; I412-F429 WeakPolarHBondContact CA-O 3.43Å; I412-R430 HydrophobicContact CG1-CB 4.38Å
413	Y	88.5	Confident	74.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	139.9	175.5	-66.6	-104.2	0	0	0	108.4	Y382 Y383 F387 I391 L400 I402 N409 S428 F429 I431	Y382-Y413 WeakPolarHBondContact O-CA 3.47Å; Y383-Y413 AromaticContact CD2-CD1 3.69Å; Y383-Y413 HydrophobicContact CD2-CD1 3.69Å; Y383-Y413 AromaticContact CD2-CD2 3.77Å; Y383-Y413 HydrophobicContact CD2-CD2 3.77Å; Y383-Y413 AromaticContact CD2-CE1 3.42Å; Y383-Y413 HydrophobicContact CD2-CE1 3.42Å; Y383-Y413 VanDerWaalsContact CD2-CE1 3.42Å; Y383-Y413 AromaticContact CD2-CE2 3.48Å; Y383-Y413 HydrophobicContact CD2-CE2 3.48Å; Y383-Y413 VanDerWaalsContact CD2-CE2 3.48Å; Y383-Y413 AromaticContact CD2-CG 3.86Å; Y383-Y413 HydrophobicContact CD2-CG 3.86Å; Y383-Y413 AromaticContact CD2-CZ 3.31Å; Y383-Y413 HydrophobicContact CE2-CD2 4Å; Y383-Y413 AromaticContact CE2-CE1 3.97Å; Y383-Y413 HydrophobicContact CE2-CE1 3.97Å; Y383-Y413 AromaticContact CE2-CE2 3.35Å; Y383-Y413 HydrophobicContact CE2-CE2 3.35Å; Y383-Y413 AromaticContact CE2-CZ 3.35Å; Y383-Y413 HydrophobicContact CG-CD1 4.24Å; Y383-Y413 AromaticContact CG-CE1 3.91Å; Y383-Y413 HydrophobicContact CG-CE1 3.91Å; F387-Y413 HydrophobicContact CE1-CD1 4.32Å; F387-Y413 HydrophobicContact CE1-CE1 4.27Å; I391-Y413 HydrophobicContact CD1-CE1 4.21Å; L400-Y413 HydrophobicContact CD2-CD1 3.69Å; L400-Y413 HydrophobicContact CD2-CE1 4.26Å; L400-Y413 HydrophobicContact CD2-CG 4.3Å; I402-Y413 HydrophobicContact CD1-CE1 4.18Å; I402-Y413 HydrophobicContact CD1-CE2 4.44Å; N409-Y413 WeakPolarHBondContact O-CE2 3.33Å; N409-Y413 PolarHBondContact O-OH 3.07Å; Y413-S428 VanDerWaalsContact O-CA 3.3Å; Y413-S428 WeakPolarHBondContact O-CA 3.38Å; Y413-F429 HydrophobicContact CD2-CE2 4.47Å; Y413-F429 HydrophobicContact CG-CE2 4.19Å; Y413-F429 PolarHBondContact N-O 2.84Å; Y413-F429 PolarHBondContact O-N 3.31Å; Y413-I431 HydrophobicContact CD2-CB 4.21Å; Y413-I431 HydrophobicContact CD2-CD1 3.66Å; Y413-I431 HydrophobicContact CD2-CG1 3.89Å; Y413-I431 HydrophobicContact CE2-CB 4Å; Y413-I431 HydrophobicContact CE2-CD1 3.62Å; Y413-I431 HydrophobicContact CE2-CG1 4.03Å; Y413-I431 HydrophobicContact CG-CD1 4.27Å
414	T	86.3	Confident	73.3	Confident	36 Å²	36	62.6 Å²	62.6	22%	0.221	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129	179.1	-57.4	0	0	0	0	109.7	Y382 K427 S428	Y382-T414 PolarHBondContact N-O 2.82Å; Y382-T414 PolarHBondContact O-N 2.82Å; T414-K427 WeakPolarHBondContact CA-O 3.4Å; T414-S428 WeakPolarHBondContact CG2-OG 3.45Å; T414-S428 WeakPolarHBondContact OG1-CB 3.4Å; T414-S428 PolarHBondContact OG1-OG 3.42Å
415	C	88	Confident	72.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	144.1	161.3	60.9	0	0	0	0	109.9	C369 T379 R380 W381 G426 K427	C369-C415 HydrophobicContact CB-CB 3.43Å; C369-C415 VanDerWaalsContact CB-CB 3.43Å; C369-C415 WeakPolarHBondContact CB-SG 2.92Å; C369-C415 WeakPolarHBondContact SG-CB 3.49Å; C369-C415 CovalentContact SG-SG 2.03Å; C369-C415 PolarHBondContact SG-SG 2.98Å; T379-C415 HydrophobicContact CG2-CB 4.19Å; R380-C415 VanDerWaalsContact O-CA 3.3Å; R380-C415 WeakPolarHBondContact O-CA 3.05Å; W381-C415 HydrophobicContact CD2-CB 3.93Å; W381-C415 HydrophobicContact CE3-CB 3.75Å; W381-C415 HydrophobicContact CH2-CB 3.87Å; W381-C415 HydrophobicContact CZ2-CB 4.02Å; W381-C415 HydrophobicContact CZ3-CB 3.7Å; C415-G426 CarbonylContact O-C 3.56Å; C415-G426 WeakPolarHBondContact O-CA 3.27Å; C415-K427 PolarHBondContact N-O 2.93Å; C415-K427 VanDerWaalsContact N-O 3.1Å; C415-K427 PolarHBondContact O-N 2.77Å
416	S	84.3	Confident	72.9	Confident	11 Å²	11	62.7 Å²	62.7	8%	0.077	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	173.7	170.3	69.5	0	0	0	0	111.2	R380 Y382 I425	R380-S416 PolarHBondContact N-O 3.21Å; R380-S416 PolarHBondContact O-N 3.13Å; Y382-S416 VanDerWaalsContact CE2-OG 3.25Å; Y382-S416 WeakPolarHBondContact CE2-OG 3.35Å; S416-I425 WeakPolarHBondContact CA-O 3.45Å
417	V	77.8	Confident	73	Confident	8 Å²	8	59.9 Å²	59.9	5%	0.048	32%	0.324	C	S	.	.			trans	-117.8	130.4	171	177.6	0	0	0	0	109.3	F371 V377 N419 I425	F371-V417 HydrophobicContact CB-CG2 4.2Å; F371-V417 HydrophobicContact CD1-CG2 3.6Å; F371-V417 HydrophobicContact CD2-CG2 3.35Å; F371-V417 HydrophobicContact CE1-CG2 3.66Å; F371-V417 HydrophobicContact CE2-CG2 3.46Å; F371-V417 VanDerWaalsContact CE2-CG2 3.46Å; F371-V417 HydrophobicContact CG-CG2 3.43Å; F371-V417 VanDerWaalsContact CG-CG2 3.43Å; F371-V417 HydrophobicContact CZ-CG2 3.61Å; V377-V417 HydrophobicContact CB-CG1 3.54Å; V377-V417 HydrophobicContact CB-CG2 4.48Å; V377-V417 HydrophobicContact CG1-CG1 3.97Å; V377-V417 HydrophobicContact CG2-CB 4.36Å; V377-V417 HydrophobicContact CG2-CG1 3.66Å; V377-V417 HydrophobicContact CG2-CG2 3.76Å; V417-N419 HydrophobicContact CG1-CB 3.87Å; V417-N419 PolarHBondContact O-N 2.93Å; V417-I425 PolarHBondContact N-O 3.03Å
418	D	63.5	Low	73.3	Confident	90 Å²	90	60.2 Å²	60.2	48%	0.481	33%	0.328	S	S	.	.			trans	-79.6	102.6	156.4	-100.1	-1.6	0	0	0	108	R380	R380-D418 IonicContact CZ-OD2 2.65Å; R380-D418 VanDerWaalsContact CZ-OD2 3.3Å; R380-D418 IonicContact NH1-OD2 2.71Å; R380-D418 PolarHBondContact NH1-OD2 2.62Å; R380-D418 IonicContact NH2-OD2 2.86Å; R380-D418 PolarHBondContact NH2-OD2 2.68Å
419	N	59.5	Low	73.4	Confident	33 Å²	33	55.5 Å²	55.5	18%	0.176	31%	0.306	C	S	.	.			trans	-124.4	119.5	169	-172	-6.3	0	0	0	107.5	V377 V417 H421 S422	V377-N419 HydrophobicContact CG1-CB 4.26Å; V417-N419 HydrophobicContact CG1-CB 3.87Å; V417-N419 PolarHBondContact O-N 2.93Å; N419-H421 PolarHBondContact O-N 2.91Å; N419-S422 PolarHBondContact O-N 3Å
420	S	56.6	Low	73.5	Confident	95 Å²	95	59.5 Å²	59.5	66%	0.664	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-0.7	-174.5	45.2	0	0	0	0	115
421	H	54	Low	73.5	Confident	150 Å²	150	56.2 Å²	56.2	69%	0.694	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.6	5	-173.5	-53.7	-59.4	0	0	0	114.2	N419	N419-H421 PolarHBondContact O-N 2.91Å
422	S	51	Low	73.3	Confident	47 Å²	47	56.6 Å²	56.6	33%	0.329	30%	0.303	S	S	.	.	S	Bend	trans	-139.1	151.5	172.5	61.1	0	0	0	0	112.6	N419	N419-S422 PolarHBondContact O-N 3Å
423	K	54.2	Low	72.9	Confident	196 Å²	196	53.3 Å²	53.3	85%	0.852	29%	0.287	S	S	*	.			trans	-59.9	135.7	173.8	-164.7	174.3	-171.3	174.5	0	108.6	I425	K423-I425 WeakPolarHBondContact O-CG1 3.43Å; K423-I425 PolarHBondContact O-N 2.89Å
424	L	56.4	Low	71.9	Confident	123 Å²	123	56.9 Å²	56.9	64%	0.644	31%	0.305	S	S	*	.			trans	-45.4	99.2	-177.2	-91.1	162	0	0	0	112.6
425	I	65.4	Low	70.5	Confident	62 Å²	62	62.8 Å²	62.8	32%	0.318	32%	0.323	S	S	.	.			trans	-90.4	112.1	171.3	-68.4	152.5	0	0	0	106.5	T320 L322 F371 S416 V417 K423	T320-I425 WeakPolarHBondContact OG1-CD1 3.46Å; L322-I425 HydrophobicContact CB-CG2 4.12Å; L322-I425 HydrophobicContact CD2-CG2 4.47Å; F371-I425 HydrophobicContact CE1-CG2 4.08Å; S416-I425 WeakPolarHBondContact CA-O 3.45Å; V417-I425 PolarHBondContact N-O 3.03Å; K423-I425 WeakPolarHBondContact O-CG1 3.43Å; K423-I425 PolarHBondContact O-N 2.89Å
426	G	72.6	Confident	68.3	Low	40 Å²	40	64.9 Å²	64.9	41%	0.412	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	162.7	176.6	0	0	0	0	0	110.9	C415	C415-G426 CarbonylContact O-C 3.56Å; C415-G426 WeakPolarHBondContact O-CA 3.27Å
427	K	80.4	Confident	66	Low	62 Å²	62	68.4 Å²	68.4	27%	0.27	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	127.1	179.2	-170.4	156.1	-171.7	163.9	0	110.7	L322 F324 D327 T414 C415	L322-K427 HydrophobicContact CD2-CB 3.92Å; L322-K427 HydrophobicContact CD2-CD 4.47Å; F324-K427 HydrophobicContact CD1-CD 4.1Å; D327-K427 IonicContact OD1-NZ 3.59Å; D327-K427 PolarHBondContact OD1-NZ 3.36Å; D327-K427 WeakPolarHBondContact OD2-CD 3.38Å; D327-K427 VanDerWaalsContact OD2-CE 3.31Å; D327-K427 WeakPolarHBondContact OD2-CE 3.44Å; D327-K427 IonicContact OD2-NZ 3.71Å; D327-K427 PolarHBondContact OD2-NZ 2.9Å; T414-K427 WeakPolarHBondContact CA-O 3.4Å; C415-K427 PolarHBondContact N-O 2.93Å; C415-K427 VanDerWaalsContact N-O 3.1Å; C415-K427 PolarHBondContact O-N 2.77Å
428	S	82	Confident	64	Low	47 Å²	47	73.3 Å²	73.3	33%	0.329	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	142.9	177.7	-51.1	0	0	0	0	111.1	Y413 T414	Y413-S428 VanDerWaalsContact O-CA 3.3Å; Y413-S428 WeakPolarHBondContact O-CA 3.38Å; T414-S428 WeakPolarHBondContact CG2-OG 3.45Å; T414-S428 WeakPolarHBondContact OG1-CB 3.4Å; T414-S428 PolarHBondContact OG1-OG 3.42Å
429	F	82.8	Confident	62.7	Low	1 Å²	1	71.4 Å²	71.4	0%	0.004	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	154.4	173.9	53.6	-91	0	0	0	109.4	F324 K355 I357 L367 W381 L400 I412 Y413 I431	F324-F429 AromaticContact CE1-CD1 3.99Å; F324-F429 HydrophobicContact CE1-CD1 3.99Å; F324-F429 HydrophobicContact CE1-CE1 4.34Å; F324-F429 HydrophobicContact CE2-CD1 4.2Å; F324-F429 AromaticContact CE2-CE1 3.74Å; F324-F429 HydrophobicContact CE2-CE1 3.74Å; F324-F429 AromaticContact CZ-CD1 3.42Å; F324-F429 HydrophobicContact CZ-CD1 3.42Å; F324-F429 VanDerWaalsContact CZ-CD1 3.42Å; F324-F429 AromaticContact CZ-CE1 3.35Å; F324-F429 HydrophobicContact CZ-CE1 3.35Å; F324-F429 HydrophobicContact CZ-CG 4.27Å; F324-F429 HydrophobicContact CZ-CZ 4.15Å; K355-F429 CarbonylContact O-C 3.56Å; K355-F429 WeakPolarHBondContact O-CA 3.12Å; K355-F429 WeakPolarHBondContact O-CB 2.91Å; I357-F429 HydrophobicContact CD1-CB 4.34Å; I357-F429 HydrophobicContact CD1-CD2 3.37Å; I357-F429 HydrophobicContact CD1-CE2 3.84Å; I357-F429 HydrophobicContact CD1-CG 3.98Å; I357-F429 HydrophobicContact CG1-CD2 4.22Å; L367-F429 HydrophobicContact CD1-CD2 4.08Å; L367-F429 HydrophobicContact CD1-CE1 4.23Å; L367-F429 HydrophobicContact CD1-CE2 3.21Å; L367-F429 HydrophobicContact CD1-CZ 3.3Å; W381-F429 AromaticContact CH2-CE1 3.63Å; W381-F429 HydrophobicContact CH2-CE1 3.63Å; W381-F429 AromaticContact CH2-CZ 3.6Å; W381-F429 HydrophobicContact CH2-CZ 3.6Å; W381-F429 AromaticContact CZ3-CE1 3.48Å; W381-F429 HydrophobicContact CZ3-CE1 3.48Å; W381-F429 VanDerWaalsContact CZ3-CE1 3.48Å; W381-F429 AromaticContact CZ3-CZ 3.4Å; W381-F429 HydrophobicContact CZ3-CZ 3.4Å; W381-F429 VanDerWaalsContact CZ3-CZ 3.4Å; L400-F429 HydrophobicContact CD2-CZ 4.32Å; I412-F429 WeakPolarHBondContact CA-O 3.43Å; Y413-F429 HydrophobicContact CD2-CE2 4.47Å; Y413-F429 HydrophobicContact CG-CE2 4.19Å; Y413-F429 PolarHBondContact N-O 2.84Å; Y413-F429 PolarHBondContact O-N 3.31Å; F429-I431 HydrophobicContact CD2-CG1 4.13Å; F429-I431 HydrophobicContact CE2-CD1 4.05Å; F429-I431 HydrophobicContact CE2-CG1 4.06Å
430	R	83.7	Confident	61.4	Low	84 Å²	84	76.1 Å²	76.1	32%	0.317	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	126.9	177.8	-178.7	-175.1	171.4	-155.6	2.3	109.4	I354 K355 E356 I357 E410 G411 I412 I432	I354-R430 HydrophobicContact CG2-CB 4.22Å; K355-R430 PolarHBondContact O-N 2.73Å; E356-R430 CarbonylContact C-O 3.55Å; E356-R430 WeakPolarHBondContact CA-O 3.37Å; E356-R430 HydrophobicContact CG-CB 4.37Å; E356-R430 WeakPolarHBondContact OE1-CD 3.42Å; E356-R430 IonicContact OE1-CZ 3.25Å; E356-R430 IonicContact OE1-NE 2.59Å; E356-R430 IonicContact OE1-NH1 2.86Å; E356-R430 PolarHBondContact OE1-NH1 2.97Å; I357-R430 PolarHBondContact N-O 2.88Å; E410-R430 IonicContact OE1-CZ 2.72Å; E410-R430 IonicContact OE1-NE 3.91Å; E410-R430 IonicContact OE1-NH2 2.9Å; E410-R430 PolarHBondContact OE1-NH2 2.74Å; G411-R430 CarbonylContact O-C 3.56Å; G411-R430 WeakPolarHBondContact O-CA 3.34Å; I412-R430 HydrophobicContact CG1-CB 4.38Å; R430-I432 HydrophobicContact CG-CG1 4.14Å
431	I	84.3	Confident	60.5	Low	0 Å²	0	75.2 Å²	75.2	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	135.8	167.6	-65.8	179.8	0	0	0	108.3	I357 I359 L365 I402 E410 G411 Y413 F429 V433	I357-I431 HydrophobicContact CB-CG1 4.45Å; I357-I431 HydrophobicContact CD1-CG1 4.37Å; I357-I431 WeakPolarHBondContact O-CA 3.43Å; I359-I431 HydrophobicContact CD1-CG2 3.59Å; I359-I431 HydrophobicContact CG1-CG2 4.01Å; L365-I431 HydrophobicContact CD2-CD1 3.45Å; L365-I431 VanDerWaalsContact CD2-CD1 3.45Å; L365-I431 HydrophobicContact CD2-CG1 4.12Å; I402-I431 HydrophobicContact CD1-CD1 3.51Å; E410-I431 WeakPolarHBondContact CG-O 3.46Å; G411-I431 PolarHBondContact N-O 2.93Å; G411-I431 PolarHBondContact O-N 2.84Å; Y413-I431 HydrophobicContact CD2-CB 4.21Å; Y413-I431 HydrophobicContact CD2-CD1 3.66Å; Y413-I431 HydrophobicContact CD2-CG1 3.89Å; Y413-I431 HydrophobicContact CE2-CB 4Å; Y413-I431 HydrophobicContact CE2-CD1 3.62Å; Y413-I431 HydrophobicContact CE2-CG1 4.03Å; Y413-I431 HydrophobicContact CG-CD1 4.27Å; F429-I431 HydrophobicContact CD2-CG1 4.13Å; F429-I431 HydrophobicContact CE2-CD1 4.05Å; F429-I431 HydrophobicContact CE2-CG1 4.06Å; I431-V433 HydrophobicContact CG2-CG2 4.21Å
432	I	81.7	Confident	60.1	Low	25 Å²	25	74.6 Å²	74.6	13%	0.128	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.6	175.7	-58	175.1	0	0	0	107.7	E356 I357 K358 I359 R430	E356-I432 HydrophobicContact CB-CD1 4.21Å; E356-I432 HydrophobicContact CG-CD1 4.36Å; I357-I432 PolarHBondContact O-N 3.17Å; K358-I432 HydrophobicContact CG-CB 4.32Å; I359-I432 PolarHBondContact N-O 2.98Å; R430-I432 HydrophobicContact CG-CG1 4.14Å
433	V	77.6	Confident	59.9	Low	9 Å²	9	77.9 Å²	77.9	6%	0.055	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	105.9	-175.1	-173.5	0	0	0	0	110.7	I359 E361 R406 E410 I431	I359-V433 HydrophobicContact CD1-CG2 4.13Å; I359-V433 HydrophobicContact CG1-CG2 3.98Å; I359-V433 WeakPolarHBondContact O-CA 3.37Å; E361-V433 HydrophobicContact CB-CG1 4.15Å; R406-V433 WeakPolarHBondContact O-CG2 3.44Å; E410-V433 HydrophobicContact CB-CG2 4.37Å; E410-V433 PolarHBondContact OE2-N 2.86Å; I431-V433 HydrophobicContact CG2-CG2 4.21Å
434	I	69	Low	60	Low	75 Å²	75	69.4 Å²	69.4	39%	0.385	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	118.9	179.5	-57.8	179.6	0	0	0	109.2	K358 I359 N360 E361	K358-I434 HydrophobicContact CB-CD1 3.94Å; K358-I434 HydrophobicContact CD-CD1 4.34Å; K358-I434 HydrophobicContact CG-CD1 4.37Å; I359-I434 PolarHBondContact O-N 2.84Å; N360-I434 CarbonylContact C-O 3.56Å; N360-I434 WeakPolarHBondContact CA-O 3.38Å; E361-I434 PolarHBondContact N-O 2.87Å
435	R	55.1	Low	60.6	Low	161 Å²	161	69.9 Å²	69.9	61%	0.608	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-88.6	145.2	173.7	-49.9	-172	-142.6	166.3	3.6	110.2	E361 P407	E361-R435 HydrophobicContact CB-CG 4.41Å; E361-R435 VanDerWaalsContact OE2-CB 3.28Å; E361-R435 WeakPolarHBondContact OE2-CB 3.03Å; E361-R435 VanDerWaalsContact OE2-CG 3.28Å; E361-R435 WeakPolarHBondContact OE2-CG 3.21Å; P407-R435 HydrophobicContact CG-CG 4.27Å; P407-R435 VanDerWaalsContact CG-NE 3.29Å
436	A	43.6	Very low	60.6	Low	44 Å²	44	69.3 Å²	69.3	36%	0.364	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-74.8	157.4	166.9	0	0	0	0	0	110.4	T438	A436-T438 PolarHBondContact O-N 2.96Å
437	P	35.8	Very low	60.6	Low	84 Å²	84	69.2 Å²	69.2	55%	0.545	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-55.2	121.3	167.9	-21.4	32.3	0	0	0	110.8	T439 E578	P437-T439 PolarHBondContact O-N 3.45Å; P437-E578 WeakPolarHBondContact CB-OE1 3.45Å; P437-E578 WeakPolarHBondContact CD-OE1 3.43Å
438	T	35.9	Very low	60.3	Low	112 Å²	112	69.6 Å²	69.6	69%	0.687	37%	0.369	S	S	*	.			trans	-79.9	88.4	177.7	27.5	0	0	0	0	109.7	A436 N440	A436-T438 PolarHBondContact O-N 2.96Å; T438-N440 PolarHBondContact O-N 2.74Å
439	T	35.4	Very low	60.1	Low	49 Å²	49	67.9 Å²	67.9	30%	0.301	36%	0.356	S	S	.	.			trans	-68	72.2	174.4	39.8	0	0	0	0	111.7	P437 L441 E578	P437-T439 PolarHBondContact O-N 3.45Å; T439-L441 PolarHBondContact O-N 2.96Å; T439-E578 WeakPolarHBondContact CG2-OE2 3.43Å
440	N	31.9	Very low	59.6	Low	132 Å²	132	71.9 Å²	71.9	71%	0.706	38%	0.375	S	S	*	.			trans	-71.5	61.4	179.9	-76	-19.9	0	0	0	112.9	T438	T438-N440 PolarHBondContact O-N 2.74Å
441	L	38.3	Very low	59.2	Low	77 Å²	77	72.8 Å²	72.8	40%	0.403	39%	0.385	S	S	.	.			trans	-128.4	45	169.8	-89.8	98.2	0	0	0	111.7	T439 N443	T439-L441 PolarHBondContact O-N 2.96Å; L441-N443 PolarHBondContact O-N 3.39Å
442	L	44.6	Very low	58.5	Low	136 Å²	136	74.6 Å²	74.6	71%	0.712	40%	0.404	S	S	*	.			trans	-68.2	-21.2	168.1	-85.6	95.1	0	0	0	113.2
443	N	48.2	Very low	58.3	Low	116 Å²	116	78.2 Å²	78.2	62%	0.62	42%	0.419	S	S	*	.	S	Bend	trans	-96	130.3	175.7	-66.1	-13.2	0	0	0	109.8	L441	L441-N443 PolarHBondContact O-N 3.39Å
444	P	56.4	Low	58.6	Low	19 Å²	19	83 Å²	83	12%	0.123	44%	0.441	C	S	.	.			trans	-66.8	139	176.9	28	-34.1	0	0	0	111.2	L446 K583	P444-L446 PolarHBondContact O-N 2.92Å; P444-K583 CarbonylContact C-O 3.49Å; P444-K583 VanDerWaalsContact CA-O 3.25Å; P444-K583 WeakPolarHBondContact CA-O 3.29Å; P444-K583 HydrophobicContact CB-CB 4.04Å
445	K	67.9	Low	59.2	Low	132 Å²	132	80.1 Å²	80.1	57%	0.574	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	107.7	-179.6	-166.1	173.3	-174.8	178.1	0	110.5	K583 F584 Y585	K445-K583 PolarHBondContact N-O 3.16Å; K445-F584 HydrophobicContact CB-CD1 3.93Å; K445-F584 HydrophobicContact CB-CE1 4.38Å; K445-F584 HydrophobicContact CD-CD1 4.46Å; K445-F584 HydrophobicContact CD-CE1 4.3Å; K445-F584 WeakPolarHBondContact O-CA 3.3Å; K445-Y585 PolarHBondContact O-N 3Å
446	L	65.4	Low	60.5	Low	51 Å²	51	75.8 Å²	75.8	27%	0.267	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	136	172.7	172.8	66.1	0	0	0	111	Y39 L41 P444 T448 Y585 Q587	Y39-L446 HydrophobicContact CD2-CD2 4.28Å; Y39-L446 HydrophobicContact CG-CD2 4.46Å; L41-L446 HydrophobicContact CD1-CB 3.99Å; L41-L446 HydrophobicContact CD2-CB 4.41Å; P444-L446 PolarHBondContact O-N 2.92Å; L446-T448 HydrophobicContact CD1-CG2 4.4Å; L446-Y585 HydrophobicContact CD1-CD1 3.56Å; L446-Y585 HydrophobicContact CD1-CE1 3.96Å; L446-Q587 HydrophobicContact CD1-CB 4.28Å
447	I	73.6	Confident	62.3	Low	37 Å²	37	73.7 Å²	73.7	19%	0.19	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	103	173	-62.2	172.1	0	0	0	107.5	V455 L457 F584 Y585 I586 Q587	I447-V455 HydrophobicContact CG2-CG1 4.18Å; I447-V455 HydrophobicContact CG2-CG2 4.11Å; I447-L457 HydrophobicContact CD1-CD2 3.32Å; I447-F584 HydrophobicContact CD1-CD1 4.06Å; I447-Y585 PolarHBondContact N-O 2.97Å; I447-I586 WeakPolarHBondContact O-CA 2.99Å; I447-Q587 PolarHBondContact O-N 3.18Å
448	T	72.9	Confident	64.5	Low	71 Å²	71	74.1 Å²	74.1	44%	0.436	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	139	168.1	31.8	0	0	0	0	110.5	L446 Q587 N589	L446-T448 HydrophobicContact CD1-CG2 4.4Å; T448-Q587 WeakPolarHBondContact CA-O 3.17Å; T448-Q587 HydrophobicContact CG2-CB 4.17Å; T448-N589 WeakPolarHBondContact CB-OD1 3.38Å
449	T	77.3	Confident	66.2	Low	10 Å²	10	69 Å²	69	6%	0.061	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	165.7	-173.5	-177.4	0	0	0	0	111.3	V455 I546 I586 Q587 L588 N589	T449-V455 HydrophobicContact CG2-CG2 4.27Å; T449-I546 HydrophobicContact CG2-CD1 3.56Å; T449-I546 HydrophobicContact CG2-CG2 4.3Å; T449-I586 HydrophobicContact CG2-CG2 3.78Å; T449-Q587 PolarHBondContact N-O 2.98Å; T449-L588 HydrophobicContact CG2-CD2 4.35Å; T449-L588 CarbonylContact O-C 3.56Å; T449-L588 WeakPolarHBondContact O-CA 3.22Å; T449-L588 WeakPolarHBondContact O-CD2 3.44Å; T449-N589 PolarHBondContact O-N 3.14Å
450	E	73.7	Confident	67.4	Low	85 Å²	85	70.8 Å²	70.8	40%	0.397	38%	0.375	S	S	.	.			trans	-98.1	159.1	171.4	-67.9	137.4	-114	0	0	111.2	K453	E450-K453 HydrophobicContact CB-CD 4.13Å; E450-K453 HydrophobicContact CB-CG 4.4Å; E450-K453 PolarHBondContact O-N 3.24Å; E450-K453 IonicContact OE1-NZ 3.13Å; E450-K453 PolarHBondContact OE1-NZ 3.41Å; E450-K453 WeakPolarHBondContact OE2-CE 3.33Å; E450-K453 IonicContact OE2-NZ 3.17Å; E450-K453 PolarHBondContact OE2-NZ 3.34Å
451	I	75.4	Confident	68	Low	104 Å²	104	68 Å²	68	53%	0.533	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	139.6	171.1	-59.9	178.1	0	0	0	109.2	K453 L588	I451-K453 VanDerWaalsContact C-N 3.28Å; I451-K453 PolarHBondContact O-N 2.86Å; I451-L588 HydrophobicContact CB-CD2 4.48Å; I451-L588 HydrophobicContact CD1-CD1 4.08Å; I451-L588 HydrophobicContact CG1-CD1 3.65Å; I451-L588 HydrophobicContact CG1-CD2 3.62Å; I451-L588 HydrophobicContact CG1-CG 4.26Å
452	G	69.7	Low	67.9	Low	38 Å²	38	70.2 Å²	70.2	39%	0.392	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	-13.2	178	0	0	0	0	0	115.6	I546	G452-I546 PolarHBondContact N-O 3.3Å
453	K	77.5	Confident	67.2	Low	101 Å²	101	70.3 Å²	70.3	44%	0.439	37%	0.373	S	S	.	.			trans	-74	154.9	173.1	-73.3	-173.9	177.7	172.2	0	111.7	E450 I451 I546	E450-K453 HydrophobicContact CB-CD 4.13Å; E450-K453 HydrophobicContact CB-CG 4.4Å; E450-K453 PolarHBondContact O-N 3.24Å; E450-K453 IonicContact OE1-NZ 3.13Å; E450-K453 PolarHBondContact OE1-NZ 3.41Å; E450-K453 WeakPolarHBondContact OE2-CE 3.33Å; E450-K453 IonicContact OE2-NZ 3.17Å; E450-K453 PolarHBondContact OE2-NZ 3.34Å; I451-K453 VanDerWaalsContact C-N 3.28Å; I451-K453 PolarHBondContact O-N 2.86Å; K453-I546 WeakPolarHBondContact O-CD1 3.44Å; K453-I546 WeakPolarHBondContact O-CG1 3.45Å; K453-I546 PolarHBondContact O-N 3.08Å
454	Q	82.2	Confident	66.2	Low	110 Å²	110	70.5 Å²	70.5	51%	0.514	37%	0.374	S	S	.	.			trans	-85.7	131.8	170.5	179.5	177	-0.5	0	0	110	I543 L544	Q454-I543 VanDerWaalsContact CA-O 3.27Å; Q454-I543 WeakPolarHBondContact CA-O 3.23Å; Q454-I543 WeakPolarHBondContact CG-O 3.16Å; Q454-L544 WeakPolarHBondContact CB-O 3.28Å
455	V	83	Confident	64.7	Low	14 Å²	14	76.5 Å²	76.5	9%	0.085	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	146.9	170.7	156.6	0	0	0	0	110.3	I447 T449 L457 K542 I543 I546 I586	I447-V455 HydrophobicContact CG2-CG1 4.18Å; I447-V455 HydrophobicContact CG2-CG2 4.11Å; T449-V455 HydrophobicContact CG2-CG2 4.27Å; V455-L457 HydrophobicContact CG1-CD2 3.83Å; V455-K542 WeakPolarHBondContact O-CA 3.5Å; V455-I543 PolarHBondContact N-O 3.08Å; V455-I543 PolarHBondContact O-N 3.05Å; V455-I546 HydrophobicContact CB-CD1 3.5Å; V455-I546 HydrophobicContact CG2-CD1 3.29Å; V455-I586 HydrophobicContact CG1-CD1 4.11Å
456	T	81.8	Confident	62.7	Low	69 Å²	69	76.5 Å²	76.5	42%	0.423	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	117.1	175.8	-56.3	0	0	0	0	110.1	L540 L541 K542	T456-L540 HydrophobicContact CG2-CD1 4.5Å; T456-L540 HydrophobicContact CG2-CD2 3.59Å; T456-L540 HydrophobicContact CG2-CG 4.03Å; T456-L541 CarbonylContact C-O 3.23Å; T456-L541 WeakPolarHBondContact CA-O 3.4Å; T456-K542 HydrophobicContact CG2-CG 3.95Å
457	L	82.3	Confident	60.7	Low	1 Å²	1	80.7 Å²	80.7	1%	0.005	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	135	170	-46.5	-175.7	0	0	0	108.6	I447 V455 W518 L540 L541 Y554 F584 I586	I447-L457 HydrophobicContact CD1-CD2 3.32Å; V455-L457 HydrophobicContact CG1-CD2 3.83Å; L457-W518 HydrophobicContact CB-CH2 3.47Å; L457-W518 VanDerWaalsContact CB-CH2 3.47Å; L457-W518 HydrophobicContact CB-CZ2 4.12Å; L457-W518 HydrophobicContact CB-CZ3 3.97Å; L457-W518 HydrophobicContact CD1-CE3 4.21Å; L457-W518 HydrophobicContact CD1-CH2 4.04Å; L457-W518 HydrophobicContact CD1-CZ3 3.6Å; L457-W518 HydrophobicContact CG-CH2 4.41Å; L457-W518 HydrophobicContact CG-CZ3 4.45Å; L457-L540 CarbonylContact O-C 3.33Å; L457-L540 WeakPolarHBondContact O-CA 3.5Å; L457-L541 HydrophobicContact CB-CB 4.29Å; L457-L541 HydrophobicContact CD1-CD2 4.1Å; L457-L541 PolarHBondContact N-O 3.35Å; L457-L541 PolarHBondContact O-N 2.84Å; L457-Y554 HydrophobicContact CD1-CD1 3.97Å; L457-Y554 HydrophobicContact CD1-CD2 4.3Å; L457-Y554 HydrophobicContact CD1-CG 3.7Å; L457-F584 HydrophobicContact CB-CD2 4.4Å; L457-F584 HydrophobicContact CB-CE1 4.48Å; L457-F584 HydrophobicContact CB-CE2 4.35Å; L457-F584 HydrophobicContact CB-CG 4.5Å; L457-F584 HydrophobicContact CB-CZ 4.4Å; L457-F584 HydrophobicContact CD1-CB 4.3Å; L457-F584 HydrophobicContact CD1-CD2 4.25Å; L457-F584 HydrophobicContact CD1-CG 4.28Å; L457-F584 HydrophobicContact CD2-CB 4.21Å; L457-F584 HydrophobicContact CD2-CD1 4.09Å; L457-F584 HydrophobicContact CD2-CG 4.12Å; L457-I586 HydrophobicContact CD2-CD1 4.24Å
458	N	80.6	Confident	58.4	Low	93 Å²	93	85 Å²	85	50%	0.497	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	121.4	-179.2	178.7	6.6	0	0	0	110.2	N460 L540 F584	N458-N460 PolarHBondContact OD1-N 2.79Å; N458-N460 VanDerWaalsContact OD1-N 3.08Å; N458-L540 HydrophobicContact CB-CD1 4.27Å; N458-L540 HydrophobicContact CB-CG 4.41Å; N458-F584 WeakPolarHBondContact O-CZ 3.27Å
459	C	72.6	Confident	56	Low	5 Å²	5	88.4 Å²	88.4	3%	0.034	48%	0.477	C	S	.	.			trans	-125	33.9	-177.7	-171.5	0	0	0	0	112.2	W518 G539 Y556 V580 C582 F584	C459-W518 HydrophobicContact CB-CH2 4.32Å; C459-W518 HydrophobicContact CB-CZ2 4.37Å; C459-G539 WeakPolarHBondContact CA-O 3.22Å; C459-G539 WeakPolarHBondContact CB-O 3.39Å; C459-G539 PolarHBondContact N-O 3.39Å; C459-Y556 HydrophobicContact CB-CD1 3.95Å; C459-Y556 HydrophobicContact CB-CG 4.15Å; C459-Y556 VanDerWaalsContact SG-CD1 3.52Å; C459-V580 VanDerWaalsContact SG-CG1 3.56Å; C459-V580 PolarHBondContact SG-O 2.91Å; C459-V580 VanDerWaalsContact SG-O 3.35Å; C459-C582 WeakPolarHBondContact CA-SG 3.04Å; C459-C582 HydrophobicContact CB-CB 3.7Å; C459-C582 WeakPolarHBondContact CB-SG 3.21Å; C459-C582 WeakPolarHBondContact SG-CB 3.31Å; C459-C582 CovalentContact SG-SG 2.02Å; C459-C582 PolarHBondContact SG-SG 3.01Å; C459-F584 HydrophobicContact CB-CE2 4.44Å; C459-F584 HydrophobicContact CB-CZ 4.48Å
460	N	60	Low	53.5	Low	86 Å²	86	94.1 Å²	94.1	46%	0.46	50%	0.504	S	S	.	.			trans	-85.1	128.3	170.8	-78.4	-41.4	0	0	0	111.7	N458 N462 D538	N458-N460 PolarHBondContact OD1-N 2.79Å; N458-N460 VanDerWaalsContact OD1-N 3.08Å; N460-N462 VanDerWaalsContact C-N 3.27Å; N460-N462 PolarHBondContact O-N 2.87Å; N460-D538 PolarHBondContact ND2-O 2.84Å; N460-D538 PolarHBondContact OD1-O 3.26Å
461	N	45.7	Very low	51.1	Low	72 Å²	72	96.5 Å²	96.5	39%	0.385	52%	0.52	S	S	.	.			trans	-80.4	63.3	-165.6	-162.2	14.6	0	0	0	112.8	E578 V580	N461-E578 PolarHBondContact ND2-OE2 2.88Å; N461-V580 HydrophobicContact CB-CG1 4.32Å; N461-V580 HydrophobicContact CB-CG2 4.2Å
462	N	35	Very low	48.7	Very low	125 Å²	125	100.6 Å²	100.6	67%	0.668	54%	0.537	S	S	*	.			trans	-116	44.4	-170.2	-126	-12.5	0	0	0	113.8	N460 N464	N460-N462 VanDerWaalsContact C-N 3.27Å; N460-N462 PolarHBondContact O-N 2.87Å; N462-N464 PolarHBondContact O-N 3.4Å
463	N	31	Very low	46.7	Very low	138 Å²	138	104.8 Å²	104.8	74%	0.738	55%	0.549	S	S	*	.			trans	-86.5	46	163.8	-89.3	-9.5	0	0	0	111.4	N465	N463-N465 PolarHBondContact O-N 2.82Å
464	N	26.9	Very low	44.1	Very low	120 Å²	120	105.6 Å²	105.6	64%	0.642	56%	0.564	S	S	*	*			trans	-73.8	50.1	172.7	-95.5	-45.2	0	0	0	112.1	N462 N466	N462-N464 PolarHBondContact O-N 3.4Å; N464-N466 PolarHBondContact O-N 3.29Å
465	N	25	Very low	41.4	Very low	145 Å²	145	109.4 Å²	109.4	78%	0.775	58%	0.58	S	S	*	*			trans	-78.8	54.4	172.6	-82	-4.4	0	0	0	111.4	N463 V467	N463-N465 PolarHBondContact O-N 2.82Å; N465-V467 PolarHBondContact O-N 2.83Å
466	N	24.8	Very low	38.6	Very low	132 Å²	132	114.4 Å²	114.4	71%	0.706	61%	0.612	S	S	*	*			trans	-62.8	124.3	149.6	-91.2	-30.9	0	0	0	107.2	N464 I468	N464-N466 PolarHBondContact O-N 3.29Å; N466-I468 PolarHBondContact O-N 3.46Å
467	V	24	Very low	35.9	Very low	138 Å²	138	120.4 Å²	120.4	84%	0.836	63%	0.633	S	S	*	*			trans	-72	80.3	177.3	-178.1	0	0	0	0	109.3	N465	N465-V467 PolarHBondContact O-N 2.83Å
468	I	25.2	Very low	33.2	Very low	129 Å²	129	127.8 Å²	127.8	66%	0.662	67%	0.671	S	S	*	*			trans	-91.2	100.5	164.6	-60.5	-176.4	0	0	0	106.9	N466 M470	N466-I468 PolarHBondContact O-N 3.46Å; I468-M470 HydrophobicContact CG2-CB 3.97Å; I468-M470 HydrophobicContact CG2-CG 3.41Å; I468-M470 VanDerWaalsContact CG2-CG 3.41Å; I468-M470 PolarHBondContact O-N 3.16Å
469	N	22.9	Very low	30.5	Very low	141 Å²	141	127.3 Å²	127.3	75%	0.754	67%	0.673	S	S	*	*			trans	-76.2	63.6	178.7	-153.6	-2.4	0	0	0	110.6	N471	N469-N471 PolarHBondContact O-N 3.09Å
470	M	24.2	Very low	28.3	Very low	131 Å²	131	130.9 Å²	130.9	65%	0.645	70%	0.695	S	S	*	*			trans	-92.5	73.5	178.8	-88.4	-82	-171	0	0	110.7	I468 I473	I468-M470 HydrophobicContact CG2-CB 3.97Å; I468-M470 HydrophobicContact CG2-CG 3.41Å; I468-M470 VanDerWaalsContact CG2-CG 3.41Å; I468-M470 PolarHBondContact O-N 3.16Å; M470-I473 HydrophobicContact SD-CD1 4.49Å
471	N	24.2	Very low	26.9	Very low	135 Å²	135	132.1 Å²	132.1	72%	0.722	71%	0.708	S	S	*	*			trans	-59.6	135.8	151.2	-77.5	-50.1	0	0	0	108.2	N469	N469-N471 PolarHBondContact O-N 3.09Å
472	Q	24.4	Very low	26.3	Very low	190 Å²	190	134.8 Å²	134.8	89%	0.888	72%	0.722	S	S	*	*			trans	79	62.3	176.6	-47.7	179.9	9.7	0	0	117.6
473	I	27.1	Very low	26.2	Very low	125 Å²	125	134.2 Å²	134.2	64%	0.641	72%	0.715	S	S	*	*			trans	-122.2	136	140.5	-59.9	-178.8	0	0	0	107.4	M470	M470-I473 HydrophobicContact SD-CD1 4.49Å
474	P	24.2	Very low	26.3	Very low	119 Å²	119	138.2 Å²	138.2	77%	0.773	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-73.5	133.7	-173.1	-15.7	30.7	0	0	0	112.7
475	F	24.3	Very low	26.4	Very low	190 Å²	190	139.3 Å²	139.3	83%	0.833	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-60.7	136.9	163.3	-72.2	-89.4	0	0	0	110.4	K477	F475-K477 PolarHBondContact O-N 3.13Å
476	P	24	Very low	26.7	Very low	119 Å²	119	141.2 Å²	141.2	77%	0.773	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-56.7	125.7	151.5	-13.7	28.4	0	0	0	107.2
477	K	25	Very low	26.8	Very low	195 Å²	195	145.9 Å²	145.9	85%	0.848	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-61.2	148.3	176.9	-70.2	-178.1	177.3	179.8	0	109.7	F475	F475-K477 PolarHBondContact O-N 3.13Å
478	L	25.4	Very low	27	Very low	155 Å²	155	143.8 Å²	143.8	81%	0.812	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-52.7	131.4	160.4	-88.7	65.4	0	0	0	108.1	T480	L478-T480 PolarHBondContact O-N 3.19Å
479	P	25.1	Very low	27	Very low	84 Å²	84	147.4 Å²	147.4	55%	0.545	73%	0.726	S	S	.	*	P	Polyproline II helix	trans	-63	130.5	170.8	27	-32.6	0	0	0	108.5	E483	P479-E483 VanDerWaalsContact CA-OE2 3.25Å; P479-E483 WeakPolarHBondContact CA-OE2 3.1Å; P479-E483 HydrophobicContact CB-CB 4.44Å; P479-E483 WeakPolarHBondContact CB-OE2 3.46Å
480	T	25.9	Very low	27.2	Very low	80 Å²	80	147.6 Å²	147.6	49%	0.491	73%	0.727	S	S	.	*	P	Polyproline II helix	trans	-71.7	153.8	178	39	0	0	0	0	110.5	L478 D482 E483	L478-T480 PolarHBondContact O-N 3.19Å; T480-D482 PolarHBondContact O-N 3.35Å; T480-E483 PolarHBondContact N-OE2 2.78Å; T480-E483 PolarHBondContact O-N 3.48Å
481	P	31.5	Very low	27.4	Very low	111 Å²	111	149.4 Å²	149.4	72%	0.721	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-51.5	-29	-175.6	-30.3	36.8	0	0	0	115.4	E483	P481-E483 VanDerWaalsContact C-N 3.29Å; P481-E483 PolarHBondContact O-N 2.98Å
482	D	32.6	Very low	27.5	Very low	129 Å²	129	154.6 Å²	154.6	69%	0.69	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-70.7	-16.8	178.3	-57.7	-59	0	0	0	114.7	T480	T480-D482 PolarHBondContact O-N 3.35Å
483	E	32.5	Very low	27.6	Very low	113 Å²	113	152 Å²	152	53%	0.528	73%	0.732	S	S	.	*	G	3₁₀ helix	trans	-80	-21.8	-179.9	-65.1	-169.3	122.8	0	0	113.2	P479 T480 P481 N485 K486	P479-E483 VanDerWaalsContact CA-OE2 3.25Å; P479-E483 WeakPolarHBondContact CA-OE2 3.1Å; P479-E483 HydrophobicContact CB-CB 4.44Å; P479-E483 WeakPolarHBondContact CB-OE2 3.46Å; T480-E483 PolarHBondContact N-OE2 2.78Å; T480-E483 PolarHBondContact O-N 3.48Å; P481-E483 VanDerWaalsContact C-N 3.29Å; P481-E483 PolarHBondContact O-N 2.98Å; E483-N485 PolarHBondContact O-N 2.72Å; E483-K486 PolarHBondContact O-N 2.91Å
484	W	33.4	Very low	27.4	Very low	221 Å²	221	152.8 Å²	152.8	84%	0.837	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-61.3	-28.3	173.4	-96.3	32.1	0	0	0	112.8	K486	W484-K486 PolarHBondContact O-N 2.9Å
485	N	29.8	Very low	27.5	Very low	143 Å²	143	157 Å²	157	77%	0.765	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-83.3	14	-177.6	-68.8	-38.4	0	0	0	114.4	E483	E483-N485 PolarHBondContact O-N 2.72Å
486	K	29.6	Very low	27.4	Very low	185 Å²	185	152.8 Å²	152.8	80%	0.804	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-122.5	4.7	177.7	-86.1	-178.1	177	172	0	115.8	E483 W484	E483-K486 PolarHBondContact O-N 2.91Å; W484-K486 PolarHBondContact O-N 2.9Å
487	W	26.9	Very low	27.5	Very low	230 Å²	230	155.7 Å²	155.7	87%	0.871	74%	0.741	S	S	*	*	S	Bend	trans	-91	119.4	167.1	-78.8	10.2	0	0	0	110.2	Y489	W487-Y489 PolarHBondContact O-N 2.72Å
488	D	28.1	Very low	27.4	Very low	95 Å²	95	156.5 Å²	156.5	51%	0.508	74%	0.74	S	S	.	*			trans	-64.9	87.4	-171.2	179.9	13.1	0	0	0	112.3	N490 K491	D488-N490 PolarHBondContact O-N 3.25Å; D488-N490 VanDerWaalsContact O-N 3.08Å; D488-N490 PolarHBondContact OD1-N 2.86Å; D488-K491 IonicContact OD2-NZ 2.61Å
489	Y	26.6	Very low	27.3	Very low	205 Å²	205	158.5 Å²	158.5	80%	0.804	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-8.8	-175.4	-137.5	-92.4	0	0	0	113.8	W487	W487-Y489 PolarHBondContact O-N 2.72Å
490	N	26.4	Very low	27.3	Very low	144 Å²	144	161.9 Å²	161.9	77%	0.77	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	2.3	-174.8	-71	-49	0	0	0	114.3	D488	D488-N490 PolarHBondContact O-N 3.25Å; D488-N490 VanDerWaalsContact O-N 3.08Å; D488-N490 PolarHBondContact OD1-N 2.86Å
491	K	28.5	Very low	27.2	Very low	169 Å²	169	165.8 Å²	165.8	74%	0.735	76%	0.763	S	S	*	*	S	Bend	trans	-98.6	9.7	-170	-129.7	169.4	-158.6	139.8	0	117.3	D488	D488-K491 IonicContact OD2-NZ 2.61Å
492	R	26.9	Very low	26.9	Very low	244 Å²	244	169.5 Å²	169.5	92%	0.921	77%	0.767	S	S	*	*	S	Bend	trans	-136.3	5.9	172.5	-77.8	-163.8	178.6	-177.4	2.4	116.7
493	I	25.7	Very low	26.6	Very low	137 Å²	137	172 Å²	172	70%	0.703	78%	0.775	S	S	*	*	S	Bend	trans	-127.8	62.5	176	-45.8	-178.8	0	0	0	110.7
494	N	24.1	Very low	26.3	Very low	141 Å²	141	178.1 Å²	178.1	75%	0.754	80%	0.795	S	S	*	*			trans	-167.5	60.1	161.1	-112.1	-33.1	0	0	0	114.1
495	H	25.7	Very low	25.9	Very low	206 Å²	206	175.3 Å²	175.3	95%	0.954	79%	0.789	S	S	*	*			trans	-136.3	61.1	163.7	-90.1	169.4	0	0	0	110.8
496	S	22.7	Very low	25.7	Very low	102 Å²	102	177.2 Å²	177.2	71%	0.713	79%	0.79	S	S	*	*			trans	-110.1	69.3	175.6	57.6	0	0	0	0	111.5
497	K	24.8	Very low	25.6	Very low	181 Å²	181	176.9 Å²	176.9	79%	0.787	79%	0.789	S	S	*	*	S	Bend	trans	-157.4	104	164.5	-120.6	173.6	-175.7	176.7	0	111.2
498	Y	23.9	Very low	25.5	Very low	211 Å²	211	173.3 Å²	173.3	83%	0.827	78%	0.779	S	S	*	*	S	Bend	trans	62.8	133.9	-176.5	-51.2	-87.6	0	0	0	114
499	Y	23.3	Very low	25.3	Very low	198 Å²	198	174.7 Å²	174.7	78%	0.776	79%	0.786	S	S	*	*			cis	-125.5	110.6	8.2	-155.7	-72.6	0	0	0	110.1
500	I	23.7	Very low	25.1	Very low	154 Å²	154	172.2 Å²	172.2	79%	0.79	79%	0.787	S	S	*	*			trans	-93.1	117.8	175.9	-62.9	173.1	0	0	0	107.7
501	E	24.8	Very low	25.1	Very low	162 Å²	162	174.8 Å²	174.8	76%	0.757	79%	0.787	S	S	*	*	S	Bend	trans	173.5	-29.2	147.6	-103.9	176.5	179.3	0	0	114.6
502	K	24.1	Very low	25	Very low	189 Å²	189	169.9 Å²	169.9	82%	0.822	77%	0.774	S	S	*	*	S	Bend	trans	-116.4	25.4	-160.1	-74.4	-169.3	175.4	178.9	0	119
503	Q	26.5	Very low	25.1	Very low	182 Å²	182	161.7 Å²	161.7	85%	0.85	75%	0.753	S	S	*	*	S	Bend	trans	-121	-3.7	176.1	-73.1	-158.2	-11.6	0	0	117.9	K505	Q503-K505 VanDerWaalsContact C-N 3.35Å; Q503-K505 PolarHBondContact O-N 2.95Å
504	Y	26.3	Very low	25.6	Very low	242 Å²	242	159.9 Å²	159.9	95%	0.949	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-5.6	179.8	-94.4	-77.7	0	0	0	116.2
505	K	25.4	Very low	26.9	Very low	161 Å²	161	153.6 Å²	153.6	70%	0.7	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	9.5	176.5	-78.7	-160.2	172.3	-169.9	0	116.1	Q503 E805	Q503-K505 VanDerWaalsContact C-N 3.35Å; Q503-K505 PolarHBondContact O-N 2.95Å; K505-E805 IonicContact NZ-OE1 3.72Å; K505-E805 PolarHBondContact NZ-OE1 3.32Å; K505-E805 IonicContact NZ-OE2 3.55Å; K505-E805 PolarHBondContact NZ-OE2 3.25Å
506	K	25.4	Very low	28.4	Very low	183 Å²	183	145.8 Å²	145.8	80%	0.796	67%	0.669	S	S	*	*			trans	-132.3	52.8	175.7	-76.6	-166.1	176.3	-177.3	0	115.7
507	K	27.3	Very low	30.5	Very low	179 Å²	179	142.4 Å²	142.4	78%	0.778	64%	0.642	S	S	*	*			trans	-109.3	96.6	143.3	-83.8	-172.2	175.9	-178.6	0	109.2
508	K	24.2	Very low	33	Very low	154 Å²	154	134.5 Å²	134.5	67%	0.67	61%	0.607	S	S	*	*			trans	-71	122.3	151	-85.5	-170.3	170.9	-173.8	0	106	N510 P802	K508-N510 PolarHBondContact O-N 2.67Å; K508-P802 WeakPolarHBondContact CE-O 3.43Å; K508-P802 PolarHBondContact NZ-O 3.47Å; K508-P802 VanDerWaalsContact NZ-O 3.11Å
509	L	25.1	Very low	35.5	Very low	124 Å²	124	124.5 Å²	124.5	65%	0.649	57%	0.568	S	S	*	*			trans	-66.3	123.1	156.9	-81.9	76	0	0	0	105.9	Y511	L509-Y511 VanDerWaalsContact C-N 3.3Å; L509-Y511 HydrophobicContact CB-CD2 4.41Å; L509-Y511 HydrophobicContact CB-CE2 4.39Å; L509-Y511 PolarHBondContact O-N 2.32Å
510	N	22	Very low	38.2	Very low	154 Å²	154	116.5 Å²	116.5	82%	0.824	54%	0.538	S	S	*	.			trans	-70.2	96.4	164.2	-80.7	-4.5	0	0	0	106.7	K508 S512	K508-N510 PolarHBondContact O-N 2.67Å; N510-S512 VanDerWaalsContact C-N 3.27Å; N510-S512 PolarHBondContact O-N 2.93Å
511	Y	25.8	Very low	40.9	Very low	197 Å²	197	111.4 Å²	111.4	77%	0.773	51%	0.512	S	S	*	.			trans	-62.5	93.3	166	-84	-90.9	0	0	0	108.2	L509	L509-Y511 VanDerWaalsContact C-N 3.3Å; L509-Y511 HydrophobicContact CB-CD2 4.41Å; L509-Y511 HydrophobicContact CB-CE2 4.39Å; L509-Y511 PolarHBondContact O-N 2.32Å
512	S	26.8	Very low	43	Very low	66 Å²	66	103.7 Å²	103.7	46%	0.462	48%	0.477	S	S	.	.			trans	-71	143.3	167.7	-152.5	0	0	0	0	108.5	N510 Y514	N510-S512 VanDerWaalsContact C-N 3.27Å; N510-S512 PolarHBondContact O-N 2.93Å; S512-Y514 PolarHBondContact O-N 2.89Å; S512-Y514 VanDerWaalsContact OG-CD2 3.24Å; S512-Y514 WeakPolarHBondContact OG-CD2 3.33Å; S512-Y514 WeakPolarHBondContact OG-CE2 3.24Å
513	P	29.8	Very low	45.3	Very low	73 Å²	73	101 Å²	101	47%	0.474	47%	0.467	S	S	.	.	S	Bend	trans	-73.8	9.9	-173.4	31	-36.4	0	0	0	114.5	I515	P513-I515 PolarHBondContact O-N 3.28Å
514	Y	36.2	Very low	47.4	Very low	99 Å²	99	93.4 Å²	93.4	39%	0.388	43%	0.431	S	S	.	.			trans	-72.5	112.4	177.7	-55	-53.8	0	0	0	111.2	S512 N516	S512-Y514 PolarHBondContact O-N 2.89Å; S512-Y514 VanDerWaalsContact OG-CD2 3.24Å; S512-Y514 WeakPolarHBondContact OG-CD2 3.33Å; S512-Y514 WeakPolarHBondContact OG-CE2 3.24Å; Y514-N516 PolarHBondContact O-N 3.36Å
515	I	50.4	Low	49.6	Very low	9 Å²	9	83.9 Å²	83.9	5%	0.046	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	76.9	171.9	-43.5	179.8	0	0	0	107.8	P88 L179 P513 Q517 M557 K558 S559	P88-I515 HydrophobicContact CB-CD1 3.54Å; P88-I515 HydrophobicContact CB-CG1 3.68Å; L179-I515 HydrophobicContact CD1-CD1 4.04Å; P513-I515 PolarHBondContact O-N 3.28Å; I515-Q517 HydrophobicContact CG2-CB 4.18Å; I515-Q517 HydrophobicContact CG2-CG 3.97Å; I515-M557 HydrophobicContact CG2-CE 4.34Å; I515-M557 CarbonylContact O-C 3.55Å; I515-K558 CarbonylContact O-C 3.57Å; I515-K558 WeakPolarHBondContact O-CA 3.47Å; I515-S559 WeakPolarHBondContact CB-OG 3.46Å; I515-S559 WeakPolarHBondContact CG1-OG 3.46Å; I515-S559 PolarHBondContact O-N 3.29Å
516	N	57.4	Low	51.3	Low	42 Å²	42	80.8 Å²	80.8	23%	0.225	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	80.1	168.4	-70.1	9	0	0	0	107.5	Y514 M557	Y514-N516 PolarHBondContact O-N 3.36Å; N516-M557 CarbonylContact C-O 3.29Å; N516-M557 WeakPolarHBondContact CA-O 3.35Å
517	Q	67.6	Low	52.4	Low	31 Å²	31	76.3 Å²	76.3	15%	0.145	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	139.3	-166.2	-61.6	-173.9	18.2	0	0	112.4	N89 I515 F524 M557	N89-Q517 VanDerWaalsContact CG-OE1 3.28Å; N89-Q517 PolarHBondContact ND2-NE2 2.89Å; N89-Q517 PolarHBondContact ND2-OE1 2.79Å; N89-Q517 PolarHBondContact OD1-NE2 2.85Å; I515-Q517 HydrophobicContact CG2-CB 4.18Å; I515-Q517 HydrophobicContact CG2-CG 3.97Å; Q517-F524 HydrophobicContact CB-CD1 3.82Å; Q517-F524 HydrophobicContact CB-CE1 3.93Å; Q517-M557 PolarHBondContact N-O 2.77Å; Q517-M557 PolarHBondContact O-N 3.49Å
518	W	77.2	Confident	53.2	Low	14 Å²	14	73.1 Å²	73.1	5%	0.053	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	129.7	172.1	-74.2	91	0	0	0	110.2	L457 C459 I525 L541 Q555 Y556 F584	L457-W518 HydrophobicContact CB-CH2 3.47Å; L457-W518 VanDerWaalsContact CB-CH2 3.47Å; L457-W518 HydrophobicContact CB-CZ2 4.12Å; L457-W518 HydrophobicContact CB-CZ3 3.97Å; L457-W518 HydrophobicContact CD1-CE3 4.21Å; L457-W518 HydrophobicContact CD1-CH2 4.04Å; L457-W518 HydrophobicContact CD1-CZ3 3.6Å; L457-W518 HydrophobicContact CG-CH2 4.41Å; L457-W518 HydrophobicContact CG-CZ3 4.45Å; C459-W518 HydrophobicContact CB-CH2 4.32Å; C459-W518 HydrophobicContact CB-CZ2 4.37Å; W518-I525 HydrophobicContact CB-CD1 3.75Å; W518-I525 HydrophobicContact CB-CG1 4.3Å; W518-I525 PolarHBondContact O-N 2.85Å; W518-L541 HydrophobicContact CB-CD2 4.45Å; W518-L541 HydrophobicContact CD2-CB 3.9Å; W518-L541 HydrophobicContact CD2-CD2 4.11Å; W518-L541 HydrophobicContact CE3-CB 4.48Å; W518-L541 HydrophobicContact CE3-CD2 4.27Å; W518-L541 HydrophobicContact CG-CB 4.22Å; W518-L541 HydrophobicContact CG-CD1 4.4Å; W518-L541 HydrophobicContact CG-CD2 4.2Å; W518-L541 HydrophobicContact CH2-CB 4.45Å; W518-L541 HydrophobicContact CZ2-CB 3.88Å; W518-Q555 WeakPolarHBondContact CA-O 3.38Å; W518-Y556 AromaticContact CD1-CD2 3.77Å; W518-Y556 AromaticContact CD2-CD2 3.91Å; W518-Y556 HydrophobicContact CD2-CD2 3.91Å; W518-Y556 HydrophobicContact CD2-CG 4.5Å; W518-Y556 AromaticContact CE2-CD2 3.55Å; W518-Y556 HydrophobicContact CG-CD2 4.06Å; W518-Y556 HydrophobicContact CZ2-CD2 4.08Å; W518-Y556 HydrophobicContact CZ2-CG 4.26Å; W518-Y556 AromaticContact NE1-CD2 3.44Å; W518-Y556 AromaticContact NE1-CE2 3.83Å; W518-F584 AromaticContact CH2-CD2 3.98Å; W518-F584 HydrophobicContact CH2-CD2 3.98Å; W518-F584 AromaticContact CH2-CE2 3.52Å; W518-F584 HydrophobicContact CH2-CE2 3.52Å; W518-F584 HydrophobicContact CH2-CZ 4.3Å; W518-F584 AromaticContact CZ3-CD2 3.75Å; W518-F584 HydrophobicContact CZ3-CD2 3.75Å; W518-F584 AromaticContact CZ3-CE2 3.74Å; W518-F584 HydrophobicContact CZ3-CE2 3.74Å
519	I	75.6	Confident	54	Low	2 Å²	2	72.9 Å²	72.9	1%	0.01	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.9	172.5	-63.8	172.6	0	0	0	107.4	Q523 F524 Y554 Q555 M557	I519-Q523 CarbonylContact C-O 3.54Å; I519-Q523 VanDerWaalsContact CA-O 3.27Å; I519-Q523 WeakPolarHBondContact CA-O 3.37Å; I519-F524 HydrophobicContact CD1-CD1 4.31Å; I519-F524 HydrophobicContact CD1-CE1 3.76Å; I519-F524 HydrophobicContact CD1-CZ 4.21Å; I519-F524 HydrophobicContact CG1-CD1 3.58Å; I519-F524 HydrophobicContact CG1-CE1 3.54Å; I519-F524 HydrophobicContact CG1-CG 4.42Å; I519-F524 HydrophobicContact CG1-CZ 4.35Å; I519-Y554 CarbonylContact O-C 3.52Å; I519-Y554 WeakPolarHBondContact O-CA 3.32Å; I519-Q555 HydrophobicContact CB-CB 4.39Å; I519-Q555 PolarHBondContact N-O 3.26Å; I519-Q555 PolarHBondContact O-N 3.04Å; I519-M557 HydrophobicContact CD1-CB 4.42Å; I519-M557 HydrophobicContact CD1-CE 4.13Å; I519-M557 HydrophobicContact CD1-SD 3.69Å
520	H	81.6	Confident	54.7	Low	29 Å²	29	74.2 Å²	74.2	13%	0.134	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	124	172.3	172.1	-122.8	0	0	0	108.7	G522 Q523 I525 S549 T551 I553 Y554	H520-G522 PolarHBondContact O-N 2.89Å; H520-Q523 PolarHBondContact N-O 2.88Å; H520-Q523 PolarHBondContact O-N 2.79Å; H520-I525 HydrophobicContact CB-CD1 4.15Å; H520-I525 HydrophobicContact CB-CG1 3.97Å; H520-S549 PolarHBondContact CE1-O 2.72Å; H520-S549 VanDerWaalsContact CE1-O 3.25Å; H520-T551 PolarHBondContact NE2-O 2.98Å; H520-I553 WeakPolarHBondContact CA-O 3.47Å; H520-Y554 HydrophobicContact CB-CD1 3.97Å; H520-Y554 HydrophobicContact CB-CE1 3.74Å; H520-Y554 AromaticContact CD2-CD2 3.76Å; H520-Y554 AromaticContact CD2-CE1 3.65Å; H520-Y554 AromaticContact CD2-CE2 3.29Å; H520-Y554 WeakPolarHBondContact CD2-CE2 3.49Å; H520-Y554 AromaticContact CD2-CZ 3.22Å; H520-Y554 AromaticContact CG-CE1 3.76Å; H520-Y554 AromaticContact CG-CZ 3.71Å; H520-Y554 AromaticContact NE2-CE2 3.7Å; H520-Y554 AromaticContact NE2-CZ 3.69Å
521	N	79.2	Confident	55.5	Low	47 Å²	47	74.3 Å²	74.3	25%	0.251	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	36.2	-178.8	-68.2	-32.8	0	0	0	114.6	G173 T174 T551 G552 I553	G173-N521 WeakPolarHBondContact CA-OD1 3.12Å; T174-N521 VanDerWaalsContact CB-C 3.44Å; T174-N521 WeakPolarHBondContact CB-O 3.41Å; T174-N521 PolarHBondContact OG1-O 2.9Å; N521-T551 PolarHBondContact ND2-O 2.87Å; N521-G552 WeakPolarHBondContact OD1-CA 3.23Å; N521-I553 PolarHBondContact N-O 3.45Å; N521-I553 PolarHBondContact OD1-N 2.82Å
522	G	68.5	Low	56.8	Low	1 Å²	1	67.2 Å²	67.2	1%	0.01	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	12.4	179.6	0	0	0	0	0	115.5	I91 Y93 H520	I91-G522 WeakPolarHBondContact CD1-O 3.3Å; Y93-G522 PolarHBondContact OH-O 2.79Å; H520-G522 PolarHBondContact O-N 2.89Å
523	Q	73.2	Confident	58.5	Low	132 Å²	132	66.2 Å²	66.2	62%	0.617	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	147.3	173.4	-60.4	-173.6	3.9	0	0	111.3	I519 H520	I519-Q523 CarbonylContact C-O 3.54Å; I519-Q523 VanDerWaalsContact CA-O 3.27Å; I519-Q523 WeakPolarHBondContact CA-O 3.37Å; H520-Q523 PolarHBondContact N-O 2.88Å; H520-Q523 PolarHBondContact O-N 2.79Å
524	F	71.2	Confident	60.1	Low	23 Å²	23	64.3 Å²	64.3	10%	0.101	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	136.8	176.9	-70.2	-71.7	0	0	0	111.8	I83 P88 N89 I91 Q517 I519 T526 M557	I83-F524 HydrophobicContact CD1-CE2 3.74Å; I83-F524 HydrophobicContact CD1-CZ 3.7Å; P88-F524 VanDerWaalsContact O-CE2 3.23Å; P88-F524 WeakPolarHBondContact O-CE2 3.16Å; P88-F524 WeakPolarHBondContact O-CZ 3.43Å; N89-F524 WeakPolarHBondContact O-CD2 3.34Å; I91-F524 HydrophobicContact CD1-CD2 4.35Å; I91-F524 HydrophobicContact CD1-CE2 4.03Å; I91-F524 HydrophobicContact CG1-CD2 4.12Å; I91-F524 HydrophobicContact CG1-CE2 3.67Å; Q517-F524 HydrophobicContact CB-CD1 3.82Å; Q517-F524 HydrophobicContact CB-CE1 3.93Å; I519-F524 HydrophobicContact CD1-CD1 4.31Å; I519-F524 HydrophobicContact CD1-CE1 3.76Å; I519-F524 HydrophobicContact CD1-CZ 4.21Å; I519-F524 HydrophobicContact CG1-CD1 3.58Å; I519-F524 HydrophobicContact CG1-CE1 3.54Å; I519-F524 HydrophobicContact CG1-CG 4.42Å; I519-F524 HydrophobicContact CG1-CZ 4.35Å; F524-T526 PolarHBondContact O-N 2.81Å; F524-M557 HydrophobicContact CE1-CE 4.39Å; F524-M557 HydrophobicContact CZ-CE 4.32Å
525	I	72.7	Confident	61.6	Low	42 Å²	42	64.6 Å²	64.6	22%	0.215	33%	0.333	C	S	.	.			trans	-74.6	112.6	175.2	-55	178.4	0	0	0	109.2	W518 H520 Y534 L541 Y554	W518-I525 HydrophobicContact CB-CD1 3.75Å; W518-I525 HydrophobicContact CB-CG1 4.3Å; W518-I525 PolarHBondContact O-N 2.85Å; H520-I525 HydrophobicContact CB-CD1 4.15Å; H520-I525 HydrophobicContact CB-CG1 3.97Å; I525-Y534 HydrophobicContact CD1-CE1 4.4Å; I525-Y534 HydrophobicContact CG2-CD1 4.22Å; I525-Y534 HydrophobicContact CG2-CE1 4.42Å; I525-Y534 HydrophobicContact CG2-CG 4.24Å; I525-L541 HydrophobicContact CD1-CD1 4.44Å; I525-L541 HydrophobicContact CD1-CD2 3.71Å; I525-Y554 HydrophobicContact CD1-CD1 3.97Å; I525-Y554 HydrophobicContact CD1-CE1 3.72Å
526	T	59.8	Low	62.4	Low	96 Å²	96	69.7 Å²	69.7	59%	0.589	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-92.2	125.9	179.1	52.8	0	0	0	0	112.1	F524 N528 N532	F524-T526 PolarHBondContact O-N 2.81Å; T526-N528 PolarHBondContact O-N 3.37Å; T526-N532 PolarHBondContact O-ND2 3.01Å
527	M	48.5	Very low	62.5	Low	89 Å²	89	72.8 Å²	72.8	44%	0.438	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-77	117.3	168.8	-68.5	-63	-70.5	0	0	110.4	N532 Y534	M527-N532 WeakPolarHBondContact CA-ND2 3.49Å; M527-N532 HydrophobicContact CE-CB 4.35Å; M527-N532 HydrophobicContact SD-CB 4.41Å; M527-Y534 WeakPolarHBondContact CE-O 3.18Å
528	N	45	Very low	62.2	Low	111 Å²	111	76.4 Å²	76.4	59%	0.594	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-96.3	127.2	156.6	-76.3	-12.8	0	0	0	107.2	T526 D530 N532	T526-N528 PolarHBondContact O-N 3.37Å; N528-D530 PolarHBondContact O-N 3.03Å; N528-D530 VanDerWaalsContact O-N 3.13Å; N528-N532 PolarHBondContact N-ND2 3.16Å; N528-N532 PolarHBondContact O-OD1 3.02Å
529	D	39.7	Very low	61.6	Low	150 Å²	150	75.8 Å²	75.8	80%	0.802	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-20	-166.3	-71.6	-35.8	0	0	0	114.3
530	D	39.8	Very low	61.4	Low	152 Å²	152	77.2 Å²	77.2	81%	0.813	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-8.8	-165.4	-60.3	-56.6	0	0	0	116.3	N528	N528-D530 PolarHBondContact O-N 3.03Å; N528-D530 VanDerWaalsContact O-N 3.13Å
531	N	39.4	Very low	61.3	Low	156 Å²	156	76.1 Å²	76.1	83%	0.834	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-156.9	11.1	-169.8	-117.2	-24.9	0	0	0	117.6
532	N	53.2	Low	61.2	Low	47 Å²	47	76.6 Å²	76.6	25%	0.251	39%	0.389	S	S	.	.			trans	-81.2	129.6	-166.4	-91.9	28.5	0	0	0	115.3	T526 M527 N528 Y534	T526-N532 PolarHBondContact O-ND2 3.01Å; M527-N532 WeakPolarHBondContact CA-ND2 3.49Å; M527-N532 HydrophobicContact CE-CB 4.35Å; M527-N532 HydrophobicContact SD-CB 4.41Å; N528-N532 PolarHBondContact N-ND2 3.16Å; N528-N532 PolarHBondContact O-OD1 3.02Å; N532-Y534 PolarHBondContact O-N 2.81Å
533	N	62	Low	61.9	Low	46 Å²	46	76.6 Å²	76.6	25%	0.246	39%	0.388	C	S	.	.	S	Bend	trans	-61.8	10.1	167.3	-90.3	-31.1	0	0	0	114.7	I543 L544 E547	N533-I543 CarbonylContact O-C 3.5Å; N533-L544 PolarHBondContact O-N 2.65Å; N533-E547 PolarHBondContact ND2-OE1 2.97Å
534	Y	64.7	Low	62.1	Low	32 Å²	32	73.9 Å²	73.9	13%	0.125	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	135.3	-167.8	-64.4	-87	0	0	0	111.2	I525 M527 N532 L541 K542 I543 H550	I525-Y534 HydrophobicContact CD1-CE1 4.4Å; I525-Y534 HydrophobicContact CG2-CD1 4.22Å; I525-Y534 HydrophobicContact CG2-CE1 4.42Å; I525-Y534 HydrophobicContact CG2-CG 4.24Å; M527-Y534 WeakPolarHBondContact CE-O 3.18Å; N532-Y534 PolarHBondContact O-N 2.81Å; Y534-L541 HydrophobicContact CD1-CD1 4.21Å; Y534-K542 WeakPolarHBondContact CA-O 3.49Å; Y534-I543 HydrophobicContact CD1-CG1 4.06Å; Y534-I543 HydrophobicContact CE1-CD1 4.23Å; Y534-I543 HydrophobicContact CE1-CG1 3.92Å; Y534-I543 HydrophobicContact CE1-CG2 4.3Å; Y534-H550 AromaticContact CE2-NE2 3.93Å; Y534-H550 AromaticContact CZ-CD2 3.97Å; Y534-H550 AromaticContact CZ-NE2 3.76Å; Y534-H550 PolarHBondContact OH-CD2 2.81Å; Y534-H550 PolarHBondContact OH-NE2 3.08Å; Y534-H550 VanDerWaalsContact OH-NE2 3.08Å
535	H	66.9	Low	62.2	Low	106 Å²	106	77.8 Å²	77.8	49%	0.491	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.8	172.1	-134.4	-68.5	0	0	0	109	K542	H535-K542 HydrophobicContact CB-CB 4.02Å; H535-K542 HydrophobicContact CB-CD 4.49Å; H535-K542 PolarHBondContact N-O 3.39Å; H535-K542 PolarHBondContact O-N 2.87Å
536	F	67.5	Low	62.4	Low	116 Å²	116	75.8 Å²	75.8	51%	0.509	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.6	174.2	103.1	-88.4	0	0	0	111.2	L540	F536-L540 WeakPolarHBondContact CA-O 3.44Å
537	E	59.8	Low	63.3	Low	106 Å²	106	74.6 Å²	74.6	50%	0.495	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	160.9	162.6	-66.6	173.3	109.9	0	0	105.7	G539 L540 K542	E537-G539 PolarHBondContact O-N 2.99Å; E537-G539 VanDerWaalsContact O-N 3.16Å; E537-L540 PolarHBondContact N-O 3.25Å; E537-L540 VanDerWaalsContact N-O 3.09Å; E537-L540 WeakPolarHBondContact O-CA 3.42Å; E537-L540 PolarHBondContact O-N 2.97Å; E537-K542 IonicContact OE2-NZ 2.68Å; E537-K542 PolarHBondContact OE2-NZ 3.08Å
538	D	61.3	Low	64.6	Low	108 Å²	108	75 Å²	75	58%	0.578	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	123.8	-169.1	-80.1	-65.2	0	0	0	113.8	N460 L540	N460-D538 PolarHBondContact ND2-O 2.84Å; N460-D538 PolarHBondContact OD1-O 3.26Å; D538-L540 PolarHBondContact O-N 2.85Å
539	G	64.7	Low	65.8	Low	1 Å²	1	72.6 Å²	72.6	1%	0.01	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	4.6	-176.4	0	0	0	0	0	116.1	C459 E537 Y556	C459-G539 WeakPolarHBondContact CA-O 3.22Å; C459-G539 WeakPolarHBondContact CB-O 3.39Å; C459-G539 PolarHBondContact N-O 3.39Å; E537-G539 PolarHBondContact O-N 2.99Å; E537-G539 VanDerWaalsContact O-N 3.16Å; G539-Y556 PolarHBondContact N-OH 2.82Å
540	L	70.7	Confident	67.8	Low	32 Å²	32	66 Å²	66	17%	0.168	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	122.1	-164.4	-163.9	150.6	0	0	0	112.4	T456 L457 N458 F536 E537 D538 K542	T456-L540 HydrophobicContact CG2-CD1 4.5Å; T456-L540 HydrophobicContact CG2-CD2 3.59Å; T456-L540 HydrophobicContact CG2-CG 4.03Å; L457-L540 CarbonylContact O-C 3.33Å; L457-L540 WeakPolarHBondContact O-CA 3.5Å; N458-L540 HydrophobicContact CB-CD1 4.27Å; N458-L540 HydrophobicContact CB-CG 4.41Å; F536-L540 WeakPolarHBondContact CA-O 3.44Å; E537-L540 PolarHBondContact N-O 3.25Å; E537-L540 VanDerWaalsContact N-O 3.09Å; E537-L540 WeakPolarHBondContact O-CA 3.42Å; E537-L540 PolarHBondContact O-N 2.97Å; D538-L540 PolarHBondContact O-N 2.85Å; L540-K542 HydrophobicContact CD2-CD 4.21Å; L540-K542 HydrophobicContact CD2-CG 3.95Å
541	L	80	Confident	69.6	Low	5 Å²	5	61 Å²	61	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.7	179.7	-175.3	71.9	0	0	0	110.5	T456 L457 W518 I525 Y534 I543 Y554	T456-L541 CarbonylContact C-O 3.23Å; T456-L541 WeakPolarHBondContact CA-O 3.4Å; L457-L541 HydrophobicContact CB-CB 4.29Å; L457-L541 HydrophobicContact CD1-CD2 4.1Å; L457-L541 PolarHBondContact N-O 3.35Å; L457-L541 PolarHBondContact O-N 2.84Å; W518-L541 HydrophobicContact CB-CD2 4.45Å; W518-L541 HydrophobicContact CD2-CB 3.9Å; W518-L541 HydrophobicContact CD2-CD2 4.11Å; W518-L541 HydrophobicContact CE3-CB 4.48Å; W518-L541 HydrophobicContact CE3-CD2 4.27Å; W518-L541 HydrophobicContact CG-CB 4.22Å; W518-L541 HydrophobicContact CG-CD1 4.4Å; W518-L541 HydrophobicContact CG-CD2 4.2Å; W518-L541 HydrophobicContact CH2-CB 4.45Å; W518-L541 HydrophobicContact CZ2-CB 3.88Å; I525-L541 HydrophobicContact CD1-CD1 4.44Å; I525-L541 HydrophobicContact CD1-CD2 3.71Å; Y534-L541 HydrophobicContact CD1-CD1 4.21Å; L541-I543 HydrophobicContact CD2-CG1 4.28Å; L541-I543 HydrophobicContact CG-CG1 4.41Å; L541-Y554 HydrophobicContact CD2-CD1 3.83Å; L541-Y554 HydrophobicContact CD2-CE1 3.92Å
542	K	77.5	Confident	71.4	Confident	58 Å²	58	53.8 Å²	53.8	25%	0.252	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.9	168.8	-69.5	159.1	-178.1	159.2	0	108.7	V455 T456 Y534 H535 E537 L540	V455-K542 WeakPolarHBondContact O-CA 3.5Å; T456-K542 HydrophobicContact CG2-CG 3.95Å; Y534-K542 WeakPolarHBondContact CA-O 3.49Å; H535-K542 HydrophobicContact CB-CB 4.02Å; H535-K542 HydrophobicContact CB-CD 4.49Å; H535-K542 PolarHBondContact N-O 3.39Å; H535-K542 PolarHBondContact O-N 2.87Å; E537-K542 IonicContact OE2-NZ 2.68Å; E537-K542 PolarHBondContact OE2-NZ 3.08Å; L540-K542 HydrophobicContact CD2-CD 4.21Å; L540-K542 HydrophobicContact CD2-CG 3.95Å
543	I	82.1	Confident	72.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	106.3	166.6	-52.4	178.8	0	0	0	105.7	Q454 V455 N533 Y534 L541 K545 I546 Y554 I586	Q454-I543 VanDerWaalsContact CA-O 3.27Å; Q454-I543 WeakPolarHBondContact CA-O 3.23Å; Q454-I543 WeakPolarHBondContact CG-O 3.16Å; V455-I543 PolarHBondContact N-O 3.08Å; V455-I543 PolarHBondContact O-N 3.05Å; N533-I543 CarbonylContact O-C 3.5Å; Y534-I543 HydrophobicContact CD1-CG1 4.06Å; Y534-I543 HydrophobicContact CE1-CD1 4.23Å; Y534-I543 HydrophobicContact CE1-CG1 3.92Å; Y534-I543 HydrophobicContact CE1-CG2 4.3Å; L541-I543 HydrophobicContact CD2-CG1 4.28Å; L541-I543 HydrophobicContact CG-CG1 4.41Å; I543-K545 VanDerWaalsContact C-N 3.34Å; I543-K545 PolarHBondContact O-N 2.86Å; I543-I546 HydrophobicContact CB-CG1 4.35Å; I543-I546 HydrophobicContact CG2-CG1 3.86Å; I543-Y554 HydrophobicContact CD1-CE1 4.05Å; I543-Y554 HydrophobicContact CD1-CE2 4.33Å; I543-I586 HydrophobicContact CD1-CD1 3.64Å
544	L	76.8	Confident	73.5	Confident	75 Å²	75	49.6 Å²	49.6	39%	0.393	24%	0.244	S	C	.	.	S	Bend	trans	-64.9	-38.4	-171.6	-65.7	173.5	0	0	0	112.3	Q454 N533	Q454-L544 WeakPolarHBondContact CB-O 3.28Å; N533-L544 PolarHBondContact O-N 2.65Å
545	K	74	Confident	74.1	Confident	105 Å²	105	48.1 Å²	48.1	46%	0.457	24%	0.239	S	C	.	.	S	Bend	trans	-141.1	119.8	178.3	-168.5	-171.7	178.5	-161.9	0	108.4	I543 H550	I543-K545 VanDerWaalsContact C-N 3.34Å; I543-K545 PolarHBondContact O-N 2.86Å; K545-H550 PolarHBondContact O-CE1 3.3Å; K545-H550 PolarHBondContact O-ND1 3.36Å; K545-H550 VanDerWaalsContact O-ND1 3.16Å
546	I	77.7	Confident	74.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.217	C	C	.	.			trans	-81.1	135.6	177.2	-75.3	159	0	0	0	110.9	T449 G452 K453 V455 I543 L588	T449-I546 HydrophobicContact CG2-CD1 3.56Å; T449-I546 HydrophobicContact CG2-CG2 4.3Å; G452-I546 PolarHBondContact N-O 3.3Å; K453-I546 WeakPolarHBondContact O-CD1 3.44Å; K453-I546 WeakPolarHBondContact O-CG1 3.45Å; K453-I546 PolarHBondContact O-N 3.08Å; V455-I546 HydrophobicContact CB-CD1 3.5Å; V455-I546 HydrophobicContact CG2-CD1 3.29Å; I543-I546 HydrophobicContact CB-CG1 4.35Å; I543-I546 HydrophobicContact CG2-CG1 3.86Å; I546-L588 HydrophobicContact CG2-CD2 3.81Å
547	E	78.9	Confident	74.4	Confident	71 Å²	71	38.7 Å²	38.7	33%	0.332	20%	0.196	S	C	.	.			trans	-126.6	165.9	175.3	-68.8	170.5	-164	0	0	108	N533 S549 H550	N533-E547 PolarHBondContact ND2-OE1 2.97Å; E547-S549 WeakPolarHBondContact CB-OG 3.44Å; E547-S549 PolarHBondContact O-N 2.92Å; E547-H550 PolarHBondContact N-ND1 2.91Å; E547-H550 WeakPolarHBondContact O-CA 3.19Å; E547-H550 WeakPolarHBondContact O-CB 3.39Å; E547-H550 PolarHBondContact O-N 2.79Å
548	Q	74.6	Confident	74.5	Confident	98 Å²	98	35.7 Å²	35.7	46%	0.458	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-65.1	-27.4	-176.1	-161.9	157.7	18.2	0	0	112.6	H550 T551 L588	Q548-H550 PolarHBondContact O-N 3.37Å; Q548-T551 PolarHBondContact O-N 3.01Å; Q548-T551 PolarHBondContact O-OG1 2.7Å; Q548-L588 HydrophobicContact CB-CD1 4.11Å; Q548-L588 HydrophobicContact CG-CD1 4.04Å
549	S	70.4	Confident	74	Confident	61 Å²	61	31.8 Å²	31.8	43%	0.427	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-58.8	-21.8	166.5	50.4	0	0	0	0	114.4	H520 E547 T551	H520-S549 PolarHBondContact CE1-O 2.72Å; H520-S549 VanDerWaalsContact CE1-O 3.25Å; E547-S549 WeakPolarHBondContact CB-OG 3.44Å; E547-S549 PolarHBondContact O-N 2.92Å; S549-T551 VanDerWaalsContact C-N 3.34Å
550	H	80.8	Confident	72.8	Confident	12 Å²	12	34.2 Å²	34.2	6%	0.056	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-93.6	12.7	-178	-53.5	169.3	0	0	0	112.5	Y534 K545 E547 Q548 Y554	Y534-H550 AromaticContact CE2-NE2 3.93Å; Y534-H550 AromaticContact CZ-CD2 3.97Å; Y534-H550 AromaticContact CZ-NE2 3.76Å; Y534-H550 PolarHBondContact OH-CD2 2.81Å; Y534-H550 PolarHBondContact OH-NE2 3.08Å; Y534-H550 VanDerWaalsContact OH-NE2 3.08Å; K545-H550 PolarHBondContact O-CE1 3.3Å; K545-H550 PolarHBondContact O-ND1 3.36Å; K545-H550 VanDerWaalsContact O-ND1 3.16Å; E547-H550 PolarHBondContact N-ND1 2.91Å; E547-H550 WeakPolarHBondContact O-CA 3.19Å; E547-H550 WeakPolarHBondContact O-CB 3.39Å; E547-H550 PolarHBondContact O-N 2.79Å; Q548-H550 PolarHBondContact O-N 3.37Å; H550-Y554 WeakPolarHBondContact O-CE2 2.99Å; H550-Y554 PolarHBondContact O-OH 2.87Å
551	T	78	Confident	71.3	Confident	45 Å²	45	36.3 Å²	36.3	28%	0.276	18%	0.184	S	C	.	.			trans	-83.9	158.1	173.8	57.5	0	0	0	0	111.9	H520 N521 Q548 S549 L588	H520-T551 PolarHBondContact NE2-O 2.98Å; N521-T551 PolarHBondContact ND2-O 2.87Å; Q548-T551 PolarHBondContact O-N 3.01Å; Q548-T551 PolarHBondContact O-OG1 2.7Å; S549-T551 VanDerWaalsContact C-N 3.34Å; T551-L588 HydrophobicContact CG2-CB 4.31Å; T551-L588 HydrophobicContact CG2-CD1 3.72Å; T551-L588 HydrophobicContact CG2-CG 3.68Å
552	G	78.5	Confident	68.8	Low	5 Å²	5	42.6 Å²	42.6	5%	0.052	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108	-159.1	178	0	0	0	0	0	114.1	Y172 N521 Y585 I586	Y172-G552 WeakPolarHBondContact O-CA 3.48Å; N521-G552 WeakPolarHBondContact OD1-CA 3.23Å; G552-Y585 WeakPolarHBondContact O-CA 3.44Å; G552-Y585 WeakPolarHBondContact O-CD2 3.21Å; G552-I586 PolarHBondContact N-O 2.93Å; G552-I586 PolarHBondContact O-N 2.68Å
553	I	76.7	Confident	66.2	Low	6 Å²	6	43.6 Å²	43.6	3%	0.031	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	127	-166.5	-56	176.2	0	0	0	110.2	F44 V175 H520 N521 Q555 F584 Y585	F44-I553 HydrophobicContact CE2-CD1 4.09Å; F44-I553 HydrophobicContact CZ-CD1 3.82Å; V175-I553 HydrophobicContact CG2-CD1 3.47Å; V175-I553 VanDerWaalsContact CG2-CD1 3.47Å; V175-I553 HydrophobicContact CG2-CG2 4.3Å; H520-I553 WeakPolarHBondContact CA-O 3.47Å; N521-I553 PolarHBondContact N-O 3.45Å; N521-I553 PolarHBondContact OD1-N 2.82Å; I553-Q555 HydrophobicContact CG2-CG 4.29Å; I553-F584 WeakPolarHBondContact CA-O 3.5Å; I553-Y585 HydrophobicContact CG1-CD2 3.94Å
554	Y	82.3	Confident	63.4	Low	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.4	172.2	-72.4	-99.1	0	0	0	109.6	L457 I519 H520 I525 L541 I543 H550 K583 F584 I586	L457-Y554 HydrophobicContact CD1-CD1 3.97Å; L457-Y554 HydrophobicContact CD1-CD2 4.3Å; L457-Y554 HydrophobicContact CD1-CG 3.7Å; I519-Y554 CarbonylContact O-C 3.52Å; I519-Y554 WeakPolarHBondContact O-CA 3.32Å; H520-Y554 HydrophobicContact CB-CD1 3.97Å; H520-Y554 HydrophobicContact CB-CE1 3.74Å; H520-Y554 AromaticContact CD2-CD2 3.76Å; H520-Y554 AromaticContact CD2-CE1 3.65Å; H520-Y554 AromaticContact CD2-CE2 3.29Å; H520-Y554 WeakPolarHBondContact CD2-CE2 3.49Å; H520-Y554 AromaticContact CD2-CZ 3.22Å; H520-Y554 AromaticContact CG-CE1 3.76Å; H520-Y554 AromaticContact CG-CZ 3.71Å; H520-Y554 AromaticContact NE2-CE2 3.7Å; H520-Y554 AromaticContact NE2-CZ 3.69Å; I525-Y554 HydrophobicContact CD1-CD1 3.97Å; I525-Y554 HydrophobicContact CD1-CE1 3.72Å; L541-Y554 HydrophobicContact CD2-CD1 3.83Å; L541-Y554 HydrophobicContact CD2-CE1 3.92Å; I543-Y554 HydrophobicContact CD1-CE1 4.05Å; I543-Y554 HydrophobicContact CD1-CE2 4.33Å; H550-Y554 WeakPolarHBondContact O-CE2 2.99Å; H550-Y554 PolarHBondContact O-OH 2.87Å; Y554-K583 WeakPolarHBondContact O-CA 3.38Å; Y554-F584 PolarHBondContact N-O 3.14Å; Y554-F584 PolarHBondContact O-N 3.23Å; Y554-I586 HydrophobicContact CD2-CB 4.49Å; Y554-I586 HydrophobicContact CD2-CD1 3.78Å; Y554-I586 HydrophobicContact CD2-CG1 3.85Å; Y554-I586 HydrophobicContact CE2-CB 4.23Å; Y554-I586 HydrophobicContact CE2-CD1 3.48Å; Y554-I586 VanDerWaalsContact CE2-CD1 3.48Å; Y554-I586 HydrophobicContact CE2-CG1 3.87Å
555	Q	77.1	Confident	60.8	Low	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.9	173.7	-65.3	-179.1	-114.7	0	0	109.5	S176 W518 I519 I553 N581 C582 K583	S176-Q555 PolarHBondContact O-NE2 2.78Å; S176-Q555 PolarHBondContact OG-NE2 2.79Å; S176-Q555 PolarHBondContact OG-OE1 3.24Å; W518-Q555 WeakPolarHBondContact CA-O 3.38Å; I519-Q555 HydrophobicContact CB-CB 4.39Å; I519-Q555 PolarHBondContact N-O 3.26Å; I519-Q555 PolarHBondContact O-N 3.04Å; I553-Q555 HydrophobicContact CG2-CG 4.29Å; Q555-N581 PolarHBondContact NE2-OD1 2.8Å; Q555-C582 WeakPolarHBondContact CA-O 3.42Å; Q555-K583 HydrophobicContact CG-CB 4.39Å; Q555-K583 HydrophobicContact CG-CD 4.44Å; Q555-K583 HydrophobicContact CG-CG 4.08Å
556	Y	76.3	Confident	58.3	Low	10 Å²	10	55 Å²	55	4%	0.039	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	126.2	164.7	-175.2	-117.4	0	0	0	108.7	C459 W518 G539 K558 N581 C582	C459-Y556 HydrophobicContact CB-CD1 3.95Å; C459-Y556 HydrophobicContact CB-CG 4.15Å; C459-Y556 VanDerWaalsContact SG-CD1 3.52Å; W518-Y556 AromaticContact CD1-CD2 3.77Å; W518-Y556 AromaticContact CD2-CD2 3.91Å; W518-Y556 HydrophobicContact CD2-CD2 3.91Å; W518-Y556 HydrophobicContact CD2-CG 4.5Å; W518-Y556 AromaticContact CE2-CD2 3.55Å; W518-Y556 HydrophobicContact CG-CD2 4.06Å; W518-Y556 HydrophobicContact CZ2-CD2 4.08Å; W518-Y556 HydrophobicContact CZ2-CG 4.26Å; W518-Y556 AromaticContact NE1-CD2 3.44Å; W518-Y556 AromaticContact NE1-CE2 3.83Å; G539-Y556 PolarHBondContact N-OH 2.82Å; Y556-K558 HydrophobicContact CD1-CB 4.45Å; Y556-K558 HydrophobicContact CE1-CB 3.89Å; Y556-N581 WeakPolarHBondContact O-CA 3.49Å; Y556-C582 PolarHBondContact N-O 2.86Å
557	M	64.9	Low	55.7	Low	13 Å²	13	60.7 Å²	60.7	6%	0.064	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.3	171.4	-125	170.6	54.1	0	0	108.3	L179 I515 N516 Q517 I519 F524	L179-M557 HydrophobicContact CD1-CE 3.65Å; L179-M557 HydrophobicContact CD2-CE 3.96Å; L179-M557 HydrophobicContact CG-CE 3.68Å; L179-M557 HydrophobicContact CG-SD 4.29Å; I515-M557 HydrophobicContact CG2-CE 4.34Å; I515-M557 CarbonylContact O-C 3.55Å; N516-M557 CarbonylContact C-O 3.29Å; N516-M557 WeakPolarHBondContact CA-O 3.35Å; Q517-M557 PolarHBondContact N-O 2.77Å; Q517-M557 PolarHBondContact O-N 3.49Å; I519-M557 HydrophobicContact CD1-CB 4.42Å; I519-M557 HydrophobicContact CD1-CE 4.13Å; I519-M557 HydrophobicContact CD1-SD 3.69Å; F524-M557 HydrophobicContact CE1-CE 4.39Å; F524-M557 HydrophobicContact CZ-CE 4.32Å
558	K	60.8	Low	53	Low	44 Å²	44	63 Å²	63	19%	0.191	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	119.4	171	-170.5	179	-173.6	169.6	0	107.7	I515 Y556 E577 V580	I515-K558 CarbonylContact O-C 3.57Å; I515-K558 WeakPolarHBondContact O-CA 3.47Å; Y556-K558 HydrophobicContact CD1-CB 4.45Å; Y556-K558 HydrophobicContact CE1-CB 3.89Å; K558-E577 IonicContact NZ-OE2 2.68Å; K558-E577 PolarHBondContact NZ-OE2 2.58Å; K558-V580 HydrophobicContact CD-CG2 4.38Å
559	S	51.3	Low	50.6	Low	25 Å²	25	65.8 Å²	65.8	18%	0.175	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	104.8	173.5	96.3	0	0	0	0	111.7	I515 Q561	I515-S559 WeakPolarHBondContact CB-OG 3.46Å; I515-S559 WeakPolarHBondContact CG1-OG 3.46Å; I515-S559 PolarHBondContact O-N 3.29Å; S559-Q561 PolarHBondContact O-N 2.9Å
560	N	39.6	Very low	48.3	Very low	53 Å²	53	68.9 Å²	68.9	28%	0.283	37%	0.37	S	S	.	.			trans	-80	113.3	164.2	-67.3	-1.8	0	0	0	108.1
561	Q	38.2	Very low	45.5	Very low	75 Å²	75	74.4 Å²	74.4	35%	0.35	40%	0.4	S	S	.	.			trans	-138	106.7	162.9	-80.7	-160.6	-21.6	0	0	110.2	K163 D181 S559 T563	K163-Q561 VanDerWaalsContact NZ-CD 3.32Å; D181-Q561 PolarHBondContact OD2-NE2 3.11Å; S559-Q561 PolarHBondContact O-N 2.9Å; Q561-T563 PolarHBondContact O-N 3.39Å
562	Y	29.2	Very low	42.9	Very low	137 Å²	137	80.6 Å²	80.6	54%	0.537	43%	0.425	S	S	.	.			trans	-62.9	117.7	169.7	-107.9	-128.5	0	0	0	110.7	N564 E574	Y562-N564 PolarHBondContact O-N 2.79Å; Y562-N564 VanDerWaalsContact O-N 3.15Å; Y562-E574 WeakPolarHBondContact CD1-OE2 3.33Å; Y562-E574 WeakPolarHBondContact CD2-OE1 3.5Å; Y562-E574 WeakPolarHBondContact CE1-OE2 3.29Å; Y562-E574 VanDerWaalsContact CE2-CD 3.46Å; Y562-E574 HydrophobicContact CE2-CG 4.47Å; Y562-E574 WeakPolarHBondContact CE2-OE1 3.49Å; Y562-E574 VanDerWaalsContact CZ-CD 3.5Å
563	T	22.3	Very low	40.3	Very low	79 Å²	79	85.6 Å²	85.6	49%	0.485	45%	0.451	S	S	.	.			trans	-78.9	90.1	167.1	50.9	0	0	0	0	108.8	Q561 S565	Q561-T563 PolarHBondContact O-N 3.39Å; T563-S565 PolarHBondContact O-N 3.3Å
564	N	23.5	Very low	37.8	Very low	152 Å²	152	89 Å²	89	81%	0.813	47%	0.467	S	S	*	.			trans	-62.1	96.8	171	-80	-3.8	0	0	0	110.4	Y562	Y562-N564 PolarHBondContact O-N 2.79Å; Y562-N564 VanDerWaalsContact O-N 3.15Å
565	S	21.1	Very low	35.2	Very low	94 Å²	94	97.7 Å²	97.7	66%	0.657	50%	0.501	S	S	*	.			trans	-119.9	109.1	168.5	58.1	0	0	0	0	109.1	T563	T563-S565 PolarHBondContact O-N 3.3Å
566	M	22.5	Very low	32.8	Very low	175 Å²	175	101.5 Å²	101.5	86%	0.862	52%	0.521	S	S	*	.	S	Bend	trans	18.7	99.5	165	-79.9	63.3	179.6	0	0	117.3
567	D	22.8	Very low	30.5	Very low	118 Å²	118	106.5 Å²	106.5	63%	0.631	55%	0.545	S	S	*	.				-178.8	169.1	105.6	-92.8	-21.1	0	0	0	112.3	K1483	D567-K1483 IonicContact OD1-NZ 2.76Å; D567-K1483 PolarHBondContact OD1-NZ 2.93Å; D567-K1483 IonicContact OD2-NZ 2.66Å; D567-K1483 PolarHBondContact OD2-NZ 2.88Å
568	D	23	Very low	29	Very low	119 Å²	119	108 Å²	108	64%	0.636	55%	0.552	S	S	*	*			trans	-37.2	134.8	-173.5	-55.9	-67.9	0	0	0	120.9
569	N	22.8	Very low	28	Very low	158 Å²	158	108.4 Å²	108.4	85%	0.845	56%	0.56	S	S	*	*			trans	49.8	65.6	136.1	-64.6	-36	0	0	0	120.6
570	T	22.6	Very low	27.8	Very low	126 Å²	126	108 Å²	108	77%	0.773	56%	0.556	S	S	*	*			trans	-131.6	130.2	152.9	47	0	0	0	0	112.6	E572	T570-E572 PolarHBondContact O-N 3.43Å
571	N	23	Very low	28.4	Very low	128 Å²	128	106.4 Å²	106.4	68%	0.684	55%	0.548	S	S	*	.			trans	-94.1	79.9	173.3	-83.9	-42.1	0	0	0	110.1
572	E	23.4	Very low	29.7	Very low	174 Å²	174	103.5 Å²	103.5	81%	0.813	54%	0.535	S	S	*	.			trans	-99.6	148.5	165.9	-62.6	-155.4	145.6	0	0	111.4	T570 E574	T570-E572 PolarHBondContact O-N 3.43Å; E572-E574 PolarHBondContact O-N 3.32Å
573	N	23.4	Very low	31.6	Very low	110 Å²	110	98.2 Å²	98.2	59%	0.588	52%	0.515	S	S	*	.			trans	-91.1	91.1	-160.8	-56.6	-75	0	0	0	111.9	N341 Y575	N341-N573 PolarHBondContact ND2-OD1 2.89Å; N573-Y575 PolarHBondContact O-N 2.95Å
574	E	24.6	Very low	34.2	Very low	79 Å²	79	94.7 Å²	94.7	37%	0.369	49%	0.493	S	S	.	.			trans	-72	125.2	172.9	-81.8	-160.5	88.3	0	0	113.2	K268 Y562 E572	K268-E574 PolarHBondContact NZ-O 2.9Å; Y562-E574 WeakPolarHBondContact CD1-OE2 3.33Å; Y562-E574 WeakPolarHBondContact CD2-OE1 3.5Å; Y562-E574 WeakPolarHBondContact CE1-OE2 3.29Å; Y562-E574 VanDerWaalsContact CE2-CD 3.46Å; Y562-E574 HydrophobicContact CE2-CG 4.47Å; Y562-E574 WeakPolarHBondContact CE2-OE1 3.49Å; Y562-E574 VanDerWaalsContact CZ-CD 3.5Å; E572-E574 PolarHBondContact O-N 3.32Å
575	Y	25.8	Very low	36.7	Very low	182 Å²	182	88.7 Å²	88.7	71%	0.714	46%	0.46	S	S	*	.			trans	-94.8	96.6	157.4	-74.1	-98.2	0	0	0	108.5	N573 E577	N573-Y575 PolarHBondContact O-N 2.95Å; Y575-E577 PolarHBondContact O-N 2.83Å
576	D	28.2	Very low	39.4	Very low	80 Å²	80	84.2 Å²	84.2	43%	0.428	43%	0.428	S	S	.	.			trans	-54.9	91	158.5	-62.7	-81.4	0	0	0	108.7	K268	K268-D576 VanDerWaalsContact CE-OD2 3.31Å; K268-D576 WeakPolarHBondContact CE-OD2 3.37Å; K268-D576 WeakPolarHBondContact CG-OD2 3.26Å
577	E	27.8	Very low	42	Very low	115 Å²	115	79 Å²	79	54%	0.537	40%	0.402	S	S	.	.			trans	-70.1	142	170.9	-72.7	-169.3	152.7	0	0	110.1	K558 Y575	K558-E577 IonicContact NZ-OE2 2.68Å; K558-E577 PolarHBondContact NZ-OE2 2.58Å; Y575-E577 PolarHBondContact O-N 2.83Å
578	E	33.1	Very low	44.3	Very low	45 Å²	45	73.9 Å²	73.9	21%	0.21	37%	0.374	C	S	.	.			trans	-49.9	149.7	-178.2	-57	171.3	140.8	0	0	112.5	P437 T439 N461 V580	P437-E578 WeakPolarHBondContact CB-OE1 3.45Å; P437-E578 WeakPolarHBondContact CD-OE1 3.43Å; T439-E578 WeakPolarHBondContact CG2-OE2 3.43Å; N461-E578 PolarHBondContact ND2-OE2 2.88Å; E578-V580 WeakPolarHBondContact O-CG2 3.46Å; E578-V580 PolarHBondContact O-N 2.84Å
579	S	40.7	Very low	45.9	Very low	52 Å²	52	72.4 Å²	72.4	36%	0.364	37%	0.366	S	S	.	.			trans	-68	79.1	169	46.3	0	0	0	0	110.3	E265 N581	E265-S579 WeakPolarHBondContact OE2-CB 3.4Å; E265-S579 PolarHBondContact OE2-OG 3.02Å; S579-N581 VanDerWaalsContact C-N 3.26Å; S579-N581 PolarHBondContact O-N 3.26Å
580	V	45.5	Very low	46.8	Very low	16 Å²	16	70.9 Å²	70.9	10%	0.097	36%	0.358	C	S	.	.			trans	-67.7	76.1	-172.1	-159.6	0	0	0	0	112.1	C459 N461 K558 E578 C582	C459-V580 VanDerWaalsContact SG-CG1 3.56Å; C459-V580 PolarHBondContact SG-O 2.91Å; C459-V580 VanDerWaalsContact SG-O 3.35Å; N461-V580 HydrophobicContact CB-CG1 4.32Å; N461-V580 HydrophobicContact CB-CG2 4.2Å; K558-V580 HydrophobicContact CD-CG2 4.38Å; E578-V580 WeakPolarHBondContact O-CG2 3.46Å; E578-V580 PolarHBondContact O-N 2.84Å; V580-C582 VanDerWaalsContact C-N 3.29Å; V580-C582 PolarHBondContact O-N 2.82Å
581	N	54.1	Low	47.2	Very low	21 Å²	21	72.4 Å²	72.4	11%	0.112	36%	0.356	C	S	.	.			trans	-85.3	60.5	-173	-164.2	-6.1	0	0	0	111.6	Q555 Y556 S579 K583	Q555-N581 PolarHBondContact NE2-OD1 2.8Å; Y556-N581 WeakPolarHBondContact O-CA 3.49Å; S579-N581 VanDerWaalsContact C-N 3.26Å; S579-N581 PolarHBondContact O-N 3.26Å; N581-K583 WeakPolarHBondContact O-CG 3.39Å; N581-K583 PolarHBondContact O-N 2.63Å
582	C	63.7	Low	47.4	Very low	13 Å²	13	73.8 Å²	73.8	9%	0.088	36%	0.356	C	S	.	.			trans	-65	133.4	177.4	-54.6	0	0	0	0	110.6	C459 Q555 Y556 V580 F584	C459-C582 WeakPolarHBondContact CA-SG 3.04Å; C459-C582 HydrophobicContact CB-CB 3.7Å; C459-C582 WeakPolarHBondContact CB-SG 3.21Å; C459-C582 WeakPolarHBondContact SG-CB 3.31Å; C459-C582 CovalentContact SG-SG 2.02Å; C459-C582 PolarHBondContact SG-SG 3.01Å; Q555-C582 WeakPolarHBondContact CA-O 3.42Å; Y556-C582 PolarHBondContact N-O 2.86Å; V580-C582 VanDerWaalsContact C-N 3.29Å; V580-C582 PolarHBondContact O-N 2.82Å; C582-F584 HydrophobicContact CB-CD2 4.33Å; C582-F584 HydrophobicContact CB-CE2 3.44Å; C582-F584 VanDerWaalsContact CB-CE2 3.44Å; C582-F584 HydrophobicContact CB-CZ 3.86Å
583	K	70.9	Confident	47.6	Very low	26 Å²	26	73.7 Å²	73.7	11%	0.113	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129	178.2	-44.1	-168.9	-174.2	176.9	0	108.9	E47 P444 K445 Y554 Q555 N581	E47-K583 IonicContact OE1-NZ 2.69Å; E47-K583 PolarHBondContact OE1-NZ 3.28Å; P444-K583 CarbonylContact C-O 3.49Å; P444-K583 VanDerWaalsContact CA-O 3.25Å; P444-K583 WeakPolarHBondContact CA-O 3.29Å; P444-K583 HydrophobicContact CB-CB 4.04Å; K445-K583 PolarHBondContact N-O 3.16Å; Y554-K583 WeakPolarHBondContact O-CA 3.38Å; Q555-K583 HydrophobicContact CG-CB 4.39Å; Q555-K583 HydrophobicContact CG-CD 4.44Å; Q555-K583 HydrophobicContact CG-CG 4.08Å; N581-K583 WeakPolarHBondContact O-CG 3.39Å; N581-K583 PolarHBondContact O-N 2.63Å
584	F	75.9	Confident	47.6	Very low	6 Å²	6	72.4 Å²	72.4	3%	0.026	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	152.7	177.4	-53.6	-98.5	0	0	0	108.7	K445 I447 L457 N458 C459 W518 I553 Y554 C582	K445-F584 HydrophobicContact CB-CD1 3.93Å; K445-F584 HydrophobicContact CB-CE1 4.38Å; K445-F584 HydrophobicContact CD-CD1 4.46Å; K445-F584 HydrophobicContact CD-CE1 4.3Å; K445-F584 WeakPolarHBondContact O-CA 3.3Å; I447-F584 HydrophobicContact CD1-CD1 4.06Å; L457-F584 HydrophobicContact CB-CD2 4.4Å; L457-F584 HydrophobicContact CB-CE1 4.48Å; L457-F584 HydrophobicContact CB-CE2 4.35Å; L457-F584 HydrophobicContact CB-CG 4.5Å; L457-F584 HydrophobicContact CB-CZ 4.4Å; L457-F584 HydrophobicContact CD1-CB 4.3Å; L457-F584 HydrophobicContact CD1-CD2 4.25Å; L457-F584 HydrophobicContact CD1-CG 4.28Å; L457-F584 HydrophobicContact CD2-CB 4.21Å; L457-F584 HydrophobicContact CD2-CD1 4.09Å; L457-F584 HydrophobicContact CD2-CG 4.12Å; N458-F584 WeakPolarHBondContact O-CZ 3.27Å; C459-F584 HydrophobicContact CB-CE2 4.44Å; C459-F584 HydrophobicContact CB-CZ 4.48Å; W518-F584 AromaticContact CH2-CD2 3.98Å; W518-F584 HydrophobicContact CH2-CD2 3.98Å; W518-F584 AromaticContact CH2-CE2 3.52Å; W518-F584 HydrophobicContact CH2-CE2 3.52Å; W518-F584 HydrophobicContact CH2-CZ 4.3Å; W518-F584 AromaticContact CZ3-CD2 3.75Å; W518-F584 HydrophobicContact CZ3-CD2 3.75Å; W518-F584 AromaticContact CZ3-CE2 3.74Å; W518-F584 HydrophobicContact CZ3-CE2 3.74Å; I553-F584 WeakPolarHBondContact CA-O 3.5Å; Y554-F584 PolarHBondContact N-O 3.14Å; Y554-F584 PolarHBondContact O-N 3.23Å; C582-F584 HydrophobicContact CB-CD2 4.33Å; C582-F584 HydrophobicContact CB-CE2 3.44Å; C582-F584 VanDerWaalsContact CB-CE2 3.44Å; C582-F584 HydrophobicContact CB-CZ 3.86Å
585	Y	75.7	Confident	47.8	Very low	26 Å²	26	68.7 Å²	68.7	10%	0.102	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	119.7	173.3	171	-113.8	0	0	0	109.1	L41 Y172 K445 L446 I447 G552 I553 Q587	L41-Y585 HydrophobicContact CD2-CD1 3.65Å; L41-Y585 HydrophobicContact CD2-CE1 4.43Å; L41-Y585 HydrophobicContact CD2-CG 4.22Å; Y172-Y585 HydrophobicContact CD1-CE2 4.5Å; Y172-Y585 AromaticContact CD1-CZ 4Å; Y172-Y585 WeakPolarHBondContact O-CE2 3.44Å; K445-Y585 PolarHBondContact O-N 3Å; L446-Y585 HydrophobicContact CD1-CD1 3.56Å; L446-Y585 HydrophobicContact CD1-CE1 3.96Å; I447-Y585 PolarHBondContact N-O 2.97Å; G552-Y585 WeakPolarHBondContact O-CA 3.44Å; G552-Y585 WeakPolarHBondContact O-CD2 3.21Å; I553-Y585 HydrophobicContact CG1-CD2 3.94Å; Y585-Q587 HydrophobicContact CE1-CB 3.79Å; Y585-Q587 HydrophobicContact CE1-CG 4.4Å
586	I	77.5	Confident	47.9	Very low	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.3	178.2	-58.1	-172.9	0	0	0	109.1	I447 T449 V455 L457 I543 G552 Y554	I447-I586 WeakPolarHBondContact O-CA 2.99Å; T449-I586 HydrophobicContact CG2-CG2 3.78Å; V455-I586 HydrophobicContact CG1-CD1 4.11Å; L457-I586 HydrophobicContact CD2-CD1 4.24Å; I543-I586 HydrophobicContact CD1-CD1 3.64Å; G552-I586 PolarHBondContact N-O 2.93Å; G552-I586 PolarHBondContact O-N 2.68Å; Y554-I586 HydrophobicContact CD2-CB 4.49Å; Y554-I586 HydrophobicContact CD2-CD1 3.78Å; Y554-I586 HydrophobicContact CD2-CG1 3.85Å; Y554-I586 HydrophobicContact CE2-CB 4.23Å; Y554-I586 HydrophobicContact CE2-CD1 3.48Å; Y554-I586 VanDerWaalsContact CE2-CD1 3.48Å; Y554-I586 HydrophobicContact CE2-CG1 3.87Å
587	Q	77	Confident	48	Very low	65 Å²	65	56.4 Å²	56.4	30%	0.304	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142	176.3	-174.5	175.4	-9.5	0	0	110.1	L446 I447 T448 T449 Y585	L446-Q587 HydrophobicContact CD1-CB 4.28Å; I447-Q587 PolarHBondContact O-N 3.18Å; T448-Q587 WeakPolarHBondContact CA-O 3.17Å; T448-Q587 HydrophobicContact CG2-CB 4.17Å; T449-Q587 PolarHBondContact N-O 2.98Å; Y585-Q587 HydrophobicContact CE1-CB 3.79Å; Y585-Q587 HydrophobicContact CE1-CG 4.4Å
588	L	71.6	Confident	48	Very low	11 Å²	11	51 Å²	51	6%	0.058	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	142.5	173.1	-78.4	172.7	0	0	0	111.8	T449 I451 I546 Q548 T551 D590	T449-L588 HydrophobicContact CG2-CD2 4.35Å; T449-L588 CarbonylContact O-C 3.56Å; T449-L588 WeakPolarHBondContact O-CA 3.22Å; T449-L588 WeakPolarHBondContact O-CD2 3.44Å; I451-L588 HydrophobicContact CB-CD2 4.48Å; I451-L588 HydrophobicContact CD1-CD1 4.08Å; I451-L588 HydrophobicContact CG1-CD1 3.65Å; I451-L588 HydrophobicContact CG1-CD2 3.62Å; I451-L588 HydrophobicContact CG1-CG 4.26Å; I546-L588 HydrophobicContact CG2-CD2 3.81Å; Q548-L588 HydrophobicContact CB-CD1 4.11Å; Q548-L588 HydrophobicContact CG-CD1 4.04Å; T551-L588 HydrophobicContact CG2-CB 4.31Å; T551-L588 HydrophobicContact CG2-CD1 3.72Å; T551-L588 HydrophobicContact CG2-CG 3.68Å; L588-D590 PolarHBondContact O-N 3.44Å
589	N	56.3	Low	47.8	Very low	88 Å²	88	48.8 Å²	48.8	47%	0.471	24%	0.243	S	C	.	.			trans	-82.9	95.5	167	-73.9	-2.9	0	0	0	109	T448 T449 E591	T448-N589 WeakPolarHBondContact CB-OD1 3.38Å; T449-N589 PolarHBondContact O-N 3.14Å; N589-E591 PolarHBondContact O-N 2.79Å
590	D	43	Very low	47.2	Very low	126 Å²	126	49.9 Å²	49.9	67%	0.674	24%	0.243	S	C	*	.			trans	-77.2	87.3	-176.8	-71.2	-33	0	0	0	112.8	L588	L588-D590 PolarHBondContact O-N 3.44Å
591	E	30.2	Very low	46.4	Very low	157 Å²	157	56.7 Å²	56.7	73%	0.734	27%	0.273	S	S	*	.			trans	-113.6	98.5	161	-86.9	-146.7	-148.7	0	0	112.8	N589	N589-E591 PolarHBondContact O-N 2.79Å
592	K	27.4	Very low	45.6	Very low	157 Å²	157	57.7 Å²	57.7	68%	0.683	28%	0.278	S	S	*	.	S	Bend	trans	94.4	129.5	150.4	-53	-175.6	177.9	82.6	0	120.7
593	F	26.5	Very low	44.2	Very low	172 Å²	172	65.7 Å²	65.7	75%	0.754	31%	0.312	S	S	*	.			trans	93.9	152.1	156.3	-72.5	-66.8	0	0	0	121.6
594	V	24.9	Very low	42.7	Very low	83 Å²	83	67.7 Å²	67.7	50%	0.503	33%	0.326	S	S	.	.			trans	-125.2	166.4	-157.1	173.2	0	0	0	0	110.8
595	H	28.5	Very low	41.3	Very low	2 Å²	2	70.7 Å²	70.7	1%	0.009	34%	0.342	C	S	.	.			trans	-63.9	-179.3	-169.3	-118.3	-149.8	0	0	0	115.1	L621 S673 N674 V675 T679 I681	H595-L621 WeakPolarHBondContact CE1-CD1 3.48Å; H595-L621 WeakPolarHBondContact ND1-CD1 3.49Å; H595-S673 CarbonylContact O-C 3.57Å; H595-S673 WeakPolarHBondContact O-CB 3.36Å; H595-S673 PolarHBondContact O-OG 3.09Å; H595-N674 CarbonylContact C-O 3.56Å; H595-N674 CarbonylContact O-C 3.33Å; H595-N674 PolarHBondContact O-N 1.76Å; H595-V675 HydrophobicContact CB-CG1 3.72Å; H595-V675 WeakPolarHBondContact CD2-CG1 3.3Å; H595-V675 WeakPolarHBondContact NE2-CG1 3.45Å; H595-T679 PolarHBondContact CD2-OG1 2.94Å; H595-T679 PolarHBondContact NE2-O 2.92Å; H595-T679 PolarHBondContact NE2-OG1 2.64Å; H595-I681 HydrophobicContact CB-CB 3.77Å; H595-I681 HydrophobicContact CB-CD1 4.26Å; H595-I681 HydrophobicContact CB-CG1 4.45Å; H595-I681 HydrophobicContact CB-CG2 4.3Å; H595-I681 PolarHBondContact CD2-N 2.88Å; H595-I681 PolarHBondContact CE1-N 2.87Å; H595-I681 VanDerWaalsContact CE1-N 3.27Å; H595-I681 PolarHBondContact CE1-O 2.87Å; H595-I681 VanDerWaalsContact CG-CB 3.49Å; H595-I681 PolarHBondContact ND1-O 3.49Å; H595-I681 PolarHBondContact NE2-N 3.41Å
596	N	27.6	Very low	39.7	Very low	4 Å²	4	76 Å²	76	2%	0.021	37%	0.366	C	S	.	.				159.4	141.8	95.6	-81.4	19.7	0	0	0	106.1	W642 S643 I644 I672 S673 N674 V675	N596-W642 CarbonylContact O-C 3.59Å; N596-S643 WeakPolarHBondContact O-CA 3.44Å; N596-S643 PolarHBondContact O-N 3.26Å; N596-S643 VanDerWaalsContact O-N 3.07Å; N596-I644 VanDerWaalsContact C-N 3.31Å; N596-I644 VanDerWaalsContact CA-CG1 3.48Å; N596-I644 HydrophobicContact CB-CB 3.69Å; N596-I644 HydrophobicContact CB-CD1 4.12Å; N596-I644 HydrophobicContact CB-CG1 3.04Å; N596-I644 WeakPolarHBondContact ND2-CG1 3.25Å; N596-I672 VanDerWaalsContact ND2-C 3.28Å; N596-S673 VanDerWaalsContact CB-C 3.42Å; N596-S673 WeakPolarHBondContact CB-O 3.36Å; N596-S673 PolarHBondContact ND2-N 3.18Å; N596-S673 PolarHBondContact ND2-OG 2.84Å; N596-S673 PolarHBondContact OD1-OG 2.75Å; N596-S673 VanDerWaalsContact OD1-OG 3.09Å; N596-N674 CarbonylContact O-C 3.58Å; N596-N674 WeakPolarHBondContact O-CA 3.4Å; N596-V675 VanDerWaalsContact N-N 3.14Å; N596-V675 WeakPolarHBondContact O-CG2 3.24Å; N596-V675 PolarHBondContact O-N 3.25Å
597	E	29.2	Very low	38.5	Very low	0 Å²	0	79.5 Å²	79.5	0%	0	38%	0.382	C	S	.	.	B	Isolated β-bridge	cis	-177.7	177.3	-23.6	171.3	169.3	-107	0	0	115.4	L621 W642 S643 I644 V675 C698 V700 Y701	E597-L621 HydrophobicContact CB-CD1 3.72Å; E597-L621 HydrophobicContact CB-CD2 4.41Å; E597-L621 HydrophobicContact CB-CG 4.26Å; E597-L621 HydrophobicContact CG-CD1 3.8Å; E597-L621 HydrophobicContact CG-CD2 3.91Å; E597-L621 HydrophobicContact CG-CG 3.8Å; E597-L621 WeakPolarHBondContact OE1-CG 3.23Å; E597-W642 CarbonylContact O-C 3.52Å; E597-W642 WeakPolarHBondContact O-CA 3.4Å; E597-W642 WeakPolarHBondContact O-CB 3.4Å; E597-S643 VanDerWaalsContact N-CA 3.35Å; E597-S643 PolarHBondContact O-N 2.74Å; E597-I644 HydrophobicContact CB-CB 4Å; E597-I644 HydrophobicContact CB-CD1 3.48Å; E597-I644 VanDerWaalsContact CB-CD1 3.48Å; E597-I644 HydrophobicContact CB-CG1 3.31Å; E597-I644 HydrophobicContact CG-CD1 3.82Å; E597-I644 HydrophobicContact CG-CG1 4.09Å; E597-I644 WeakPolarHBondContact OE1-CD1 3.33Å; E597-I644 WeakPolarHBondContact OE2-CD1 3.3Å; E597-I644 WeakPolarHBondContact OE2-CG1 3.39Å; E597-V675 VanDerWaalsContact N-CG2 3.26Å; E597-C698 PolarHBondContact OE2-SG 3.37Å; E597-V700 VanDerWaalsContact C-C 3.42Å; E597-V700 CarbonylContact C-O 3.54Å; E597-V700 WeakPolarHBondContact CA-O 3.36Å; E597-V700 HydrophobicContact CB-CG1 4.22Å; E597-V700 WeakPolarHBondContact CB-O 3.31Å; E597-V700 HydrophobicContact CG-CB 3.44Å; E597-V700 VanDerWaalsContact CG-CB 3.44Å; E597-V700 HydrophobicContact CG-CG1 2.88Å; E597-V700 HydrophobicContact CG-CG2 3.77Å; E597-V700 CarbonylContact O-C 3.58Å; E597-V700 WeakPolarHBondContact OE2-CG2 3.39Å; E597-Y701 CarbonylContact O-C 3.55Å
598	T	29.3	Very low	37.4	Very low	0 Å²	0	82.3 Å²	82.3	0%	0	40%	0.395	C	S	.	.			trans	-158.9	121.2	166.9	-55.4	0	0	0	0	118.8	L626 W642 V700 Y701 N702 K707 L709 G710	T598-L626 WeakPolarHBondContact O-CD2 3.47Å; T598-W642 VanDerWaalsContact OG1-CG 3.24Å; T598-V700 VanDerWaalsContact C-CB 3.49Å; T598-V700 VanDerWaalsContact CA-CA 3.46Å; T598-V700 VanDerWaalsContact CA-CG1 3.49Å; T598-V700 VanDerWaalsContact N-CG1 3.29Å; T598-V700 PolarHBondContact N-O 2.84Å; T598-V700 VanDerWaalsContact O-CG1 3.23Å; T598-V700 WeakPolarHBondContact O-CG1 3.41Å; T598-Y701 PolarHBondContact OG1-O 2.8Å; T598-N702 HydrophobicContact CG2-CB 3.76Å; T598-N702 WeakPolarHBondContact OG1-CA 3.37Å; T598-N702 PolarHBondContact OG1-N 2.95Å; T598-N702 VanDerWaalsContact OG1-N 3.17Å; T598-K707 WeakPolarHBondContact CG2-O 3.42Å; T598-L709 HydrophobicContact CG2-CB 3.65Å; T598-L709 HydrophobicContact CG2-CD1 3.82Å; T598-L709 HydrophobicContact CG2-CG 3.5Å; T598-L709 VanDerWaalsContact CG2-CG 3.5Å; T598-G710 CarbonylContact C-O 3.53Å; T598-G710 PolarHBondContact O-N 3.37Å
599	D	29.2	Very low	36.3	Very low	0 Å²	0	83.3 Å²	83.3	0%	0	40%	0.402	C	S	.	.				127.4	-8.5	65.4	-100.8	57.2	0	0	0	126.5	R699 V700 L708 G710 E711	D599-R699 WeakPolarHBondContact OD1-CA 3.24Å; D599-R699 WeakPolarHBondContact OD2-CD 3.08Å; D599-R699 IonicContact OD2-NE 2.99Å; D599-R699 PolarHBondContact OD2-NE 3Å; D599-V700 HydrophobicContact CB-CB 4.06Å; D599-V700 VanDerWaalsContact N-CA 3.31Å; D599-V700 VanDerWaalsContact N-CB 3.26Å; D599-V700 WeakPolarHBondContact OD1-CA 3.35Å; D599-V700 WeakPolarHBondContact OD1-CB 3.49Å; D599-V700 PolarHBondContact OD1-N 3.44Å; D599-L708 HydrophobicContact CB-CB 4.05Å; D599-L708 HydrophobicContact CB-CD1 3.9Å; D599-L708 HydrophobicContact CB-CG 3.61Å; D599-L708 WeakPolarHBondContact O-CB 3.32Å; D599-L708 WeakPolarHBondContact O-CG 3.43Å; D599-G710 CarbonylContact C-O 3.56Å; D599-G710 VanDerWaalsContact CA-O 3.3Å; D599-G710 WeakPolarHBondContact CA-O 3.26Å; D599-G710 PolarHBondContact N-O 3.12Å; D599-E711 WeakPolarHBondContact OD1-CA 3.28Å; D599-E711 WeakPolarHBondContact OD1-CB 3.27Å
600	Q	27.3	Very low	36.1	Very low	75 Å²	75	80.9 Å²	80.9	35%	0.35	39%	0.391	S	S	.	.	S	Bend	trans	-152.8	121.3	174.6	-52.5	-171.1	-86.4	0	0	119.7	T627 L708 L709 G710 E711	Q600-T627 HydrophobicContact CB-CG2 4.12Å; Q600-T627 PolarHBondContact OE1-OG1 3.36Å; Q600-L708 HydrophobicContact CG-CB 3.79Å; Q600-L708 PolarHBondContact OE1-O 3.27Å; Q600-L709 VanDerWaalsContact CB-O 3.31Å; Q600-L709 WeakPolarHBondContact CB-O 3.37Å; Q600-L709 PolarHBondContact N-O 2.89Å; Q600-G710 VanDerWaalsContact C-C 3.4Å; Q600-G710 PolarHBondContact N-O 2.93Å; Q600-G710 VanDerWaalsContact N-O 3.14Å; Q600-G710 CarbonylContact O-C 3.49Å; Q600-G710 WeakPolarHBondContact O-CA 3.41Å; Q600-E711 VanDerWaalsContact CA-N 3.31Å; Q600-E711 PolarHBondContact O-N 3.35Å
601	Q	29.4	Very low	36.5	Very low	158 Å²	158	78.4 Å²	78.4	74%	0.738	38%	0.376	S	S	*	.			trans	61.8	101.2	163.9	-58.1	-169.9	-3.8	0	0	123.7	E711	Q601-E711 CarbonylContact C-O 3.57Å; Q601-E711 VanDerWaalsContact N-N 3.11Å
602	L	36.3	Very low	37.2	Very low	42 Å²	42	73.8 Å²	73.8	22%	0.22	37%	0.37	C	S	.	.			trans	-131.5	168.2	165.8	-82.8	84.3	0	0	0	113.9	S623 L624 E711 Q712	L602-S623 WeakPolarHBondContact CD2-O 3.28Å; L602-L624 HydrophobicContact CD1-CB 4.29Å; L602-L624 HydrophobicContact CD1-CD1 3.82Å; L602-L624 HydrophobicContact CD1-CG 3.57Å; L602-L624 HydrophobicContact CD2-CD1 3.65Å; L602-L624 HydrophobicContact CD2-CG 4.25Å; L602-L624 HydrophobicContact CG-CD1 4.41Å; L602-E711 WeakPolarHBondContact CB-O 3.44Å; L602-E711 WeakPolarHBondContact CD1-O 3.34Å; L602-E711 PolarHBondContact N-O 2.74Å; L602-Q712 HydrophobicContact CB-CB 4.35Å; L602-Q712 HydrophobicContact CB-CG 4.25Å; L602-Q712 HydrophobicContact CD1-CB 4.47Å; L602-Q712 HydrophobicContact CD2-CB 4.15Å; L602-Q712 HydrophobicContact CD2-CG 3.9Å
603	K	34	Very low	38	Very low	182 Å²	182	71.6 Å²	71.6	79%	0.791	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-57.2	136.9	165.9	-68.5	177.2	176.7	176	0	111.6
604	T	39.2	Very low	39.1	Very low	67 Å²	67	66.4 Å²	66.4	41%	0.411	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-67.3	129.3	164.3	-34.4	0	0	0	0	110.3	R713 Q715	T604-R713 VanDerWaalsContact CA-O 3.31Å; T604-R713 WeakPolarHBondContact CA-O 3.44Å; T604-R713 HydrophobicContact CG2-CB 4.11Å; T604-Q715 HydrophobicContact CG2-CB 4.33Å
605	I	48.1	Very low	40.4	Very low	70 Å²	70	62.6 Å²	62.6	36%	0.359	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	139.8	171	-59.5	179	0	0	0	109.1	R713 F714 Q715	I605-R713 PolarHBondContact N-O 2.78Å; I605-R713 VanDerWaalsContact N-O 3.08Å; I605-F714 HydrophobicContact CB-CD1 3.99Å; I605-F714 HydrophobicContact CB-CE1 4.33Å; I605-F714 HydrophobicContact CD1-CE1 4.14Å; I605-F714 CarbonylContact O-C 3.12Å; I605-F714 WeakPolarHBondContact O-CA 3.27Å; I605-Q715 PolarHBondContact O-N 2.79Å
606	F	42	Very low	41.9	Very low	138 Å²	138	66.1 Å²	66.1	61%	0.605	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	126.9	175.9	-65.1	-92.6	0	0	0	109.4	Q715	F606-Q715 HydrophobicContact CD1-CB 3.74Å; F606-Q715 HydrophobicContact CD1-CG 3.86Å; F606-Q715 HydrophobicContact CE1-CB 3.89Å; F606-Q715 HydrophobicContact CE1-CG 3.89Å
607	E	51.9	Low	43.6	Very low	72 Å²	72	66 Å²	66	34%	0.336	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.9	169.1	-68.9	-165.7	146.8	0	0	109.7	Q715 I717	E607-Q715 PolarHBondContact N-O 2.9Å; E607-I717 PolarHBondContact O-N 3.41Å
608	H	52.4	Low	45.3	Very low	125 Å²	125	69 Å²	69	58%	0.579	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.4	172.8	-72.1	-107.9	0	0	0	108.9
609	T	49.2	Very low	47.1	Very low	32 Å²	32	69.1 Å²	69.1	20%	0.196	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	167.4	176.1	51.2	0	0	0	0	110	I717 I718 E719	T609-I717 PolarHBondContact N-O 2.87Å; T609-I717 PolarHBondContact OG1-O 3.07Å; T609-I718 CarbonylContact O-C 3.19Å; T609-I718 WeakPolarHBondContact O-CA 3.39Å; T609-I718 WeakPolarHBondContact OG1-CG1 3.46Å; T609-E719 PolarHBondContact O-N 2.82Å
610	S	51.5	Low	48.8	Very low	36 Å²	36	71.2 Å²	71.2	25%	0.252	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	155.3	169.6	55.4	0	0	0	0	110.7	G612 L613	S610-G612 PolarHBondContact O-N 2.81Å; S610-L613 PolarHBondContact O-N 2.9Å; S610-L613 VanDerWaalsContact O-N 3.16Å
611	E	52.3	Low	50.4	Low	75 Å²	75	68.7 Å²	68.7	35%	0.35	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	133.1	-172.8	-167.9	170.2	-130.4	0	0	112.5	K689 I690 I718 E719	E611-K689 WeakPolarHBondContact OE1-CA 3.33Å; E611-I690 HydrophobicContact CB-CG1 4.15Å; E611-I690 VanDerWaalsContact CD-CD1 3.48Å; E611-I690 HydrophobicContact CG-CG1 4.23Å; E611-I690 WeakPolarHBondContact OE1-CG1 3.17Å; E611-I690 PolarHBondContact OE1-N 2.61Å; E611-I690 VanDerWaalsContact OE2-CD1 3.24Å; E611-I690 WeakPolarHBondContact OE2-CD1 3.19Å; E611-I718 HydrophobicContact CB-CG2 3.86Å; E611-I718 HydrophobicContact CG-CG2 4.37Å; E611-E719 PolarHBondContact N-O 2.88Å
612	G	45.5	Very low	51.6	Low	59 Å²	59	65.5 Å²	65.5	61%	0.608	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.6	-17.9	-177.4	0	0	0	0	0	115.6	S610 R688	S610-G612 PolarHBondContact O-N 2.81Å; G612-R688 PolarHBondContact N-O 2.89Å
613	L	44.4	Very low	52.4	Low	112 Å²	112	66.7 Å²	66.7	59%	0.586	37%	0.365	S	S	*	.	S	Bend	trans	-83.6	145.2	168.2	-71.8	176.2	0	0	0	111	S610 G615	S610-L613 PolarHBondContact O-N 2.9Å; S610-L613 VanDerWaalsContact O-N 3.16Å; L613-G615 PolarHBondContact O-N 3.34Å
614	T	48.9	Very low	53.7	Low	62 Å²	62	59 Å²	59	38%	0.38	33%	0.332	S	S	.	.			trans	-85.5	94.9	-175.3	52.1	0	0	0	0	111.8	H616 N686	T614-H616 PolarHBondContact O-CD2 3.12Å; T614-H616 VanDerWaalsContact O-CD2 3.25Å; T614-N686 WeakPolarHBondContact CG2-OD1 3.14Å
615	G	52.6	Low	54.4	Low	3 Å²	3	62 Å²	62	3%	0.031	35%	0.345	C	S	.	.			trans	-61.1	133	160	0	0	0	0	0	109.7	L613 N686	L613-G615 PolarHBondContact O-N 3.34Å; G615-N686 WeakPolarHBondContact O-CA 3.36Å
616	H	59.2	Low	55	Low	77 Å²	77	61.1 Å²	61.1	36%	0.356	34%	0.34	S	S	.	.			trans	-123	82.3	-174.6	-87.3	-80	0	0	0	109.5	T614 N618 I684 N686	T614-H616 PolarHBondContact O-CD2 3.12Å; T614-H616 VanDerWaalsContact O-CD2 3.25Å; H616-N618 VanDerWaalsContact O-CG 3.22Å; H616-N618 PolarHBondContact O-N 3.28Å; H616-N618 PolarHBondContact O-ND2 2.93Å; H616-I684 HydrophobicContact CB-CG2 4.33Å; H616-I684 VanDerWaalsContact ND1-CG2 3.34Å; H616-I684 WeakPolarHBondContact ND1-CG2 3.35Å; H616-N686 PolarHBondContact CE1-ND2 3.11Å; H616-N686 PolarHBondContact NE2-ND2 3.01Å
617	L	64.9	Low	55.6	Low	1 Å²	1	57.8 Å²	57.8	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	98.7	179.4	-62.9	179.3	0	0	0	109.3	W646 I684 V685 P687 Y696 F714 L716	L617-W646 HydrophobicContact CB-CH2 3.95Å; L617-W646 HydrophobicContact CB-CZ3 4.29Å; L617-W646 WeakPolarHBondContact O-CH2 3.38Å; L617-W646 WeakPolarHBondContact O-CZ2 3.49Å; L617-I684 WeakPolarHBondContact O-CA 3.37Å; L617-V685 HydrophobicContact CB-CB 4.36Å; L617-V685 PolarHBondContact N-O 2.81Å; L617-V685 PolarHBondContact O-N 2.91Å; L617-V685 VanDerWaalsContact O-N 3.14Å; L617-P687 HydrophobicContact CD1-CG 4.42Å; L617-Y696 HydrophobicContact CD1-CD1 4.27Å; L617-Y696 HydrophobicContact CD1-CD2 3.69Å; L617-Y696 HydrophobicContact CD1-CE2 4.33Å; L617-Y696 HydrophobicContact CD1-CG 3.66Å; L617-F714 HydrophobicContact CD1-CB 4.48Å; L617-F714 HydrophobicContact CD2-CB 3.98Å; L617-F714 HydrophobicContact CD2-CD1 3.91Å; L617-F714 HydrophobicContact CD2-CG 4.12Å; L617-L716 HydrophobicContact CD2-CD1 4.4Å
618	N	64.7	Low	55.7	Low	64 Å²	64	59 Å²	59	34%	0.342	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.9	-175	-66.4	-40	0	0	0	110.7	H616 L682 S683 I684 F714	H616-N618 VanDerWaalsContact O-CG 3.22Å; H616-N618 PolarHBondContact O-N 3.28Å; H616-N618 PolarHBondContact O-ND2 2.93Å; N618-L682 HydrophobicContact CB-CB 4.4Å; N618-L682 HydrophobicContact CB-CD2 3.83Å; N618-S683 WeakPolarHBondContact CA-O 3.48Å; N618-I684 WeakPolarHBondContact OD1-CD1 3.26Å; N618-I684 VanDerWaalsContact OD1-CG1 3.29Å; N618-I684 WeakPolarHBondContact OD1-CG1 3.41Å; N618-I684 WeakPolarHBondContact OD1-CG2 3.33Å; N618-F714 WeakPolarHBondContact O-CZ 3.41Å
619	C	65.6	Low	55.3	Low	1 Å²	1	58.2 Å²	58.2	1%	0.007	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.7	173.6	-161.1	0	0	0	0	110.8	W646 L682 S683 C698 Q712 F714	C619-W646 HydrophobicContact CB-CH2 4.05Å; C619-W646 HydrophobicContact CB-CZ2 3.62Å; C619-L682 VanDerWaalsContact O-CA 3.26Å; C619-L682 WeakPolarHBondContact O-CA 3.4Å; C619-S683 PolarHBondContact N-O 3.03Å; C619-S683 PolarHBondContact O-N 3.33Å; C619-C698 HydrophobicContact CB-CB 3.71Å; C619-C698 WeakPolarHBondContact CB-SG 3.43Å; C619-C698 WeakPolarHBondContact SG-CB 3.5Å; C619-C698 CovalentContact SG-SG 2.02Å; C619-C698 PolarHBondContact SG-SG 3.45Å; C619-Q712 PolarHBondContact SG-OE1 3.08Å; C619-Q712 VanDerWaalsContact SG-OE1 3.35Å; C619-F714 HydrophobicContact CB-CZ 4.44Å
620	N	66.5	Low	54.9	Low	45 Å²	45	63.5 Å²	63.5	24%	0.241	36%	0.363	C	S	.	.			trans	-133.8	106.3	-172	176.9	12.8	0	0	0	112.5	S622 S623 L624 L682	N620-S622 PolarHBondContact ND2-OG 2.87Å; N620-S622 VanDerWaalsContact ND2-OG 3.07Å; N620-S622 PolarHBondContact O-N 2.96Å; N620-S622 VanDerWaalsContact O-N 3.11Å; N620-S622 PolarHBondContact OD1-N 3.05Å; N620-S622 PolarHBondContact OD1-OG 2.77Å; N620-S622 VanDerWaalsContact OD1-OG 3.12Å; N620-S623 PolarHBondContact O-N 3.22Å; N620-S623 PolarHBondContact O-OG 3.35Å; N620-L624 WeakPolarHBondContact O-CD1 3.42Å; N620-L682 HydrophobicContact CB-CD2 4.25Å
621	L	60.9	Low	54.1	Low	21 Å²	21	69.8 Å²	69.8	11%	0.11	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-50.9	-28.9	174.4	-86.3	143.3	0	0	0	115.4	H595 E597 S623 L624 L626 W642 V675	H595-L621 WeakPolarHBondContact CE1-CD1 3.48Å; H595-L621 WeakPolarHBondContact ND1-CD1 3.49Å; E597-L621 HydrophobicContact CB-CD1 3.72Å; E597-L621 HydrophobicContact CB-CD2 4.41Å; E597-L621 HydrophobicContact CB-CG 4.26Å; E597-L621 HydrophobicContact CG-CD1 3.8Å; E597-L621 HydrophobicContact CG-CD2 3.91Å; E597-L621 HydrophobicContact CG-CG 3.8Å; E597-L621 WeakPolarHBondContact OE1-CG 3.23Å; L621-S623 PolarHBondContact O-N 2.94Å; L621-L624 HydrophobicContact CD2-CD2 4.2Å; L621-L624 HydrophobicContact CG-CD2 4.47Å; L621-L624 WeakPolarHBondContact O-CB 3.34Å; L621-L624 PolarHBondContact O-N 3.25Å; L621-L626 HydrophobicContact CD2-CD2 4.43Å; L621-W642 HydrophobicContact CD2-CE3 4.06Å; L621-W642 HydrophobicContact CD2-CZ3 4.1Å; L621-V675 HydrophobicContact CD1-CG1 4.13Å; L621-V675 HydrophobicContact CD1-CG2 4.29Å
622	S	53.8	Low	53.3	Low	92 Å²	92	72 Å²	72	64%	0.643	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-75.7	-7.3	177.2	85.6	0	0	0	0	113.5	N620	N620-S622 PolarHBondContact ND2-OG 2.87Å; N620-S622 VanDerWaalsContact ND2-OG 3.07Å; N620-S622 PolarHBondContact O-N 2.96Å; N620-S622 VanDerWaalsContact O-N 3.11Å; N620-S622 PolarHBondContact OD1-N 3.05Å; N620-S622 PolarHBondContact OD1-OG 2.77Å; N620-S622 VanDerWaalsContact OD1-OG 3.12Å
623	S	53.1	Low	52.4	Low	67 Å²	67	74.7 Å²	74.7	47%	0.469	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-106.6	0.9	174.4	68.6	0	0	0	0	113.4	L602 N620 L621	L602-S623 WeakPolarHBondContact CD2-O 3.28Å; N620-S623 PolarHBondContact O-N 3.22Å; N620-S623 PolarHBondContact O-OG 3.35Å; L621-S623 PolarHBondContact O-N 2.94Å
624	L	61.2	Low	51.7	Low	19 Å²	19	76 Å²	76	10%	0.099	42%	0.415	C	S	.	.			trans	-87.5	137.3	-175.9	-104.8	65.5	0	0	0	112.8	L602 N620 L621 L626 V700 G710 Q712	L602-L624 HydrophobicContact CD1-CB 4.29Å; L602-L624 HydrophobicContact CD1-CD1 3.82Å; L602-L624 HydrophobicContact CD1-CG 3.57Å; L602-L624 HydrophobicContact CD2-CD1 3.65Å; L602-L624 HydrophobicContact CD2-CG 4.25Å; L602-L624 HydrophobicContact CG-CD1 4.41Å; N620-L624 WeakPolarHBondContact O-CD1 3.42Å; L621-L624 HydrophobicContact CD2-CD2 4.2Å; L621-L624 HydrophobicContact CG-CD2 4.47Å; L621-L624 WeakPolarHBondContact O-CB 3.34Å; L621-L624 PolarHBondContact O-N 3.25Å; L624-L626 HydrophobicContact CB-CD2 4.1Å; L624-L626 HydrophobicContact CB-CG 4.48Å; L624-L626 HydrophobicContact CD2-CD2 4.13Å; L624-L626 PolarHBondContact O-N 2.89Å; L624-V700 HydrophobicContact CD2-CG1 3.18Å; L624-G710 WeakPolarHBondContact CD2-O 3.35Å; L624-Q712 HydrophobicContact CD1-CB 4.34Å
625	L	53.7	Low	50.9	Low	130 Å²	130	81.4 Å²	81.4	68%	0.681	44%	0.436	S	S	*	.			trans	-90.6	77.7	173.2	-162.4	111.4	0	0	0	110.9	T627	L625-T627 PolarHBondContact O-N 2.85Å
626	L	60.7	Low	50	Low	52 Å²	52	86.9 Å²	86.9	27%	0.272	47%	0.469	S	S	.	.			trans	-61.3	125.6	179.3	-54.8	178	0	0	0	111.5	T598 L621 L624 E628 W642 L709	T598-L626 WeakPolarHBondContact O-CD2 3.47Å; L621-L626 HydrophobicContact CD2-CD2 4.43Å; L624-L626 HydrophobicContact CB-CD2 4.1Å; L624-L626 HydrophobicContact CB-CG 4.48Å; L624-L626 HydrophobicContact CD2-CD2 4.13Å; L624-L626 PolarHBondContact O-N 2.89Å; L626-E628 VanDerWaalsContact C-N 3.3Å; L626-E628 PolarHBondContact O-N 2.86Å; L626-W642 HydrophobicContact CD1-CH2 3.56Å; L626-W642 HydrophobicContact CD1-CZ2 4.34Å; L626-W642 HydrophobicContact CD1-CZ3 3.88Å; L626-L709 WeakPolarHBondContact CA-O 3.42Å; L626-L709 HydrophobicContact CB-CB 4.16Å; L626-L709 HydrophobicContact CD2-CB 4.02Å
627	T	54.7	Low	48.8	Very low	68 Å²	68	89.9 Å²	89.9	42%	0.417	49%	0.488	S	S	.	.	S	Bend	trans	-78.5	0.3	-175.4	55	0	0	0	0	116.3	Q600 L625 L709	Q600-T627 HydrophobicContact CB-CG2 4.12Å; Q600-T627 PolarHBondContact OE1-OG1 3.36Å; L625-T627 PolarHBondContact O-N 2.85Å; T627-L709 WeakPolarHBondContact CG2-O 3.47Å; T627-L709 PolarHBondContact N-O 2.92Å; T627-L709 WeakPolarHBondContact OG1-CA 3.25Å; T627-L709 WeakPolarHBondContact OG1-CD2 3.44Å; T627-L709 PolarHBondContact OG1-O 3.16Å
628	E	53.7	Low	47.5	Very low	97 Å²	97	95.5 Å²	95.5	45%	0.453	52%	0.518	S	S	.	.			trans	-127	115	170.9	-72.1	-178.4	156.8	0	0	109.6	L626 K707 L709	L626-E628 VanDerWaalsContact C-N 3.3Å; L626-E628 PolarHBondContact O-N 2.86Å; E628-K707 IonicContact OE1-NZ 2.78Å; E628-K707 PolarHBondContact OE1-NZ 3.22Å; E628-L709 HydrophobicContact CB-CD1 4.33Å; E628-L709 HydrophobicContact CB-CD2 3.6Å; E628-L709 HydrophobicContact CG-CD2 3.53Å
629	S	43.7	Very low	46.6	Very low	109 Å²	109	100.7 Å²	100.7	76%	0.762	54%	0.54	S	S	*	.			trans	-88	135.8	166.5	51.9	0	0	0	0	109.7	Q631	S629-Q631 PolarHBondContact O-N 2.96Å
630	Y	40.9	Very low	45.9	Very low	143 Å²	143	106 Å²	106	56%	0.561	56%	0.56	S	S	*	*			trans	-68.1	103.7	-168.4	-166.8	-91	0	0	0	112.5	N632	Y630-N632 HydrophobicContact CD1-CB 3.82Å; Y630-N632 HydrophobicContact CE1-CB 3.76Å; Y630-N632 PolarHBondContact O-N 2.8Å
631	Q	34.8	Very low	45.7	Very low	168 Å²	168	106.4 Å²	106.4	79%	0.785	56%	0.561	S	S	*	*			trans	-76.9	98.9	168.5	-71.9	-163.5	-5.3	0	0	109.7	S629 T633	S629-Q631 PolarHBondContact O-N 2.96Å; Q631-T633 PolarHBondContact O-N 2.93Å
632	N	35.2	Very low	46.1	Very low	123 Å²	123	106.8 Å²	106.8	66%	0.658	56%	0.561	S	S	*	*			trans	-76.9	83	-176.1	-164.7	-6.5	0	0	0	112.4	Y630	Y630-N632 HydrophobicContact CD1-CB 3.82Å; Y630-N632 HydrophobicContact CE1-CB 3.76Å; Y630-N632 PolarHBondContact O-N 2.8Å
633	T	27.1	Very low	47	Very low	114 Å²	114	103.4 Å²	103.4	70%	0.699	54%	0.537	S	S	*	.			trans	-111.7	82.9	172.8	47.3	0	0	0	0	112.1	Q631	Q631-T633 PolarHBondContact O-N 2.93Å
634	N	31.1	Very low	48	Very low	140 Å²	140	100.2 Å²	100.2	75%	0.749	52%	0.515	S	S	*	.	S	Bend	trans	74.3	113.3	162.9	-53.4	-39.5	0	0	0	118.7
635	Q	30.9	Very low	48.7	Very low	175 Å²	175	101 Å²	101	82%	0.818	52%	0.519	S	S	*	.			trans	64.3	118.6	133.7	-70.3	-172.6	-15.4	0	0	121.4
636	V	33.6	Very low	49.7	Very low	118 Å²	118	94.8 Å²	94.8	72%	0.715	49%	0.487	S	S	*	.			trans	85.2	120.7	143.3	178.4	0	0	0	0	118.5
637	N	34.3	Very low	50.4	Low	141 Å²	141	93 Å²	93	75%	0.754	48%	0.476	S	S	*	.			trans	49.6	99.3	157.4	-61.4	-4.7	0	0	0	119.6
638	N	37.8	Very low	51.1	Low	119 Å²	119	93.9 Å²	93.9	64%	0.636	47%	0.472	S	S	*	.				-155.7	128.5	127	-99.3	-33.9	0	0	0	110.4
639	Q	46.5	Very low	51.6	Low	172 Å²	172	91.5 Å²	91.5	80%	0.804	47%	0.466	S	S	*	.	S	Bend	trans	-97.3	131.9	176.8	-69.3	179	-39.2	0	0	109.6
640	Y	50.3	Low	52.1	Low	113 Å²	113	89.5 Å²	89.5	44%	0.443	45%	0.449	S	S	.	.			trans	63.7	108.5	-173.6	-45.1	-80.7	0	0	0	113.9	N674 V675 T703	Y640-N674 VanDerWaalsContact CD1-O 3.24Å; Y640-N674 WeakPolarHBondContact CD1-O 3.43Å; Y640-N674 HydrophobicContact CG-CB 4.42Å; Y640-V675 CarbonylContact C-O 3.43Å; Y640-V675 WeakPolarHBondContact CA-O 3.37Å; Y640-T703 PolarHBondContact O-OG1 3.09Å
641	Q	62	Low	52.6	Low	54 Å²	54	88.5 Å²	88.5	25%	0.252	46%	0.458	S	S	.	.			trans	-115	-6.8	-171.9	-65.3	-173.6	-3.2	0	0	114.2	V675 N702 T703	Q641-V675 PolarHBondContact N-O 3.22Å; Q641-N702 CarbonylContact O-C 3.6Å; Q641-N702 PolarHBondContact O-OD1 3.43Å; Q641-T703 VanDerWaalsContact CA-OG1 3.28Å; Q641-T703 WeakPolarHBondContact CA-OG1 3.49Å; Q641-T703 PolarHBondContact O-N 2.9Å; Q641-T703 PolarHBondContact O-OG1 3.19Å
642	W	68.5	Low	53.7	Low	29 Å²	29	82.1 Å²	82.1	11%	0.11	43%	0.432	C	S	.	.	B	Isolated β-bridge	trans	-140.9	153.3	-162.3	-70.5	-3.7	0	0	0	108.6	N596 E597 T598 L621 L626 N674 V675 E677 Y701	N596-W642 CarbonylContact O-C 3.59Å; E597-W642 CarbonylContact O-C 3.52Å; E597-W642 WeakPolarHBondContact O-CA 3.4Å; E597-W642 WeakPolarHBondContact O-CB 3.4Å; T598-W642 VanDerWaalsContact OG1-CG 3.24Å; L621-W642 HydrophobicContact CD2-CE3 4.06Å; L621-W642 HydrophobicContact CD2-CZ3 4.1Å; L626-W642 HydrophobicContact CD1-CH2 3.56Å; L626-W642 HydrophobicContact CD1-CZ2 4.34Å; L626-W642 HydrophobicContact CD1-CZ3 3.88Å; W642-N674 CarbonylContact O-C 3.58Å; W642-N674 WeakPolarHBondContact O-CA 3.35Å; W642-N674 WeakPolarHBondContact O-CB 3.32Å; W642-V675 HydrophobicContact CB-CB 4.47Å; W642-V675 HydrophobicContact CB-CG2 3.23Å; W642-V675 HydrophobicContact CD2-CG2 4.11Å; W642-V675 HydrophobicContact CE3-CG2 3.64Å; W642-V675 HydrophobicContact CG-CG2 4.05Å; W642-V675 PolarHBondContact N-O 2.82Å; W642-V675 PolarHBondContact O-N 2.88Å; W642-E677 HydrophobicContact CH2-CB 3.63Å; W642-E677 HydrophobicContact CZ2-CB 4.27Å; W642-E677 HydrophobicContact CZ3-CB 4.02Å; W642-Y701 CarbonylContact C-O 3.6Å
643	S	73	Confident	54.7	Low	20 Å²	20	83.3 Å²	83.3	14%	0.14	44%	0.438	C	S	.	.	B	Isolated β-bridge	trans	-156.4	106.8	-172.2	56.5	0	0	0	0	117.3	N596 E597 S673 N674 V700 Y701	N596-S643 WeakPolarHBondContact O-CA 3.44Å; N596-S643 PolarHBondContact O-N 3.26Å; N596-S643 VanDerWaalsContact O-N 3.07Å; E597-S643 VanDerWaalsContact N-CA 3.35Å; E597-S643 PolarHBondContact O-N 2.74Å; S643-S673 WeakPolarHBondContact CA-O 3.27Å; S643-N674 WeakPolarHBondContact CB-OD1 3.12Å; S643-V700 CarbonylContact C-O 3.49Å; S643-Y701 PolarHBondContact N-O 3.37Å; S643-Y701 WeakPolarHBondContact O-CB 3.45Å; S643-Y701 PolarHBondContact OG-O 3.23Å
644	I	74.2	Confident	56.1	Low	0 Å²	0	85.3 Å²	85.3	0%	0	44%	0.439	C	S	.	.			trans	-59.6	138.4	179.4	-48.6	-117.8	0	0	0	110.5	N596 E597 W646 V700	N596-I644 VanDerWaalsContact C-N 3.31Å; N596-I644 VanDerWaalsContact CA-CG1 3.48Å; N596-I644 HydrophobicContact CB-CB 3.69Å; N596-I644 HydrophobicContact CB-CD1 4.12Å; N596-I644 HydrophobicContact CB-CG1 3.04Å; N596-I644 WeakPolarHBondContact ND2-CG1 3.25Å; E597-I644 HydrophobicContact CB-CB 4Å; E597-I644 HydrophobicContact CB-CD1 3.48Å; E597-I644 VanDerWaalsContact CB-CD1 3.48Å; E597-I644 HydrophobicContact CB-CG1 3.31Å; E597-I644 HydrophobicContact CG-CD1 3.82Å; E597-I644 HydrophobicContact CG-CG1 4.09Å; E597-I644 WeakPolarHBondContact OE1-CD1 3.33Å; E597-I644 WeakPolarHBondContact OE2-CD1 3.3Å; E597-I644 WeakPolarHBondContact OE2-CG1 3.39Å; I644-W646 HydrophobicContact CG2-CG 4.46Å; I644-V700 WeakPolarHBondContact CA-O 3.47Å; I644-V700 PolarHBondContact N-O 2.94Å
645	L	75.4	Confident	57.8	Low	36 Å²	36	81 Å²	81	19%	0.188	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125.9	159.6	-72.6	161	0	0	0	111	Y647 P655 I672 R699 Y701	L645-Y647 HydrophobicContact CB-CD2 4.47Å; L645-Y647 HydrophobicContact CB-CE2 3.62Å; L645-Y647 WeakPolarHBondContact O-CD2 3.21Å; L645-Y647 WeakPolarHBondContact O-CE2 3.29Å; L645-P655 HydrophobicContact CB-CB 4.27Å; L645-P655 HydrophobicContact CD2-CB 3.85Å; L645-P655 HydrophobicContact CD2-CG 4.08Å; L645-I672 HydrophobicContact CD2-CD1 3.61Å; L645-I672 HydrophobicContact CD2-CG1 3.84Å; L645-R699 CarbonylContact C-O 3.46Å; L645-R699 PolarHBondContact N-O 3.24Å; L645-R699 CarbonylContact O-C 3.59Å; L645-R699 VanDerWaalsContact O-CA 3.26Å; L645-R699 WeakPolarHBondContact O-CA 3.28Å; L645-R699 WeakPolarHBondContact O-CB 3.34Å; L645-R699 PolarHBondContact O-N 3.17Å; L645-Y701 HydrophobicContact CB-CD2 4.17Å; L645-Y701 HydrophobicContact CD1-CD2 3.7Å; L645-Y701 HydrophobicContact CD1-CE2 4.2Å; L645-Y701 HydrophobicContact CD1-CG 4.21Å; L645-Y701 HydrophobicContact CG-CD2 4.43Å
646	W	75.6	Confident	59.5	Low	0 Å²	0	74 Å²	74	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	142.5	174.5	-75.1	87.3	0	0	0	113.3	L617 C619 I644 P655 L656 I671 S683 V685 C698 F714	L617-W646 HydrophobicContact CB-CH2 3.95Å; L617-W646 HydrophobicContact CB-CZ3 4.29Å; L617-W646 WeakPolarHBondContact O-CH2 3.38Å; L617-W646 WeakPolarHBondContact O-CZ2 3.49Å; C619-W646 HydrophobicContact CB-CH2 4.05Å; C619-W646 HydrophobicContact CB-CZ2 3.62Å; I644-W646 HydrophobicContact CG2-CG 4.46Å; W646-P655 WeakPolarHBondContact O-CA 3.2Å; W646-L656 HydrophobicContact CB-CD1 4.01Å; W646-L656 PolarHBondContact O-N 2.78Å; W646-I671 HydrophobicContact CB-CG2 4.23Å; W646-S683 PolarHBondContact NE1-OG 2.81Å; W646-V685 HydrophobicContact CB-CG2 4.22Å; W646-V685 HydrophobicContact CD2-CG2 3.4Å; W646-V685 HydrophobicContact CE3-CG2 3.78Å; W646-V685 HydrophobicContact CG-CG2 3.63Å; W646-V685 HydrophobicContact CH2-CG2 4.35Å; W646-V685 HydrophobicContact CZ2-CG2 4.03Å; W646-V685 HydrophobicContact CZ3-CG2 4.24Å; W646-C698 HydrophobicContact CD2-CB 4.1Å; W646-C698 HydrophobicContact CE3-CB 3.91Å; W646-C698 HydrophobicContact CH2-CB 3.84Å; W646-C698 HydrophobicContact CZ2-CB 4Å; W646-C698 HydrophobicContact CZ3-CB 3.78Å; W646-F714 AromaticContact CH2-CD2 3.95Å; W646-F714 HydrophobicContact CH2-CD2 3.95Å; W646-F714 AromaticContact CH2-CE2 3.52Å; W646-F714 HydrophobicContact CH2-CE2 3.52Å; W646-F714 HydrophobicContact CH2-CZ 4.04Å; W646-F714 AromaticContact CZ3-CD2 3.7Å; W646-F714 HydrophobicContact CZ3-CD2 3.7Å; W646-F714 AromaticContact CZ3-CE2 3.7Å; W646-F714 HydrophobicContact CZ3-CE2 3.7Å
647	Y	76.2	Confident	60.5	Low	13 Å²	13	73 Å²	73	5%	0.051	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	157.1	-178.1	-64.9	-112	0	0	0	110.8	L645 S652 E654 P655 Y696 I697 R699 Y701	L645-Y647 HydrophobicContact CB-CD2 4.47Å; L645-Y647 HydrophobicContact CB-CE2 3.62Å; L645-Y647 WeakPolarHBondContact O-CD2 3.21Å; L645-Y647 WeakPolarHBondContact O-CE2 3.29Å; Y647-S652 WeakPolarHBondContact CD1-O 3.49Å; Y647-E654 VanDerWaalsContact CD1-O 3.3Å; Y647-E654 WeakPolarHBondContact CD1-O 3.32Å; Y647-P655 HydrophobicContact CE1-CB 4.17Å; Y647-P655 HydrophobicContact CE2-CB 4.09Å; Y647-Y696 WeakPolarHBondContact O-CA 3.43Å; Y647-I697 PolarHBondContact N-O 2.9Å; Y647-I697 PolarHBondContact O-N 3.36Å; Y647-R699 HydrophobicContact CD2-CB 3.37Å; Y647-R699 HydrophobicContact CD2-CG 3.93Å; Y647-R699 HydrophobicContact CE2-CB 3.37Å; Y647-R699 HydrophobicContact CE2-CG 4.07Å; Y647-R699 HydrophobicContact CG-CB 4.46Å; Y647-Y701 HydrophobicContact CE2-CE2 4.06Å; Y647-Y701 WeakPolarHBondContact OH-CE2 3.27Å
648	R	68.3	Low	61.2	Low	88 Å²	88	69.9 Å²	69.9	33%	0.332	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	116.9	-177	-174.5	171.2	168.2	165.5	-3	109	S652 L656 T691 D692 Y696	R648-S652 WeakPolarHBondContact O-CB 3.44Å; R648-L656 HydrophobicContact CB-CD1 4.5Å; R648-L656 HydrophobicContact CB-CD2 4.1Å; R648-L656 HydrophobicContact CB-CG 4.43Å; R648-T691 PolarHBondContact NH2-O 3.39Å; R648-D692 IonicContact CZ-OD1 3.27Å; R648-D692 IonicContact NH1-OD1 2.82Å; R648-D692 PolarHBondContact NH1-OD1 2.9Å; R648-Y696 HydrophobicContact CB-CE1 4.36Å; R648-Y696 HydrophobicContact CG-CE1 4.15Å
649	S	64.6	Low	61.6	Low	46 Å²	46	71.1 Å²	71.1	32%	0.322	36%	0.362	S	S	.	.	S	Bend	trans	69.9	147	-163.4	-170.9	0	0	0	0	115.9	T651 S652 Q695	S649-T651 PolarHBondContact O-N 2.78Å; S649-T651 PolarHBondContact OG-N 2.67Å; S649-T651 PolarHBondContact OG-OG1 3.19Å; S649-S652 PolarHBondContact O-N 3.44Å; S649-Q695 PolarHBondContact N-O 3.43Å
650	V	54.4	Low	61.6	Low	67 Å²	67	66.4 Å²	66.4	41%	0.406	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.9	172	176.4	0	0	0	0	112.5	I697	V650-I697 HydrophobicContact CB-CD1 4.43Å; V650-I697 HydrophobicContact CG2-CD1 3.94Å
651	T	50.1	Low	61.3	Low	122 Å²	122	62.6 Å²	62.6	75%	0.748	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-5.3	179.8	51	0	0	0	0	114.7	S649	S649-T651 PolarHBondContact O-N 2.78Å; S649-T651 PolarHBondContact OG-N 2.67Å; S649-T651 PolarHBondContact OG-OG1 3.19Å
652	S	58	Low	60.2	Low	34 Å²	34	64.7 Å²	64.7	24%	0.238	35%	0.35	C	S	.	.			trans	-83.3	120.7	175.6	-169.4	0	0	0	0	111.2	Y647 R648 S649 E654	Y647-S652 WeakPolarHBondContact CD1-O 3.49Å; R648-S652 WeakPolarHBondContact O-CB 3.44Å; S649-S652 PolarHBondContact O-N 3.44Å; S652-E654 PolarHBondContact OG-N 3.25Å; S652-E654 PolarHBondContact OG-O 3.39Å
653	N	56.4	Low	59	Low	149 Å²	149	72 Å²	72	80%	0.797	38%	0.383	S	S	*	.			trans	-88.1	-8.8	166.9	-71.2	-17.4	0	0	0	112.4
654	E	56.7	Low	57.3	Low	155 Å²	155	74 Å²	74	72%	0.724	40%	0.4	S	S	*	.	S	Bend	trans	-100.5	133.7	178.2	-65.5	-174	176.5	0	0	110.8	Y647 S652	Y647-E654 VanDerWaalsContact CD1-O 3.3Å; Y647-E654 WeakPolarHBondContact CD1-O 3.32Å; S652-E654 PolarHBondContact OG-N 3.25Å; S652-E654 PolarHBondContact OG-O 3.39Å
655	P	66.1	Low	55.3	Low	51 Å²	51	79 Å²	79	33%	0.331	44%	0.435	S	S	.	.			trans	-74.7	158.7	173.1	32.5	-35.1	0	0	0	111.2	L645 W646 Y647 N657	L645-P655 HydrophobicContact CB-CB 4.27Å; L645-P655 HydrophobicContact CD2-CB 3.85Å; L645-P655 HydrophobicContact CD2-CG 4.08Å; W646-P655 WeakPolarHBondContact O-CA 3.2Å; Y647-P655 HydrophobicContact CE1-CB 4.17Å; Y647-P655 HydrophobicContact CE2-CB 4.09Å; P655-N657 PolarHBondContact O-N 2.62Å
656	L	67.4	Low	53.4	Low	28 Å²	28	78.9 Å²	78.9	15%	0.147	44%	0.442	C	S	.	.			trans	-63	104.7	-179.1	-76	162	0	0	0	111.8	W646 R648 I658 I671 Y696	W646-L656 HydrophobicContact CB-CD1 4.01Å; W646-L656 PolarHBondContact O-N 2.78Å; R648-L656 HydrophobicContact CB-CD1 4.5Å; R648-L656 HydrophobicContact CB-CD2 4.1Å; R648-L656 HydrophobicContact CB-CG 4.43Å; L656-I658 PolarHBondContact O-N 2.69Å; L656-I671 HydrophobicContact CB-CD1 3.99Å; L656-I671 HydrophobicContact CB-CG2 4.36Å; L656-I671 WeakPolarHBondContact O-CD1 3.47Å; L656-Y696 HydrophobicContact CD1-CD1 4.33Å; L656-Y696 HydrophobicContact CD1-CE1 4.14Å
657	N	55.8	Low	51.5	Low	95 Å²	95	81 Å²	81	51%	0.508	46%	0.464	S	S	.	.			trans	-70.7	125.9	-175	-172.3	-20	0	0	0	112.6	P655 E659 S660	P655-N657 PolarHBondContact O-N 2.62Å; N657-E659 VanDerWaalsContact C-N 3.32Å; N657-E659 PolarHBondContact O-N 2.91Å; N657-E659 PolarHBondContact OD1-N 2.83Å; N657-S660 PolarHBondContact O-OG 2.8Å
658	I	48.9	Very low	49.9	Very low	77 Å²	77	81.4 Å²	81.4	40%	0.395	47%	0.467	S	S	.	.	H	α-helix	trans	-65.6	-30	-177.5	-62	169.1	0	0	0	112.2	L656 N662 I671 I672	L656-I658 PolarHBondContact O-N 2.69Å; I658-N662 PolarHBondContact O-ND2 3.5Å; I658-I671 HydrophobicContact CG1-CB 4.29Å; I658-I671 HydrophobicContact CG1-CD1 4.23Å; I658-I672 HydrophobicContact CD1-CD1 4.25Å; I658-I672 HydrophobicContact CD1-CG1 4.39Å
659	E	46.1	Very low	48.6	Very low	144 Å²	144	85.4 Å²	85.4	67%	0.673	49%	0.487	S	S	*	.	H	α-helix	trans	-82.6	-22.3	-172.5	-62.8	-161.4	147	0	0	115.1	N657	N657-E659 VanDerWaalsContact C-N 3.32Å; N657-E659 PolarHBondContact O-N 2.91Å; N657-E659 PolarHBondContact OD1-N 2.83Å
660	S	45.1	Very low	47.7	Very low	73 Å²	73	91 Å²	91	51%	0.51	50%	0.502	S	S	.	.	H	α-helix	trans	-87.8	-45.4	178	56.6	0	0	0	0	111.5	N657 N662 K663	N657-S660 PolarHBondContact O-OG 2.8Å; S660-N662 PolarHBondContact O-N 3.49Å; S660-K663 PolarHBondContact O-N 3.29Å
661	V	44.6	Very low	47.6	Very low	34 Å²	34	88 Å²	88	21%	0.206	48%	0.484	C	S	.	.	H	α-helix	trans	-64	-39.1	-177.5	180	0	0	0	0	111.8	K663 A664 I668	V661-K663 PolarHBondContact O-N 3Å; V661-A664 PolarHBondContact O-N 2.9Å; V661-I668 HydrophobicContact CG1-CB 4.29Å; V661-I668 HydrophobicContact CG1-CD1 3.95Å; V661-I668 HydrophobicContact CG1-CG1 3.97Å
662	N	39.2	Very low	47.6	Very low	98 Å²	98	86 Å²	86	52%	0.524	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-7.5	179.2	-80.4	-62.9	0	0	0	114.7	I658 S660	I658-N662 PolarHBondContact O-ND2 3.5Å; S660-N662 PolarHBondContact O-N 3.49Å
663	K	42.2	Very low	47.7	Very low	183 Å²	183	86.2 Å²	86.2	80%	0.796	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-11.2	173.4	-68.7	169.9	-177.2	157.8	0	113.3	S660 V661	S660-K663 PolarHBondContact O-N 3.29Å; V661-K663 PolarHBondContact O-N 3Å
664	A	38.6	Very low	47.8	Very low	61 Å²	61	82.8 Å²	82.8	50%	0.504	45%	0.451	S	S	.	.	S	Bend	trans	-104.3	130.3	174	0	0	0	0	0	110	V661 G666	V661-A664 PolarHBondContact O-N 2.9Å; A664-G666 PolarHBondContact O-N 2.91Å
665	S	31.9	Very low	48.1	Very low	106 Å²	106	75.5 Å²	75.5	74%	0.741	42%	0.416	S	S	*	.	S	Bend	trans	-59.6	96.7	-171.9	44.1	0	0	0	0	113.7	K689	S665-K689 WeakPolarHBondContact O-CE 3.09Å; S665-K689 PolarHBondContact O-NZ 2.83Å
666	G	35.6	Very low	47.6	Very low	32 Å²	32	75.8 Å²	75.8	33%	0.33	42%	0.415	S	S	.	.	S	Bend	trans	153	53.8	179.9	0	0	0	0	0	113.7	A664 I668	A664-G666 PolarHBondContact O-N 2.91Å; G666-I668 PolarHBondContact O-N 3.27Å
667	G	35.8	Very low	46.7	Very low	45 Å²	45	78.5 Å²	78.5	46%	0.464	43%	0.427	S	S	.	.			trans	-63	117.5	-164.6	0	0	0	0	0	116.4
668	I	41.4	Very low	46.3	Very low	21 Å²	21	83 Å²	83	11%	0.108	44%	0.439	C	S	.	.			trans	-70.3	124.4	163.4	-56	172.4	0	0	0	108.1	V661 G666 I671 V685	V661-I668 HydrophobicContact CG1-CB 4.29Å; V661-I668 HydrophobicContact CG1-CD1 3.95Å; V661-I668 HydrophobicContact CG1-CG1 3.97Å; G666-I668 PolarHBondContact O-N 3.27Å; I668-I671 HydrophobicContact CB-CD1 4.39Å; I668-I671 HydrophobicContact CG2-CD1 3.89Å; I668-I671 HydrophobicContact CG2-CG1 3.79Å; I668-V685 HydrophobicContact CD1-CG1 4.02Å; I668-V685 HydrophobicContact CG1-CG1 4.45Å; I668-V685 HydrophobicContact CG2-CG1 4.2Å
669	K	42.3	Very low	46.3	Very low	173 Å²	173	82 Å²	82	75%	0.752	44%	0.436	S	S	*	.			trans	-92	-30.6	-164.2	-108.1	-175.7	176.6	-177	0	116.8
670	Y	45.1	Very low	46.3	Very low	163 Å²	163	81.4 Å²	81.4	64%	0.639	43%	0.433	S	S	*	.			trans	-144.2	127	179.7	-56.7	-72.1	0	0	0	110
671	I	52	Low	46.3	Very low	5 Å²	5	80.6 Å²	80.6	3%	0.026	42%	0.422	C	S	.	.			trans	-125.8	-26	-178.6	-58.3	-179	0	0	0	111.7	W646 L656 I658 I668	W646-I671 HydrophobicContact CB-CG2 4.23Å; L656-I671 HydrophobicContact CB-CD1 3.99Å; L656-I671 HydrophobicContact CB-CG2 4.36Å; L656-I671 WeakPolarHBondContact O-CD1 3.47Å; I658-I671 HydrophobicContact CG1-CB 4.29Å; I658-I671 HydrophobicContact CG1-CD1 4.23Å; I668-I671 HydrophobicContact CB-CD1 4.39Å; I668-I671 HydrophobicContact CG2-CD1 3.89Å; I668-I671 HydrophobicContact CG2-CG1 3.79Å
672	I	51.2	Low	46.6	Very low	80 Å²	80	82.8 Å²	82.8	41%	0.41	43%	0.433	S	S	.	.			trans	-142	143.1	-175.1	-47.4	176.7	0	0	0	110.4	N596 L645 I658	N596-I672 VanDerWaalsContact ND2-C 3.28Å; L645-I672 HydrophobicContact CD2-CD1 3.61Å; L645-I672 HydrophobicContact CD2-CG1 3.84Å; I658-I672 HydrophobicContact CD1-CD1 4.25Å; I658-I672 HydrophobicContact CD1-CG1 4.39Å
673	S	59.5	Low	47.3	Very low	37 Å²	37	78.3 Å²	78.3	26%	0.259	41%	0.409	S	S	.	.			trans	-167.5	-162.2	157	41.3	0	0	0	0	108.1	H595 N596 S643	H595-S673 CarbonylContact O-C 3.57Å; H595-S673 WeakPolarHBondContact O-CB 3.36Å; H595-S673 PolarHBondContact O-OG 3.09Å; N596-S673 VanDerWaalsContact CB-C 3.42Å; N596-S673 WeakPolarHBondContact CB-O 3.36Å; N596-S673 PolarHBondContact ND2-N 3.18Å; N596-S673 PolarHBondContact ND2-OG 2.84Å; N596-S673 PolarHBondContact OD1-OG 2.75Å; N596-S673 VanDerWaalsContact OD1-OG 3.09Å; S643-S673 WeakPolarHBondContact CA-O 3.27Å
674	N	59	Low	48	Very low	78 Å²	78	72.8 Å²	72.8	42%	0.417	39%	0.388	S	S	.	.			trans	-133.1	131.8	-174	-56.5	-27.5	0	0	0	114	H595 N596 Y640 W642 S643	H595-N674 CarbonylContact C-O 3.56Å; H595-N674 CarbonylContact O-C 3.33Å; H595-N674 PolarHBondContact O-N 1.76Å; N596-N674 CarbonylContact O-C 3.58Å; N596-N674 WeakPolarHBondContact O-CA 3.4Å; Y640-N674 VanDerWaalsContact CD1-O 3.24Å; Y640-N674 WeakPolarHBondContact CD1-O 3.43Å; Y640-N674 HydrophobicContact CG-CB 4.42Å; W642-N674 CarbonylContact O-C 3.58Å; W642-N674 WeakPolarHBondContact O-CA 3.35Å; W642-N674 WeakPolarHBondContact O-CB 3.32Å; S643-N674 WeakPolarHBondContact CB-OD1 3.12Å
675	V	61.9	Low	49.1	Very low	1 Å²	1	69.9 Å²	69.9	1%	0.006	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-106.9	164	-177.8	-88.5	0	0	0	0	114.1	H595 N596 E597 L621 Y640 Q641 W642 T679	H595-V675 HydrophobicContact CB-CG1 3.72Å; H595-V675 WeakPolarHBondContact CD2-CG1 3.3Å; H595-V675 WeakPolarHBondContact NE2-CG1 3.45Å; N596-V675 VanDerWaalsContact N-N 3.14Å; N596-V675 WeakPolarHBondContact O-CG2 3.24Å; N596-V675 PolarHBondContact O-N 3.25Å; E597-V675 VanDerWaalsContact N-CG2 3.26Å; L621-V675 HydrophobicContact CD1-CG1 4.13Å; L621-V675 HydrophobicContact CD1-CG2 4.29Å; Y640-V675 CarbonylContact C-O 3.43Å; Y640-V675 WeakPolarHBondContact CA-O 3.37Å; Q641-V675 PolarHBondContact N-O 3.22Å; W642-V675 HydrophobicContact CB-CB 4.47Å; W642-V675 HydrophobicContact CB-CG2 3.23Å; W642-V675 HydrophobicContact CD2-CG2 4.11Å; W642-V675 HydrophobicContact CE3-CG2 3.64Å; W642-V675 HydrophobicContact CG-CG2 4.05Å; W642-V675 PolarHBondContact N-O 2.82Å; W642-V675 PolarHBondContact O-N 2.88Å; V675-T679 WeakPolarHBondContact CG1-OG1 3.42Å
676	N	55.9	Low	50.4	Low	58 Å²	58	66 Å²	66	31%	0.31	33%	0.334	S	S	.	.			trans	-108.9	166.7	142.9	65.3	66.3	0	0	0	112.4	Y678 T679	N676-Y678 PolarHBondContact O-N 2.81Å; N676-Y678 WeakPolarHBondContact OD1-CB 3.25Å; N676-Y678 PolarHBondContact OD1-N 2.87Å; N676-T679 PolarHBondContact O-N 3.01Å; N676-T679 PolarHBondContact O-OG1 3.36Å
677	E	49.6	Very low	51.7	Low	85 Å²	85	64.6 Å²	64.6	40%	0.397	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-17.1	-177.9	70	-165.9	136.3	0	0	116.8	W642	W642-E677 HydrophobicContact CH2-CB 3.63Å; W642-E677 HydrophobicContact CZ2-CB 4.27Å; W642-E677 HydrophobicContact CZ3-CB 4.02Å
678	Y	46.9	Very low	52.6	Low	190 Å²	190	68 Å²	68	75%	0.745	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-1.8	-172.7	-61.7	-66.9	0	0	0	114.9	N676	N676-Y678 PolarHBondContact O-N 2.81Å; N676-Y678 WeakPolarHBondContact OD1-CB 3.25Å; N676-Y678 PolarHBondContact OD1-N 2.87Å
679	T	48.4	Very low	53.4	Low	54 Å²	54	70.6 Å²	70.6	33%	0.331	33%	0.329	S	S	.	.			trans	-94.7	145.5	-172.7	49.4	0	0	0	0	112.2	H595 V675 N676	H595-T679 PolarHBondContact CD2-OG1 2.94Å; H595-T679 PolarHBondContact NE2-O 2.92Å; H595-T679 PolarHBondContact NE2-OG1 2.64Å; V675-T679 WeakPolarHBondContact CG1-OG1 3.42Å; N676-T679 PolarHBondContact O-N 3.01Å; N676-T679 PolarHBondContact O-OG1 3.36Å
680	Q	45.7	Very low	54.2	Low	132 Å²	132	65.3 Å²	65.3	62%	0.617	31%	0.308	S	S	*	.			trans	-122.1	86.9	-178.9	-67.6	-176.1	-2.5	0	0	111.6
681	I	46.6	Very low	55.1	Low	56 Å²	56	62.5 Å²	62.5	29%	0.287	31%	0.308	S	S	.	.			trans	-135.2	165.2	174.2	-50.4	169.2	0	0	0	107.6	H595	H595-I681 HydrophobicContact CB-CB 3.77Å; H595-I681 HydrophobicContact CB-CD1 4.26Å; H595-I681 HydrophobicContact CB-CG1 4.45Å; H595-I681 HydrophobicContact CB-CG2 4.3Å; H595-I681 PolarHBondContact CD2-N 2.88Å; H595-I681 PolarHBondContact CE1-N 2.87Å; H595-I681 VanDerWaalsContact CE1-N 3.27Å; H595-I681 PolarHBondContact CE1-O 2.87Å; H595-I681 VanDerWaalsContact CG-CB 3.49Å; H595-I681 PolarHBondContact ND1-O 3.49Å; H595-I681 PolarHBondContact NE2-N 3.41Å
682	L	50.5	Low	55.6	Low	81 Å²	81	63.9 Å²	63.9	42%	0.424	32%	0.315	S	S	.	.			trans	-117	132.7	177.2	-50.6	91.6	0	0	0	108	N618 C619 N620 I684	N618-L682 HydrophobicContact CB-CB 4.4Å; N618-L682 HydrophobicContact CB-CD2 3.83Å; C619-L682 VanDerWaalsContact O-CA 3.26Å; C619-L682 WeakPolarHBondContact O-CA 3.4Å; N620-L682 HydrophobicContact CB-CD2 4.25Å; L682-I684 HydrophobicContact CB-CG1 4.4Å; L682-I684 WeakPolarHBondContact O-CG1 3.43Å
683	S	54.1	Low	56.3	Low	4 Å²	4	62.8 Å²	62.8	3%	0.028	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	141.9	164.6	-179.4	0	0	0	0	109.4	N618 C619 W646	N618-S683 WeakPolarHBondContact CA-O 3.48Å; C619-S683 PolarHBondContact N-O 3.03Å; C619-S683 PolarHBondContact O-N 3.33Å; W646-S683 PolarHBondContact NE1-OG 2.81Å
684	I	55.8	Low	56.8	Low	67 Å²	67	62.2 Å²	62.2	34%	0.344	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	115.2	-160.1	-48.3	-172.6	0	0	0	110.3	H616 L617 N618 L682	H616-I684 HydrophobicContact CB-CG2 4.33Å; H616-I684 VanDerWaalsContact ND1-CG2 3.34Å; H616-I684 WeakPolarHBondContact ND1-CG2 3.35Å; L617-I684 WeakPolarHBondContact O-CA 3.37Å; N618-I684 WeakPolarHBondContact OD1-CD1 3.26Å; N618-I684 VanDerWaalsContact OD1-CG1 3.29Å; N618-I684 WeakPolarHBondContact OD1-CG1 3.41Å; N618-I684 WeakPolarHBondContact OD1-CG2 3.33Å; L682-I684 HydrophobicContact CB-CG1 4.4Å; L682-I684 WeakPolarHBondContact O-CG1 3.43Å
685	V	62.1	Low	57.4	Low	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	136.1	168.1	-172.1	0	0	0	0	109.2	L617 W646 I668 P687 Y696	L617-V685 HydrophobicContact CB-CB 4.36Å; L617-V685 PolarHBondContact N-O 2.81Å; L617-V685 PolarHBondContact O-N 2.91Å; L617-V685 VanDerWaalsContact O-N 3.14Å; W646-V685 HydrophobicContact CB-CG2 4.22Å; W646-V685 HydrophobicContact CD2-CG2 3.4Å; W646-V685 HydrophobicContact CE3-CG2 3.78Å; W646-V685 HydrophobicContact CG-CG2 3.63Å; W646-V685 HydrophobicContact CH2-CG2 4.35Å; W646-V685 HydrophobicContact CZ2-CG2 4.03Å; W646-V685 HydrophobicContact CZ3-CG2 4.24Å; I668-V685 HydrophobicContact CD1-CG1 4.02Å; I668-V685 HydrophobicContact CG1-CG1 4.45Å; I668-V685 HydrophobicContact CG2-CG1 4.2Å; V685-P687 VanDerWaalsContact C-CD 3.47Å; V685-P687 WeakPolarHBondContact O-CD 3.45Å; V685-Y696 HydrophobicContact CG1-CE1 4.24Å
686	N	60.2	Low	58.2	Low	23 Å²	23	62.3 Å²	62.3	12%	0.123	31%	0.308	C	S	.	.			trans	-121.3	76.2	-178.2	-169.2	-49	0	0	0	109.9	T614 G615 H616 R688	T614-N686 WeakPolarHBondContact CG2-OD1 3.14Å; G615-N686 WeakPolarHBondContact O-CA 3.36Å; H616-N686 PolarHBondContact CE1-ND2 3.11Å; H616-N686 PolarHBondContact NE2-ND2 3.01Å; N686-R688 VanDerWaalsContact OD1-CG 3.3Å; N686-R688 WeakPolarHBondContact OD1-CG 3.34Å; N686-R688 PolarHBondContact OD1-NE 2.92Å
687	P	62.6	Low	59.1	Low	3 Å²	3	59.6 Å²	59.6	2%	0.019	29%	0.294	C	S	.	.			trans	-64.3	148.4	170	30.1	-35	0	0	0	110.2	L617 V685 D692 L716 I718	L617-P687 HydrophobicContact CD1-CG 4.42Å; V685-P687 VanDerWaalsContact C-CD 3.47Å; V685-P687 WeakPolarHBondContact O-CD 3.45Å; P687-D692 HydrophobicContact CB-CB 3.6Å; P687-L716 HydrophobicContact CB-CD2 3.61Å; P687-L716 HydrophobicContact CG-CD1 4.22Å; P687-L716 HydrophobicContact CG-CD2 3.34Å; P687-L716 HydrophobicContact CG-CG 4.41Å; P687-I718 HydrophobicContact CB-CD1 4.36Å
688	R	54.4	Low	60.7	Low	117 Å²	117	55.6 Å²	55.6	44%	0.442	28%	0.275	S	S	.	.			trans	-140.8	-12.2	-169.6	-73.8	-172.5	175.2	-149.9	-3.5	116.8	G612 N686 D692	G612-R688 PolarHBondContact N-O 2.89Å; N686-R688 VanDerWaalsContact OD1-CG 3.3Å; N686-R688 WeakPolarHBondContact OD1-CG 3.34Å; N686-R688 PolarHBondContact OD1-NE 2.92Å; R688-D692 PolarHBondContact N-OD2 3.26Å; R688-D692 VanDerWaalsContact N-OD2 3.15Å
689	K	57.6	Low	62.3	Low	76 Å²	76	48.5 Å²	48.5	33%	0.33	25%	0.247	S	C	.	.	S	Bend	trans	-125.7	154.4	-175.6	-63.9	172.8	-171.3	167.6	0	109.7	E611 S665 T691 D692 I718	E611-K689 WeakPolarHBondContact OE1-CA 3.33Å; S665-K689 WeakPolarHBondContact O-CE 3.09Å; S665-K689 PolarHBondContact O-NZ 2.83Å; K689-T691 WeakPolarHBondContact CB-OG1 3.21Å; K689-T691 PolarHBondContact O-N 2.83Å; K689-D692 PolarHBondContact N-OD2 2.78Å; K689-D692 WeakPolarHBondContact O-CA 3.04Å; K689-D692 VanDerWaalsContact O-CB 3.31Å; K689-D692 WeakPolarHBondContact O-CB 3.23Å; K689-D692 PolarHBondContact O-N 3.19Å; K689-I718 WeakPolarHBondContact O-CD1 3.31Å
690	I	59.7	Low	63.8	Low	61 Å²	61	46 Å²	46	31%	0.313	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-52.2	-33.2	172.3	-59.9	147.9	0	0	0	110.7	E611 D692 D693 I718 S720	E611-I690 HydrophobicContact CB-CG1 4.15Å; E611-I690 VanDerWaalsContact CD-CD1 3.48Å; E611-I690 HydrophobicContact CG-CG1 4.23Å; E611-I690 WeakPolarHBondContact OE1-CG1 3.17Å; E611-I690 PolarHBondContact OE1-N 2.61Å; E611-I690 VanDerWaalsContact OE2-CD1 3.24Å; E611-I690 WeakPolarHBondContact OE2-CD1 3.19Å; I690-D692 PolarHBondContact O-N 3.4Å; I690-D693 WeakPolarHBondContact O-CB 3.33Å; I690-D693 PolarHBondContact O-N 2.76Å; I690-D693 VanDerWaalsContact O-N 3.14Å; I690-I718 HydrophobicContact CG1-CG2 4.27Å; I690-S720 VanDerWaalsContact CD1-CB 3.42Å; I690-S720 VanDerWaalsContact CD1-OG 3.29Å; I690-S720 WeakPolarHBondContact CD1-OG 3.09Å
691	T	62.7	Low	65.3	Low	104 Å²	104	42.4 Å²	42.4	64%	0.638	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-60.6	-14.8	175.2	58.2	0	0	0	0	114.1	R648 K689	R648-T691 PolarHBondContact NH2-O 3.39Å; K689-T691 WeakPolarHBondContact CB-OG1 3.21Å; K689-T691 PolarHBondContact O-N 2.83Å
692	D	63.5	Low	66.8	Low	34 Å²	34	40.4 Å²	40.4	18%	0.182	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-90.9	0.8	178.6	-64.3	-39.6	0	0	0	114	R648 P687 R688 K689 I690 Y696 I718	R648-D692 IonicContact CZ-OD1 3.27Å; R648-D692 IonicContact NH1-OD1 2.82Å; R648-D692 PolarHBondContact NH1-OD1 2.9Å; P687-D692 HydrophobicContact CB-CB 3.6Å; R688-D692 PolarHBondContact N-OD2 3.26Å; R688-D692 VanDerWaalsContact N-OD2 3.15Å; K689-D692 PolarHBondContact N-OD2 2.78Å; K689-D692 WeakPolarHBondContact O-CA 3.04Å; K689-D692 VanDerWaalsContact O-CB 3.31Å; K689-D692 WeakPolarHBondContact O-CB 3.23Å; K689-D692 PolarHBondContact O-N 3.19Å; I690-D692 PolarHBondContact O-N 3.4Å; D692-Y696 WeakPolarHBondContact O-CE2 3.39Å; D692-Y696 PolarHBondContact O-OH 2.89Å; D692-I718 HydrophobicContact CB-CD1 4.28Å
693	D	66.4	Low	67.6	Low	58 Å²	58	39.5 Å²	39.5	31%	0.31	20%	0.2	S	C	.	.			trans	-62	149.9	178.7	-95.1	10.5	0	0	0	114.5	I690 I717 I718	I690-D693 WeakPolarHBondContact O-CB 3.33Å; I690-D693 PolarHBondContact O-N 2.76Å; I690-D693 VanDerWaalsContact O-N 3.14Å; D693-I717 WeakPolarHBondContact OD1-CA 3.37Å; D693-I718 VanDerWaalsContact CG-N 3.28Å; D693-I718 WeakPolarHBondContact OD1-CA 3.31Å; D693-I718 WeakPolarHBondContact OD1-CB 3.23Å; D693-I718 VanDerWaalsContact OD1-CG1 3.27Å; D693-I718 WeakPolarHBondContact OD1-CG1 3.49Å; D693-I718 PolarHBondContact OD1-N 2.91Å; D693-I718 PolarHBondContact OD2-N 2.99Å; D693-I718 VanDerWaalsContact OD2-N 3.09Å
694	G	70.4	Confident	68.2	Low	24 Å²	24	43.2 Å²	43.2	25%	0.247	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.3	-159.4	174.7	0	0	0	0	0	114	Q715 L716	G694-Q715 PolarHBondContact O-NE2 2.84Å; G694-L716 PolarHBondContact O-N 2.92Å
695	Q	71.2	Confident	68.9	Low	80 Å²	80	44.3 Å²	44.3	37%	0.374	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	135.6	178.8	-70.9	176.9	-1.5	0	0	110.5	S649 F714	S649-Q695 PolarHBondContact N-O 3.43Å; Q695-F714 WeakPolarHBondContact CA-O 3.38Å
696	Y	77.8	Confident	69.3	Low	2 Å²	2	46.7 Å²	46.7	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	140.1	171.6	-74.9	-95.9	0	0	0	109.1	L617 Y647 R648 L656 V685 D692 F714 L716	L617-Y696 HydrophobicContact CD1-CD1 4.27Å; L617-Y696 HydrophobicContact CD1-CD2 3.69Å; L617-Y696 HydrophobicContact CD1-CE2 4.33Å; L617-Y696 HydrophobicContact CD1-CG 3.66Å; Y647-Y696 WeakPolarHBondContact O-CA 3.43Å; R648-Y696 HydrophobicContact CB-CE1 4.36Å; R648-Y696 HydrophobicContact CG-CE1 4.15Å; L656-Y696 HydrophobicContact CD1-CD1 4.33Å; L656-Y696 HydrophobicContact CD1-CE1 4.14Å; V685-Y696 HydrophobicContact CG1-CE1 4.24Å; D692-Y696 WeakPolarHBondContact O-CE2 3.39Å; D692-Y696 PolarHBondContact O-OH 2.89Å; Y696-F714 PolarHBondContact N-O 3.49Å; Y696-F714 PolarHBondContact O-N 2.84Å; Y696-L716 HydrophobicContact CD2-CB 4.4Å; Y696-L716 HydrophobicContact CE2-CB 4.46Å; Y696-L716 HydrophobicContact CE2-CD2 4.13Å
697	I	76.1	Confident	69.8	Low	1 Å²	1	50 Å²	50	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	113.2	175.1	-49.7	-178.7	0	0	0	106.8	Y647 V650 R699 R713	Y647-I697 PolarHBondContact N-O 2.9Å; Y647-I697 PolarHBondContact O-N 3.36Å; V650-I697 HydrophobicContact CB-CD1 4.43Å; V650-I697 HydrophobicContact CG2-CD1 3.94Å; I697-R699 HydrophobicContact CB-CG 4.45Å; I697-R699 HydrophobicContact CG2-CB 4.43Å; I697-R699 HydrophobicContact CG2-CG 3.6Å; I697-R699 PolarHBondContact O-N 2.9Å; I697-R713 HydrophobicContact CG1-CG 4.32Å; I697-R713 HydrophobicContact CG2-CG 4.33Å
698	C	81.8	Confident	70.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	119.6	159.8	174.7	0	0	0	0	105.8	E597 C619 W646 V700 Q712 F714	E597-C698 PolarHBondContact OE2-SG 3.37Å; C619-C698 HydrophobicContact CB-CB 3.71Å; C619-C698 WeakPolarHBondContact CB-SG 3.43Å; C619-C698 WeakPolarHBondContact SG-CB 3.5Å; C619-C698 CovalentContact SG-SG 2.02Å; C619-C698 PolarHBondContact SG-SG 3.45Å; W646-C698 HydrophobicContact CD2-CB 4.1Å; W646-C698 HydrophobicContact CE3-CB 3.91Å; W646-C698 HydrophobicContact CH2-CB 3.84Å; W646-C698 HydrophobicContact CZ2-CB 4Å; W646-C698 HydrophobicContact CZ3-CB 3.78Å; C698-V700 HydrophobicContact CB-CG2 4.18Å; C698-V700 VanDerWaalsContact O-CG2 3.27Å; C698-V700 WeakPolarHBondContact O-CG2 3.31Å; C698-V700 WeakPolarHBondContact SG-CG2 3.18Å; C698-Q712 HydrophobicContact CB-CB 4.17Å; C698-Q712 WeakPolarHBondContact CB-O 3.47Å; C698-Q712 PolarHBondContact N-O 2.85Å; C698-Q712 PolarHBondContact O-N 3.36Å; C698-F714 HydrophobicContact CB-CE2 3.9Å
699	R	80.4	Confident	71.4	Confident	42 Å²	42	47.5 Å²	47.5	16%	0.158	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124.8	-171.6	-107.3	-120.8	172.4	89	24.3	113.6	D599 L645 Y647 I697 Y701 E711	D599-R699 WeakPolarHBondContact OD1-CA 3.24Å; D599-R699 WeakPolarHBondContact OD2-CD 3.08Å; D599-R699 IonicContact OD2-NE 2.99Å; D599-R699 PolarHBondContact OD2-NE 3Å; L645-R699 CarbonylContact C-O 3.46Å; L645-R699 PolarHBondContact N-O 3.24Å; L645-R699 CarbonylContact O-C 3.59Å; L645-R699 VanDerWaalsContact O-CA 3.26Å; L645-R699 WeakPolarHBondContact O-CA 3.28Å; L645-R699 WeakPolarHBondContact O-CB 3.34Å; L645-R699 PolarHBondContact O-N 3.17Å; Y647-R699 HydrophobicContact CD2-CB 3.37Å; Y647-R699 HydrophobicContact CD2-CG 3.93Å; Y647-R699 HydrophobicContact CE2-CB 3.37Å; Y647-R699 HydrophobicContact CE2-CG 4.07Å; Y647-R699 HydrophobicContact CG-CB 4.46Å; I697-R699 HydrophobicContact CB-CG 4.45Å; I697-R699 HydrophobicContact CG2-CB 4.43Å; I697-R699 HydrophobicContact CG2-CG 3.6Å; I697-R699 PolarHBondContact O-N 2.9Å; R699-Y701 HydrophobicContact CB-CD2 4.44Å; R699-Y701 HydrophobicContact CB-CE2 4.05Å; R699-E711 IonicContact CZ-OE2 3.89Å; R699-E711 IonicContact NE-OE2 3.75Å; R699-E711 IonicContact NH2-OE2 2.94Å; R699-E711 PolarHBondContact NH2-OE2 2.88Å
700	V	80.9	Confident	72.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.249	C	C	.	.			trans	-72	-63.1	-130.7	161.3	0	0	0	0	111.2	E597 T598 D599 L624 S643 I644 C698 G710	E597-V700 VanDerWaalsContact C-C 3.42Å; E597-V700 CarbonylContact C-O 3.54Å; E597-V700 WeakPolarHBondContact CA-O 3.36Å; E597-V700 HydrophobicContact CB-CG1 4.22Å; E597-V700 WeakPolarHBondContact CB-O 3.31Å; E597-V700 HydrophobicContact CG-CB 3.44Å; E597-V700 VanDerWaalsContact CG-CB 3.44Å; E597-V700 HydrophobicContact CG-CG1 2.88Å; E597-V700 HydrophobicContact CG-CG2 3.77Å; E597-V700 CarbonylContact O-C 3.58Å; E597-V700 WeakPolarHBondContact OE2-CG2 3.39Å; T598-V700 VanDerWaalsContact C-CB 3.49Å; T598-V700 VanDerWaalsContact CA-CA 3.46Å; T598-V700 VanDerWaalsContact CA-CG1 3.49Å; T598-V700 VanDerWaalsContact N-CG1 3.29Å; T598-V700 PolarHBondContact N-O 2.84Å; T598-V700 VanDerWaalsContact O-CG1 3.23Å; T598-V700 WeakPolarHBondContact O-CG1 3.41Å; D599-V700 HydrophobicContact CB-CB 4.06Å; D599-V700 VanDerWaalsContact N-CA 3.31Å; D599-V700 VanDerWaalsContact N-CB 3.26Å; D599-V700 WeakPolarHBondContact OD1-CA 3.35Å; D599-V700 WeakPolarHBondContact OD1-CB 3.49Å; D599-V700 PolarHBondContact OD1-N 3.44Å; L624-V700 HydrophobicContact CD2-CG1 3.18Å; S643-V700 CarbonylContact C-O 3.49Å; I644-V700 WeakPolarHBondContact CA-O 3.47Å; I644-V700 PolarHBondContact N-O 2.94Å; C698-V700 HydrophobicContact CB-CG2 4.18Å; C698-V700 VanDerWaalsContact O-CG2 3.27Å; C698-V700 WeakPolarHBondContact O-CG2 3.31Å; C698-V700 WeakPolarHBondContact SG-CG2 3.18Å; V700-G710 WeakPolarHBondContact CG1-O 3.4Å
701	Y	77.3	Confident	73.1	Confident	58 Å²	58	41.9 Å²	41.9	23%	0.227	24%	0.239	C	C	.	.			trans	49.3	121.1	-173.9	-68.6	-79.9	0	0	0	126.5	E597 T598 W642 S643 L645 Y647 R699 L708	E597-Y701 CarbonylContact O-C 3.55Å; T598-Y701 PolarHBondContact OG1-O 2.8Å; W642-Y701 CarbonylContact C-O 3.6Å; S643-Y701 PolarHBondContact N-O 3.37Å; S643-Y701 WeakPolarHBondContact O-CB 3.45Å; S643-Y701 PolarHBondContact OG-O 3.23Å; L645-Y701 HydrophobicContact CB-CD2 4.17Å; L645-Y701 HydrophobicContact CD1-CD2 3.7Å; L645-Y701 HydrophobicContact CD1-CE2 4.2Å; L645-Y701 HydrophobicContact CD1-CG 4.21Å; L645-Y701 HydrophobicContact CG-CD2 4.43Å; Y647-Y701 HydrophobicContact CE2-CE2 4.06Å; Y647-Y701 WeakPolarHBondContact OH-CE2 3.27Å; R699-Y701 HydrophobicContact CB-CD2 4.44Å; R699-Y701 HydrophobicContact CB-CE2 4.05Å; Y701-L708 HydrophobicContact CD1-CD1 3.94Å; Y701-L708 HydrophobicContact CE1-CD1 3.46Å; Y701-L708 VanDerWaalsContact CE1-CD1 3.46Å
702	N	77.2	Confident	73.6	Confident	14 Å²	14	37.3 Å²	37.3	8%	0.075	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-85.3	128	174	176.3	-52.6	0	0	0	113.7	T598 Q641 T704 T705 G706 K707	T598-N702 HydrophobicContact CG2-CB 3.76Å; T598-N702 WeakPolarHBondContact OG1-CA 3.37Å; T598-N702 PolarHBondContact OG1-N 2.95Å; T598-N702 VanDerWaalsContact OG1-N 3.17Å; Q641-N702 CarbonylContact O-C 3.6Å; Q641-N702 PolarHBondContact O-OD1 3.43Å; N702-T704 PolarHBondContact OD1-N 2.83Å; N702-T704 PolarHBondContact OD1-OG1 3.15Å; N702-T704 VanDerWaalsContact OD1-OG1 3.08Å; N702-T705 PolarHBondContact ND2-OG1 2.89Å; N702-T705 PolarHBondContact OD1-N 2.93Å; N702-T705 PolarHBondContact OD1-OG1 3.15Å; N702-G706 WeakPolarHBondContact O-CA 3.15Å; N702-G706 PolarHBondContact O-N 3.26Å; N702-K707 WeakPolarHBondContact CB-O 3.34Å; N702-K707 PolarHBondContact N-O 2.81Å
703	T	66.7	Low	74.2	Confident	62 Å²	62	39.5 Å²	39.5	38%	0.38	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-28.4	-172.1	62.7	0	0	0	0	115.2	Y640 Q641	Y640-T703 PolarHBondContact O-OG1 3.09Å; Q641-T703 VanDerWaalsContact CA-OG1 3.28Å; Q641-T703 WeakPolarHBondContact CA-OG1 3.49Å; Q641-T703 PolarHBondContact O-N 2.9Å; Q641-T703 PolarHBondContact O-OG1 3.19Å
704	T	67.9	Low	74.5	Confident	82 Å²	82	37 Å²	37	50%	0.503	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-25.7	-174.6	61.3	0	0	0	0	113	N702	N702-T704 PolarHBondContact OD1-N 2.83Å; N702-T704 PolarHBondContact OD1-OG1 3.15Å; N702-T704 VanDerWaalsContact OD1-OG1 3.08Å
705	T	69.6	Low	74.6	Confident	90 Å²	90	37.9 Å²	37.9	55%	0.552	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.5	-12.9	-175.9	58.6	0	0	0	0	114.2	N702 K707	N702-T705 PolarHBondContact ND2-OG1 2.89Å; N702-T705 PolarHBondContact OD1-N 2.93Å; N702-T705 PolarHBondContact OD1-OG1 3.15Å; T705-K707 PolarHBondContact O-N 2.79Å; T705-K707 VanDerWaalsContact OG1-CB 3.25Å; T705-K707 WeakPolarHBondContact OG1-CB 3.36Å; T705-K707 PolarHBondContact OG1-N 3.4Å
706	G	70.4	Confident	74.5	Confident	50 Å²	50	34.1 Å²	34.1	52%	0.515	18%	0.183	S	C	.	.			trans	68.3	9	-170.2	0	0	0	0	0	114.3	N702	N702-G706 WeakPolarHBondContact O-CA 3.15Å; N702-G706 PolarHBondContact O-N 3.26Å
707	K	70.4	Confident	73.9	Confident	93 Å²	93	37 Å²	37	40%	0.404	20%	0.197	S	C	.	.			trans	-84.3	166	-169.6	-167.2	173.6	171.7	-174.4	0	113.9	T598 E628 N702 T705	T598-K707 WeakPolarHBondContact CG2-O 3.42Å; E628-K707 IonicContact OE1-NZ 2.78Å; E628-K707 PolarHBondContact OE1-NZ 3.22Å; N702-K707 WeakPolarHBondContact CB-O 3.34Å; N702-K707 PolarHBondContact N-O 2.81Å; T705-K707 PolarHBondContact O-N 2.79Å; T705-K707 VanDerWaalsContact OG1-CB 3.25Å; T705-K707 WeakPolarHBondContact OG1-CB 3.36Å; T705-K707 PolarHBondContact OG1-N 3.4Å
708	L	77.9	Confident	73.3	Confident	63 Å²	63	37.3 Å²	37.3	33%	0.33	20%	0.199	S	C	.	.			trans	-109.2	129.9	-176	-98.6	51.8	0	0	0	111.6	D599 Q600 Y701	D599-L708 HydrophobicContact CB-CB 4.05Å; D599-L708 HydrophobicContact CB-CD1 3.9Å; D599-L708 HydrophobicContact CB-CG 3.61Å; D599-L708 WeakPolarHBondContact O-CB 3.32Å; D599-L708 WeakPolarHBondContact O-CG 3.43Å; Q600-L708 HydrophobicContact CG-CB 3.79Å; Q600-L708 PolarHBondContact OE1-O 3.27Å; Y701-L708 HydrophobicContact CD1-CD1 3.94Å; Y701-L708 HydrophobicContact CE1-CD1 3.46Å; Y701-L708 VanDerWaalsContact CE1-CD1 3.46Å
709	L	73.1	Confident	71.8	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.016	23%	0.225	C	C	.	.			trans	-128.3	-61.3	179.3	-54.7	178.6	0	0	0	120.2	T598 Q600 L626 T627 E628	T598-L709 HydrophobicContact CG2-CB 3.65Å; T598-L709 HydrophobicContact CG2-CD1 3.82Å; T598-L709 HydrophobicContact CG2-CG 3.5Å; T598-L709 VanDerWaalsContact CG2-CG 3.5Å; Q600-L709 VanDerWaalsContact CB-O 3.31Å; Q600-L709 WeakPolarHBondContact CB-O 3.37Å; Q600-L709 PolarHBondContact N-O 2.89Å; L626-L709 WeakPolarHBondContact CA-O 3.42Å; L626-L709 HydrophobicContact CB-CB 4.16Å; L626-L709 HydrophobicContact CD2-CB 4.02Å; T627-L709 WeakPolarHBondContact CG2-O 3.47Å; T627-L709 PolarHBondContact N-O 2.92Å; T627-L709 WeakPolarHBondContact OG1-CA 3.25Å; T627-L709 WeakPolarHBondContact OG1-CD2 3.44Å; T627-L709 PolarHBondContact OG1-O 3.16Å; E628-L709 HydrophobicContact CB-CD1 4.33Å; E628-L709 HydrophobicContact CB-CD2 3.6Å; E628-L709 HydrophobicContact CG-CD2 3.53Å
710	G	71.9	Confident	70.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.245	C	C	.	.			trans	-119.4	130.2	168.1	0	0	0	0	0	115.9	T598 D599 Q600 L624 V700	T598-G710 CarbonylContact C-O 3.53Å; T598-G710 PolarHBondContact O-N 3.37Å; D599-G710 CarbonylContact C-O 3.56Å; D599-G710 VanDerWaalsContact CA-O 3.3Å; D599-G710 WeakPolarHBondContact CA-O 3.26Å; D599-G710 PolarHBondContact N-O 3.12Å; Q600-G710 VanDerWaalsContact C-C 3.4Å; Q600-G710 PolarHBondContact N-O 2.93Å; Q600-G710 VanDerWaalsContact N-O 3.14Å; Q600-G710 CarbonylContact O-C 3.49Å; Q600-G710 WeakPolarHBondContact O-CA 3.41Å; L624-G710 WeakPolarHBondContact CD2-O 3.35Å; V700-G710 WeakPolarHBondContact CG1-O 3.4Å
711	E	80.9	Confident	68.8	Low	20 Å²	20	49.5 Å²	49.5	9%	0.093	27%	0.269	C	S	.	.			trans	-126.5	123.8	-173.6	75.3	134.9	-141.5	0	0	113	D599 Q600 Q601 L602 R699 R713	D599-E711 WeakPolarHBondContact OD1-CA 3.28Å; D599-E711 WeakPolarHBondContact OD1-CB 3.27Å; Q600-E711 VanDerWaalsContact CA-N 3.31Å; Q600-E711 PolarHBondContact O-N 3.35Å; Q601-E711 CarbonylContact C-O 3.57Å; Q601-E711 VanDerWaalsContact N-N 3.11Å; L602-E711 WeakPolarHBondContact CB-O 3.44Å; L602-E711 WeakPolarHBondContact CD1-O 3.34Å; L602-E711 PolarHBondContact N-O 2.74Å; R699-E711 IonicContact CZ-OE2 3.89Å; R699-E711 IonicContact NE-OE2 3.75Å; R699-E711 IonicContact NH2-OE2 2.94Å; R699-E711 PolarHBondContact NH2-OE2 2.88Å; E711-R713 IonicContact OE1-CZ 3.63Å; E711-R713 IonicContact OE1-NE 3.71Å; E711-R713 PolarHBondContact OE1-NE 2.88Å; E711-R713 IonicContact OE1-NH2 3.05Å; E711-R713 PolarHBondContact OE1-NH2 2.87Å; E711-R713 IonicContact OE2-NH2 3.45Å
712	Q	74.6	Confident	66.8	Low	8 Å²	8	52.5 Å²	52.5	4%	0.037	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.3	-170.2	-163.8	169.9	7.2	0	0	113.9	L602 C619 L624 C698 F714	L602-Q712 HydrophobicContact CB-CB 4.35Å; L602-Q712 HydrophobicContact CB-CG 4.25Å; L602-Q712 HydrophobicContact CD1-CB 4.47Å; L602-Q712 HydrophobicContact CD2-CB 4.15Å; L602-Q712 HydrophobicContact CD2-CG 3.9Å; C619-Q712 PolarHBondContact SG-OE1 3.08Å; C619-Q712 VanDerWaalsContact SG-OE1 3.35Å; L624-Q712 HydrophobicContact CD1-CB 4.34Å; C698-Q712 HydrophobicContact CB-CB 4.17Å; C698-Q712 WeakPolarHBondContact CB-O 3.47Å; C698-Q712 PolarHBondContact N-O 2.85Å; C698-Q712 PolarHBondContact O-N 3.36Å; Q712-F714 HydrophobicContact CB-CE2 4.18Å; Q712-F714 HydrophobicContact CG-CE2 3.73Å; Q712-F714 HydrophobicContact CG-CZ 3.74Å
713	R	75.4	Confident	64.9	Low	79 Å²	79	59.4 Å²	59.4	30%	0.298	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	145.9	-176.7	-58.4	-174.5	-178.5	-145.7	-2.4	111.5	T604 I605 I697 E711	T604-R713 VanDerWaalsContact CA-O 3.31Å; T604-R713 WeakPolarHBondContact CA-O 3.44Å; T604-R713 HydrophobicContact CG2-CB 4.11Å; I605-R713 PolarHBondContact N-O 2.78Å; I605-R713 VanDerWaalsContact N-O 3.08Å; I697-R713 HydrophobicContact CG1-CG 4.32Å; I697-R713 HydrophobicContact CG2-CG 4.33Å; E711-R713 IonicContact OE1-CZ 3.63Å; E711-R713 IonicContact OE1-NE 3.71Å; E711-R713 PolarHBondContact OE1-NE 2.88Å; E711-R713 IonicContact OE1-NH2 3.05Å; E711-R713 PolarHBondContact OE1-NH2 2.87Å; E711-R713 IonicContact OE2-NH2 3.45Å
714	F	72.6	Confident	63.2	Low	6 Å²	6	62.5 Å²	62.5	3%	0.026	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	144.7	178.7	-56.7	-97.7	0	0	0	109.7	I605 L617 N618 C619 W646 Q695 Y696 C698 Q712	I605-F714 HydrophobicContact CB-CD1 3.99Å; I605-F714 HydrophobicContact CB-CE1 4.33Å; I605-F714 HydrophobicContact CD1-CE1 4.14Å; I605-F714 CarbonylContact O-C 3.12Å; I605-F714 WeakPolarHBondContact O-CA 3.27Å; L617-F714 HydrophobicContact CD1-CB 4.48Å; L617-F714 HydrophobicContact CD2-CB 3.98Å; L617-F714 HydrophobicContact CD2-CD1 3.91Å; L617-F714 HydrophobicContact CD2-CG 4.12Å; N618-F714 WeakPolarHBondContact O-CZ 3.41Å; C619-F714 HydrophobicContact CB-CZ 4.44Å; W646-F714 AromaticContact CH2-CD2 3.95Å; W646-F714 HydrophobicContact CH2-CD2 3.95Å; W646-F714 AromaticContact CH2-CE2 3.52Å; W646-F714 HydrophobicContact CH2-CE2 3.52Å; W646-F714 HydrophobicContact CH2-CZ 4.04Å; W646-F714 AromaticContact CZ3-CD2 3.7Å; W646-F714 HydrophobicContact CZ3-CD2 3.7Å; W646-F714 AromaticContact CZ3-CE2 3.7Å; W646-F714 HydrophobicContact CZ3-CE2 3.7Å; Q695-F714 WeakPolarHBondContact CA-O 3.38Å; Y696-F714 PolarHBondContact N-O 3.49Å; Y696-F714 PolarHBondContact O-N 2.84Å; C698-F714 HydrophobicContact CB-CE2 3.9Å; Q712-F714 HydrophobicContact CB-CE2 4.18Å; Q712-F714 HydrophobicContact CG-CE2 3.73Å; Q712-F714 HydrophobicContact CG-CZ 3.74Å
715	Q	71.9	Confident	61.3	Low	43 Å²	43	66.6 Å²	66.6	20%	0.201	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	115.7	169.4	178.7	71	68.1	0	0	107.7	T604 I605 F606 E607 G694	T604-Q715 HydrophobicContact CG2-CB 4.33Å; I605-Q715 PolarHBondContact O-N 2.79Å; F606-Q715 HydrophobicContact CD1-CB 3.74Å; F606-Q715 HydrophobicContact CD1-CG 3.86Å; F606-Q715 HydrophobicContact CE1-CB 3.89Å; F606-Q715 HydrophobicContact CE1-CG 3.89Å; E607-Q715 PolarHBondContact N-O 2.9Å; G694-Q715 PolarHBondContact O-NE2 2.84Å
716	L	69.8	Low	59.4	Low	1 Å²	1	70 Å²	70	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	144.5	176.5	-171.3	76.1	0	0	0	110.1	L617 P687 G694 Y696 I718	L617-L716 HydrophobicContact CD2-CD1 4.4Å; P687-L716 HydrophobicContact CB-CD2 3.61Å; P687-L716 HydrophobicContact CG-CD1 4.22Å; P687-L716 HydrophobicContact CG-CD2 3.34Å; P687-L716 HydrophobicContact CG-CG 4.41Å; G694-L716 PolarHBondContact O-N 2.92Å; Y696-L716 HydrophobicContact CD2-CB 4.4Å; Y696-L716 HydrophobicContact CE2-CB 4.46Å; Y696-L716 HydrophobicContact CE2-CD2 4.13Å; L716-I718 HydrophobicContact CD2-CD1 3.66Å; L716-I718 HydrophobicContact CD2-CG1 3.94Å; L716-I718 HydrophobicContact CG-CD1 4.41Å; L716-I718 HydrophobicContact CG-CG1 4.14Å
717	I	64.5	Low	57.7	Low	61 Å²	61	75.2 Å²	75.2	31%	0.313	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	125	167.5	-55.4	176.6	0	0	0	108.4	E607 T609 D693 E719	E607-I717 PolarHBondContact O-N 3.41Å; T609-I717 PolarHBondContact N-O 2.87Å; T609-I717 PolarHBondContact OG1-O 3.07Å; D693-I717 WeakPolarHBondContact OD1-CA 3.37Å; I717-E719 HydrophobicContact CG2-CG 4.45Å
718	I	63.5	Low	55.6	Low	8 Å²	8	79.3 Å²	79.3	4%	0.041	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	104.5	179.5	-64.2	169	0	0	0	108	T609 E611 P687 K689 I690 D692 D693 L716	T609-I718 CarbonylContact O-C 3.19Å; T609-I718 WeakPolarHBondContact O-CA 3.39Å; T609-I718 WeakPolarHBondContact OG1-CG1 3.46Å; E611-I718 HydrophobicContact CB-CG2 3.86Å; E611-I718 HydrophobicContact CG-CG2 4.37Å; P687-I718 HydrophobicContact CB-CD1 4.36Å; K689-I718 WeakPolarHBondContact O-CD1 3.31Å; I690-I718 HydrophobicContact CG1-CG2 4.27Å; D692-I718 HydrophobicContact CB-CD1 4.28Å; D693-I718 VanDerWaalsContact CG-N 3.28Å; D693-I718 WeakPolarHBondContact OD1-CA 3.31Å; D693-I718 WeakPolarHBondContact OD1-CB 3.23Å; D693-I718 VanDerWaalsContact OD1-CG1 3.27Å; D693-I718 WeakPolarHBondContact OD1-CG1 3.49Å; D693-I718 PolarHBondContact OD1-N 2.91Å; D693-I718 PolarHBondContact OD2-N 2.99Å; D693-I718 VanDerWaalsContact OD2-N 3.09Å; L716-I718 HydrophobicContact CD2-CD1 3.66Å; L716-I718 HydrophobicContact CD2-CG1 3.94Å; L716-I718 HydrophobicContact CG-CD1 4.41Å; L716-I718 HydrophobicContact CG-CG1 4.14Å
719	E	51.5	Low	53.3	Low	116 Å²	116	85 Å²	85	54%	0.542	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130.3	-179.2	-68.4	178.6	-166	0	0	111.4	T609 E611 I717	T609-E719 PolarHBondContact O-N 2.82Å; E611-E719 PolarHBondContact N-O 2.88Å; I717-E719 HydrophobicContact CG2-CG 4.45Å
720	S	50.8	Low	51.1	Low	83 Å²	83	91.9 Å²	91.9	58%	0.58	46%	0.462	S	S	*	.			trans	-72.7	135.2	-178.6	-178.4	0	0	0	0	111.9	I690	I690-S720 VanDerWaalsContact CD1-CB 3.42Å; I690-S720 VanDerWaalsContact CD1-OG 3.29Å; I690-S720 WeakPolarHBondContact CD1-OG 3.09Å
721	I	45.9	Very low	49	Very low	99 Å²	99	100.6 Å²	100.6	51%	0.508	50%	0.5	S	S	.	.			trans	-112.4	126.4	175.6	-64.5	179.5	0	0	0	109.2
722	N	37.2	Very low	46.4	Very low	122 Å²	122	106.1 Å²	106.1	65%	0.652	53%	0.529	S	S	*	.			trans	80.6	95.1	179.1	-53.2	-22.2	0	0	0	117
723	N	35.6	Very low	44.2	Very low	159 Å²	159	114.1 Å²	114.1	85%	0.85	56%	0.564	S	S	*	*				-153	99.7	113.6	-93.5	-34.5	0	0	0	109.2
724	D	30.9	Very low	42	Very low	126 Å²	126	118.5 Å²	118.5	67%	0.674	59%	0.587	S	S	*	*				19.4	142.9	116.6	-56.1	-23.9	0	0	0	117.9
725	E	29.7	Very low	39.7	Very low	168 Å²	168	126.6 Å²	126.6	79%	0.785	63%	0.625	S	S	*	*			cis	-160.7	130.1	6.9	-134.3	-176.2	179.5	0	0	108.2
726	N	28.5	Very low	37.4	Very low	161 Å²	161	130.3 Å²	130.3	86%	0.861	65%	0.651	S	S	*	*	S	Bend	trans	-175	150.9	152.5	-111.9	-69.9	0	0	0	113.9
727	I	34.4	Very low	35.2	Very low	161 Å²	161	140 Å²	140	83%	0.826	69%	0.693	S	S	*	*			trans	58.3	52	175.2	-35.8	-176.6	0	0	0	115.6
728	H	27.3	Very low	33.4	Very low	179 Å²	179	143.7 Å²	143.7	83%	0.829	71%	0.713	S	S	*	*			trans	-100.8	85.1	149.5	-137.4	0.3	0	0	0	109.8
729	K	29.2	Very low	31.6	Very low	181 Å²	181	148.4 Å²	148.4	79%	0.787	74%	0.743	S	S	*	*			trans	-149.9	43.2	171.9	-130.4	165.4	-167.2	168.8	0	114.9
730	N	27.8	Very low	30.2	Very low	149 Å²	149	151.8 Å²	151.8	80%	0.797	76%	0.755	S	S	*	*	S	Bend	trans	-139.4	43.5	164.7	-133.3	6.6	0	0	0	112.9
731	F	27.5	Very low	28.9	Very low	183 Å²	183	152.6 Å²	152.6	80%	0.803	76%	0.761	S	S	*	*				-172.8	98.1	122.5	-106.4	-73.1	0	0	0	110.8
732	I	26.5	Very low	27.9	Very low	136 Å²	136	153.2 Å²	153.2	70%	0.697	77%	0.774	S	S	*	*			trans	-123.2	114	160.6	-63.8	176.5	0	0	0	106.5
733	K	28.7	Very low	27.3	Very low	175 Å²	175	154.7 Å²	154.7	76%	0.761	78%	0.781	S	S	*	*			trans	-144.4	101.7	164.2	-89.6	-159.8	172.3	-173.8	0	110.9
734	H	27.9	Very low	26.7	Very low	171 Å²	171	151.7 Å²	151.7	79%	0.792	77%	0.773	S	S	*	*			trans	49.1	103.9	147.3	-59.4	-76.2	0	0	0	119.8
735	E	24.6	Very low	26.5	Very low	176 Å²	176	150.1 Å²	150.1	82%	0.822	77%	0.772	S	S	*	*			trans	-79.9	-179.1	130.7	-69	-165.7	123	0	0	111.6
736	T	23.3	Very low	26.4	Very low	122 Å²	122	149.9 Å²	149.9	75%	0.748	77%	0.774	S	S	*	*			trans	97.7	87.3	155	68.3	0	0	0	0	120.3
737	F	24	Very low	26.3	Very low	203 Å²	203	146.7 Å²	146.7	89%	0.89	76%	0.764	S	S	*	*			trans	-164.7	126.6	136.3	-98.8	-74.8	0	0	0	104.5
738	L	26.7	Very low	26	Very low	139 Å²	139	143.3 Å²	143.3	73%	0.728	76%	0.755	S	S	*	*	S	Bend	cis	-140.6	135.8	25.1	-86.4	157.3	0	0	0	113.9
739	T	24.6	Very low	25.9	Very low	108 Å²	108	142.9 Å²	142.9	66%	0.663	75%	0.753	S	S	*	*			trans	56.9	117.9	140.3	59.6	0	0	0	0	124.3
740	K	23.7	Very low	25.8	Very low	186 Å²	186	141.1 Å²	141.1	81%	0.809	75%	0.751	S	S	*	*				82	104.6	120.4	-71.4	-177.6	176.3	-178.4	0	122
741	S	23.2	Very low	26	Very low	100 Å²	100	138.3 Å²	138.3	70%	0.699	74%	0.741	S	S	*	*				68.7	132.5	120.9	69.5	0	0	0	0	122.3
742	S	23.7	Very low	26	Very low	112 Å²	112	135.7 Å²	135.7	78%	0.783	74%	0.735	S	S	*	*			trans	68.5	148.3	158.7	80	0	0	0	0	117.1
743	L	24.8	Very low	26.1	Very low	154 Å²	154	135.3 Å²	135.3	81%	0.806	73%	0.729	S	S	*	*			cis	-149.4	170.6	0.1	-156.7	73.1	0	0	0	110.7
744	S	24	Very low	26	Very low	95 Å²	95	134.6 Å²	134.6	66%	0.664	72%	0.722	S	S	*	*			trans	63.5	109.7	147.5	60.9	0	0	0	0	121.4
745	S	26.8	Very low	25.9	Very low	94 Å²	94	131.6 Å²	131.6	66%	0.657	71%	0.709	S	S	*	*				67.8	115.5	124.5	68.4	0	0	0	0	122.6
746	I	27.5	Very low	25.8	Very low	162 Å²	162	126.7 Å²	126.7	83%	0.831	69%	0.688	S	S	*	*				65.7	120.7	121.4	-62.8	168.7	0	0	0	117.4
747	S	26.4	Very low	26.2	Very low	94 Å²	94	124.3 Å²	124.3	66%	0.657	67%	0.674	S	S	*	*			cis	-166.6	154.7	-5.9	49.6	0	0	0	0	112.9
748	S	27.5	Very low	26.3	Very low	90 Å²	90	117.2 Å²	117.2	63%	0.629	65%	0.65	S	S	*	*			trans	50.6	106.3	149	60.4	0	0	0	0	118.1
749	E	25.6	Very low	26.3	Very low	170 Å²	170	116 Å²	116	79%	0.794	64%	0.639	S	S	*	*				72	146.6	52.6	-57.9	175.1	144.4	0	0	114.6
750	I	28.2	Very low	26.3	Very low	144 Å²	144	113.2 Å²	113.2	74%	0.738	62%	0.616	S	S	*	*			cis	-145	154.7	-21.1	-118.2	163.2	0	0	0	108.7
751	P	30.1	Very low	26.4	Very low	90 Å²	90	107.2 Å²	107.2	58%	0.584	59%	0.593	S	S	*	*			trans	-115.7	-171	-173.6	40.2	-27.9	0	0	0	113.5
752	N	28.5	Very low	26.6	Very low	129 Å²	129	107.6 Å²	107.6	69%	0.69	58%	0.584	S	S	*	*			trans	75	163.8	143.9	-77.6	-19.2	0	0	0	117.3
753	K	27.6	Very low	26.7	Very low	127 Å²	127	109.4 Å²	109.4	55%	0.552	58%	0.58	S	S	*	*			cis	-161.1	165.8	0.7	-126.6	158.7	178.8	-152.2	0	112
754	Y	27	Very low	26.7	Very low	161 Å²	161	106.9 Å²	106.9	63%	0.631	57%	0.567	S	S	*	*			trans	69.1	123.8	145.6	-68.7	-29.7	0	0	0	118.8
755	E	25.5	Very low	26.7	Very low	107 Å²	107	107.3 Å²	107.3	50%	0.5	56%	0.561	S	S	.	*				80.5	149.6	72.6	-87.8	-179.1	-180	0	0	112.5
756	L	24.3	Very low	26.7	Very low	73 Å²	73	105.5 Å²	105.5	38%	0.382	55%	0.546	S	S	.	.			cis	-147	-160.1	14.9	-125.2	178.7	0	0	0	109.9	S101 Y105	S101-L756 WeakPolarHBondContact OG-CD1 3.5Å; S101-L756 WeakPolarHBondContact OG-CD2 3.43Å; Y105-L756 HydrophobicContact CD2-CD1 4.42Å; Y105-L756 HydrophobicContact CE2-CD1 4.29Å
757	P	30.9	Very low	26.8	Very low	72 Å²	72	103.9 Å²	103.9	47%	0.468	54%	0.539	S	S	.	.			trans	-123	-141.6	-139	45.6	-26.1	0	0	0	113.1
758	S	25.8	Very low	26.9	Very low	54 Å²	54	106.2 Å²	106.2	38%	0.378	54%	0.537	S	S	.	.			trans	87.9	129	154	95.7	0	0	0	0	113.1	M107	M107-S758 VanDerWaalsContact SD-CB 3.52Å
759	K	26.4	Very low	26.9	Very low	115 Å²	115	109.4 Å²	109.4	50%	0.5	54%	0.542	S	S	.	.			cis	-164.2	162.4	47.8	-97.6	147.4	-177.1	137.4	0	110.4	S106 M107	S106-K759 WeakPolarHBondContact O-CE 3.48Å; M107-K759 HydrophobicContact CG-CG 3.78Å
760	R	25.8	Very low	27.4	Very low	48 Å²	48	107.9 Å²	107.9	18%	0.181	54%	0.544	C	S	.	.			cis	-176.5	-178.4	17.7	-123	162	178.9	-114.8	-1	112.2	S106 M107 T108 F109 A110	S106-R760 PolarHBondContact O-NE 3.14Å; S106-R760 PolarHBondContact O-NH2 3.11Å; M107-R760 VanDerWaalsContact CA-CG 3.49Å; M107-R760 HydrophobicContact CB-CG 4.02Å; M107-R760 HydrophobicContact CG-CG 4.49Å; M107-R760 CarbonylContact O-C 3.59Å; M107-R760 WeakPolarHBondContact O-CA 2.99Å; M107-R760 WeakPolarHBondContact O-CG 3.2Å; T108-R760 VanDerWaalsContact N-CG 3.35Å; T108-R760 WeakPolarHBondContact O-CD 3.3Å; T108-R760 VanDerWaalsContact O-CG 3.27Å; T108-R760 WeakPolarHBondContact O-CG 3.44Å; T108-R760 PolarHBondContact O-NH1 3.01Å; T108-R760 PolarHBondContact OG1-NH1 3.01Å; F109-R760 HydrophobicContact CB-CB 3.47Å; F109-R760 VanDerWaalsContact CB-CB 3.47Å; F109-R760 HydrophobicContact CB-CG 4.23Å; F109-R760 HydrophobicContact CD1-CB 3.53Å; F109-R760 HydrophobicContact CD1-CG 3.84Å; F109-R760 HydrophobicContact CE1-CB 4.49Å; F109-R760 HydrophobicContact CE1-CG 4.42Å; F109-R760 HydrophobicContact CG-CB 3.66Å; F109-R760 HydrophobicContact CG-CG 3.98Å; A110-R760 CarbonylContact C-O 3.57Å; A110-R760 VanDerWaalsContact CA-O 3.29Å; A110-R760 WeakPolarHBondContact CA-O 3.2Å; A110-R760 WeakPolarHBondContact CB-O 3.26Å; A110-R760 PolarHBondContact N-O 2.93Å
761	N	25.3	Very low	27.6	Very low	61 Å²	61	108.3 Å²	108.3	33%	0.326	54%	0.543	S	S	.	.	B	Isolated β-bridge	trans	-123.1	140.9	-176.8	72.5	-121.3	0	0	0	123.2	M107 T108 F109 A110 T112	M107-N761 PolarHBondContact O-N 2.92Å; M107-N761 PolarHBondContact O-OD1 3.23Å; T108-N761 CarbonylContact C-O 3.55Å; F109-N761 CarbonylContact C-O 3.52Å; F109-N761 VanDerWaalsContact N-C 3.31Å; F109-N761 PolarHBondContact N-O 3.16Å; A110-N761 VanDerWaalsContact N-N 3.14Å; T112-N761 HydrophobicContact CG2-CB 3.7Å; T112-N761 WeakPolarHBondContact OG1-CB 3.4Å
762	E	27.5	Very low	27.7	Very low	108 Å²	108	113.1 Å²	113.1	51%	0.505	56%	0.555	S	S	.	*			trans	-157	103.5	175.1	-88.5	-175.7	-158.1	0	0	118.3	F109 Q111	F109-E762 WeakPolarHBondContact O-CB 3.38Å; F109-E762 WeakPolarHBondContact O-CG 3.4Å; Q111-E762 WeakPolarHBondContact CB-O 3.49Å; Q111-E762 WeakPolarHBondContact CG-O 3.5Å; Q111-E762 PolarHBondContact NE2-O 2.81Å
763	Q	25.3	Very low	28.4	Very low	149 Å²	149	111.5 Å²	111.5	70%	0.696	55%	0.551	S	S	*	*				51.3	117.8	128.4	-56.4	176.4	12.9	0	0	127.1	Q111	Q111-Q763 PolarHBondContact NE2-O 2.71Å
764	N	24.2	Very low	29.3	Very low	102 Å²	102	108.6 Å²	108.6	55%	0.545	54%	0.54	S	S	.	.				55.8	147.2	121.5	-57.4	-2.9	0	0	0	122.6	N157	N157-N764 PolarHBondContact ND2-OD1 3.41Å
765	L	24.5	Very low	30.5	Very low	103 Å²	103	101 Å²	101	54%	0.539	51%	0.51	S	S	.	.			cis	-162.9	145.2	-6.6	-143.3	74.2	0	0	0	112.3	F61	F61-L765 HydrophobicContact CD2-CD1 3.69Å; F61-L765 HydrophobicContact CD2-CG 3.78Å; F61-L765 HydrophobicContact CE2-CD1 4.01Å; F61-L765 HydrophobicContact CE2-CG 3.71Å; F61-L765 HydrophobicContact CG-CD1 4.33Å
766	V	27.5	Very low	31.7	Very low	56 Å²	56	100.7 Å²	100.7	34%	0.339	51%	0.507	S	S	.	.			trans	54.9	175.1	165.6	-112.9	0	0	0	0	119.3	Q60 F61	Q60-V766 HydrophobicContact CB-CG1 3.77Å; Q60-V766 VanDerWaalsContact CD-CG1 3.43Å; Q60-V766 HydrophobicContact CG-CG1 4.2Å; F61-V766 HydrophobicContact CE2-CB 4.01Å; F61-V766 HydrophobicContact CE2-CG1 3.76Å; F61-V766 HydrophobicContact CE2-CG2 4.16Å; F61-V766 HydrophobicContact CZ-CG1 4.36Å; F61-V766 VanDerWaalsContact CZ-N 3.3Å
767	L	28.3	Very low	33.6	Very low	129 Å²	129	97.7 Å²	97.7	68%	0.675	49%	0.492	S	S	*	.			cis	-125.4	-178.4	15.9	-81.6	88.7	0	0	0	111.4
768	K	28.4	Very low	35.3	Very low	143 Å²	143	95.1 Å²	95.1	62%	0.622	48%	0.475	S	S	*	.			cis	-167	161.7	28.4	-152.3	151.9	-173.4	178.6	0	114.4
769	Q	29.4	Very low	37.4	Very low	156 Å²	156	97.7 Å²	97.7	73%	0.729	48%	0.477	S	S	*	.			trans	-62.2	168.8	169.9	-68.6	157.1	-66.8	0	0	114
770	T	36.1	Very low	39.5	Very low	138 Å²	138	92.5 Å²	92.5	85%	0.847	46%	0.455	S	S	*	.			trans	-78.3	126.2	178.7	47.9	0	0	0	0	113.6
771	E	31.2	Very low	41.5	Very low	154 Å²	154	94.9 Å²	94.9	72%	0.72	47%	0.47	S	S	*	.			trans	-164.5	115.2	171.5	-132.9	171.2	-149.7	0	0	111.9	Q774	E771-Q774 WeakPolarHBondContact O-CG 3.46Å; E771-Q774 PolarHBondContact O-NE2 2.9Å
772	K	31.4	Very low	43.5	Very low	190 Å²	190	93.2 Å²	93.2	83%	0.826	46%	0.462	S	S	*	.	S	Bend	trans	60.6	164.4	-164.5	-68	-179.9	179.6	176.9	0	113.2	Q774	K772-Q774 PolarHBondContact O-N 2.74Å
773	P	44.1	Very low	44.9	Very low	95 Å²	95	94.6 Å²	94.6	62%	0.617	47%	0.467	S	S	*	.			trans	-68.7	83.3	168.2	29	-35.3	0	0	0	109.4	I775	P773-I775 PolarHBondContact O-N 3.12Å
774	Q	46.6	Very low	46.3	Very low	66 Å²	66	90.9 Å²	90.9	31%	0.308	45%	0.446	S	S	.	.			trans	-70.3	97.6	175	-61.3	-167.6	11.4	0	0	108.5	E771 K772 K776 L880	E771-Q774 WeakPolarHBondContact O-CG 3.46Å; E771-Q774 PolarHBondContact O-NE2 2.9Å; K772-Q774 PolarHBondContact O-N 2.74Å; Q774-K776 HydrophobicContact CB-CG 4.28Å; Q774-K776 PolarHBondContact O-N 3.22Å; Q774-L880 HydrophobicContact CB-CD1 4.47Å; Q774-L880 HydrophobicContact CB-CD2 3.7Å; Q774-L880 HydrophobicContact CG-CD2 3.94Å
775	I	51.9	Low	47.5	Very low	1 Å²	1	90.2 Å²	90.2	1%	0.005	44%	0.442	C	S	.	.			trans	-60.5	85.3	161.3	-59.2	-164.8	0	0	0	106.5	P773 V777 V798 L806 V875 H878	P773-I775 PolarHBondContact O-N 3.12Å; I775-V777 PolarHBondContact O-N 3.23Å; I775-V798 HydrophobicContact CG2-CG1 3.23Å; I775-L806 HydrophobicContact CD1-CD2 3.63Å; I775-V875 HydrophobicContact CG2-CG2 4.46Å; I775-H878 VanDerWaalsContact CD1-CD2 3.49Å; I775-H878 WeakPolarHBondContact CD1-CD2 3.38Å
776	K	51.7	Low	48.4	Very low	102 Å²	102	86.8 Å²	86.8	44%	0.443	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	104.8	-179.5	-77.2	175.3	-179.2	175.2	0	106.4	Q774 Y799	Q774-K776 HydrophobicContact CB-CG 4.28Å; Q774-K776 PolarHBondContact O-N 3.22Å; K776-Y799 PolarHBondContact N-O 3.43Å; K776-Y799 WeakPolarHBondContact O-CB 3.06Å; K776-Y799 VanDerWaalsContact O-CD2 3.31Å; K776-Y799 WeakPolarHBondContact O-CD2 3.19Å; K776-Y799 PolarHBondContact O-N 2.84Å
777	V	62.8	Low	49.3	Very low	9 Å²	9	90.6 Å²	90.6	6%	0.055	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	135.9	165.9	-174.8	0	0	0	0	107.7	I775 W796 V798 Y808 V873 V875	I775-V777 PolarHBondContact O-N 3.23Å; V777-W796 HydrophobicContact CG1-CB 4.24Å; V777-W796 HydrophobicContact CG1-CG 4.4Å; V777-V798 HydrophobicContact CB-CG2 4.27Å; V777-V798 HydrophobicContact CG1-CG2 3.94Å; V777-V798 HydrophobicContact CG2-CG1 4.34Å; V777-V798 HydrophobicContact CG2-CG2 3.88Å; V777-Y808 HydrophobicContact CG2-CE1 4.33Å; V777-V873 HydrophobicContact CG1-CB 3.68Å; V777-V873 HydrophobicContact CG1-CG1 3.81Å; V777-V873 HydrophobicContact CG1-CG2 4.25Å; V777-V873 HydrophobicContact CG2-CG1 4.33Å; V777-V875 HydrophobicContact CG2-CG2 3.53Å
778	S	66.9	Low	50	Low	18 Å²	18	91.2 Å²	91.2	13%	0.126	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-54.6	149.9	173.8	82.5	0	0	0	0	109.7	P780 W796 T797 S882	S778-P780 WeakPolarHBondContact O-CD 3.37Å; S778-W796 WeakPolarHBondContact OG-CA 3.46Å; S778-T797 VanDerWaalsContact CB-O 3.31Å; S778-T797 WeakPolarHBondContact CB-O 3.48Å; S778-T797 PolarHBondContact N-O 3.01Å; S778-T797 PolarHBondContact OG-N 3.1Å; S778-T797 VanDerWaalsContact OG-N 3.07Å; S778-S882 VanDerWaalsContact O-CB 3.25Å; S778-S882 WeakPolarHBondContact O-CB 3.32Å
779	R	69.3	Low	50.9	Low	109 Å²	109	86 Å²	86	41%	0.411	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-51.1	127.1	155.2	-164.9	177.5	-158.4	-165.1	0.5	107.1	I781 P883 W884 E886	R779-I781 PolarHBondContact O-N 2.86Å; R779-P883 HydrophobicContact CB-CB 4.41Å; R779-P883 HydrophobicContact CG-CB 4.24Å; R779-W884 PolarHBondContact NE-O 2.85Å; R779-W884 PolarHBondContact NH2-O 2.85Å; R779-E886 IonicContact CZ-OE1 2.79Å; R779-E886 IonicContact NH1-OE1 3.71Å; R779-E886 PolarHBondContact NH1-OE1 3.5Å; R779-E886 VanDerWaalsContact NH2-CG 3.26Å
780	P	71	Confident	51.8	Low	6 Å²	6	81.7 Å²	81.7	4%	0.039	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-63.2	131	-177.4	-22.8	31.3	0	0	0	110.3	S778 V782 I794 V873 S882 T885	S778-P780 WeakPolarHBondContact O-CD 3.37Å; P780-V782 PolarHBondContact O-N 2.92Å; P780-I794 HydrophobicContact CB-CG2 3.85Å; P780-V873 HydrophobicContact CG-CG2 4.04Å; P780-S882 WeakPolarHBondContact CD-OG 3.34Å; P780-T885 HydrophobicContact CB-CG2 3.58Å; P780-T885 HydrophobicContact CG-CG2 3.83Å; P780-T885 WeakPolarHBondContact O-CG2 3.34Å
781	I	67.6	Low	52.4	Low	98 Å²	98	76.3 Å²	76.3	50%	0.503	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	104.7	175.2	-59	177.1	0	0	0	106.7	R779 K783 I794 K795	R779-I781 PolarHBondContact O-N 2.86Å; I781-K783 HydrophobicContact CG2-CG 4.29Å; I781-I794 WeakPolarHBondContact O-CA 3.14Å; I781-K795 WeakPolarHBondContact CB-O 3.16Å; I781-K795 PolarHBondContact N-O 2.9Å; I781-K795 PolarHBondContact O-N 3.23Å
782	V	67.1	Low	53.9	Low	26 Å²	26	69 Å²	69	16%	0.158	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	119	178	-177.7	0	0	0	0	108.4	P780 V792 H793 I794 L871 T885 V888	P780-V782 PolarHBondContact O-N 2.92Å; V782-V792 HydrophobicContact CG1-CG1 3.4Å; V782-V792 VanDerWaalsContact CG1-CG1 3.4Å; V782-H793 WeakPolarHBondContact CA-O 3.42Å; V782-I794 HydrophobicContact CG1-CG1 4.3Å; V782-I794 HydrophobicContact CG2-CD1 4.29Å; V782-I794 HydrophobicContact CG2-CG1 4.08Å; V782-I794 HydrophobicContact CG2-CG2 4.02Å; V782-L871 HydrophobicContact CG2-CD1 3.67Å; V782-T885 HydrophobicContact CG2-CG2 3.84Å; V782-V888 HydrophobicContact CB-CG2 3.79Å; V782-V888 HydrophobicContact CG1-CB 4.47Å; V782-V888 HydrophobicContact CG1-CG1 4.1Å; V782-V888 HydrophobicContact CG1-CG2 3.78Å; V782-V888 HydrophobicContact CG2-CG2 4.26Å
783	K	58.4	Low	55.4	Low	137 Å²	137	62.3 Å²	62.3	60%	0.596	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	130	173	-70.8	-167.6	174.6	-168.9	0	109.9	I781 H793	I781-K783 HydrophobicContact CG2-CG 4.29Å; K783-H793 PolarHBondContact N-O 2.79Å; K783-H793 PolarHBondContact O-N 3.29Å
784	R	54.3	Low	56.4	Low	70 Å²	70	57.8 Å²	57.8	26%	0.264	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	137.4	163.6	-156.5	-179.2	-178.3	-169.9	-4.8	108.7	A786 N787 F788 T789 N892	R784-A786 VanDerWaalsContact CD-O 3.28Å; R784-A786 WeakPolarHBondContact CD-O 3.43Å; R784-A786 WeakPolarHBondContact CG-O 3.49Å; R784-A786 PolarHBondContact NE-O 3.44Å; R784-N787 PolarHBondContact NH1-O 3.06Å; R784-F788 VanDerWaalsContact NH2-C 3.34Å; R784-T789 PolarHBondContact NE-O 2.86Å; R784-T789 PolarHBondContact NH2-O 3.27Å; R784-N892 PolarHBondContact NH2-O 3.34Å
785	L	48.9	Very low	57.4	Low	88 Å²	88	59.4 Å²	59.4	46%	0.461	29%	0.289	S	S	.	.	S	Bend	trans	-77.1	-29	-173.7	-77.4	164.6	0	0	0	113.7	T789 A791 H793 I856	L785-T789 HydrophobicContact CB-CG2 4.31Å; L785-T789 PolarHBondContact N-OG1 3.33Å; L785-A791 HydrophobicContact CD1-CB 3.72Å; L785-A791 PolarHBondContact N-O 3.22Å; L785-H793 HydrophobicContact CD1-CB 4.24Å; L785-H793 HydrophobicContact CD2-CB 3.87Å; L785-H793 HydrophobicContact CG-CB 3.92Å; L785-I856 HydrophobicContact CD1-CD1 4.04Å; L785-I856 HydrophobicContact CD1-CG1 4.2Å; L785-I856 HydrophobicContact CD1-CG2 3.65Å
786	A	44.4	Very low	58.4	Low	32 Å²	32	59.4 Å²	59.4	26%	0.264	29%	0.289	S	S	.	.	S	Bend	trans	-154.5	172.3	158.1	0	0	0	0	0	110.6	R784 F788 T789	R784-A786 VanDerWaalsContact CD-O 3.28Å; R784-A786 WeakPolarHBondContact CD-O 3.43Å; R784-A786 WeakPolarHBondContact CG-O 3.49Å; R784-A786 PolarHBondContact NE-O 3.44Å; A786-F788 HydrophobicContact CB-CE1 4.18Å; A786-F788 HydrophobicContact CB-CE2 4.11Å; A786-F788 HydrophobicContact CB-CZ 3.92Å; A786-F788 PolarHBondContact O-N 3.06Å; A786-T789 HydrophobicContact CB-CG2 3.92Å; A786-T789 PolarHBondContact N-OG1 2.6Å; A786-T789 PolarHBondContact O-N 2.76Å; A786-T789 VanDerWaalsContact O-N 3.09Å; A786-T789 PolarHBondContact O-OG1 2.88Å
787	N	44.8	Very low	59.1	Low	136 Å²	136	56 Å²	56	73%	0.727	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-6.2	-175.1	-67.4	-1.4	0	0	0	115.5	R784	R784-N787 PolarHBondContact NH1-O 3.06Å
788	F	44.8	Very low	59	Low	142 Å²	142	56.1 Å²	56.1	62%	0.623	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	1.1	-179.6	44.8	-94.9	0	0	0	112.9	R784 A786	R784-F788 VanDerWaalsContact NH2-C 3.34Å; A786-F788 HydrophobicContact CB-CE1 4.18Å; A786-F788 HydrophobicContact CB-CE2 4.11Å; A786-F788 HydrophobicContact CB-CZ 3.92Å; A786-F788 PolarHBondContact O-N 3.06Å
789	T	45.7	Very low	58.5	Low	33 Å²	33	58.2 Å²	58.2	20%	0.202	28%	0.283	C	S	.	.			trans	-78.9	137.5	179.7	58.2	0	0	0	0	112	R784 L785 A786 A791	R784-T789 PolarHBondContact NE-O 2.86Å; R784-T789 PolarHBondContact NH2-O 3.27Å; L785-T789 HydrophobicContact CB-CG2 4.31Å; L785-T789 PolarHBondContact N-OG1 3.33Å; A786-T789 HydrophobicContact CB-CG2 3.92Å; A786-T789 PolarHBondContact N-OG1 2.6Å; A786-T789 PolarHBondContact O-N 2.76Å; A786-T789 VanDerWaalsContact O-N 3.09Å; A786-T789 PolarHBondContact O-OG1 2.88Å; T789-A791 PolarHBondContact OG1-O 3.28Å
790	M	49.8	Very low	57.5	Low	66 Å²	66	57.5 Å²	57.5	33%	0.325	28%	0.284	S	S	.	.	S	Bend	trans	-71	-20.1	159.8	-61.9	-172.5	89.6	0	0	111.5	S859 R860	M790-S859 WeakPolarHBondContact CA-OG 3.38Å; M790-S859 WeakPolarHBondContact CB-OG 3.4Å; M790-S859 WeakPolarHBondContact O-CB 3.35Å; M790-S859 PolarHBondContact O-N 2.85Å; M790-S859 PolarHBondContact O-OG 2.94Å; M790-R860 HydrophobicContact CE-CB 3.91Å; M790-R860 HydrophobicContact CE-CG 3.72Å; M790-R860 HydrophobicContact SD-CG 3.91Å
791	A	48.5	Very low	56.7	Low	24 Å²	24	58.8 Å²	58.8	20%	0.198	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	128.7	178.9	0	0	0	0	0	113	L785 T789 I856 F857	L785-A791 HydrophobicContact CD1-CB 3.72Å; L785-A791 PolarHBondContact N-O 3.22Å; T789-A791 PolarHBondContact OG1-O 3.28Å; A791-I856 HydrophobicContact CB-CG2 3.94Å; A791-F857 CarbonylContact C-O 3.4Å; A791-F857 WeakPolarHBondContact CA-O 3.38Å
792	V	62	Low	55.7	Low	1 Å²	1	57.7 Å²	57.7	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	114.6	-176.5	-174.8	0	0	0	0	109.5	V782 I794 I856 F857 F890	V782-V792 HydrophobicContact CG1-CG1 3.4Å; V782-V792 VanDerWaalsContact CG1-CG1 3.4Å; V792-I794 HydrophobicContact CG1-CD1 4.4Å; V792-I794 HydrophobicContact CG1-CG1 4.03Å; V792-I856 WeakPolarHBondContact O-CA 3.17Å; V792-F857 PolarHBondContact N-O 3.28Å; V792-F857 PolarHBondContact O-N 2.73Å; V792-F890 HydrophobicContact CG1-CE1 4.26Å; V792-F890 HydrophobicContact CG1-CZ 4.2Å; V792-F890 HydrophobicContact CG2-CD1 4.49Å; V792-F890 HydrophobicContact CG2-CE1 3.56Å; V792-F890 HydrophobicContact CG2-CZ 4.01Å
793	H	62.2	Low	55.1	Low	49 Å²	49	59.3 Å²	59.3	23%	0.227	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	115.6	178.3	173.4	-136.9	0	0	0	110.4	V782 K783 L785 S854 I856	V782-H793 WeakPolarHBondContact CA-O 3.42Å; K783-H793 PolarHBondContact N-O 2.79Å; K783-H793 PolarHBondContact O-N 3.29Å; L785-H793 HydrophobicContact CD1-CB 4.24Å; L785-H793 HydrophobicContact CD2-CB 3.87Å; L785-H793 HydrophobicContact CG-CB 3.92Å; H793-S854 WeakPolarHBondContact NE2-CB 3.49Å; H793-I856 HydrophobicContact CB-CG1 4.2Å
794	I	66	Low	54.8	Low	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.3	-179.6	-48.6	-171.6	0	0	0	108.4	P780 I781 V782 V792 W796 L810 S854 I855 F857 L871	P780-I794 HydrophobicContact CB-CG2 3.85Å; I781-I794 WeakPolarHBondContact O-CA 3.14Å; V782-I794 HydrophobicContact CG1-CG1 4.3Å; V782-I794 HydrophobicContact CG2-CD1 4.29Å; V782-I794 HydrophobicContact CG2-CG1 4.08Å; V782-I794 HydrophobicContact CG2-CG2 4.02Å; V792-I794 HydrophobicContact CG1-CD1 4.4Å; V792-I794 HydrophobicContact CG1-CG1 4.03Å; I794-W796 HydrophobicContact CB-CZ3 4.21Å; I794-W796 HydrophobicContact CG2-CE3 3.84Å; I794-W796 HydrophobicContact CG2-CZ3 3.86Å; I794-L810 HydrophobicContact CD1-CD2 4.07Å; I794-S854 CarbonylContact O-C 3.54Å; I794-S854 WeakPolarHBondContact O-CA 3.3Å; I794-I855 PolarHBondContact N-O 2.89Å; I794-I855 PolarHBondContact O-N 3.38Å; I794-F857 HydrophobicContact CB-CE2 4.45Å; I794-F857 HydrophobicContact CD1-CD2 3.62Å; I794-F857 HydrophobicContact CD1-CE2 3.79Å; I794-F857 HydrophobicContact CG1-CD2 3.98Å; I794-F857 HydrophobicContact CG1-CE2 4.25Å; I794-L871 HydrophobicContact CD1-CD1 3.84Å; I794-L871 HydrophobicContact CD1-CD2 3.79Å; I794-L871 HydrophobicContact CD1-CG 4.37Å
795	K	68.3	Low	54.9	Low	100 Å²	100	62 Å²	62	44%	0.435	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	122.3	176.4	179.4	171.7	-177.8	170	0	110	I781	I781-K795 WeakPolarHBondContact CB-O 3.16Å; I781-K795 PolarHBondContact N-O 2.9Å; I781-K795 PolarHBondContact O-N 3.23Å
796	W	71.7	Confident	55.4	Low	1 Å²	1	57.8 Å²	57.8	0%	0.004	29%	0.293	C	S	.	.			trans	-116.7	158.6	167.2	56.9	102.8	0	0	0	109.9	V777 S778 I794 Y808 I849 S853 I855 V873	V777-W796 HydrophobicContact CG1-CB 4.24Å; V777-W796 HydrophobicContact CG1-CG 4.4Å; S778-W796 WeakPolarHBondContact OG-CA 3.46Å; I794-W796 HydrophobicContact CB-CZ3 4.21Å; I794-W796 HydrophobicContact CG2-CE3 3.84Å; I794-W796 HydrophobicContact CG2-CZ3 3.86Å; W796-Y808 AromaticContact NE1-CD2 3.9Å; W796-I849 HydrophobicContact CH2-CD1 4.02Å; W796-I849 HydrophobicContact CZ2-CB 4.39Å; W796-I849 HydrophobicContact CZ2-CD1 4.01Å; W796-I849 HydrophobicContact CZ2-CG2 4.29Å; W796-S853 VanDerWaalsContact CZ2-OG 3.29Å; W796-S853 WeakPolarHBondContact CZ2-OG 3.44Å; W796-S853 PolarHBondContact N-O 2.96Å; W796-I855 HydrophobicContact CH2-CB 4.42Å; W796-I855 HydrophobicContact CH2-CD1 3.99Å; W796-I855 HydrophobicContact CH2-CG1 3.99Å; W796-V873 HydrophobicContact CB-CG2 4.28Å; W796-V873 HydrophobicContact CD2-CG2 3.74Å; W796-V873 HydrophobicContact CE3-CG2 4.25Å; W796-V873 HydrophobicContact CG-CG2 3.75Å
797	T	66.9	Low	56.1	Low	30 Å²	30	58.9 Å²	58.9	18%	0.184	29%	0.292	C	S	.	.			trans	-130	145.4	168.4	59.3	0	0	0	0	108.8	S778 Y799 N852	S778-T797 VanDerWaalsContact CB-O 3.31Å; S778-T797 WeakPolarHBondContact CB-O 3.48Å; S778-T797 PolarHBondContact N-O 3.01Å; S778-T797 PolarHBondContact OG-N 3.1Å; S778-T797 VanDerWaalsContact OG-N 3.07Å; T797-Y799 VanDerWaalsContact OG1-CE2 3.3Å; T797-Y799 WeakPolarHBondContact OG1-CE2 3.49Å; T797-Y799 PolarHBondContact OG1-OH 3.06Å; T797-N852 WeakPolarHBondContact CA-OD1 3.37Å
798	V	61.3	Low	57.1	Low	12 Å²	12	52.5 Å²	52.5	7%	0.073	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	141.6	179.3	-176.6	0	0	0	0	109.9	K87 I775 V777 Y808 N852	K87-V798 WeakPolarHBondContact CE-O 3.07Å; K87-V798 PolarHBondContact NZ-O 3.41Å; I775-V798 HydrophobicContact CG2-CG1 3.23Å; V777-V798 HydrophobicContact CB-CG2 4.27Å; V777-V798 HydrophobicContact CG1-CG2 3.94Å; V777-V798 HydrophobicContact CG2-CG1 4.34Å; V777-V798 HydrophobicContact CG2-CG2 3.88Å; V798-Y808 WeakPolarHBondContact CB-OH 3.31Å; V798-Y808 WeakPolarHBondContact CG1-OH 3.44Å; V798-Y808 HydrophobicContact CG2-CE1 3.91Å; V798-Y808 HydrophobicContact CG2-CE2 3.97Å; V798-Y808 VanDerWaalsContact CG2-CZ 3.43Å; V798-Y808 WeakPolarHBondContact CG2-OH 3.44Å; V798-N852 PolarHBondContact N-OD1 3.38Å
799	Y	56	Low	58.2	Low	63 Å²	63	46.7 Å²	46.7	25%	0.247	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	121.5	-176.6	-62.9	-106.7	0	0	0	107.2	K87 K776 T797	K87-Y799 HydrophobicContact CD-CD1 3.55Å; K87-Y799 HydrophobicContact CD-CE1 3.66Å; K87-Y799 HydrophobicContact CD-CG 4.46Å; K87-Y799 HydrophobicContact CG-CD1 4.22Å; K776-Y799 PolarHBondContact N-O 3.43Å; K776-Y799 WeakPolarHBondContact O-CB 3.06Å; K776-Y799 VanDerWaalsContact O-CD2 3.31Å; K776-Y799 WeakPolarHBondContact O-CD2 3.19Å; K776-Y799 PolarHBondContact O-N 2.84Å; T797-Y799 VanDerWaalsContact OG1-CE2 3.3Å; T797-Y799 WeakPolarHBondContact OG1-CE2 3.49Å; T797-Y799 PolarHBondContact OG1-OH 3.06Å
800	H	48.5	Very low	59.1	Low	93 Å²	93	45.2 Å²	45.2	43%	0.431	22%	0.224	S	C	.	.			trans	63.1	45.2	164.3	-49	93	0	0	0	116.6	D86 K87	D86-H800 VanDerWaalsContact CA-NE2 3.33Å; D86-H800 WeakPolarHBondContact CA-NE2 3.21Å; D86-H800 WeakPolarHBondContact CB-CE1 3.49Å; D86-H800 WeakPolarHBondContact CB-NE2 3.36Å; D86-H800 CovalentContact O-NE2 1.76Å; D86-H800 PolarHBondContact O-NE2 2.97Å; K87-H800 WeakPolarHBondContact CG-CE1 3.37Å; K87-H800 VanDerWaalsContact CG-NE2 3.33Å; K87-H800 WeakPolarHBondContact CG-NE2 3.26Å; K87-H800 PolarHBondContact N-NE2 3.24Å
801	S	52.7	Low	60.1	Low	34 Å²	34	42 Å²	42	24%	0.238	21%	0.208	C	C	.	.			trans	-75.6	134.9	159.1	-176.3	0	0	0	0	112	I803 L806	S801-I803 VanDerWaalsContact C-N 3.3Å; S801-I803 WeakPolarHBondContact OG-CB 3.46Å; S801-I803 PolarHBondContact OG-N 2.94Å; S801-I803 PolarHBondContact OG-O 2.89Å; S801-L806 WeakPolarHBondContact OG-CD1 3.33Å; S801-L806 WeakPolarHBondContact OG-CD2 3.49Å
802	P	46.9	Very low	61.1	Low	74 Å²	74	41 Å²	41	48%	0.481	20%	0.199	S	C	.	.	S	Bend	trans	-88.3	8.1	167.6	36.9	-34.6	0	0	0	113.5	K508	K508-P802 WeakPolarHBondContact CE-O 3.43Å; K508-P802 PolarHBondContact NZ-O 3.47Å; K508-P802 VanDerWaalsContact NZ-O 3.11Å
803	I	54.5	Low	61.3	Low	61 Å²	61	42.9 Å²	42.9	31%	0.313	21%	0.207	S	C	.	.	S	Bend	trans	-113.6	139.6	-176.8	-50.6	177	0	0	0	108.2	S801 L806 E877	S801-I803 VanDerWaalsContact C-N 3.3Å; S801-I803 WeakPolarHBondContact OG-CB 3.46Å; S801-I803 PolarHBondContact OG-N 2.94Å; S801-I803 PolarHBondContact OG-O 2.89Å; I803-L806 HydrophobicContact CB-CD2 4.25Å; I803-L806 HydrophobicContact CB-CG 4.23Å; I803-L806 HydrophobicContact CD1-CD2 4.33Å; I803-L806 HydrophobicContact CG2-CG 4.49Å; I803-E877 WeakPolarHBondContact CD1-OE2 3.41Å
804	K	53.2	Low	61.4	Low	169 Å²	169	43.6 Å²	43.6	74%	0.735	21%	0.211	S	C	*	.	S	Bend	trans	-85.6	-14.4	-174.2	-91.6	-158.7	172.3	-158.2	0	115.5
805	E	56.6	Low	61	Low	93 Å²	93	46.9 Å²	46.9	44%	0.435	23%	0.228	S	C	.	.	S	Bend	trans	-144	103	-174.7	-66.4	153.1	140.4	0	0	105.9	K505 Y850	K505-E805 IonicContact NZ-OE1 3.72Å; K505-E805 PolarHBondContact NZ-OE1 3.32Å; K505-E805 IonicContact NZ-OE2 3.55Å; K505-E805 PolarHBondContact NZ-OE2 3.25Å; E805-Y850 HydrophobicContact CB-CD1 4.29Å
806	L	58.4	Low	60.3	Low	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.			trans	-106.7	141.5	179.5	-67.7	125.3	0	0	0	111.9	I775 S801 I803 Y808 I849 D851 V875	I775-L806 HydrophobicContact CD1-CD2 3.63Å; S801-L806 WeakPolarHBondContact OG-CD1 3.33Å; S801-L806 WeakPolarHBondContact OG-CD2 3.49Å; I803-L806 HydrophobicContact CB-CD2 4.25Å; I803-L806 HydrophobicContact CB-CG 4.23Å; I803-L806 HydrophobicContact CD1-CD2 4.33Å; I803-L806 HydrophobicContact CG2-CG 4.49Å; L806-Y808 HydrophobicContact CB-CE1 3.75Å; L806-Y808 HydrophobicContact CB-CE2 3.91Å; L806-Y808 VanDerWaalsContact CB-OH 3.26Å; L806-Y808 WeakPolarHBondContact CB-OH 3.34Å; L806-Y808 WeakPolarHBondContact CD1-OH 3.38Å; L806-I849 VanDerWaalsContact O-O 3.08Å; L806-D851 PolarHBondContact N-OD1 2.83Å; L806-V875 HydrophobicContact CD2-CG1 4.45Å
807	H	60.2	Low	59	Low	56 Å²	56	51.9 Å²	51.9	26%	0.259	27%	0.27	S	S	.	.			trans	-90.8	104.7	178.3	-74.7	-57.5	0	0	0	111.2	N848 Y850 L876	H807-N848 WeakPolarHBondContact CA-OD1 3.43Å; H807-N848 WeakPolarHBondContact CB-OD1 2.95Å; H807-N848 PolarHBondContact ND1-ND2 3.37Å; H807-Y850 AromaticContact CE1-CE1 3.43Å; H807-Y850 VanDerWaalsContact CE1-CE1 3.43Å; H807-Y850 WeakPolarHBondContact CE1-CE1 3.39Å; H807-Y850 AromaticContact CE1-CZ 3.85Å; H807-Y850 AromaticContact ND1-CE1 3.77Å; H807-L876 HydrophobicContact CB-CB 4.31Å; H807-L876 HydrophobicContact CB-CD1 4.23Å; H807-L876 PolarHBondContact O-N 3.08Å
808	Y	65.6	Low	57.7	Low	1 Å²	1	57.8 Å²	57.8	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.1	176	-55	-53.7	0	0	0	113.1	V777 W796 V798 L806 N848 I849 V873 L874 V875	V777-Y808 HydrophobicContact CG2-CE1 4.33Å; W796-Y808 AromaticContact NE1-CD2 3.9Å; V798-Y808 WeakPolarHBondContact CB-OH 3.31Å; V798-Y808 WeakPolarHBondContact CG1-OH 3.44Å; V798-Y808 HydrophobicContact CG2-CE1 3.91Å; V798-Y808 HydrophobicContact CG2-CE2 3.97Å; V798-Y808 VanDerWaalsContact CG2-CZ 3.43Å; V798-Y808 WeakPolarHBondContact CG2-OH 3.44Å; L806-Y808 HydrophobicContact CB-CE1 3.75Å; L806-Y808 HydrophobicContact CB-CE2 3.91Å; L806-Y808 VanDerWaalsContact CB-OH 3.26Å; L806-Y808 WeakPolarHBondContact CB-OH 3.34Å; L806-Y808 WeakPolarHBondContact CD1-OH 3.38Å; Y808-N848 PolarHBondContact N-OD1 2.69Å; Y808-N848 VanDerWaalsContact N-OD1 3.11Å; Y808-N848 WeakPolarHBondContact O-CA 3.33Å; Y808-N848 PolarHBondContact O-OD1 3.41Å; Y808-I849 VanDerWaalsContact CD2-O 3.23Å; Y808-I849 WeakPolarHBondContact CD2-O 3.45Å; Y808-I849 PolarHBondContact N-O 3.48Å; Y808-I849 PolarHBondContact O-N 2.9Å; Y808-V873 HydrophobicContact CD1-CG1 3.88Å; Y808-V873 HydrophobicContact CG-CG1 3.94Å; Y808-L874 WeakPolarHBondContact CA-O 3.28Å; Y808-V875 HydrophobicContact CD1-CG1 4.49Å; Y808-V875 HydrophobicContact CD1-CG2 4.06Å; Y808-V875 HydrophobicContact CE1-CG1 4.29Å; Y808-V875 HydrophobicContact CE1-CG2 3.94Å
809	Q	66.5	Low	56.3	Low	21 Å²	21	68.2 Å²	68.2	10%	0.098	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	132.8	165.3	-88.8	174.3	4.5	0	0	110.4	S828 I845 L874 L876	Q809-S828 VanDerWaalsContact NE2-CB 3.33Å; Q809-S828 PolarHBondContact NE2-OG 3.22Å; Q809-I845 HydrophobicContact CB-CG2 3.72Å; Q809-I845 HydrophobicContact CG-CG2 3.74Å; Q809-L874 HydrophobicContact CB-CB 4.16Å; Q809-L874 HydrophobicContact CB-CD1 4.35Å; Q809-L874 PolarHBondContact N-O 2.64Å; Q809-L874 WeakPolarHBondContact O-CB 3.27Å; Q809-L874 PolarHBondContact O-N 3.21Å; Q809-L876 HydrophobicContact CG-CD1 4.09Å; Q809-L876 HydrophobicContact CG-CG 4.42Å
810	L	66.1	Low	55.2	Low	1 Å²	1	73.8 Å²	73.8	1%	0.005	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	110.9	173.8	-174.5	74.4	0	0	0	109	I794 I845 L846 F857 L871 V873	I794-L810 HydrophobicContact CD1-CD2 4.07Å; L810-I845 WeakPolarHBondContact O-CA 3.16Å; L810-L846 HydrophobicContact CB-CB 4.22Å; L810-L846 HydrophobicContact CD2-CD1 4Å; L810-L846 PolarHBondContact O-N 2.59Å; L810-F857 HydrophobicContact CD2-CE2 3.5Å; L810-F857 VanDerWaalsContact CD2-CE2 3.5Å; L810-F857 HydrophobicContact CD2-CZ 3.57Å; L810-L871 HydrophobicContact CD1-CB 4.47Å; L810-L871 HydrophobicContact CD1-CD2 4.29Å; L810-L871 HydrophobicContact CD2-CD2 3.91Å; L810-L871 HydrophobicContact CG-CD2 4.05Å; L810-V873 HydrophobicContact CD1-CG2 3.67Å
811	G	70	Confident	54.2	Low	0 Å²	0	76.2 Å²	76.2	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	124.5	173.8	0	0	0	0	0	111	R872 W884	G811-R872 PolarHBondContact N-O 3.49Å; G811-R872 PolarHBondContact O-N 2.99Å; G811-W884 WeakPolarHBondContact O-CZ3 3.41Å
812	I	68.8	Low	52.9	Low	1 Å²	1	84 Å²	84	1%	0.005	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	138.7	171	-38.2	-168.4	0	0	0	108.9	F843 S844 L846 L862 F863 Y869 L871	I812-F843 WeakPolarHBondContact O-CA 3.29Å; I812-F843 WeakPolarHBondContact O-CD1 3.14Å; I812-S844 WeakPolarHBondContact CB-OG 3.3Å; I812-S844 PolarHBondContact N-O 2.78Å; I812-L846 HydrophobicContact CD1-CD1 3.94Å; I812-L846 HydrophobicContact CG1-CD1 4.23Å; I812-L862 HydrophobicContact CD1-CD2 4.05Å; I812-F863 HydrophobicContact CD1-CE1 4Å; I812-F863 HydrophobicContact CD1-CZ 3.86Å; I812-F863 HydrophobicContact CG2-CE1 3.95Å; I812-Y869 HydrophobicContact CG2-CD1 3.73Å; I812-Y869 HydrophobicContact CG2-CG 4.45Å; I812-L871 HydrophobicContact CB-CD2 4.24Å; I812-L871 HydrophobicContact CD1-CD2 4.2Å; I812-L871 HydrophobicContact CG1-CD2 3.75Å; I812-L871 HydrophobicContact CG2-CD2 4.09Å; I812-L871 HydrophobicContact CG2-CG 4.29Å
813	K	66.7	Low	52	Low	41 Å²	41	85.2 Å²	85.2	18%	0.178	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	122.7	165.8	173.2	164.2	-176.3	157.9	0	110.1	L815 E841 F843 Y869 S870 W884	K813-L815 HydrophobicContact CD-CD2 4.33Å; K813-L815 HydrophobicContact CG-CD2 4.26Å; K813-E841 WeakPolarHBondContact CE-OE2 3.28Å; K813-E841 IonicContact NZ-OE1 3.83Å; K813-E841 PolarHBondContact NZ-OE1 2.6Å; K813-E841 IonicContact NZ-OE2 2.95Å; K813-E841 PolarHBondContact NZ-OE2 3.46Å; K813-F843 HydrophobicContact CB-CD1 4.27Å; K813-F843 HydrophobicContact CB-CE1 3.96Å; K813-F843 HydrophobicContact CD-CE1 4.09Å; K813-F843 HydrophobicContact CG-CE1 4.27Å; K813-Y869 WeakPolarHBondContact O-CA 3.17Å; K813-S870 PolarHBondContact N-O 2.97Å; K813-S870 PolarHBondContact O-N 3.47Å; K813-W884 HydrophobicContact CB-CD2 4.44Å; K813-W884 HydrophobicContact CB-CE3 4.03Å; K813-W884 HydrophobicContact CB-CH2 3.21Å; K813-W884 HydrophobicContact CB-CZ2 3.63Å; K813-W884 HydrophobicContact CB-CZ3 3.42Å; K813-W884 VanDerWaalsContact CB-CZ3 3.42Å; K813-W884 HydrophobicContact CD-CH2 4.44Å; K813-W884 HydrophobicContact CD-CZ2 3.96Å; K813-W884 HydrophobicContact CG-CH2 4.41Å; K813-W884 HydrophobicContact CG-CZ2 4.42Å
814	H	64.3	Low	50.6	Low	65 Å²	65	89.2 Å²	89.2	30%	0.301	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	125.7	160.1	179.1	-98.6	0	0	0	109.6	G816 N867 Y869	H814-G816 VanDerWaalsContact C-N 3.29Å; H814-G816 PolarHBondContact ND1-N 2.98Å; H814-G816 PolarHBondContact O-N 3.34Å; H814-G816 VanDerWaalsContact O-N 3.15Å; H814-N867 PolarHBondContact NE2-OD1 3.28Å; H814-Y869 HydrophobicContact CB-CD1 4.4Å; H814-Y869 HydrophobicContact CB-CE1 4.11Å; H814-Y869 AromaticContact CD2-CE1 3.99Å; H814-Y869 AromaticContact CD2-CZ 3.99Å
815	L	57.3	Low	49.5	Very low	69 Å²	69	84.7 Å²	84.7	36%	0.361	43%	0.431	S	S	.	.			trans	-89.4	63.4	-179	-67.9	174.6	0	0	0	111.5	K813 S868 P887	K813-L815 HydrophobicContact CD-CD2 4.33Å; K813-L815 HydrophobicContact CG-CD2 4.26Å; L815-S868 WeakPolarHBondContact CB-O 3.36Å; L815-S868 PolarHBondContact N-O 3.32Å; L815-P887 HydrophobicContact CD1-CB 3.67Å; L815-P887 HydrophobicContact CD1-CG 3.74Å
816	G	55	Low	48.1	Very low	47 Å²	47	86 Å²	86	49%	0.485	45%	0.445	S	S	.	.			trans	-71.7	149.4	172.7	0	0	0	0	0	113.7	H814 I818	H814-G816 VanDerWaalsContact C-N 3.29Å; H814-G816 PolarHBondContact ND1-N 2.98Å; H814-G816 PolarHBondContact O-N 3.34Å; H814-G816 VanDerWaalsContact O-N 3.15Å; G816-I818 PolarHBondContact O-N 2.9Å
817	N	43.5	Very low	46.6	Very low	158 Å²	158	92.8 Å²	92.8	85%	0.845	48%	0.475	S	S	*	.			trans	-90.7	73.7	-169.6	-166.1	8.1	0	0	0	113.5
818	I	39.6	Very low	45	Very low	155 Å²	155	91.8 Å²	91.8	80%	0.795	47%	0.474	S	S	*	.			trans	-129.1	122.1	170.7	-59.4	-178.5	0	0	0	111	G816 Q820	G816-I818 PolarHBondContact O-N 2.9Å; I818-Q820 PolarHBondContact O-N 2.99Å
819	R	31.3	Very low	43	Very low	230 Å²	230	99.4 Å²	99.4	87%	0.868	52%	0.515	S	S	*	.			trans	-83.5	84.3	179.5	-67.4	-179.5	177.5	176.1	-0.9	112.7
820	Q	33	Very low	41	Very low	180 Å²	180	106.2 Å²	106.2	84%	0.841	55%	0.547	S	S	*	.			trans	-164.2	112.1	151.9	-115.5	167.7	63.4	0	0	112.4	I818 K822	I818-Q820 PolarHBondContact O-N 2.99Å; Q820-K822 PolarHBondContact O-N 3.5Å
821	T	27.2	Very low	39.2	Very low	145 Å²	145	113.6 Å²	113.6	89%	0.89	58%	0.576	S	S	*	*			trans	-85.5	112.7	-178.5	49.5	0	0	0	0	112.2
822	K	25.2	Very low	37	Very low	198 Å²	198	120 Å²	120	86%	0.861	61%	0.608	S	S	*	*			trans	-133.6	129.4	157.7	-75.9	-173.5	176.5	179.4	0	109.2	Q820	Q820-K822 PolarHBondContact O-N 3.5Å
823	S	28.5	Very low	34.9	Very low	98 Å²	98	128 Å²	128	69%	0.685	65%	0.646	S	S	*	*			trans	-103.2	129.5	-178.8	55	0	0	0	0	111.4
824	I	25.4	Very low	32.9	Very low	146 Å²	146	130.8 Å²	130.8	75%	0.749	67%	0.67	S	S	*	*			trans	-110.8	144.7	165.9	-65.3	177.8	0	0	0	108.3
825	I	30.7	Very low	31	Very low	74 Å²	74	137.7 Å²	137.7	38%	0.379	69%	0.694	S	S	.	*			trans	-117.8	103	175.6	-42	-173.8	0	0	0	107.5	W881	I825-W881 HydrophobicContact CB-CZ2 4.35Å; I825-W881 HydrophobicContact CD1-CH2 3.79Å; I825-W881 HydrophobicContact CD1-CZ2 3.52Å; I825-W881 HydrophobicContact CG1-CH2 3.8Å; I825-W881 HydrophobicContact CG1-CZ2 3.59Å; I825-W881 HydrophobicContact CG2-CZ2 4.04Å
826	T	27.1	Very low	29.5	Very low	121 Å²	121	141.2 Å²	141.2	74%	0.742	71%	0.713	S	S	*	*			trans	-89	125.4	166.8	35.8	0	0	0	0	109.1
827	F	25.9	Very low	28.3	Very low	141 Å²	141	148.4 Å²	148.4	62%	0.618	73%	0.731	S	S	*	*			trans	-80.9	135.8	172.4	-69.7	-90.5	0	0	0	109.5	N829 Q879	F827-N829 PolarHBondContact O-N 2.98Å; F827-Q879 HydrophobicContact CE1-CG 4.03Å; F827-Q879 HydrophobicContact CZ-CG 3.96Å
828	S	27.8	Very low	27.5	Very low	35 Å²	35	145.6 Å²	145.6	25%	0.245	72%	0.723	C	S	.	*	S	Bend	trans	-86.1	99.1	-176.2	65.9	0	0	0	0	112.6	Q809 L876	Q809-S828 VanDerWaalsContact NE2-CB 3.33Å; Q809-S828 PolarHBondContact NE2-OG 3.22Å; S828-L876 VanDerWaalsContact OG-CD2 3.28Å; S828-L876 WeakPolarHBondContact OG-CD2 3.39Å
829	N	22.9	Very low	27	Very low	162 Å²	162	146.3 Å²	146.3	87%	0.866	73%	0.729	S	S	*	*	S	Bend	trans	-108.2	-15.1	146.8	-92.6	-6.4	0	0	0	112.2	F827	F827-N829 PolarHBondContact O-N 2.98Å
830	E	24.9	Very low	27	Very low	164 Å²	164	138.8 Å²	138.8	77%	0.766	72%	0.723	S	S	*	*			trans	-125.5	84.1	-176.1	-65	-174.3	145.5	0	0	112.3
831	Y	27.6	Very low	27.2	Very low	156 Å²	156	134.9 Å²	134.9	61%	0.612	71%	0.705	S	S	*	*			trans	-93.4	28.2	143.2	-105.4	-83.3	0	0	0	111.1	I845	Y831-I845 HydrophobicContact CE2-CB 3.82Å; Y831-I845 HydrophobicContact CE2-CD1 4.26Å; Y831-I845 HydrophobicContact CE2-CG1 4.43Å; Y831-I845 HydrophobicContact CE2-CG2 4.35Å
832	I	24.3	Very low	27.8	Very low	133 Å²	133	137 Å²	137	68%	0.682	70%	0.704	S	S	*	*	S	Bend	trans	-92.7	104.5	161.3	-62.4	178.9	0	0	0	107.3
833	H	25.7	Very low	28.8	Very low	170 Å²	170	130.8 Å²	130.8	79%	0.787	68%	0.678	S	S	*	*			trans	49.1	89	155.2	-77.1	56.5	0	0	0	118.9
834	S	24.4	Very low	29.9	Very low	99 Å²	99	128.4 Å²	128.4	69%	0.692	66%	0.661	S	S	*	*				96.4	146.2	114.2	83.9	0	0	0	0	122
835	R	24.4	Very low	31	Very low	211 Å²	211	123.5 Å²	123.5	80%	0.796	64%	0.636	S	S	*	*			trans	85.2	99.2	135.6	-162.6	173.1	-71.1	176.7	-0.5	119.7
836	N	25.9	Very low	32.2	Very low	142 Å²	142	121.3 Å²	121.3	76%	0.759	63%	0.625	S	S	*	*			trans	64.7	113.1	140.4	-57.8	7.2	0	0	0	119.6
837	K	28.2	Very low	33.4	Very low	199 Å²	199	120.3 Å²	120.3	87%	0.865	62%	0.62	S	S	*	*				-160.6	116.4	112.6	-106.8	158.9	-174.4	174.3	0	112.8
838	S	28.2	Very low	34.6	Very low	99 Å²	99	116.8 Å²	116.8	69%	0.692	61%	0.608	S	S	*	*			trans	28.2	122.3	149.3	57.5	0	0	0	0	120.5
839	N	29.2	Very low	36	Very low	169 Å²	169	116.5 Å²	116.5	90%	0.904	60%	0.603	S	S	*	*	S	Bend	trans	74.3	96.4	157.1	-54.5	-7.6	0	0	0	117.6
840	G	31.7	Very low	37.4	Very low	72 Å²	72	115.1 Å²	115.1	74%	0.742	59%	0.587	S	S	*	*	S	Bend	trans	135.6	103.4	155.4	0	0	0	0	0	115
841	E	35.2	Very low	38.8	Very low	99 Å²	99	110.3 Å²	110.3	46%	0.463	57%	0.566	S	S	.	*			trans	56.1	101.1	163.9	-50.1	-166.9	164.8	0	0	116.6	K813 F843	K813-E841 WeakPolarHBondContact CE-OE2 3.28Å; K813-E841 IonicContact NZ-OE1 3.83Å; K813-E841 PolarHBondContact NZ-OE1 2.6Å; K813-E841 IonicContact NZ-OE2 2.95Å; K813-E841 PolarHBondContact NZ-OE2 3.46Å; E841-F843 HydrophobicContact CB-CD2 4.27Å; E841-F843 HydrophobicContact CB-CE2 3.64Å; E841-F843 HydrophobicContact CB-CZ 3.96Å; E841-F843 WeakPolarHBondContact O-CD2 3.44Å; E841-F843 PolarHBondContact O-N 3.05Å; E841-F843 WeakPolarHBondContact OE2-CZ 3.17Å
842	E	41.4	Very low	40.1	Very low	188 Å²	188	107.1 Å²	107.1	88%	0.879	56%	0.56	S	S	*	*			trans	-69.7	115.5	165.8	-73.2	-164.3	141.6	0	0	110.6
843	F	46.3	Very low	41.5	Very low	69 Å²	69	101.6 Å²	101.6	30%	0.303	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	112.9	168.4	-63.2	-80.9	0	0	0	109.6	I812 K813 E841 W884	I812-F843 WeakPolarHBondContact O-CA 3.29Å; I812-F843 WeakPolarHBondContact O-CD1 3.14Å; K813-F843 HydrophobicContact CB-CD1 4.27Å; K813-F843 HydrophobicContact CB-CE1 3.96Å; K813-F843 HydrophobicContact CD-CE1 4.09Å; K813-F843 HydrophobicContact CG-CE1 4.27Å; E841-F843 HydrophobicContact CB-CD2 4.27Å; E841-F843 HydrophobicContact CB-CE2 3.64Å; E841-F843 HydrophobicContact CB-CZ 3.96Å; E841-F843 WeakPolarHBondContact O-CD2 3.44Å; E841-F843 PolarHBondContact O-N 3.05Å; E841-F843 WeakPolarHBondContact OE2-CZ 3.17Å; F843-W884 HydrophobicContact CD1-CH2 4.09Å; F843-W884 HydrophobicContact CD1-CZ2 4.36Å; F843-W884 AromaticContact CE1-CH2 3.86Å; F843-W884 HydrophobicContact CE1-CH2 3.86Å; F843-W884 AromaticContact CE1-CZ2 3.68Å; F843-W884 HydrophobicContact CE1-CZ2 3.68Å
844	S	50	Low	42.9	Very low	48 Å²	48	96.9 Å²	96.9	34%	0.336	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	122.1	161.6	38.6	0	0	0	0	108.7	I812	I812-S844 WeakPolarHBondContact CB-OG 3.3Å; I812-S844 PolarHBondContact N-O 2.78Å
845	I	48.6	Very low	44.5	Very low	43 Å²	43	94.2 Å²	94.2	22%	0.221	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123	176	-60.2	-178.8	0	0	0	108.3	Q809 L810 Y831 L874	Q809-I845 HydrophobicContact CB-CG2 3.72Å; Q809-I845 HydrophobicContact CG-CG2 3.74Å; L810-I845 WeakPolarHBondContact O-CA 3.16Å; Y831-I845 HydrophobicContact CE2-CB 3.82Å; Y831-I845 HydrophobicContact CE2-CD1 4.26Å; Y831-I845 HydrophobicContact CE2-CG1 4.43Å; Y831-I845 HydrophobicContact CE2-CG2 4.35Å; I845-L874 HydrophobicContact CD1-CD1 4.24Å
846	L	57.6	Low	45.7	Very low	28 Å²	28	89.1 Å²	89.1	15%	0.147	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	154.8	-177.3	-75.2	156.1	0	0	0	111.3	L810 I812 F857 L862	L810-L846 HydrophobicContact CB-CB 4.22Å; L810-L846 HydrophobicContact CD2-CD1 4Å; L810-L846 PolarHBondContact O-N 2.59Å; I812-L846 HydrophobicContact CD1-CD1 3.94Å; I812-L846 HydrophobicContact CG1-CD1 4.23Å; L846-F857 HydrophobicContact CD1-CD1 4.21Å; L846-F857 HydrophobicContact CD1-CE1 3.59Å; L846-F857 HydrophobicContact CD1-CZ 3.86Å; L846-F857 HydrophobicContact CD2-CE1 4.14Å; L846-F857 HydrophobicContact CG-CE1 4.35Å; L846-L862 HydrophobicContact CD1-CD1 4.48Å; L846-L862 HydrophobicContact CD2-CD1 4.17Å; L846-L862 HydrophobicContact CD2-CD2 4.31Å
847	P	51.2	Low	47.2	Very low	100 Å²	100	83.6 Å²	83.6	65%	0.649	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	165.4	-168.4	24.4	-35.3	0	0	0	114.3	I849	P847-I849 VanDerWaalsContact O-CD1 3.28Å; P847-I849 WeakPolarHBondContact O-CD1 3.14Å; P847-I849 WeakPolarHBondContact O-CG1 3.45Å
848	N	51.5	Low	48.3	Very low	66 Å²	66	77.7 Å²	77.7	35%	0.353	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	129.7	-171.2	-123.7	-16.7	0	0	0	112.8	H807 Y808	H807-N848 WeakPolarHBondContact CA-OD1 3.43Å; H807-N848 WeakPolarHBondContact CB-OD1 2.95Å; H807-N848 PolarHBondContact ND1-ND2 3.37Å; Y808-N848 PolarHBondContact N-OD1 2.69Å; Y808-N848 VanDerWaalsContact N-OD1 3.11Å; Y808-N848 WeakPolarHBondContact O-CA 3.33Å; Y808-N848 PolarHBondContact O-OD1 3.41Å
849	I	57.6	Low	49.4	Very low	29 Å²	29	73 Å²	73	15%	0.149	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.6	-177.5	-51.6	132.6	0	0	0	109.7	W796 L806 Y808 P847 S853 I855	W796-I849 HydrophobicContact CH2-CD1 4.02Å; W796-I849 HydrophobicContact CZ2-CB 4.39Å; W796-I849 HydrophobicContact CZ2-CD1 4.01Å; W796-I849 HydrophobicContact CZ2-CG2 4.29Å; L806-I849 VanDerWaalsContact O-O 3.08Å; Y808-I849 VanDerWaalsContact CD2-O 3.23Å; Y808-I849 WeakPolarHBondContact CD2-O 3.45Å; Y808-I849 PolarHBondContact N-O 3.48Å; Y808-I849 PolarHBondContact O-N 2.9Å; P847-I849 VanDerWaalsContact O-CD1 3.28Å; P847-I849 WeakPolarHBondContact O-CD1 3.14Å; P847-I849 WeakPolarHBondContact O-CG1 3.45Å; I849-S853 WeakPolarHBondContact CG2-OG 3.5Å; I849-I855 HydrophobicContact CB-CD1 4.45Å; I849-I855 HydrophobicContact CD1-CD1 3.49Å; I849-I855 VanDerWaalsContact CD1-CD1 3.49Å; I849-I855 HydrophobicContact CG1-CD1 3.65Å; I849-I855 HydrophobicContact CG2-CD1 3.97Å
850	Y	51	Low	50.4	Low	134 Å²	134	70.9 Å²	70.9	53%	0.525	38%	0.378	S	S	.	.			trans	-92.8	168.3	-178.7	-55	-80.4	0	0	0	113.4	E805 H807 S853	E805-Y850 HydrophobicContact CB-CD1 4.29Å; H807-Y850 AromaticContact CE1-CE1 3.43Å; H807-Y850 VanDerWaalsContact CE1-CE1 3.43Å; H807-Y850 WeakPolarHBondContact CE1-CE1 3.39Å; H807-Y850 AromaticContact CE1-CZ 3.85Å; H807-Y850 AromaticContact ND1-CE1 3.77Å; Y850-S853 WeakPolarHBondContact O-CB 3.32Å; Y850-S853 PolarHBondContact O-OG 3.26Å
851	D	55	Low	51.2	Low	63 Å²	63	74 Å²	74	34%	0.337	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-26.2	133.8	-173.1	-71.5	46	0	0	0	119.4	L806 S853	L806-D851 PolarHBondContact N-OD1 2.83Å; D851-S853 VanDerWaalsContact C-N 3.25Å; D851-S853 PolarHBondContact O-N 2.82Å; D851-S853 VanDerWaalsContact O-N 3.14Å
852	N	54	Low	52.2	Low	88 Å²	88	71.7 Å²	71.7	47%	0.471	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	38	170.7	-73.7	-34.9	0	0	0	115.9	T797 V798	T797-N852 WeakPolarHBondContact CA-OD1 3.37Å; V798-N852 PolarHBondContact N-OD1 3.38Å
853	S	54.3	Low	53	Low	17 Å²	17	63 Å²	63	12%	0.119	33%	0.327	C	S	.	.			trans	-74.5	146	-174.6	18.7	0	0	0	0	114.2	W796 I849 Y850 D851	W796-S853 VanDerWaalsContact CZ2-OG 3.29Å; W796-S853 WeakPolarHBondContact CZ2-OG 3.44Å; W796-S853 PolarHBondContact N-O 2.96Å; I849-S853 WeakPolarHBondContact CG2-OG 3.5Å; Y850-S853 WeakPolarHBondContact O-CB 3.32Å; Y850-S853 PolarHBondContact O-OG 3.26Å; D851-S853 VanDerWaalsContact C-N 3.25Å; D851-S853 PolarHBondContact O-N 2.82Å; D851-S853 VanDerWaalsContact O-N 3.14Å
854	S	55	Low	53.4	Low	71 Å²	71	62.5 Å²	62.5	50%	0.497	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.3	162.4	53.4	0	0	0	0	109.1	H793 I794	H793-S854 WeakPolarHBondContact NE2-CB 3.49Å; I794-S854 CarbonylContact O-C 3.54Å; I794-S854 WeakPolarHBondContact O-CA 3.3Å
855	I	58.3	Low	53.4	Low	44 Å²	44	61.9 Å²	61.9	23%	0.226	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	144.3	179.9	-62.6	-170.1	0	0	0	110.2	I794 W796 I849 F857	I794-I855 PolarHBondContact N-O 2.89Å; I794-I855 PolarHBondContact O-N 3.38Å; W796-I855 HydrophobicContact CH2-CB 4.42Å; W796-I855 HydrophobicContact CH2-CD1 3.99Å; W796-I855 HydrophobicContact CH2-CG1 3.99Å; I849-I855 HydrophobicContact CB-CD1 4.45Å; I849-I855 HydrophobicContact CD1-CD1 3.49Å; I849-I855 VanDerWaalsContact CD1-CD1 3.49Å; I849-I855 HydrophobicContact CG1-CD1 3.65Å; I849-I855 HydrophobicContact CG2-CD1 3.97Å; I855-F857 HydrophobicContact CB-CD2 4.43Å; I855-F857 HydrophobicContact CB-CE2 3.8Å; I855-F857 HydrophobicContact CB-CZ 4.1Å; I855-F857 HydrophobicContact CD1-CZ 4.37Å; I855-F857 HydrophobicContact CG2-CD1 4.26Å; I855-F857 HydrophobicContact CG2-CD2 3.83Å; I855-F857 HydrophobicContact CG2-CE1 3.89Å; I855-F857 HydrophobicContact CG2-CE2 3.43Å; I855-F857 VanDerWaalsContact CG2-CE2 3.43Å; I855-F857 HydrophobicContact CG2-CG 4.23Å; I855-F857 HydrophobicContact CG2-CZ 3.47Å; I855-F857 VanDerWaalsContact CG2-CZ 3.47Å
856	I	49.7	Very low	53.6	Low	104 Å²	104	61.3 Å²	61.3	53%	0.533	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.6	168.7	-59.5	171.5	0	0	0	107.4	L785 A791 V792 H793	L785-I856 HydrophobicContact CD1-CD1 4.04Å; L785-I856 HydrophobicContact CD1-CG1 4.2Å; L785-I856 HydrophobicContact CD1-CG2 3.65Å; A791-I856 HydrophobicContact CB-CG2 3.94Å; V792-I856 WeakPolarHBondContact O-CA 3.17Å; H793-I856 HydrophobicContact CB-CG1 4.2Å
857	F	58	Low	53.6	Low	26 Å²	26	60.3 Å²	60.3	11%	0.114	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.1	172.9	-65.2	-83.3	0	0	0	109.3	A791 V792 I794 L810 L846 I855 L862 F863	A791-F857 CarbonylContact C-O 3.4Å; A791-F857 WeakPolarHBondContact CA-O 3.38Å; V792-F857 PolarHBondContact N-O 3.28Å; V792-F857 PolarHBondContact O-N 2.73Å; I794-F857 HydrophobicContact CB-CE2 4.45Å; I794-F857 HydrophobicContact CD1-CD2 3.62Å; I794-F857 HydrophobicContact CD1-CE2 3.79Å; I794-F857 HydrophobicContact CG1-CD2 3.98Å; I794-F857 HydrophobicContact CG1-CE2 4.25Å; L810-F857 HydrophobicContact CD2-CE2 3.5Å; L810-F857 VanDerWaalsContact CD2-CE2 3.5Å; L810-F857 HydrophobicContact CD2-CZ 3.57Å; L846-F857 HydrophobicContact CD1-CD1 4.21Å; L846-F857 HydrophobicContact CD1-CE1 3.59Å; L846-F857 HydrophobicContact CD1-CZ 3.86Å; L846-F857 HydrophobicContact CD2-CE1 4.14Å; L846-F857 HydrophobicContact CG-CE1 4.35Å; I855-F857 HydrophobicContact CB-CD2 4.43Å; I855-F857 HydrophobicContact CB-CE2 3.8Å; I855-F857 HydrophobicContact CB-CZ 4.1Å; I855-F857 HydrophobicContact CD1-CZ 4.37Å; I855-F857 HydrophobicContact CG2-CD1 4.26Å; I855-F857 HydrophobicContact CG2-CD2 3.83Å; I855-F857 HydrophobicContact CG2-CE1 3.89Å; I855-F857 HydrophobicContact CG2-CE2 3.43Å; I855-F857 VanDerWaalsContact CG2-CE2 3.43Å; I855-F857 HydrophobicContact CG2-CG 4.23Å; I855-F857 HydrophobicContact CG2-CZ 3.47Å; I855-F857 VanDerWaalsContact CG2-CZ 3.47Å; F857-L862 HydrophobicContact CD1-CD1 4.21Å; F857-F863 HydrophobicContact CB-CE2 4.47Å
858	D	50.4	Low	54	Low	75 Å²	75	57.4 Å²	57.4	40%	0.401	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	120.6	166.5	-166.3	-14.3	0	0	0	108	R860	D858-R860 VanDerWaalsContact C-N 3.29Å; D858-R860 VanDerWaalsContact CG-NE 3.33Å; D858-R860 PolarHBondContact O-N 2.83Å; D858-R860 WeakPolarHBondContact OD1-CG 3.4Å; D858-R860 IonicContact OD1-NE 2.75Å; D858-R860 PolarHBondContact OD1-NE 3.19Å; D858-R860 VanDerWaalsContact OD1-NE 3.11Å; D858-R860 IonicContact OD2-CZ 2.62Å; D858-R860 VanDerWaalsContact OD2-CZ 3.23Å; D858-R860 IonicContact OD2-NE 2.72Å; D858-R860 PolarHBondContact OD2-NE 3.01Å; D858-R860 IonicContact OD2-NH2 2.69Å; D858-R860 PolarHBondContact OD2-NH2 3.35Å
859	S	51.8	Low	54.8	Low	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-75.6	-10.1	-158.7	64.7	0	0	0	0	116.3	M790 D861 L862 F863 M893	M790-S859 WeakPolarHBondContact CA-OG 3.38Å; M790-S859 WeakPolarHBondContact CB-OG 3.4Å; M790-S859 WeakPolarHBondContact O-CB 3.35Å; M790-S859 PolarHBondContact O-N 2.85Å; M790-S859 PolarHBondContact O-OG 2.94Å; S859-D861 PolarHBondContact O-N 3.3Å; S859-L862 PolarHBondContact O-N 2.98Å; S859-F863 PolarHBondContact O-N 3.38Å; S859-M893 VanDerWaalsContact OG-CE 3.3Å; S859-M893 WeakPolarHBondContact OG-CE 3.48Å; S859-M893 PolarHBondContact OG-SD 3.43Å
860	R	50.5	Low	55.3	Low	124 Å²	124	53.6 Å²	53.6	47%	0.468	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-54.5	-33.7	-158	-32	-165.4	-162.6	166.3	12.7	114.8	M790 D858	M790-R860 HydrophobicContact CE-CB 3.91Å; M790-R860 HydrophobicContact CE-CG 3.72Å; M790-R860 HydrophobicContact SD-CG 3.91Å; D858-R860 VanDerWaalsContact C-N 3.29Å; D858-R860 VanDerWaalsContact CG-NE 3.33Å; D858-R860 PolarHBondContact O-N 2.83Å; D858-R860 WeakPolarHBondContact OD1-CG 3.4Å; D858-R860 IonicContact OD1-NE 2.75Å; D858-R860 PolarHBondContact OD1-NE 3.19Å; D858-R860 VanDerWaalsContact OD1-NE 3.11Å; D858-R860 IonicContact OD2-CZ 2.62Å; D858-R860 VanDerWaalsContact OD2-CZ 3.23Å; D858-R860 IonicContact OD2-NE 2.72Å; D858-R860 PolarHBondContact OD2-NE 3.01Å; D858-R860 IonicContact OD2-NH2 2.69Å; D858-R860 PolarHBondContact OD2-NH2 3.35Å
861	D	48.8	Very low	56.4	Low	137 Å²	137	47.2 Å²	47.2	73%	0.733	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-104.9	-19.8	-178.4	-53.5	-43.7	0	0	0	113.8	S859	S859-D861 PolarHBondContact O-N 3.3Å
862	L	55.1	Low	57.2	Low	51 Å²	51	45.4 Å²	45.4	27%	0.267	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-25.5	-166.3	-81.1	162.5	0	0	0	114.4	I812 L846 F857 S859	I812-L862 HydrophobicContact CD1-CD2 4.05Å; L846-L862 HydrophobicContact CD1-CD1 4.48Å; L846-L862 HydrophobicContact CD2-CD1 4.17Å; L846-L862 HydrophobicContact CD2-CD2 4.31Å; F857-L862 HydrophobicContact CD1-CD1 4.21Å; S859-L862 PolarHBondContact O-N 2.98Å
863	F	58.7	Low	58.2	Low	6 Å²	6	41.2 Å²	41.2	3%	0.026	21%	0.214	C	C	.	.			trans	-128.9	139.1	-179.1	-52.8	-86.8	0	0	0	109.4	I812 F857 S859 Y869 L871 F890 M893	I812-F863 HydrophobicContact CD1-CE1 4Å; I812-F863 HydrophobicContact CD1-CZ 3.86Å; I812-F863 HydrophobicContact CG2-CE1 3.95Å; F857-F863 HydrophobicContact CB-CE2 4.47Å; S859-F863 PolarHBondContact O-N 3.38Å; F863-Y869 HydrophobicContact CB-CD2 4.33Å; F863-Y869 HydrophobicContact CB-CE2 4.01Å; F863-Y869 AromaticContact CD1-CD1 3.94Å; F863-Y869 HydrophobicContact CD1-CD1 3.94Å; F863-Y869 AromaticContact CD1-CD2 3.75Å; F863-Y869 HydrophobicContact CD1-CD2 3.75Å; F863-Y869 HydrophobicContact CD1-CE1 4.32Å; F863-Y869 HydrophobicContact CD1-CE2 4.15Å; F863-Y869 AromaticContact CD1-CG 3.63Å; F863-Y869 HydrophobicContact CD1-CG 3.63Å; F863-Y869 HydrophobicContact CE1-CD1 4.43Å; F863-Y869 HydrophobicContact CE1-CG 4.19Å; F863-L871 HydrophobicContact CE1-CD1 4.29Å; F863-L871 HydrophobicContact CZ-CD1 4.47Å; F863-L871 HydrophobicContact CZ-CD2 4.38Å; F863-F890 AromaticContact CD1-CE2 3.84Å; F863-F890 HydrophobicContact CD1-CE2 3.84Å; F863-F890 HydrophobicContact CD1-CZ 4.31Å; F863-F890 HydrophobicContact CE1-CE2 4.3Å; F863-F890 HydrophobicContact CG-CE2 4.28Å; F863-M893 HydrophobicContact CB-CE 3.94Å; F863-M893 WeakPolarHBondContact O-CE 3.47Å
864	Q	54.7	Low	58.9	Low	59 Å²	59	41.2 Å²	41.2	28%	0.276	21%	0.213	S	C	.	.			trans	-97.4	152.9	175.2	-60.7	-180	15.7	0	0	109.3	Y869 Y1027	Q864-Y869 WeakPolarHBondContact CB-OH 3.35Å; Q864-Y869 PolarHBondContact N-OH 2.91Å; Q864-Y1027 PolarHBondContact OE1-OH 3.3Å
865	P	49.5	Very low	59.7	Low	35 Å²	35	38.1 Å²	38.1	23%	0.227	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	150.6	174.8	-22.8	32.7	0	0	0	112	N867 M893 L894	P865-N867 PolarHBondContact O-N 2.94Å; P865-N867 PolarHBondContact O-ND2 3.46Å; P865-M893 HydrophobicContact CB-CB 3.81Å; P865-M893 HydrophobicContact CG-CB 3.8Å; P865-L894 HydrophobicContact CG-CD1 4.27Å; P865-L894 HydrophobicContact CG-CG 4.17Å
866	Q	52.9	Low	59.7	Low	30 Å²	30	38.2 Å²	38.2	14%	0.14	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	-11.1	161.5	-152	176.7	7.6	0	0	116.5	N889 F890 E961 T1029	Q866-N889 VanDerWaalsContact C-OD1 3.24Å; Q866-N889 PolarHBondContact O-OD1 2.89Å; Q866-F890 PolarHBondContact N-O 2.98Å; Q866-E961 HydrophobicContact CB-CG 4.47Å; Q866-E961 WeakPolarHBondContact CB-OE2 3.46Å; Q866-E961 HydrophobicContact CG-CB 3.93Å; Q866-E961 HydrophobicContact CG-CG 4.33Å; Q866-T1029 PolarHBondContact OE1-OG1 2.68Å
867	N	57.5	Low	60.3	Low	8 Å²	8	37.8 Å²	37.8	4%	0.043	19%	0.187	C	C	.	.			trans	-84.6	132.3	176.4	-77.3	-96.7	0	0	0	109.7	H814 P865 Y869 E961	H814-N867 PolarHBondContact NE2-OD1 3.28Å; P865-N867 PolarHBondContact O-N 2.94Å; P865-N867 PolarHBondContact O-ND2 3.46Å; N867-Y869 HydrophobicContact CB-CE2 3.76Å; N867-Y869 WeakPolarHBondContact O-CD2 3.36Å; N867-Y869 WeakPolarHBondContact O-CE2 3.31Å; N867-E961 PolarHBondContact N-OE2 2.85Å; N867-E961 VanDerWaalsContact ND2-CD 3.32Å; N867-E961 PolarHBondContact ND2-OE1 3.45Å; N867-E961 PolarHBondContact ND2-OE2 2.88Å
868	S	59.8	Low	60.2	Low	38 Å²	38	39.9 Å²	39.9	27%	0.266	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	126.6	173.7	-78.5	0	0	0	0	111.3	L815	L815-S868 WeakPolarHBondContact CB-O 3.36Å; L815-S868 PolarHBondContact N-O 3.32Å
869	Y	68.4	Low	60.4	Low	13 Å²	13	42.1 Å²	42.1	5%	0.051	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145.2	172.3	-66.9	-93.7	0	0	0	111.2	I812 K813 H814 F863 Q864 N867 V888 F890	I812-Y869 HydrophobicContact CG2-CD1 3.73Å; I812-Y869 HydrophobicContact CG2-CG 4.45Å; K813-Y869 WeakPolarHBondContact O-CA 3.17Å; H814-Y869 HydrophobicContact CB-CD1 4.4Å; H814-Y869 HydrophobicContact CB-CE1 4.11Å; H814-Y869 AromaticContact CD2-CE1 3.99Å; H814-Y869 AromaticContact CD2-CZ 3.99Å; F863-Y869 HydrophobicContact CB-CD2 4.33Å; F863-Y869 HydrophobicContact CB-CE2 4.01Å; F863-Y869 AromaticContact CD1-CD1 3.94Å; F863-Y869 HydrophobicContact CD1-CD1 3.94Å; F863-Y869 AromaticContact CD1-CD2 3.75Å; F863-Y869 HydrophobicContact CD1-CD2 3.75Å; F863-Y869 HydrophobicContact CD1-CE1 4.32Å; F863-Y869 HydrophobicContact CD1-CE2 4.15Å; F863-Y869 AromaticContact CD1-CG 3.63Å; F863-Y869 HydrophobicContact CD1-CG 3.63Å; F863-Y869 HydrophobicContact CE1-CD1 4.43Å; F863-Y869 HydrophobicContact CE1-CG 4.19Å; Q864-Y869 WeakPolarHBondContact CB-OH 3.35Å; Q864-Y869 PolarHBondContact N-OH 2.91Å; N867-Y869 HydrophobicContact CB-CE2 3.76Å; N867-Y869 WeakPolarHBondContact O-CD2 3.36Å; N867-Y869 WeakPolarHBondContact O-CE2 3.31Å; Y869-V888 PolarHBondContact N-O 3.38Å; Y869-V888 VanDerWaalsContact N-O 3.08Å; Y869-V888 PolarHBondContact O-N 3.03Å; Y869-F890 AromaticContact CD2-CD2 3.87Å; Y869-F890 HydrophobicContact CD2-CD2 3.87Å; Y869-F890 HydrophobicContact CD2-CE2 4Å; Y869-F890 HydrophobicContact CG-CE2 4.5Å
870	S	68.8	Low	60.7	Low	2 Å²	2	43.6 Å²	43.6	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	149.4	162.8	-167.1	0	0	0	0	110.2	K813 W884 T885	K813-S870 PolarHBondContact N-O 2.97Å; K813-S870 PolarHBondContact O-N 3.47Å; S870-W884 VanDerWaalsContact O-CZ3 3.31Å; S870-W884 WeakPolarHBondContact O-CZ3 3.39Å; S870-W884 WeakPolarHBondContact OG-CA 3.3Å; S870-W884 VanDerWaalsContact OG-CB 3.23Å; S870-W884 WeakPolarHBondContact OG-CB 3.42Å; S870-T885 WeakPolarHBondContact CA-OG1 3.47Å; S870-T885 PolarHBondContact OG-N 2.99Å; S870-T885 PolarHBondContact OG-O 2.9Å; S870-T885 PolarHBondContact OG-OG1 2.68Å
871	L	74.2	Confident	61.3	Low	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	143.7	180	-70.7	128.1	0	0	0	110.1	V782 I794 L810 I812 F863 W884 T885	V782-L871 HydrophobicContact CG2-CD1 3.67Å; I794-L871 HydrophobicContact CD1-CD1 3.84Å; I794-L871 HydrophobicContact CD1-CD2 3.79Å; I794-L871 HydrophobicContact CD1-CG 4.37Å; L810-L871 HydrophobicContact CD1-CB 4.47Å; L810-L871 HydrophobicContact CD1-CD2 4.29Å; L810-L871 HydrophobicContact CD2-CD2 3.91Å; L810-L871 HydrophobicContact CG-CD2 4.05Å; I812-L871 HydrophobicContact CB-CD2 4.24Å; I812-L871 HydrophobicContact CD1-CD2 4.2Å; I812-L871 HydrophobicContact CG1-CD2 3.75Å; I812-L871 HydrophobicContact CG2-CD2 4.09Å; I812-L871 HydrophobicContact CG2-CG 4.29Å; F863-L871 HydrophobicContact CE1-CD1 4.29Å; F863-L871 HydrophobicContact CZ-CD1 4.47Å; F863-L871 HydrophobicContact CZ-CD2 4.38Å; L871-W884 CarbonylContact O-C 3.55Å; L871-W884 WeakPolarHBondContact O-CA 3.29Å; L871-T885 HydrophobicContact CB-CG2 3.89Å; L871-T885 PolarHBondContact N-OG1 2.85Å; L871-T885 WeakPolarHBondContact O-CG2 3.25Å; L871-T885 PolarHBondContact O-N 3.28Å
872	R	71.6	Confident	62.3	Low	26 Å²	26	36.1 Å²	36.1	10%	0.098	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	146.4	169.4	71.7	179.7	163.1	163.2	-4.4	110.4	G811 L874 W881 S882 W884	G811-R872 PolarHBondContact N-O 3.49Å; G811-R872 PolarHBondContact O-N 2.99Å; R872-L874 HydrophobicContact CG-CD2 4Å; R872-L874 HydrophobicContact CG-CG 4.4Å; R872-W881 VanDerWaalsContact NH1-CD2 3.26Å; R872-S882 VanDerWaalsContact CA-OG 3.27Å; R872-S882 WeakPolarHBondContact CA-OG 3.32Å; R872-W884 HydrophobicContact CB-CD2 4.02Å; R872-W884 HydrophobicContact CB-CE3 3.71Å; R872-W884 HydrophobicContact CB-CH2 4.18Å; R872-W884 HydrophobicContact CB-CZ2 4.49Å; R872-W884 HydrophobicContact CB-CZ3 3.8Å; R872-W884 HydrophobicContact CG-CD2 4.27Å; R872-W884 HydrophobicContact CG-CE3 3.98Å; R872-W884 HydrophobicContact CG-CH2 3.49Å; R872-W884 VanDerWaalsContact CG-CH2 3.49Å; R872-W884 HydrophobicContact CG-CZ2 3.83Å; R872-W884 HydrophobicContact CG-CZ3 3.59Å; R872-W884 VanDerWaalsContact NE-CH2 3.3Å
873	V	75	Confident	62.8	Low	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124.2	169.2	175.6	0	0	0	0	108.4	V777 P780 W796 Y808 L810 W881 S882	V777-V873 HydrophobicContact CG1-CB 3.68Å; V777-V873 HydrophobicContact CG1-CG1 3.81Å; V777-V873 HydrophobicContact CG1-CG2 4.25Å; V777-V873 HydrophobicContact CG2-CG1 4.33Å; P780-V873 HydrophobicContact CG-CG2 4.04Å; W796-V873 HydrophobicContact CB-CG2 4.28Å; W796-V873 HydrophobicContact CD2-CG2 3.74Å; W796-V873 HydrophobicContact CE3-CG2 4.25Å; W796-V873 HydrophobicContact CG-CG2 3.75Å; Y808-V873 HydrophobicContact CD1-CG1 3.88Å; Y808-V873 HydrophobicContact CG-CG1 3.94Å; L810-V873 HydrophobicContact CD1-CG2 3.67Å; V873-W881 CarbonylContact O-C 3.38Å; V873-W881 WeakPolarHBondContact O-CA 3.39Å; V873-S882 PolarHBondContact N-OG 3.44Å; V873-S882 PolarHBondContact O-N 3.49Å
874	L	68.7	Low	63.4	Low	17 Å²	17	40.5 Å²	40.5	9%	0.089	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.4	175.4	-54.8	171.6	0	0	0	107.6	Y808 Q809 I845 R872 W881	Y808-L874 WeakPolarHBondContact CA-O 3.28Å; Q809-L874 HydrophobicContact CB-CB 4.16Å; Q809-L874 HydrophobicContact CB-CD1 4.35Å; Q809-L874 PolarHBondContact N-O 2.64Å; Q809-L874 WeakPolarHBondContact O-CB 3.27Å; Q809-L874 PolarHBondContact O-N 3.21Å; I845-L874 HydrophobicContact CD1-CD1 4.24Å; R872-L874 HydrophobicContact CG-CD2 4Å; R872-L874 HydrophobicContact CG-CG 4.4Å; L874-W881 HydrophobicContact CD2-CB 4.34Å; L874-W881 HydrophobicContact CD2-CD2 4.35Å; L874-W881 HydrophobicContact CD2-CG 3.76Å
875	V	70.3	Confident	64.2	Low	6 Å²	6	38 Å²	38	4%	0.036	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	133.4	164.6	-167.2	0	0	0	0	107.4	I775 V777 L806 Y808 H878 L880	I775-V875 HydrophobicContact CG2-CG2 4.46Å; V777-V875 HydrophobicContact CG2-CG2 3.53Å; L806-V875 HydrophobicContact CD2-CG1 4.45Å; Y808-V875 HydrophobicContact CD1-CG1 4.49Å; Y808-V875 HydrophobicContact CD1-CG2 4.06Å; Y808-V875 HydrophobicContact CE1-CG1 4.29Å; Y808-V875 HydrophobicContact CE1-CG2 3.94Å; V875-H878 CarbonylContact C-O 3.56Å; V875-L880 HydrophobicContact CB-CB 4.43Å; V875-L880 HydrophobicContact CG2-CB 4.27Å; V875-L880 PolarHBondContact N-O 2.9Å
876	L	60	Low	64.9	Low	46 Å²	46	42.3 Å²	42.3	24%	0.241	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-39.5	-178.8	-76	174.8	0	0	0	113.6	H807 Q809 S828 H878	H807-L876 HydrophobicContact CB-CB 4.31Å; H807-L876 HydrophobicContact CB-CD1 4.23Å; H807-L876 PolarHBondContact O-N 3.08Å; Q809-L876 HydrophobicContact CG-CD1 4.09Å; Q809-L876 HydrophobicContact CG-CG 4.42Å; S828-L876 VanDerWaalsContact OG-CD2 3.28Å; S828-L876 WeakPolarHBondContact OG-CD2 3.39Å; L876-H878 VanDerWaalsContact C-N 3.28Å; L876-H878 PolarHBondContact O-N 3.36Å
877	E	60.7	Low	65.4	Low	95 Å²	95	44.7 Å²	44.7	44%	0.444	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-15.2	-173.7	-57.6	-174	140.8	0	0	113.6	I803	I803-E877 WeakPolarHBondContact CD1-OE2 3.41Å
878	H	57.5	Low	65.4	Low	69 Å²	69	45.7 Å²	45.7	32%	0.319	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.2	138.6	172.7	-54.5	-48.7	0	0	0	108.8	I775 V875 L876 L880	I775-H878 VanDerWaalsContact CD1-CD2 3.49Å; I775-H878 WeakPolarHBondContact CD1-CD2 3.38Å; V875-H878 CarbonylContact C-O 3.56Å; L876-H878 VanDerWaalsContact C-N 3.28Å; L876-H878 PolarHBondContact O-N 3.36Å; H878-L880 HydrophobicContact CB-CD1 3.85Å; H878-L880 PolarHBondContact O-N 3.33Å
879	Q	54.6	Low	65.2	Low	122 Å²	122	46.9 Å²	46.9	57%	0.57	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	72.9	177.5	-70.9	-175.4	-43.9	0	0	112	F827	F827-Q879 HydrophobicContact CE1-CG 4.03Å; F827-Q879 HydrophobicContact CZ-CG 3.96Å
880	L	58.5	Low	64.4	Low	31 Å²	31	46.5 Å²	46.5	16%	0.162	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	128.4	-174.9	-92.2	142.4	0	0	0	109.1	Q774 V875 H878	Q774-L880 HydrophobicContact CB-CD1 4.47Å; Q774-L880 HydrophobicContact CB-CD2 3.7Å; Q774-L880 HydrophobicContact CG-CD2 3.94Å; V875-L880 HydrophobicContact CB-CB 4.43Å; V875-L880 HydrophobicContact CG2-CB 4.27Å; V875-L880 PolarHBondContact N-O 2.9Å; H878-L880 HydrophobicContact CB-CD1 3.85Å; H878-L880 PolarHBondContact O-N 3.33Å
881	W	61.7	Low	63.3	Low	98 Å²	98	50.5 Å²	50.5	37%	0.371	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	139.7	-177.4	-51.9	-27.5	0	0	0	107.8	I825 R872 V873 L874	I825-W881 HydrophobicContact CB-CZ2 4.35Å; I825-W881 HydrophobicContact CD1-CH2 3.79Å; I825-W881 HydrophobicContact CD1-CZ2 3.52Å; I825-W881 HydrophobicContact CG1-CH2 3.8Å; I825-W881 HydrophobicContact CG1-CZ2 3.59Å; I825-W881 HydrophobicContact CG2-CZ2 4.04Å; R872-W881 VanDerWaalsContact NH1-CD2 3.26Å; V873-W881 CarbonylContact O-C 3.38Å; V873-W881 WeakPolarHBondContact O-CA 3.39Å; L874-W881 HydrophobicContact CD2-CB 4.34Å; L874-W881 HydrophobicContact CD2-CD2 4.35Å; L874-W881 HydrophobicContact CD2-CG 3.76Å
882	S	70.1	Confident	61.9	Low	6 Å²	6	55.6 Å²	55.6	4%	0.042	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-59	156.1	162.1	77.4	0	0	0	0	109.5	S778 P780 R872 V873 W884	S778-S882 VanDerWaalsContact O-CB 3.25Å; S778-S882 WeakPolarHBondContact O-CB 3.32Å; P780-S882 WeakPolarHBondContact CD-OG 3.34Å; R872-S882 VanDerWaalsContact CA-OG 3.27Å; R872-S882 WeakPolarHBondContact CA-OG 3.32Å; V873-S882 PolarHBondContact N-OG 3.44Å; V873-S882 PolarHBondContact O-N 3.49Å; S882-W884 PolarHBondContact O-N 3.44Å
883	P	65.3	Low	60.5	Low	77 Å²	77	55 Å²	55	50%	0.5	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-53.1	142.9	157.6	-20.6	32.7	0	0	0	109.6	R779	R779-P883 HydrophobicContact CB-CB 4.41Å; R779-P883 HydrophobicContact CG-CB 4.24Å
884	W	71.8	Confident	58.8	Low	72 Å²	72	59.3 Å²	59.3	27%	0.273	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-51.2	134.2	162.7	-80.1	121.7	0	0	0	109.7	R779 G811 K813 F843 S870 L871 R872 S882	R779-W884 PolarHBondContact NE-O 2.85Å; R779-W884 PolarHBondContact NH2-O 2.85Å; G811-W884 WeakPolarHBondContact O-CZ3 3.41Å; K813-W884 HydrophobicContact CB-CD2 4.44Å; K813-W884 HydrophobicContact CB-CE3 4.03Å; K813-W884 HydrophobicContact CB-CH2 3.21Å; K813-W884 HydrophobicContact CB-CZ2 3.63Å; K813-W884 HydrophobicContact CB-CZ3 3.42Å; K813-W884 VanDerWaalsContact CB-CZ3 3.42Å; K813-W884 HydrophobicContact CD-CH2 4.44Å; K813-W884 HydrophobicContact CD-CZ2 3.96Å; K813-W884 HydrophobicContact CG-CH2 4.41Å; K813-W884 HydrophobicContact CG-CZ2 4.42Å; F843-W884 HydrophobicContact CD1-CH2 4.09Å; F843-W884 HydrophobicContact CD1-CZ2 4.36Å; F843-W884 AromaticContact CE1-CH2 3.86Å; F843-W884 HydrophobicContact CE1-CH2 3.86Å; F843-W884 AromaticContact CE1-CZ2 3.68Å; F843-W884 HydrophobicContact CE1-CZ2 3.68Å; S870-W884 VanDerWaalsContact O-CZ3 3.31Å; S870-W884 WeakPolarHBondContact O-CZ3 3.39Å; S870-W884 WeakPolarHBondContact OG-CA 3.3Å; S870-W884 VanDerWaalsContact OG-CB 3.23Å; S870-W884 WeakPolarHBondContact OG-CB 3.42Å; L871-W884 CarbonylContact O-C 3.55Å; L871-W884 WeakPolarHBondContact O-CA 3.29Å; R872-W884 HydrophobicContact CB-CD2 4.02Å; R872-W884 HydrophobicContact CB-CE3 3.71Å; R872-W884 HydrophobicContact CB-CH2 4.18Å; R872-W884 HydrophobicContact CB-CZ2 4.49Å; R872-W884 HydrophobicContact CB-CZ3 3.8Å; R872-W884 HydrophobicContact CG-CD2 4.27Å; R872-W884 HydrophobicContact CG-CE3 3.98Å; R872-W884 HydrophobicContact CG-CH2 3.49Å; R872-W884 VanDerWaalsContact CG-CH2 3.49Å; R872-W884 HydrophobicContact CG-CZ2 3.83Å; R872-W884 HydrophobicContact CG-CZ3 3.59Å; R872-W884 VanDerWaalsContact NE-CH2 3.3Å; S882-W884 PolarHBondContact O-N 3.44Å
885	T	71.3	Confident	57.3	Low	7 Å²	7	64.5 Å²	64.5	4%	0.043	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-56.8	169.8	172	62.7	0	0	0	0	112	P780 V782 S870 L871	P780-T885 HydrophobicContact CB-CG2 3.58Å; P780-T885 HydrophobicContact CG-CG2 3.83Å; P780-T885 WeakPolarHBondContact O-CG2 3.34Å; V782-T885 HydrophobicContact CG2-CG2 3.84Å; S870-T885 WeakPolarHBondContact CA-OG1 3.47Å; S870-T885 PolarHBondContact OG-N 2.99Å; S870-T885 PolarHBondContact OG-O 2.9Å; S870-T885 PolarHBondContact OG-OG1 2.68Å; L871-T885 HydrophobicContact CB-CG2 3.89Å; L871-T885 PolarHBondContact N-OG1 2.85Å; L871-T885 WeakPolarHBondContact O-CG2 3.25Å; L871-T885 PolarHBondContact O-N 3.28Å
886	E	63.2	Low	56	Low	125 Å²	125	65.6 Å²	65.6	58%	0.584	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-59.1	151.7	162.2	-62.6	-177.4	170.2	0	0	109.3	R779 V888	R779-E886 IonicContact CZ-OE1 2.79Å; R779-E886 IonicContact NH1-OE1 3.71Å; R779-E886 PolarHBondContact NH1-OE1 3.5Å; R779-E886 VanDerWaalsContact NH2-CG 3.26Å; E886-V888 WeakPolarHBondContact O-CG2 3.3Å; E886-V888 PolarHBondContact O-N 3.25Å
887	P	64.9	Low	55.3	Low	81 Å²	81	69.5 Å²	69.5	53%	0.526	36%	0.356	S	S	.	.			trans	-57.5	105.5	171.9	-21.3	33.4	0	0	0	108.8	L815 N889	L815-P887 HydrophobicContact CD1-CB 3.67Å; L815-P887 HydrophobicContact CD1-CG 3.74Å; P887-N889 PolarHBondContact O-N 2.93Å
888	V	57.9	Low	54.7	Low	29 Å²	29	65.2 Å²	65.2	18%	0.176	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	104.6	173	-169.1	0	0	0	0	105.5	V782 Y869 E886 F890	V782-V888 HydrophobicContact CB-CG2 3.79Å; V782-V888 HydrophobicContact CG1-CB 4.47Å; V782-V888 HydrophobicContact CG1-CG1 4.1Å; V782-V888 HydrophobicContact CG1-CG2 3.78Å; V782-V888 HydrophobicContact CG2-CG2 4.26Å; Y869-V888 PolarHBondContact N-O 3.38Å; Y869-V888 VanDerWaalsContact N-O 3.08Å; Y869-V888 PolarHBondContact O-N 3.03Å; E886-V888 WeakPolarHBondContact O-CG2 3.3Å; E886-V888 PolarHBondContact O-N 3.25Å; V888-F890 HydrophobicContact CB-CE2 3.83Å; V888-F890 HydrophobicContact CB-CZ 3.88Å; V888-F890 HydrophobicContact CG1-CD1 4.33Å; V888-F890 HydrophobicContact CG1-CD2 4.34Å; V888-F890 HydrophobicContact CG1-CE1 3.67Å; V888-F890 HydrophobicContact CG1-CE2 3.7Å; V888-F890 HydrophobicContact CG1-CZ 3.33Å; V888-F890 VanDerWaalsContact O-CD2 3.31Å; V888-F890 WeakPolarHBondContact O-CD2 2.98Å; V888-F890 WeakPolarHBondContact O-CE2 3.29Å
889	N	55	Low	54.6	Low	63 Å²	63	68.3 Å²	68.3	34%	0.337	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	136.4	173.1	-163	8	0	0	0	109.8	Q866 P887 D891	Q866-N889 VanDerWaalsContact C-OD1 3.24Å; Q866-N889 PolarHBondContact O-OD1 2.89Å; P887-N889 PolarHBondContact O-N 2.93Å; N889-D891 VanDerWaalsContact CG-OD2 3.29Å; N889-D891 PolarHBondContact ND2-OD1 3.31Å; N889-D891 PolarHBondContact ND2-OD2 3.27Å
890	F	52.2	Low	54.7	Low	4 Å²	4	63.9 Å²	63.9	2%	0.018	33%	0.331	C	S	.	.			trans	-117	54.1	-176.1	-63	-81.9	0	0	0	110.4	V792 F863 Q866 Y869 V888 N892 M893	V792-F890 HydrophobicContact CG1-CE1 4.26Å; V792-F890 HydrophobicContact CG1-CZ 4.2Å; V792-F890 HydrophobicContact CG2-CD1 4.49Å; V792-F890 HydrophobicContact CG2-CE1 3.56Å; V792-F890 HydrophobicContact CG2-CZ 4.01Å; F863-F890 AromaticContact CD1-CE2 3.84Å; F863-F890 HydrophobicContact CD1-CE2 3.84Å; F863-F890 HydrophobicContact CD1-CZ 4.31Å; F863-F890 HydrophobicContact CE1-CE2 4.3Å; F863-F890 HydrophobicContact CG-CE2 4.28Å; Q866-F890 PolarHBondContact N-O 2.98Å; Y869-F890 AromaticContact CD2-CD2 3.87Å; Y869-F890 HydrophobicContact CD2-CD2 3.87Å; Y869-F890 HydrophobicContact CD2-CE2 4Å; Y869-F890 HydrophobicContact CG-CE2 4.5Å; V888-F890 HydrophobicContact CB-CE2 3.83Å; V888-F890 HydrophobicContact CB-CZ 3.88Å; V888-F890 HydrophobicContact CG1-CD1 4.33Å; V888-F890 HydrophobicContact CG1-CD2 4.34Å; V888-F890 HydrophobicContact CG1-CE1 3.67Å; V888-F890 HydrophobicContact CG1-CE2 3.7Å; V888-F890 HydrophobicContact CG1-CZ 3.33Å; V888-F890 VanDerWaalsContact O-CD2 3.31Å; V888-F890 WeakPolarHBondContact O-CD2 2.98Å; V888-F890 WeakPolarHBondContact O-CE2 3.29Å; F890-N892 VanDerWaalsContact C-N 3.27Å; F890-N892 PolarHBondContact O-N 3.45Å; F890-M893 HydrophobicContact CB-CG 3.52Å; F890-M893 HydrophobicContact CB-SD 4.16Å; F890-M893 WeakPolarHBondContact O-CG 3.42Å
891	D	44.8	Very low	54.4	Low	86 Å²	86	67 Å²	67	46%	0.46	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-38.1	-174.1	-64.3	-65.8	0	0	0	113.7	N889	N889-D891 VanDerWaalsContact CG-OD2 3.29Å; N889-D891 PolarHBondContact ND2-OD1 3.31Å; N889-D891 PolarHBondContact ND2-OD2 3.27Å
892	N	45.5	Very low	54	Low	108 Å²	108	63.5 Å²	63.5	58%	0.578	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	60.7	-177.3	-65.4	2.6	0	0	0	111.9	R784 F890	R784-N892 PolarHBondContact NH2-O 3.34Å; F890-N892 VanDerWaalsContact C-N 3.27Å; F890-N892 PolarHBondContact O-N 3.45Å
893	M	40.8	Very low	53.5	Low	12 Å²	12	64.3 Å²	64.3	6%	0.059	34%	0.341	C	S	.	.			trans	-90.6	-7.2	176.7	-80.3	-88.9	-76	0	0	114.7	S859 F863 P865 F890	S859-M893 VanDerWaalsContact OG-CE 3.3Å; S859-M893 WeakPolarHBondContact OG-CE 3.48Å; S859-M893 PolarHBondContact OG-SD 3.43Å; F863-M893 HydrophobicContact CB-CE 3.94Å; F863-M893 WeakPolarHBondContact O-CE 3.47Å; P865-M893 HydrophobicContact CB-CB 3.81Å; P865-M893 HydrophobicContact CG-CB 3.8Å; F890-M893 HydrophobicContact CB-CG 3.52Å; F890-M893 HydrophobicContact CB-SD 4.16Å; F890-M893 WeakPolarHBondContact O-CG 3.42Å
894	L	40.1	Very low	53.2	Low	92 Å²	92	64.3 Å²	64.3	48%	0.482	34%	0.339	S	S	.	.	S	Bend	trans	-120.8	113.7	175.8	-66.4	173.8	0	0	0	108.9	P865 T896	P865-L894 HydrophobicContact CG-CD1 4.27Å; P865-L894 HydrophobicContact CG-CG 4.17Å; L894-T896 PolarHBondContact O-N 3.43Å
895	D	36.1	Very low	52.6	Low	126 Å²	126	62.5 Å²	62.5	67%	0.674	34%	0.336	S	S	*	.			trans	-83.9	58.1	-173.8	-153.4	25.8	0	0	0	110.9
896	T	44.4	Very low	52	Low	28 Å²	28	64.3 Å²	64.3	17%	0.172	35%	0.349	C	S	.	.			trans	-132.8	86	-172	59.2	0	0	0	0	111.4	L894 L898 Y917	L894-T896 PolarHBondContact O-N 3.43Å; T896-L898 PolarHBondContact O-N 3.42Å; T896-Y917 HydrophobicContact CG2-CE2 3.79Å
897	N	44.6	Very low	51.9	Low	129 Å²	129	61.5 Å²	61.5	69%	0.69	34%	0.338	S	S	*	.			trans	-66.8	98.7	172.9	-76.8	-33.5	0	0	0	110.8
898	L	49.2	Very low	51.7	Low	4 Å²	4	60.8 Å²	60.8	2%	0.021	33%	0.328	C	S	.	.			trans	-94	97.2	175.7	-171.9	161.2	0	0	0	108.9	T896 W915 Y917 F938 V1012 L1031 S1032	T896-L898 PolarHBondContact O-N 3.42Å; L898-W915 HydrophobicContact CD2-CB 3.73Å; L898-W915 HydrophobicContact CD2-CG 3.81Å; L898-Y917 HydrophobicContact CD1-CD2 4.4Å; L898-F938 HydrophobicContact CD1-CD1 4.29Å; L898-F938 HydrophobicContact CD1-CE1 3.66Å; L898-V1012 HydrophobicContact CD2-CB 4.31Å; L898-V1012 HydrophobicContact CD2-CG1 4.27Å; L898-L1031 HydrophobicContact CB-CB 3.86Å; L898-L1031 HydrophobicContact CD1-CB 3.9Å; L898-L1031 HydrophobicContact CD1-CD1 3.67Å; L898-L1031 HydrophobicContact CD1-CG 4.48Å; L898-L1031 HydrophobicContact CG-CB 4.32Å; L898-S1032 WeakPolarHBondContact O-CA 3.34Å
899	Q	54.1	Low	51.9	Low	134 Å²	134	61.9 Å²	61.9	63%	0.626	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	134.6	179.8	-66.9	-177.2	-12.1	0	0	110.8	W915 I916	Q899-W915 WeakPolarHBondContact O-CA 3.43Å; Q899-W915 WeakPolarHBondContact O-CB 3.45Å; Q899-I916 PolarHBondContact O-N 2.99Å
900	I	56.5	Low	52.4	Low	29 Å²	29	58.9 Å²	58.9	15%	0.149	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	125.4	158.4	-66.7	167.3	0	0	0	106.5	S902 I903 I913 E914 V1012 S1032 V1035	I900-S902 WeakPolarHBondContact CG2-O 3.47Å; I900-I903 HydrophobicContact CG2-CD1 4.23Å; I900-I903 HydrophobicContact CG2-CG1 3.71Å; I900-I913 HydrophobicContact CG1-CG2 4.44Å; I900-I913 HydrophobicContact CG2-CG2 4.09Å; I900-E914 CarbonylContact C-O 3.6Å; I900-E914 WeakPolarHBondContact CA-O 3.43Å; I900-V1012 HydrophobicContact CD1-CG2 4.2Å; I900-V1012 HydrophobicContact CG1-CG2 4.18Å; I900-S1032 WeakPolarHBondContact CD1-OG 3.49Å; I900-V1035 HydrophobicContact CB-CG2 4.24Å; I900-V1035 HydrophobicContact CD1-CB 4.4Å; I900-V1035 HydrophobicContact CD1-CG2 3.92Å; I900-V1035 HydrophobicContact CG2-CG2 4.36Å
901	I	52.2	Low	53.3	Low	97 Å²	97	58.7 Å²	58.7	50%	0.497	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-38.9	-172.7	-63.6	151.9	0	0	0	110.5	E914 I916	I901-E914 PolarHBondContact N-O 3.02Å; I901-I916 HydrophobicContact CD1-CB 3.78Å; I901-I916 HydrophobicContact CD1-CD1 3.49Å; I901-I916 VanDerWaalsContact CD1-CD1 3.49Å; I901-I916 HydrophobicContact CD1-CG1 3.4Å
902	S	54.3	Low	54.6	Low	25 Å²	25	58.7 Å²	58.7	18%	0.175	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	145.1	176.2	78.8	0	0	0	0	110.1	I900 I913 E914	I900-S902 WeakPolarHBondContact CG2-O 3.47Å; S902-I913 WeakPolarHBondContact O-CA 3.45Å; S902-E914 WeakPolarHBondContact CB-OE2 3.38Å; S902-E914 PolarHBondContact O-N 3.13Å; S902-E914 WeakPolarHBondContact OG-CG 3.47Å; S902-E914 PolarHBondContact OG-OE2 2.64Å
903	I	59.8	Low	55.8	Low	23 Å²	23	53.5 Å²	53.5	12%	0.118	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	118.3	152.1	-57.2	-165.7	0	0	0	106.7	I900 L911 Y912 I913 V1010 V1035 Q1037	I900-I903 HydrophobicContact CG2-CD1 4.23Å; I900-I903 HydrophobicContact CG2-CG1 3.71Å; I903-L911 HydrophobicContact CG2-CB 4.41Å; I903-L911 HydrophobicContact CG2-CD2 4.06Å; I903-Y912 CarbonylContact C-O 3.57Å; I903-Y912 VanDerWaalsContact CA-O 3.27Å; I903-Y912 WeakPolarHBondContact CA-O 3.37Å; I903-I913 HydrophobicContact CD1-CG1 4.13Å; I903-I913 HydrophobicContact CD1-CG2 4.39Å; I903-I913 HydrophobicContact CG1-CG1 4.1Å; I903-I913 HydrophobicContact CG1-CG2 4.19Å; I903-I913 HydrophobicContact CG2-CG1 4.14Å; I903-V1010 HydrophobicContact CD1-CB 4.3Å; I903-V1035 HydrophobicContact CD1-CB 3.71Å; I903-V1035 HydrophobicContact CD1-CG1 3.62Å; I903-V1035 HydrophobicContact CG1-CB 4.49Å; I903-V1035 HydrophobicContact CG1-CG1 4.03Å; I903-Q1037 HydrophobicContact CB-CB 4.4Å; I903-Q1037 HydrophobicContact CG2-CB 3.75Å; I903-Q1037 HydrophobicContact CG2-CG 3.92Å
904	V	59	Low	57	Low	77 Å²	77	56 Å²	56	47%	0.467	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.3	-176	-173.8	0	0	0	0	109.3	S906 Y912	V904-S906 PolarHBondContact O-N 2.83Å; V904-S906 VanDerWaalsContact O-N 3.16Å; V904-Y912 PolarHBondContact N-O 2.91Å; V904-Y912 PolarHBondContact O-N 2.96Å
905	T	59.1	Low	58.2	Low	34 Å²	34	51.9 Å²	51.9	21%	0.209	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	98.3	170.3	45.7	0	0	0	0	109.5	L911 Q1037 K1038 L1040	T905-L911 HydrophobicContact CG2-CD2 3.52Å; T905-Q1037 HydrophobicContact CG2-CG 3.83Å; T905-K1038 VanDerWaalsContact CG2-O 3.24Å; T905-K1038 WeakPolarHBondContact CG2-O 3.28Å; T905-L1040 HydrophobicContact CG2-CD1 4.13Å; T905-L1040 VanDerWaalsContact OG1-CD1 3.28Å; T905-L1040 WeakPolarHBondContact OG1-CD1 3.5Å
906	S	57.7	Low	59.1	Low	45 Å²	45	48.8 Å²	48.8	32%	0.315	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-26.2	177.4	53.4	0	0	0	0	112.9	V904 C910 L998	V904-S906 PolarHBondContact O-N 2.83Å; V904-S906 VanDerWaalsContact O-N 3.16Å; S906-C910 WeakPolarHBondContact OG-CB 3.31Å; S906-L998 WeakPolarHBondContact OG-CD1 3.35Å
907	N	62.8	Low	59.4	Low	65 Å²	65	50.3 Å²	50.3	35%	0.348	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	175.2	-179	-107.8	-63.2	0	0	0	112.5	T909 C910	N907-T909 PolarHBondContact O-N 2.72Å; N907-T909 VanDerWaalsContact O-N 3.14Å; N907-C910 HydrophobicContact CB-CB 4.02Å; N907-C910 VanDerWaalsContact CB-SG 3.52Å; N907-C910 PolarHBondContact O-N 3.27Å
908	Q	60.4	Low	59.4	Low	67 Å²	67	49.7 Å²	49.7	31%	0.313	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-27.6	-179.3	-67.2	-177.4	14.8	0	0	113.7	P1004	Q908-P1004 HydrophobicContact CB-CB 4.3Å; Q908-P1004 VanDerWaalsContact O-CA 3.31Å; Q908-P1004 WeakPolarHBondContact O-CA 3.39Å; Q908-P1004 WeakPolarHBondContact O-CB 3.36Å
909	T	62.1	Low	59.1	Low	51 Å²	51	55.1 Å²	55.1	31%	0.313	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	8.3	-176.8	59.2	0	0	0	0	113.6	N907 D1000 G1001 L1002	N907-T909 PolarHBondContact O-N 2.72Å; N907-T909 VanDerWaalsContact O-N 3.14Å; T909-D1000 WeakPolarHBondContact O-CA 3.15Å; T909-D1000 PolarHBondContact OG1-OD1 2.96Å; T909-D1000 VanDerWaalsContact OG1-OD1 3.1Å; T909-G1001 PolarHBondContact O-N 2.91Å; T909-L1002 WeakPolarHBondContact CA-O 3.31Å; T909-L1002 VanDerWaalsContact CB-O 3.29Å; T909-L1002 WeakPolarHBondContact CB-O 3.15Å; T909-L1002 VanDerWaalsContact CG2-O 3.32Å; T909-L1002 WeakPolarHBondContact CG2-O 3.27Å; T909-L1002 VanDerWaalsContact O-CB 3.27Å; T909-L1002 WeakPolarHBondContact O-CB 3.33Å; T909-L1002 WeakPolarHBondContact O-CG 3.43Å; T909-L1002 PolarHBondContact O-N 3.36Å
910	C	65.1	Low	58.3	Low	1 Å²	1	53 Å²	53	1%	0.007	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	139.9	-166.2	-38.9	0	0	0	0	113.4	S906 N907 L998 L999 D1000	S906-C910 WeakPolarHBondContact OG-CB 3.31Å; N907-C910 HydrophobicContact CB-CB 4.02Å; N907-C910 VanDerWaalsContact CB-SG 3.52Å; N907-C910 PolarHBondContact O-N 3.27Å; C910-L998 HydrophobicContact CB-CD1 4.08Å; C910-L999 CarbonylContact C-O 3.07Å; C910-L999 VanDerWaalsContact CA-O 3.23Å; C910-L999 WeakPolarHBondContact CA-O 3.34Å; C910-D1000 PolarHBondContact SG-OD1 3.48Å
911	L	71.8	Confident	57	Low	0 Å²	0	63 Å²	63	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	123.3	169.8	-71	174.6	0	0	0	109.5	I903 T905 L999 L1002 V1010 Q1037 T1039	I903-L911 HydrophobicContact CG2-CB 4.41Å; I903-L911 HydrophobicContact CG2-CD2 4.06Å; T905-L911 HydrophobicContact CG2-CD2 3.52Å; L911-L999 HydrophobicContact CB-CB 4.37Å; L911-L999 PolarHBondContact N-O 3.16Å; L911-L999 PolarHBondContact O-N 2.66Å; L911-L1002 HydrophobicContact CB-CD1 3.98Å; L911-L1002 HydrophobicContact CD1-CD1 3.6Å; L911-L1002 HydrophobicContact CG-CD1 3.54Å; L911-V1010 HydrophobicContact CD1-CG2 4.4Å; L911-Q1037 HydrophobicContact CD2-CB 4.03Å; L911-Q1037 HydrophobicContact CD2-CG 3.57Å; L911-T1039 HydrophobicContact CG-CG2 4.42Å
912	Y	70.7	Confident	55.9	Low	85 Å²	85	65.2 Å²	65.2	33%	0.333	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	137.8	169.4	-167.5	-108.9	0	0	0	109.9	I903 V904 E914 Y997 L998	I903-Y912 CarbonylContact C-O 3.57Å; I903-Y912 VanDerWaalsContact CA-O 3.27Å; I903-Y912 WeakPolarHBondContact CA-O 3.37Å; V904-Y912 PolarHBondContact N-O 2.91Å; V904-Y912 PolarHBondContact O-N 2.96Å; Y912-E914 HydrophobicContact CD1-CG 4.05Å; Y912-E914 HydrophobicContact CE1-CG 3.5Å; Y912-E914 VanDerWaalsContact CE1-CG 3.5Å; Y912-Y997 CarbonylContact C-O 3.58Å; Y912-Y997 WeakPolarHBondContact CA-O 3.46Å; Y912-Y997 WeakPolarHBondContact CD2-O 3.35Å; Y912-L998 HydrophobicContact CD2-CB 4.26Å; Y912-L998 HydrophobicContact CD2-CD1 4.19Å
913	I	70.6	Confident	54.5	Low	0 Å²	0	73.1 Å²	73.1	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	127.9	-172.5	-56.6	163.1	0	0	0	109	I900 S902 I903 W915 I940 G996 Y997 L999 V1010	I900-I913 HydrophobicContact CG1-CG2 4.44Å; I900-I913 HydrophobicContact CG2-CG2 4.09Å; S902-I913 WeakPolarHBondContact O-CA 3.45Å; I903-I913 HydrophobicContact CD1-CG1 4.13Å; I903-I913 HydrophobicContact CD1-CG2 4.39Å; I903-I913 HydrophobicContact CG1-CG1 4.1Å; I903-I913 HydrophobicContact CG1-CG2 4.19Å; I903-I913 HydrophobicContact CG2-CG1 4.14Å; I913-W915 HydrophobicContact CG2-CE3 4.11Å; I913-W915 HydrophobicContact CG2-CZ3 4.33Å; I913-I940 HydrophobicContact CD1-CD1 4.34Å; I913-I940 HydrophobicContact CD1-CG2 4.28Å; I913-G996 CarbonylContact O-C 3.33Å; I913-G996 VanDerWaalsContact O-CA 3.27Å; I913-G996 WeakPolarHBondContact O-CA 3.37Å; I913-Y997 PolarHBondContact N-O 3.1Å; I913-Y997 PolarHBondContact O-N 3.35Å; I913-L999 HydrophobicContact CD1-CD1 3.64Å; I913-L999 HydrophobicContact CD1-CG 3.92Å; I913-V1010 HydrophobicContact CD1-CB 4.35Å; I913-V1010 HydrophobicContact CD1-CG1 3.59Å; I913-V1010 HydrophobicContact CD1-CG2 4.45Å
914	E	67.5	Low	52.8	Low	65 Å²	65	76.3 Å²	76.3	30%	0.304	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140.5	177.5	-63.2	177.6	127.5	0	0	112.2	I900 I901 S902 Y912 K995	I900-E914 CarbonylContact C-O 3.6Å; I900-E914 WeakPolarHBondContact CA-O 3.43Å; I901-E914 PolarHBondContact N-O 3.02Å; S902-E914 WeakPolarHBondContact CB-OE2 3.38Å; S902-E914 PolarHBondContact O-N 3.13Å; S902-E914 WeakPolarHBondContact OG-CG 3.47Å; S902-E914 PolarHBondContact OG-OE2 2.64Å; Y912-E914 HydrophobicContact CD1-CG 4.05Å; Y912-E914 HydrophobicContact CE1-CG 3.5Å; Y912-E914 VanDerWaalsContact CE1-CG 3.5Å; E914-K995 CarbonylContact C-O 3.51Å; E914-K995 WeakPolarHBondContact CA-O 3.44Å
915	W	63.7	Low	51.2	Low	4 Å²	4	80.5 Å²	80.5	2%	0.015	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	149.9	173.1	66.5	93.7	0	0	0	113.2	L898 Q899 I913 I940 I988 K995 V1012	L898-W915 HydrophobicContact CD2-CB 3.73Å; L898-W915 HydrophobicContact CD2-CG 3.81Å; Q899-W915 WeakPolarHBondContact O-CA 3.43Å; Q899-W915 WeakPolarHBondContact O-CB 3.45Å; I913-W915 HydrophobicContact CG2-CE3 4.11Å; I913-W915 HydrophobicContact CG2-CZ3 4.33Å; W915-I940 HydrophobicContact CH2-CD1 3.77Å; W915-I940 HydrophobicContact CH2-CG1 4.15Å; W915-I940 HydrophobicContact CZ3-CD1 3.74Å; W915-I940 HydrophobicContact CZ3-CG1 4.39Å; W915-I988 HydrophobicContact CH2-CD1 3.72Å; W915-I988 HydrophobicContact CZ2-CD1 4.32Å; W915-K995 HydrophobicContact CD2-CB 4.09Å; W915-K995 HydrophobicContact CH2-CB 4.22Å; W915-K995 HydrophobicContact CZ2-CB 3.69Å; W915-K995 HydrophobicContact CZ2-CD 3.92Å; W915-K995 HydrophobicContact CZ2-CG 4.44Å; W915-K995 PolarHBondContact N-O 2.92Å; W915-K995 PolarHBondContact O-N 3Å; W915-V1012 HydrophobicContact CD2-CG1 4.39Å; W915-V1012 HydrophobicContact CD2-CG2 4.11Å; W915-V1012 HydrophobicContact CE3-CG2 4.03Å; W915-V1012 HydrophobicContact CZ2-CG1 4.32Å; W915-V1012 HydrophobicContact CZ3-CG2 4.4Å
916	I	54.9	Low	49.5	Very low	61 Å²	61	85.2 Å²	85.2	31%	0.313	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.6	171.7	-77.5	167.2	0	0	0	109.7	Q899 I901 I918 T993 L994	Q899-I916 PolarHBondContact O-N 2.99Å; I901-I916 HydrophobicContact CD1-CB 3.78Å; I901-I916 HydrophobicContact CD1-CD1 3.49Å; I901-I916 VanDerWaalsContact CD1-CD1 3.49Å; I901-I916 HydrophobicContact CD1-CG1 3.4Å; I916-I918 HydrophobicContact CG2-CG1 3.66Å; I916-T993 WeakPolarHBondContact CA-O 3.46Å; I916-L994 HydrophobicContact CD1-CD1 3.82Å; I916-L994 HydrophobicContact CD1-CG 4.33Å; I916-L994 HydrophobicContact CG1-CB 4.21Å; I916-L994 HydrophobicContact CG1-CD1 3.7Å; I916-L994 HydrophobicContact CG1-CG 3.65Å
917	Y	50.4	Low	47.9	Very low	60 Å²	60	89.2 Å²	89.2	24%	0.235	45%	0.451	C	S	.	.			trans	-105.6	109.5	166.2	174	-101.8	0	0	0	109.5	T896 L898 Q919 T993	T896-Y917 HydrophobicContact CG2-CE2 3.79Å; L898-Y917 HydrophobicContact CD1-CD2 4.4Å; Y917-Q919 HydrophobicContact CD1-CB 4.44Å; Y917-Q919 HydrophobicContact CE1-CB 3.9Å; Y917-Q919 HydrophobicContact CE1-CG 4.39Å; Y917-Q919 PolarHBondContact O-N 2.88Å; Y917-T993 PolarHBondContact N-O 3.15Å
918	I	46.6	Very low	46	Very low	117 Å²	117	93 Å²	93	60%	0.6	47%	0.469	S	S	*	.			trans	-89	105.8	178.2	-51.7	-178	0	0	0	109.2	I916	I916-I918 HydrophobicContact CG2-CG1 3.66Å
919	Q	42.1	Very low	44.3	Very low	117 Å²	117	97.1 Å²	97.1	55%	0.547	49%	0.493	S	S	.	.			trans	-84.1	119	172	-169.8	172.5	-0.3	0	0	110	Y917 R921	Y917-Q919 HydrophobicContact CD1-CB 4.44Å; Y917-Q919 HydrophobicContact CE1-CB 3.9Å; Y917-Q919 HydrophobicContact CE1-CG 4.39Å; Y917-Q919 PolarHBondContact O-N 2.88Å; Q919-R921 PolarHBondContact O-N 3.06Å
920	S	37.2	Very low	42.6	Very low	90 Å²	90	101.6 Å²	101.6	63%	0.629	51%	0.513	S	S	*	.			trans	-68	124.9	-178.8	59.6	0	0	0	0	112	N922	S920-N922 PolarHBondContact O-N 2.91Å
921	R	28.2	Very low	40.9	Very low	238 Å²	238	105.9 Å²	105.9	90%	0.898	54%	0.539	S	S	*	.			trans	-78.6	86.3	177.3	-72.8	-174.2	176.2	-177	0.1	112	Q919	Q919-R921 PolarHBondContact O-N 3.06Å
922	N	29.5	Very low	39	Very low	144 Å²	144	111.5 Å²	111.5	77%	0.77	57%	0.569	S	S	*	*			trans	-136.1	68.8	163.5	-94.5	-25.7	0	0	0	111	S920 S924	S920-N922 PolarHBondContact O-N 2.91Å; N922-S924 VanDerWaalsContact C-N 3.34Å; N922-S924 PolarHBondContact O-N 2.88Å
923	H	24.6	Very low	37.2	Very low	192 Å²	192	113.6 Å²	113.6	89%	0.889	58%	0.58	S	S	*	*			trans	-76.1	82.7	170	-89.4	-75.5	0	0	0	110.6
924	S	24.1	Very low	35.4	Very low	89 Å²	89	119.1 Å²	119.1	62%	0.622	61%	0.61	S	S	*	*			trans	-148.5	38.7	173.9	65.7	0	0	0	0	113.9	N922	N922-S924 VanDerWaalsContact C-N 3.34Å; N922-S924 PolarHBondContact O-N 2.88Å
925	F	25	Very low	34.2	Very low	165 Å²	165	121.2 Å²	121.2	72%	0.724	62%	0.623	S	S	*	*			trans	-131.6	73.1	166.6	-89.8	-75.9	0	0	0	111.6
926	T	24.2	Very low	33.4	Very low	134 Å²	134	125.1 Å²	125.1	82%	0.822	64%	0.644	S	S	*	*			trans	-82.6	130	153.9	50	0	0	0	0	108
927	T	23.7	Very low	33.3	Very low	128 Å²	128	122.4 Å²	122.4	79%	0.785	63%	0.63	S	S	*	*			cis	-140.5	122.8	9.6	51.2	0	0	0	0	112.4
928	M	23.3	Very low	33.8	Very low	146 Å²	146	120.5 Å²	120.5	72%	0.719	62%	0.623	S	S	*	*	S	Bend	trans	-127	149.3	145.7	-85.4	-171.7	169	0	0	107.7	I930	M928-I930 PolarHBondContact O-N 2.86Å
929	N	24.6	Very low	34.5	Very low	153 Å²	153	115.1 Å²	115.1	82%	0.818	60%	0.596	S	S	*	*			trans	-74.9	91.8	177.9	-82.7	-8.5	0	0	0	110.2	T931	N929-T931 VanDerWaalsContact C-N 3.34Å; N929-T931 PolarHBondContact O-N 3.01Å; N929-T931 VanDerWaalsContact O-N 3.13Å
930	I	27.8	Very low	35.7	Very low	144 Å²	144	109.6 Å²	109.6	74%	0.738	57%	0.57	S	S	*	*			trans	-82.2	83.2	171.4	-55.1	173.3	0	0	0	107.8	M928	M928-I930 PolarHBondContact O-N 2.86Å
931	T	28.7	Very low	37.3	Very low	92 Å²	92	106.4 Å²	106.4	56%	0.564	55%	0.545	S	S	*	.			trans	-114.4	-8.7	179.3	47.2	0	0	0	0	114.3	N929	N929-T931 VanDerWaalsContact C-N 3.34Å; N929-T931 PolarHBondContact O-N 3.01Å; N929-T931 VanDerWaalsContact O-N 3.13Å
932	D	31.5	Very low	39.4	Very low	117 Å²	117	96.1 Å²	96.1	63%	0.626	51%	0.507	S	S	*	.			trans	-108.9	13.4	-159.8	-64.4	13.3	0	0	0	113.6
933	F	33.8	Very low	41.4	Very low	130 Å²	130	91.1 Å²	91.1	57%	0.57	48%	0.477	S	S	*	.			trans	-112.1	70.9	174.5	-77.4	-69.8	0	0	0	111.8	V1016	F933-V1016 HydrophobicContact CD1-CG1 4.4Å; F933-V1016 HydrophobicContact CE1-CG1 4.14Å
934	N	31.9	Very low	43.7	Very low	115 Å²	115	82.8 Å²	82.8	62%	0.615	44%	0.439	S	S	*	.			trans	-90.5	146.5	162.1	-67.6	-41.3	0	0	0	109.7
935	D	43.4	Very low	45.8	Very low	109 Å²	109	82 Å²	82	58%	0.583	43%	0.427	S	S	*	.			trans	62.8	74.6	178.1	-65.1	-7.8	0	0	0	117.3	T937 T1017	D935-T937 HydrophobicContact CB-CG2 4.48Å; D935-T1017 PolarHBondContact O-OG1 3.06Å
936	L	46.5	Very low	47.5	Very low	86 Å²	86	77.6 Å²	77.6	45%	0.45	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	114.8	150.1	-67.4	177.5	0	0	0	109.5	I1014 V1016	L936-I1014 HydrophobicContact CB-CD1 4.27Å; L936-I1014 HydrophobicContact CD1-CD1 4.41Å; L936-I1014 HydrophobicContact CD2-CD1 4.02Å; L936-I1014 HydrophobicContact CG-CD1 4.47Å; L936-V1016 HydrophobicContact CD2-CB 4.36Å; L936-V1016 HydrophobicContact CD2-CG1 4.12Å; L936-V1016 HydrophobicContact CD2-CG2 3.89Å
937	T	53.2	Low	48.9	Very low	5 Å²	5	77.9 Å²	77.9	3%	0.031	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	149.3	-179.5	56	0	0	0	0	110.8	D935 N989 I1014 E1015	D935-T937 HydrophobicContact CB-CG2 4.48Å; T937-N989 WeakPolarHBondContact CG2-OD1 3.25Å; T937-I1014 CarbonylContact O-C 3.59Å; T937-I1014 WeakPolarHBondContact O-CA 3.44Å; T937-I1014 WeakPolarHBondContact O-CG1 3.29Å; T937-E1015 PolarHBondContact N-O 2.79Å; T937-E1015 PolarHBondContact O-N 2.77Å; T937-E1015 VanDerWaalsContact OG1-CB 3.3Å; T937-E1015 WeakPolarHBondContact OG1-CB 3.42Å; T937-E1015 VanDerWaalsContact OG1-CD 3.27Å; T937-E1015 WeakPolarHBondContact OG1-CG 3.29Å; T937-E1015 PolarHBondContact OG1-O 3.18Å
938	F	60	Low	50	Low	19 Å²	19	77.5 Å²	77.5	8%	0.083	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	142.3	-177.3	-68.8	-99.8	0	0	0	110.1	L898 R987 I988 K995 V1012 Y1013 I1014 L1031	L898-F938 HydrophobicContact CD1-CD1 4.29Å; L898-F938 HydrophobicContact CD1-CE1 3.66Å; F938-R987 CarbonylContact O-C 3.46Å; F938-I988 PolarHBondContact N-O 2.94Å; F938-I988 WeakPolarHBondContact O-CA 3.18Å; F938-I988 PolarHBondContact O-N 3.09Å; F938-K995 VanDerWaalsContact CD2-NZ 3.26Å; F938-V1012 HydrophobicContact CD1-CG1 4.3Å; F938-Y1013 CarbonylContact C-O 3.4Å; F938-Y1013 WeakPolarHBondContact CA-O 3.41Å; F938-I1014 HydrophobicContact CD1-CG1 4.45Å; F938-I1014 HydrophobicContact CE1-CB 4.47Å; F938-I1014 HydrophobicContact CE1-CD1 4.02Å; F938-I1014 HydrophobicContact CE1-CG1 4.23Å; F938-I1014 HydrophobicContact CE2-CD1 4.38Å; F938-I1014 HydrophobicContact CZ-CD1 3.84Å; F938-I1014 HydrophobicContact CZ-CG1 4.32Å; F938-L1031 HydrophobicContact CE1-CD1 4.1Å
939	N	61.6	Low	51.1	Low	5 Å²	5	77.1 Å²	77.1	3%	0.027	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137	-179.4	-69.3	-83.3	0	0	0	109.5	R986 R987 Y1013 E1015	N939-R986 WeakPolarHBondContact CA-O 3.27Å; N939-R987 VanDerWaalsContact OD1-CA 3.22Å; N939-R987 WeakPolarHBondContact OD1-CA 3.47Å; N939-R987 WeakPolarHBondContact OD1-CB 3.37Å; N939-R987 WeakPolarHBondContact OD1-CG 3.4Å; N939-Y1013 PolarHBondContact N-O 3.14Å; N939-Y1013 PolarHBondContact O-N 3.09Å; N939-E1015 VanDerWaalsContact ND2-CB 3.25Å; N939-E1015 WeakPolarHBondContact ND2-CB 3.39Å; N939-E1015 PolarHBondContact ND2-OE2 3.25Å
940	I	67.4	Low	52	Low	0 Å²	0	77.3 Å²	77.3	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	134.1	169.4	-55.5	-178.7	0	0	0	108.3	I913 W915 I985 R986 I988 Y997 L999 V1010	I913-I940 HydrophobicContact CD1-CD1 4.34Å; I913-I940 HydrophobicContact CD1-CG2 4.28Å; W915-I940 HydrophobicContact CH2-CD1 3.77Å; W915-I940 HydrophobicContact CH2-CG1 4.15Å; W915-I940 HydrophobicContact CZ3-CD1 3.74Å; W915-I940 HydrophobicContact CZ3-CG1 4.39Å; I940-I985 WeakPolarHBondContact O-CA 2.99Å; I940-R986 PolarHBondContact N-O 2.95Å; I940-R986 PolarHBondContact O-N 2.58Å; I940-I988 HydrophobicContact CD1-CD1 3.76Å; I940-I988 HydrophobicContact CG1-CD1 3.84Å; I940-Y997 HydrophobicContact CD1-CD1 3.5Å; I940-Y997 HydrophobicContact CD1-CE1 4.28Å; I940-Y997 HydrophobicContact CD1-CG 3.87Å; I940-L999 HydrophobicContact CG2-CD1 4.32Å; I940-L999 HydrophobicContact CG2-CD2 4.32Å; I940-V1010 HydrophobicContact CG2-CG1 3.38Å
941	I	70.6	Confident	52.8	Low	23 Å²	23	75.8 Å²	75.8	12%	0.118	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130	173.8	-54.2	-173.1	0	0	0	108.4	L983 Y984 I985 V1010 S1011 Y1013	I941-L983 HydrophobicContact CG2-CD1 3.56Å; I941-L983 HydrophobicContact CG2-CG 4.23Å; I941-Y984 WeakPolarHBondContact CA-O 3.17Å; I941-I985 HydrophobicContact CD1-CD1 4.42Å; I941-I985 HydrophobicContact CD1-CG1 4.43Å; I941-I985 HydrophobicContact CG1-CG1 4.14Å; I941-I985 HydrophobicContact CG1-CG2 4.27Å; I941-I985 HydrophobicContact CG2-CG1 4.35Å; I941-V1010 WeakPolarHBondContact O-CA 3.31Å; I941-S1011 PolarHBondContact N-O 3.07Å; I941-S1011 PolarHBondContact O-N 3.45Å; I941-Y1013 HydrophobicContact CB-CD2 4.42Å; I941-Y1013 HydrophobicContact CB-CE2 4.45Å; I941-Y1013 HydrophobicContact CD1-CD1 4.49Å; I941-Y1013 HydrophobicContact CD1-CD2 3.67Å; I941-Y1013 HydrophobicContact CD1-CE2 3.76Å; I941-Y1013 HydrophobicContact CD1-CG 4.1Å; I941-Y1013 HydrophobicContact CG1-CD2 3.85Å; I941-Y1013 HydrophobicContact CG1-CE2 4.19Å
942	Y	73.1	Confident	53.3	Low	22 Å²	22	81.4 Å²	81.4	9%	0.086	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.8	175.5	65	-86.1	0	0	0	112.9	Y984 L999 L1002 Y1008 A1009	Y942-Y984 AromaticContact CD2-CD2 3.97Å; Y942-Y984 HydrophobicContact CD2-CD2 3.97Å; Y942-Y984 HydrophobicContact CD2-CG 4.49Å; Y942-Y984 VanDerWaalsContact CE1-CB 3.43Å; Y942-Y984 HydrophobicContact CE1-CG 4.33Å; Y942-Y984 AromaticContact CE2-CD2 3.27Å; Y942-Y984 HydrophobicContact CE2-CD2 3.27Å; Y942-Y984 HydrophobicContact CE2-CE2 4.13Å; Y942-Y984 AromaticContact CE2-CG 3.72Å; Y942-Y984 HydrophobicContact CE2-CG 3.72Å; Y942-Y984 AromaticContact CZ-CD2 3.72Å; Y942-Y984 AromaticContact CZ-CG 3.65Å; Y942-Y984 PolarHBondContact N-O 3.26Å; Y942-Y984 PolarHBondContact O-N 2.7Å; Y942-L999 HydrophobicContact CD1-CD1 3.54Å; Y942-L999 HydrophobicContact CD1-CD2 3.89Å; Y942-L999 HydrophobicContact CD1-CG 4.32Å; Y942-L999 HydrophobicContact CE1-CD1 4.01Å; Y942-L999 HydrophobicContact CE1-CD2 3.71Å; Y942-L999 HydrophobicContact CE1-CG 4.37Å; Y942-L999 HydrophobicContact CG-CD1 3.83Å; Y942-L1002 HydrophobicContact CD2-CD2 3.74Å; Y942-L1002 HydrophobicContact CE2-CD2 3.23Å; Y942-Y1008 HydrophobicContact CD2-CD1 4.04Å; Y942-Y1008 HydrophobicContact CD2-CE1 4.31Å; Y942-A1009 WeakPolarHBondContact CA-O 3.48Å; Y942-A1009 WeakPolarHBondContact CB-O 3.41Å
943	R	71	Confident	53.5	Low	40 Å²	40	84 Å²	84	15%	0.151	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	151.5	179.8	61.5	174.6	175.1	154.2	-5.6	113	L945 L958 D982 L983 Y1008 A1009 E1034	R943-L945 HydrophobicContact CG-CD2 4.5Å; R943-L958 VanDerWaalsContact NH1-CD1 3.26Å; R943-D982 WeakPolarHBondContact CA-O 3.39Å; R943-L983 HydrophobicContact CB-CD1 4Å; R943-Y1008 VanDerWaalsContact O-CA 3.29Å; R943-Y1008 WeakPolarHBondContact O-CA 3.36Å; R943-Y1008 WeakPolarHBondContact O-CD1 3.43Å; R943-A1009 HydrophobicContact CG-CB 3.99Å; R943-A1009 PolarHBondContact N-O 3.03Å; R943-A1009 PolarHBondContact O-N 3.34Å; R943-E1034 IonicContact CZ-OE1 2.58Å; R943-E1034 IonicContact NE-OE1 2.77Å; R943-E1034 PolarHBondContact NE-OE1 2.9Å; R943-E1034 IonicContact NH2-OE1 3.51Å; R943-E1034 PolarHBondContact NH2-OE1 2.97Å; R943-E1034 IonicContact NH2-OE2 2.79Å
944	N	72.3	Confident	53.7	Low	16 Å²	16	81.1 Å²	81.1	9%	0.086	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	139.5	169.8	-172.3	-4.8	0	0	0	110.9	S946 V1006 Y1008	N944-S946 PolarHBondContact OD1-N 2.7Å; N944-S946 PolarHBondContact OD1-OG 2.81Å; N944-V1006 WeakPolarHBondContact OD1-CG1 3.18Å; N944-Y1008 HydrophobicContact CB-CE1 4.12Å
945	L	67.5	Low	53.9	Low	72 Å²	72	81 Å²	81	38%	0.377	41%	0.405	S	S	.	.			trans	-113.6	4.9	175.4	-66.7	-177.6	0	0	0	114.3	R943 T1007 A1009 V1036	R943-L945 HydrophobicContact CG-CD2 4.5Å; L945-T1007 HydrophobicContact CB-CG2 4.44Å; L945-T1007 WeakPolarHBondContact CB-O 3.31Å; L945-T1007 HydrophobicContact CD1-CG2 4.26Å; L945-T1007 PolarHBondContact N-O 2.82Å; L945-A1009 HydrophobicContact CD1-CB 3.93Å; L945-A1009 HydrophobicContact CD2-CB 4.32Å; L945-A1009 HydrophobicContact CG-CB 4.11Å; L945-V1036 HydrophobicContact CD1-CG1 3.85Å; L945-V1036 HydrophobicContact CD1-CG2 4.07Å
946	S	60.9	Low	53.6	Low	73 Å²	73	82.9 Å²	82.9	51%	0.51	41%	0.414	S	S	.	.			trans	-90.5	4.1	-171.7	71.3	0	0	0	0	116	N944	N944-S946 PolarHBondContact OD1-N 2.7Å; N944-S946 PolarHBondContact OD1-OG 2.81Å
947	E	53.3	Low	53.2	Low	140 Å²	140	84.8 Å²	84.8	65%	0.654	42%	0.421	S	S	*	.	S	Bend	trans	-105.7	139.4	-179.3	-61.2	-168.3	135.3	0	0	112.3
948	N	48.3	Very low	52.4	Low	121 Å²	121	88.1 Å²	88.1	65%	0.647	44%	0.438	S	S	*	.			trans	32.4	98.6	175.5	-80.1	-27.4	0	0	0	119.2	N950 E951	N948-N950 PolarHBondContact O-N 3.27Å; N948-E951 PolarHBondContact O-N 3.37Å
949	L	45.9	Very low	51.2	Low	137 Å²	137	89.8 Å²	89.8	72%	0.717	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-52.9	-20.9	169.3	-80.8	162	0	0	0	115.5
950	N	44.2	Very low	49.7	Very low	157 Å²	157	94.1 Å²	94.1	84%	0.84	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-80.8	-14	-177.3	-70.6	-9.2	0	0	0	114.1	N948 R952	N948-N950 PolarHBondContact O-N 3.27Å; N950-R952 VanDerWaalsContact C-N 3.28Å; N950-R952 PolarHBondContact O-N 3.23Å
951	E	44.2	Very low	47.9	Very low	112 Å²	112	96 Å²	96	52%	0.523	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-92.7	24.9	179.4	-62.8	-160.7	174.4	0	0	113.7	N948 K953	N948-E951 PolarHBondContact O-N 3.37Å; E951-K953 PolarHBondContact O-N 3.41Å
952	R	39.2	Very low	45.8	Very low	211 Å²	211	101.4 Å²	101.4	80%	0.796	50%	0.502	S	S	*	.			trans	-72.7	61.4	170.9	-74.2	-174.3	169.4	-168.2	-1.9	112.8	N950	N950-R952 VanDerWaalsContact C-N 3.28Å; N950-R952 PolarHBondContact O-N 3.23Å
953	K	35.8	Very low	43.7	Very low	170 Å²	170	103.8 Å²	103.8	74%	0.739	52%	0.516	S	S	*	.			trans	-65.1	160.6	149.3	-76.5	-171.4	175.5	-178	0	109.7	E951 L955	E951-K953 PolarHBondContact O-N 3.41Å; K953-L955 PolarHBondContact O-N 3.35Å
954	S	38	Very low	41.7	Very low	71 Å²	71	106.6 Å²	106.6	50%	0.497	53%	0.529	S	S	.	.			trans	-64.7	132.3	-164.4	41	0	0	0	0	113.4	L956 E957	S954-L956 PolarHBondContact O-N 2.92Å; S954-E957 PolarHBondContact O-N 3.47Å
955	L	35.2	Very low	39.7	Very low	111 Å²	111	111.2 Å²	111.2	58%	0.581	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-2.3	174.4	-82.6	159.5	0	0	0	115.6	K953	K953-L955 PolarHBondContact O-N 3.35Å
956	L	36.9	Very low	37.8	Very low	149 Å²	149	114.2 Å²	114.2	78%	0.78	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-26.7	172.3	-91	65.7	0	0	0	113.3	S954 L958	S954-L956 PolarHBondContact O-N 2.92Å; L956-L958 VanDerWaalsContact C-N 3.29Å; L956-L958 PolarHBondContact O-N 2.89Å
957	E	38.8	Very low	36.3	Very low	127 Å²	127	118.3 Å²	118.3	59%	0.593	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-10.1	-167.3	-65.3	-175.3	126.1	0	0	114.7	S954	S954-E957 PolarHBondContact O-N 3.47Å
958	L	36.4	Very low	35.2	Very low	75 Å²	75	121.4 Å²	121.4	39%	0.393	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.5	-6.3	-173.5	-83.3	165.3	0	0	0	115.4	R943 L956	R943-L958 VanDerWaalsContact NH1-CD1 3.26Å; L956-L958 VanDerWaalsContact C-N 3.29Å; L956-L958 PolarHBondContact O-N 2.89Å
959	W	33.9	Very low	34.1	Very low	53 Å²	53	124.6 Å²	124.6	20%	0.201	60%	0.604	C	S	.	*			trans	-123.7	22.3	-163.2	-60.2	133.5	0	0	0	115	Y1013 E1034	W959-Y1013 HydrophobicContact CE3-CE2 4.41Å; W959-Y1013 AromaticContact CE3-CZ 3.92Å; W959-Y1013 HydrophobicContact CH2-CE2 4.44Å; W959-Y1013 AromaticContact CZ3-CE2 3.89Å; W959-Y1013 HydrophobicContact CZ3-CE2 3.89Å; W959-Y1013 AromaticContact CZ3-CZ 3.84Å; W959-Y1013 WeakPolarHBondContact CZ3-OH 3.38Å; W959-E1034 HydrophobicContact CZ2-CG 4.24Å; W959-E1034 PolarHBondContact NE1-OE2 2.99Å
960	T	31.9	Very low	33.1	Very low	96 Å²	96	125.4 Å²	125.4	59%	0.589	60%	0.602	S	S	*	*			trans	-75.9	148.1	169.6	52.6	0	0	0	0	112.3	F962	T960-F962 WeakPolarHBondContact O-CD2 3.4Å
961	E	27.8	Very low	32.3	Very low	40 Å²	40	123.9 Å²	123.9	19%	0.187	60%	0.604	C	S	.	*			trans	-59.5	143.9	-178.4	-166.6	-174.5	179.6	0	0	113.7	Q866 N867	Q866-E961 HydrophobicContact CB-CG 4.47Å; Q866-E961 WeakPolarHBondContact CB-OE2 3.46Å; Q866-E961 HydrophobicContact CG-CB 3.93Å; Q866-E961 HydrophobicContact CG-CG 4.33Å; N867-E961 PolarHBondContact N-OE2 2.85Å; N867-E961 VanDerWaalsContact ND2-CD 3.32Å; N867-E961 PolarHBondContact ND2-OE1 3.45Å; N867-E961 PolarHBondContact ND2-OE2 2.88Å
962	F	27.2	Very low	31.6	Very low	136 Å²	136	126 Å²	126	60%	0.596	62%	0.615	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-125.7	129.9	171.5	-81.1	-90.7	0	0	0	111.5	T960	T960-F962 WeakPolarHBondContact O-CD2 3.4Å
963	I	28.4	Very low	31.3	Very low	72 Å²	72	120 Å²	120	37%	0.369	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.3	124.1	178.5	-58.2	173.5	0	0	0	109.1	Y1027	I963-Y1027 HydrophobicContact CD1-CE1 4.47Å; I963-Y1027 HydrophobicContact CG1-CD1 4.26Å; I963-Y1027 HydrophobicContact CG1-CE1 4.41Å; I963-Y1027 HydrophobicContact CG2-CE1 4.44Å
964	F	30	Very low	31.2	Very low	99 Å²	99	118 Å²	118	43%	0.434	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101	120.6	177.7	-95.4	-91.8	0	0	0	112.7	K1026 F1028	F964-K1026 PolarHBondContact N-O 2.03Å; F964-K1026 VanDerWaalsContact N-O 3.17Å; F964-F1028 HydrophobicContact CD2-CD2 4.24Å; F964-F1028 AromaticContact CD2-CE2 3.8Å; F964-F1028 HydrophobicContact CD2-CE2 3.8Å; F964-F1028 HydrophobicContact CE2-CE2 4.42Å
965	N	30.1	Very low	31.2	Very low	113 Å²	113	117.5 Å²	117.5	60%	0.604	59%	0.592	S	S	*	*			trans	-116.7	108.3	166.8	-79.6	-17.4	0	0	0	109.6	Q1025	N965-Q1025 PolarHBondContact OD1-NE2 3.42Å
966	N	28.4	Very low	31.1	Very low	135 Å²	135	120 Å²	120	72%	0.722	60%	0.601	S	S	*	*			trans	-96.6	109.2	175.5	-84	-6.4	0	0	0	111.1
967	E	28.4	Very low	30.8	Very low	160 Å²	160	116.6 Å²	116.6	75%	0.748	58%	0.582	S	S	*	*	S	Bend	trans	-162.7	37.1	142.7	-118.4	168.1	-151.3	0	0	115	Q1023	E967-Q1023 PolarHBondContact OE2-NE2 2.84Å
968	K	30.1	Very low	30.4	Very low	204 Å²	204	117 Å²	117	89%	0.887	59%	0.588	S	S	*	*	S	Bend	trans	-161.6	164.4	152	-106.9	148.3	-170.8	174.9	0	109.4
969	Q	26.1	Very low	30.4	Very low	188 Å²	188	121.4 Å²	121.4	88%	0.879	61%	0.607	S	S	*	*			trans	-64.1	155.7	-165.9	-70.5	160.4	-77.9	0	0	113.9
970	F	25	Very low	30.5	Very low	154 Å²	154	123.7 Å²	123.7	68%	0.675	62%	0.622	S	S	*	*			trans	-41.8	135.8	174.6	-77	-99.2	0	0	0	113.9	M972 L974	F970-M972 WeakPolarHBondContact CD1-O 3.3Å; F970-L974 HydrophobicContact CE1-CD1 4.2Å
971	S	26.8	Very low	30.9	Very low	126 Å²	126	120.5 Å²	120.5	88%	0.881	61%	0.608	S	S	*	*	S	Bend	trans	-133.7	13.2	155.9	59.7	0	0	0	0	113.7
972	M	29	Very low	31.8	Very low	157 Å²	157	122.3 Å²	122.3	77%	0.773	62%	0.619	S	S	*	*	S	Bend	trans	-101.8	82.4	150.6	-167.9	78	178.3	0	0	106	F970 L974	F970-M972 WeakPolarHBondContact CD1-O 3.3Å; M972-L974 PolarHBondContact O-N 2.75Å
973	D	33.1	Very low	32.8	Very low	83 Å²	83	119.4 Å²	119.4	44%	0.444	61%	0.61	S	S	.	*			trans	-66.8	120.7	179.2	-176.3	2.4	0	0	0	109	S975 Q976	D973-S975 PolarHBondContact O-N 3Å; D973-S975 VanDerWaalsContact O-N 3.16Å; D973-S975 WeakPolarHBondContact OD1-CB 2.95Å; D973-S975 PolarHBondContact OD1-N 3.08Å; D973-S975 PolarHBondContact OD1-OG 2.98Å; D973-S975 WeakPolarHBondContact OD2-CB 3.31Å; D973-S975 PolarHBondContact OD2-OG 2.81Å; D973-Q976 HydrophobicContact CB-CG 4.36Å; D973-Q976 WeakPolarHBondContact O-CB 3.48Å; D973-Q976 PolarHBondContact O-N 3.5Å
974	L	34.4	Very low	33.9	Very low	128 Å²	128	121.3 Å²	121.3	67%	0.67	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-64.2	-15.8	177.4	-78.5	157.9	0	0	0	111.9	F970 M972 Q976 M977	F970-L974 HydrophobicContact CE1-CD1 4.2Å; M972-L974 PolarHBondContact O-N 2.75Å; L974-Q976 PolarHBondContact O-N 3.01Å; L974-M977 PolarHBondContact O-N 2.89Å
975	S	36.9	Very low	34.9	Very low	61 Å²	61	121.7 Å²	121.7	43%	0.427	62%	0.619	S	S	.	*	G	3₁₀ helix	trans	-65.5	-19.4	167.1	91.2	0	0	0	0	113.8	D973 N978	D973-S975 PolarHBondContact O-N 3Å; D973-S975 VanDerWaalsContact O-N 3.16Å; D973-S975 WeakPolarHBondContact OD1-CB 2.95Å; D973-S975 PolarHBondContact OD1-N 3.08Å; D973-S975 PolarHBondContact OD1-OG 2.98Å; D973-S975 WeakPolarHBondContact OD2-CB 3.31Å; D973-S975 PolarHBondContact OD2-OG 2.81Å; S975-N978 PolarHBondContact O-ND2 2.74Å; S975-N978 PolarHBondContact O-OD1 2.85Å
976	Q	33.1	Very low	35.9	Very low	165 Å²	165	121.3 Å²	121.3	77%	0.771	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-87.6	-0.1	178.7	-65.5	-168.5	0.6	0	0	113.9	D973 L974 N978	D973-Q976 HydrophobicContact CB-CG 4.36Å; D973-Q976 WeakPolarHBondContact O-CB 3.48Å; D973-Q976 PolarHBondContact O-N 3.5Å; L974-Q976 PolarHBondContact O-N 3.01Å; Q976-N978 PolarHBondContact O-N 2.65Å
977	M	31.7	Very low	36.8	Very low	77 Å²	77	121 Å²	121	38%	0.379	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-83.2	20.7	167.3	-150.2	166.8	-171.5	0	0	112.8	L974 Q979 L980	L974-M977 PolarHBondContact O-N 2.89Å; M977-Q979 PolarHBondContact O-N 3.07Å; M977-L980 HydrophobicContact CE-CB 4.06Å; M977-L980 HydrophobicContact CE-CD1 3.76Å; M977-L980 HydrophobicContact CG-CB 4.37Å; M977-L980 PolarHBondContact O-N 2.85Å
978	N	29.1	Very low	38	Very low	135 Å²	135	114.6 Å²	114.6	72%	0.722	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	63.9	177	-82.1	-15.1	0	0	0	113.6	S975 Q976	S975-N978 PolarHBondContact O-ND2 2.74Å; S975-N978 PolarHBondContact O-OD1 2.85Å; Q976-N978 PolarHBondContact O-N 2.65Å
979	Q	37.4	Very low	38.7	Very low	167 Å²	167	109.8 Å²	109.8	78%	0.78	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.4	-17.5	151.6	-109.5	161.5	2.1	0	0	113.8	M977 G981	M977-Q979 PolarHBondContact O-N 3.07Å; Q979-G981 PolarHBondContact O-N 2.93Å
980	L	36.5	Very low	39.5	Very low	101 Å²	101	103 Å²	103	53%	0.529	53%	0.533	S	S	.	.	S	Bend	trans	-87.8	109	173.7	-70.8	169	0	0	0	109.5	M977	M977-L980 HydrophobicContact CE-CB 4.06Å; M977-L980 HydrophobicContact CE-CD1 3.76Å; M977-L980 HydrophobicContact CG-CB 4.37Å; M977-L980 PolarHBondContact O-N 2.85Å
981	G	40.4	Very low	40.2	Very low	29 Å²	29	102 Å²	102	30%	0.299	54%	0.535	S	S	.	.			trans	-55.3	141.7	-163.4	0	0	0	0	0	117	Q979 L983	Q979-G981 PolarHBondContact O-N 2.93Å; G981-L983 PolarHBondContact O-N 3.41Å
982	D	45.9	Very low	41.2	Very low	78 Å²	78	102.7 Å²	102.7	42%	0.417	52%	0.523	S	S	.	.			trans	-3.9	91.1	-177.6	-61.8	-21.4	0	0	0	116.9	R943 Y984	R943-D982 WeakPolarHBondContact CA-O 3.39Å; D982-Y984 HydrophobicContact CB-CD2 4.34Å; D982-Y984 HydrophobicContact CB-CE2 3.69Å
983	L	47.6	Very low	42.1	Very low	76 Å²	76	99.1 Å²	99.1	40%	0.398	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	124.1	170.3	-173.2	74.5	0	0	0	110.6	I941 R943 G981	I941-L983 HydrophobicContact CG2-CD1 3.56Å; I941-L983 HydrophobicContact CG2-CG 4.23Å; R943-L983 HydrophobicContact CB-CD1 4Å; G981-L983 PolarHBondContact O-N 3.41Å
984	Y	50.9	Low	42.9	Very low	111 Å²	111	100 Å²	100	44%	0.435	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	141.8	179	-65.4	-80.6	0	0	0	111.8	I941 Y942 D982	I941-Y984 WeakPolarHBondContact CA-O 3.17Å; Y942-Y984 AromaticContact CD2-CD2 3.97Å; Y942-Y984 HydrophobicContact CD2-CD2 3.97Å; Y942-Y984 HydrophobicContact CD2-CG 4.49Å; Y942-Y984 VanDerWaalsContact CE1-CB 3.43Å; Y942-Y984 HydrophobicContact CE1-CG 4.33Å; Y942-Y984 AromaticContact CE2-CD2 3.27Å; Y942-Y984 HydrophobicContact CE2-CD2 3.27Å; Y942-Y984 HydrophobicContact CE2-CE2 4.13Å; Y942-Y984 AromaticContact CE2-CG 3.72Å; Y942-Y984 HydrophobicContact CE2-CG 3.72Å; Y942-Y984 AromaticContact CZ-CD2 3.72Å; Y942-Y984 AromaticContact CZ-CG 3.65Å; Y942-Y984 PolarHBondContact N-O 3.26Å; Y942-Y984 PolarHBondContact O-N 2.7Å; D982-Y984 HydrophobicContact CB-CD2 4.34Å; D982-Y984 HydrophobicContact CB-CE2 3.69Å
985	I	52.5	Low	44	Very low	108 Å²	108	95.5 Å²	95.5	55%	0.554	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.4	-177.4	-53.2	-179.9	0	0	0	109.4	I940 I941	I940-I985 WeakPolarHBondContact O-CA 2.99Å; I941-I985 HydrophobicContact CD1-CD1 4.42Å; I941-I985 HydrophobicContact CD1-CG1 4.43Å; I941-I985 HydrophobicContact CG1-CG1 4.14Å; I941-I985 HydrophobicContact CG1-CG2 4.27Å; I941-I985 HydrophobicContact CG2-CG1 4.35Å
986	R	50.2	Low	45.1	Very low	105 Å²	105	94.1 Å²	94.1	40%	0.396	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	119.9	-178	-154.9	164.2	169.8	-142.2	-7	111.9	N939 I940 Y997 L998	N939-R986 WeakPolarHBondContact CA-O 3.27Å; I940-R986 PolarHBondContact N-O 2.95Å; I940-R986 PolarHBondContact O-N 2.58Å; R986-Y997 WeakPolarHBondContact CD-OH 3Å; R986-Y997 HydrophobicContact CG-CE1 4.38Å; R986-Y997 WeakPolarHBondContact CG-OH 3.47Å; R986-Y997 PolarHBondContact NE-OH 3.24Å; R986-Y997 PolarHBondContact NH2-OH 2.76Å; R986-L998 PolarHBondContact NH1-O 3.39Å
987	R	48.5	Very low	46.6	Very low	129 Å²	129	88.5 Å²	88.5	49%	0.487	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	144.9	-177.6	-172.1	-177	-78	148	2.3	112.6	F938 N939 E1015	F938-R987 CarbonylContact O-C 3.46Å; N939-R987 VanDerWaalsContact OD1-CA 3.22Å; N939-R987 WeakPolarHBondContact OD1-CA 3.47Å; N939-R987 WeakPolarHBondContact OD1-CB 3.37Å; N939-R987 WeakPolarHBondContact OD1-CG 3.4Å; R987-E1015 IonicContact CZ-OE1 3.54Å; R987-E1015 VanDerWaalsContact CZ-OE1 3.27Å; R987-E1015 IonicContact CZ-OE2 2.64Å; R987-E1015 IonicContact NE-OE1 3.67Å; R987-E1015 PolarHBondContact NE-OE1 2.94Å; R987-E1015 IonicContact NE-OE2 2.83Å; R987-E1015 PolarHBondContact NE-OE2 2.78Å; R987-E1015 IonicContact NH2-OE1 3.95Å; R987-E1015 PolarHBondContact NH2-OE1 3.27Å; R987-E1015 IonicContact NH2-OE2 3.66Å; R987-E1015 PolarHBondContact NH2-OE2 3.46Å
988	I	53.8	Low	48.2	Very low	24 Å²	24	88 Å²	88	12%	0.123	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	117.7	-175.8	-50.3	171.7	0	0	0	109.9	W915 F938 I940 Y997	W915-I988 HydrophobicContact CH2-CD1 3.72Å; W915-I988 HydrophobicContact CZ2-CD1 4.32Å; F938-I988 PolarHBondContact N-O 2.94Å; F938-I988 WeakPolarHBondContact O-CA 3.18Å; F938-I988 PolarHBondContact O-N 3.09Å; I940-I988 HydrophobicContact CD1-CD1 3.76Å; I940-I988 HydrophobicContact CG1-CD1 3.84Å; I988-Y997 HydrophobicContact CD1-CD1 3.94Å; I988-Y997 HydrophobicContact CD1-CD2 3.4Å; I988-Y997 HydrophobicContact CD1-CE1 4.04Å; I988-Y997 HydrophobicContact CD1-CE2 3.53Å; I988-Y997 HydrophobicContact CD1-CG 3.58Å; I988-Y997 HydrophobicContact CG1-CD2 4.03Å; I988-Y997 HydrophobicContact CG1-CE1 4.5Å; I988-Y997 HydrophobicContact CG1-CE2 3.64Å; I988-Y997 HydrophobicContact CG2-CE2 4.44Å
989	N	44.6	Very low	50	Low	103 Å²	103	81.6 Å²	81.6	55%	0.551	42%	0.422	S	S	*	.			trans	-108	146	174.8	-63.2	24.2	0	0	0	109.5	T937	T937-N989 WeakPolarHBondContact CG2-OD1 3.25Å
990	G	42.6	Very low	51.3	Low	46 Å²	46	76.8 Å²	76.8	47%	0.474	40%	0.401	S	S	.	.			trans	142.4	162.3	178.9	0	0	0	0	0	113.6	K995	G990-K995 WeakPolarHBondContact O-CE 3.26Å; G990-K995 PolarHBondContact O-NZ 3.39Å
991	D	39.5	Very low	52.6	Low	134 Å²	134	75.2 Å²	75.2	72%	0.717	41%	0.409	S	S	*	.			trans	-96.6	160.4	-160.7	-92.8	-49.2	0	0	0	117.8
992	H	46.5	Very low	54.1	Low	139 Å²	139	74.1 Å²	74.1	64%	0.644	40%	0.396	S	S	*	.	S	Bend	trans	45.2	116	161.7	-59.4	-46.2	0	0	0	122.1	L994	H992-L994 PolarHBondContact O-N 3.23Å
993	T	49	Very low	55.2	Low	82 Å²	82	75.1 Å²	75.1	50%	0.503	40%	0.398	S	S	.	.	S	Bend	trans	65	-37.9	151.5	61.8	0	0	0	0	121.3	I916 Y917	I916-T993 WeakPolarHBondContact CA-O 3.46Å; Y917-T993 PolarHBondContact N-O 3.15Å
994	L	50.1	Low	56.3	Low	103 Å²	103	73.4 Å²	73.4	54%	0.539	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	127.4	-179.3	-158.8	156.3	0	0	0	111.5	I916 H992	I916-L994 HydrophobicContact CD1-CD1 3.82Å; I916-L994 HydrophobicContact CD1-CG 4.33Å; I916-L994 HydrophobicContact CG1-CB 4.21Å; I916-L994 HydrophobicContact CG1-CD1 3.7Å; I916-L994 HydrophobicContact CG1-CG 3.65Å; H992-L994 PolarHBondContact O-N 3.23Å
995	K	57	Low	57.5	Low	33 Å²	33	72.2 Å²	72.2	14%	0.143	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	132.2	-178.1	-71.2	-178.5	178.3	176	0	111.7	E914 W915 F938 G990	E914-K995 CarbonylContact C-O 3.51Å; E914-K995 WeakPolarHBondContact CA-O 3.44Å; W915-K995 HydrophobicContact CD2-CB 4.09Å; W915-K995 HydrophobicContact CH2-CB 4.22Å; W915-K995 HydrophobicContact CZ2-CB 3.69Å; W915-K995 HydrophobicContact CZ2-CD 3.92Å; W915-K995 HydrophobicContact CZ2-CG 4.44Å; W915-K995 PolarHBondContact N-O 2.92Å; W915-K995 PolarHBondContact O-N 3Å; F938-K995 VanDerWaalsContact CD2-NZ 3.26Å; G990-K995 WeakPolarHBondContact O-CE 3.26Å; G990-K995 PolarHBondContact O-NZ 3.39Å
996	G	60	Low	58.4	Low	32 Å²	32	67.6 Å²	67.6	33%	0.33	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	143.8	169.3	0	0	0	0	0	110.8	I913	I913-G996 CarbonylContact O-C 3.33Å; I913-G996 VanDerWaalsContact O-CA 3.27Å; I913-G996 WeakPolarHBondContact O-CA 3.37Å
997	Y	65.4	Low	59.6	Low	47 Å²	47	64.6 Å²	64.6	18%	0.184	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	141.3	-173.9	-160.6	-102.1	0	0	0	114	Y912 I913 I940 R986 I988 L999	Y912-Y997 CarbonylContact C-O 3.58Å; Y912-Y997 WeakPolarHBondContact CA-O 3.46Å; Y912-Y997 WeakPolarHBondContact CD2-O 3.35Å; I913-Y997 PolarHBondContact N-O 3.1Å; I913-Y997 PolarHBondContact O-N 3.35Å; I940-Y997 HydrophobicContact CD1-CD1 3.5Å; I940-Y997 HydrophobicContact CD1-CE1 4.28Å; I940-Y997 HydrophobicContact CD1-CG 3.87Å; R986-Y997 WeakPolarHBondContact CD-OH 3Å; R986-Y997 HydrophobicContact CG-CE1 4.38Å; R986-Y997 WeakPolarHBondContact CG-OH 3.47Å; R986-Y997 PolarHBondContact NE-OH 3.24Å; R986-Y997 PolarHBondContact NH2-OH 2.76Å; I988-Y997 HydrophobicContact CD1-CD1 3.94Å; I988-Y997 HydrophobicContact CD1-CD2 3.4Å; I988-Y997 HydrophobicContact CD1-CE1 4.04Å; I988-Y997 HydrophobicContact CD1-CE2 3.53Å; I988-Y997 HydrophobicContact CD1-CG 3.58Å; I988-Y997 HydrophobicContact CG1-CD2 4.03Å; I988-Y997 HydrophobicContact CG1-CE1 4.5Å; I988-Y997 HydrophobicContact CG1-CE2 3.64Å; I988-Y997 HydrophobicContact CG2-CE2 4.44Å; Y997-L999 HydrophobicContact CD1-CD2 4.14Å; Y997-L999 HydrophobicContact CE1-CD2 4.12Å
998	L	64.1	Low	60.9	Low	67 Å²	67	58.7 Å²	58.7	35%	0.351	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	113.4	177.5	-169	80.2	0	0	0	111.2	S906 C910 Y912 R986	S906-L998 WeakPolarHBondContact OG-CD1 3.35Å; C910-L998 HydrophobicContact CB-CD1 4.08Å; Y912-L998 HydrophobicContact CD2-CB 4.26Å; Y912-L998 HydrophobicContact CD2-CD1 4.19Å; R986-L998 PolarHBondContact NH1-O 3.39Å
999	L	68.2	Low	61.9	Low	0 Å²	0	57.6 Å²	57.6	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	137.6	157.8	-58.5	-177.8	0	0	0	108.9	C910 L911 I913 I940 Y942 Y997 L1002 V1010	C910-L999 CarbonylContact C-O 3.07Å; C910-L999 VanDerWaalsContact CA-O 3.23Å; C910-L999 WeakPolarHBondContact CA-O 3.34Å; L911-L999 HydrophobicContact CB-CB 4.37Å; L911-L999 PolarHBondContact N-O 3.16Å; L911-L999 PolarHBondContact O-N 2.66Å; I913-L999 HydrophobicContact CD1-CD1 3.64Å; I913-L999 HydrophobicContact CD1-CG 3.92Å; I940-L999 HydrophobicContact CG2-CD1 4.32Å; I940-L999 HydrophobicContact CG2-CD2 4.32Å; Y942-L999 HydrophobicContact CD1-CD1 3.54Å; Y942-L999 HydrophobicContact CD1-CD2 3.89Å; Y942-L999 HydrophobicContact CD1-CG 4.32Å; Y942-L999 HydrophobicContact CE1-CD1 4.01Å; Y942-L999 HydrophobicContact CE1-CD2 3.71Å; Y942-L999 HydrophobicContact CE1-CG 4.37Å; Y942-L999 HydrophobicContact CG-CD1 3.83Å; Y997-L999 HydrophobicContact CD1-CD2 4.14Å; Y997-L999 HydrophobicContact CE1-CD2 4.12Å; L999-L1002 HydrophobicContact CB-CD1 4.36Å; L999-V1010 HydrophobicContact CD1-CG1 4.15Å; L999-V1010 HydrophobicContact CD1-CG2 4.35Å
1000	D	63.2	Low	63.3	Low	66 Å²	66	52.8 Å²	52.8	35%	0.353	31%	0.31	S	S	.	.			trans	-145.5	161.7	-179.4	-170.5	17.4	0	0	0	109.5	T909 C910	T909-D1000 WeakPolarHBondContact O-CA 3.15Å; T909-D1000 PolarHBondContact OG1-OD1 2.96Å; T909-D1000 VanDerWaalsContact OG1-OD1 3.1Å; C910-D1000 PolarHBondContact SG-OD1 3.48Å
1001	G	64.7	Low	64.6	Low	67 Å²	67	50.6 Å²	50.6	69%	0.691	29%	0.287	S	S	*	.	S	Bend	trans	85.2	12.5	-172.8	0	0	0	0	0	114.6	T909	T909-G1001 PolarHBondContact O-N 2.91Å
1002	L	72.8	Confident	65.9	Low	6 Å²	6	44.2 Å²	44.2	3%	0.031	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-74.8	153.7	179.1	-53.9	175.1	0	0	0	111.6	T909 L911 Y942 L999 Y1008 T1039	T909-L1002 WeakPolarHBondContact CA-O 3.31Å; T909-L1002 VanDerWaalsContact CB-O 3.29Å; T909-L1002 WeakPolarHBondContact CB-O 3.15Å; T909-L1002 VanDerWaalsContact CG2-O 3.32Å; T909-L1002 WeakPolarHBondContact CG2-O 3.27Å; T909-L1002 VanDerWaalsContact O-CB 3.27Å; T909-L1002 WeakPolarHBondContact O-CB 3.33Å; T909-L1002 WeakPolarHBondContact O-CG 3.43Å; T909-L1002 PolarHBondContact O-N 3.36Å; L911-L1002 HydrophobicContact CB-CD1 3.98Å; L911-L1002 HydrophobicContact CD1-CD1 3.6Å; L911-L1002 HydrophobicContact CG-CD1 3.54Å; Y942-L1002 HydrophobicContact CD2-CD2 3.74Å; Y942-L1002 HydrophobicContact CE2-CD2 3.23Å; L999-L1002 HydrophobicContact CB-CD1 4.36Å; L1002-Y1008 HydrophobicContact CB-CD2 4.46Å; L1002-Y1008 HydrophobicContact CB-CE2 3.77Å; L1002-Y1008 HydrophobicContact CD1-CD2 4.38Å; L1002-Y1008 HydrophobicContact CD1-CE2 4.48Å; L1002-Y1008 HydrophobicContact CD2-CD1 4.26Å; L1002-Y1008 HydrophobicContact CD2-CE1 3.95Å; L1002-Y1008 HydrophobicContact CD2-CE2 4.23Å; L1002-Y1008 HydrophobicContact CG-CE2 4.38Å; L1002-T1039 HydrophobicContact CB-CG2 4.07Å; L1002-T1039 HydrophobicContact CD1-CG2 4.07Å
1003	Q	68.9	Low	66.7	Low	99 Å²	99	38.4 Å²	38.4	46%	0.463	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-71.3	140.3	172	-65.1	-171.6	16.3	0	0	110.8	V1006 Y1008 T1039	Q1003-V1006 HydrophobicContact CB-CB 4.15Å; Q1003-V1006 HydrophobicContact CB-CG2 3.69Å; Q1003-Y1008 PolarHBondContact N-OH 3.49Å; Q1003-T1039 PolarHBondContact O-OG1 2.92Å
1004	P	70	Confident	67.3	Low	41 Å²	41	35 Å²	35	27%	0.266	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	152	175.3	31.2	-35.1	0	0	0	112.2	Q908 V1006 T1039 L1040 K1042	Q908-P1004 HydrophobicContact CB-CB 4.3Å; Q908-P1004 VanDerWaalsContact O-CA 3.31Å; Q908-P1004 WeakPolarHBondContact O-CA 3.39Å; Q908-P1004 WeakPolarHBondContact O-CB 3.36Å; P1004-V1006 PolarHBondContact O-N 3.48Å; P1004-T1039 WeakPolarHBondContact CA-OG1 3.06Å; P1004-L1040 WeakPolarHBondContact CB-O 3.22Å; P1004-K1042 HydrophobicContact CB-CB 4.04Å; P1004-K1042 HydrophobicContact CG-CB 3.94Å; P1004-K1042 HydrophobicContact CG-CD 4.33Å
1005	N	75.1	Confident	67.6	Low	85 Å²	85	30 Å²	30	46%	0.455	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	16.6	-174.7	-154.5	17.6	0	0	0	115.5	K1038 T1039 L1040 P1041	N1005-K1038 VanDerWaalsContact C-CE 3.46Å; N1005-K1038 WeakPolarHBondContact O-CE 3.05Å; N1005-K1038 WeakPolarHBondContact OD1-CE 3.02Å; N1005-K1038 PolarHBondContact OD1-NZ 2.87Å; N1005-T1039 WeakPolarHBondContact CA-O 3.42Å; N1005-T1039 PolarHBondContact N-O 3.01Å; N1005-T1039 PolarHBondContact N-OG1 3.33Å; N1005-T1039 VanDerWaalsContact N-OG1 3.12Å; N1005-L1040 PolarHBondContact N-O 3.07Å; N1005-P1041 HydrophobicContact CB-CB 4.22Å
1006	V	71.8	Confident	67.3	Low	11 Å²	11	29.8 Å²	29.8	7%	0.067	18%	0.18	C	C	.	.			trans	-110.1	140.3	-173.1	171.7	0	0	0	0	111.1	N944 Q1003 P1004 Y1008 K1038 T1039	N944-V1006 WeakPolarHBondContact OD1-CG1 3.18Å; Q1003-V1006 HydrophobicContact CB-CB 4.15Å; Q1003-V1006 HydrophobicContact CB-CG2 3.69Å; P1004-V1006 PolarHBondContact O-N 3.48Å; V1006-Y1008 HydrophobicContact CB-CD2 4.37Å; V1006-Y1008 HydrophobicContact CB-CE2 3.76Å; V1006-Y1008 HydrophobicContact CG1-CD2 3.98Å; V1006-Y1008 HydrophobicContact CG1-CE2 3.48Å; V1006-Y1008 VanDerWaalsContact CG1-CE2 3.48Å; V1006-K1038 WeakPolarHBondContact O-CA 3.43Å; V1006-T1039 PolarHBondContact N-OG1 3.26Å; V1006-T1039 PolarHBondContact O-N 2.87Å; V1006-T1039 PolarHBondContact O-OG1 2.85Å
1007	T	76.2	Confident	66.6	Low	43 Å²	43	28.8 Å²	28.8	26%	0.264	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	119.1	178.7	-53.3	0	0	0	0	109.6	L945 V1036	L945-T1007 HydrophobicContact CB-CG2 4.44Å; L945-T1007 WeakPolarHBondContact CB-O 3.31Å; L945-T1007 HydrophobicContact CD1-CG2 4.26Å; L945-T1007 PolarHBondContact N-O 2.82Å; T1007-V1036 HydrophobicContact CG2-CG1 3.35Å
1008	Y	75.2	Confident	65.5	Low	5 Å²	5	29 Å²	29	2%	0.02	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	140.2	177.2	-72.9	-88.5	0	0	0	111.1	Y942 R943 N944 L1002 Q1003 V1006 V1036 Q1037 T1039	Y942-Y1008 HydrophobicContact CD2-CD1 4.04Å; Y942-Y1008 HydrophobicContact CD2-CE1 4.31Å; R943-Y1008 VanDerWaalsContact O-CA 3.29Å; R943-Y1008 WeakPolarHBondContact O-CA 3.36Å; R943-Y1008 WeakPolarHBondContact O-CD1 3.43Å; N944-Y1008 HydrophobicContact CB-CE1 4.12Å; L1002-Y1008 HydrophobicContact CB-CD2 4.46Å; L1002-Y1008 HydrophobicContact CB-CE2 3.77Å; L1002-Y1008 HydrophobicContact CD1-CD2 4.38Å; L1002-Y1008 HydrophobicContact CD1-CE2 4.48Å; L1002-Y1008 HydrophobicContact CD2-CD1 4.26Å; L1002-Y1008 HydrophobicContact CD2-CE1 3.95Å; L1002-Y1008 HydrophobicContact CD2-CE2 4.23Å; L1002-Y1008 HydrophobicContact CG-CE2 4.38Å; Q1003-Y1008 PolarHBondContact N-OH 3.49Å; V1006-Y1008 HydrophobicContact CB-CD2 4.37Å; V1006-Y1008 HydrophobicContact CB-CE2 3.76Å; V1006-Y1008 HydrophobicContact CG1-CD2 3.98Å; V1006-Y1008 HydrophobicContact CG1-CE2 3.48Å; V1006-Y1008 VanDerWaalsContact CG1-CE2 3.48Å; Y1008-V1036 WeakPolarHBondContact O-CA 3.19Å; Y1008-Q1037 PolarHBondContact N-O 2.89Å; Y1008-Q1037 PolarHBondContact O-N 2.86Å; Y1008-T1039 HydrophobicContact CD2-CG2 4.02Å; Y1008-T1039 HydrophobicContact CE2-CG2 4.11Å
1009	A	74.4	Confident	64.3	Low	1 Å²	1	30.6 Å²	30.6	1%	0.008	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	141.7	163.7	0	0	0	0	0	109.9	Y942 R943 L945 E1034 V1036	Y942-A1009 WeakPolarHBondContact CA-O 3.48Å; Y942-A1009 WeakPolarHBondContact CB-O 3.41Å; R943-A1009 HydrophobicContact CG-CB 3.99Å; R943-A1009 PolarHBondContact N-O 3.03Å; R943-A1009 PolarHBondContact O-N 3.34Å; L945-A1009 HydrophobicContact CD1-CB 3.93Å; L945-A1009 HydrophobicContact CD2-CB 4.32Å; L945-A1009 HydrophobicContact CG-CB 4.11Å; A1009-E1034 HydrophobicContact CB-CG 4.06Å; A1009-E1034 VanDerWaalsContact CB-OE1 3.27Å; A1009-E1034 WeakPolarHBondContact CB-OE1 3.26Å; A1009-V1036 HydrophobicContact CB-CG2 4.12Å
1010	V	74.2	Confident	62.8	Low	1 Å²	1	37.4 Å²	37.4	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.9	-178.1	-162.8	0	0	0	0	111.6	I903 L911 I913 I940 I941 L999 V1035	I903-V1010 HydrophobicContact CD1-CB 4.3Å; L911-V1010 HydrophobicContact CD1-CG2 4.4Å; I913-V1010 HydrophobicContact CD1-CB 4.35Å; I913-V1010 HydrophobicContact CD1-CG1 3.59Å; I913-V1010 HydrophobicContact CD1-CG2 4.45Å; I940-V1010 HydrophobicContact CG2-CG1 3.38Å; I941-V1010 WeakPolarHBondContact O-CA 3.31Å; L999-V1010 HydrophobicContact CD1-CG1 4.15Å; L999-V1010 HydrophobicContact CD1-CG2 4.35Å; V1010-V1035 PolarHBondContact N-O 2.9Å; V1010-V1035 PolarHBondContact O-N 3.27Å
1011	S	70.7	Confident	61.5	Low	0 Å²	0	43 Å²	43	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	152.1	173.5	-169.1	0	0	0	0	112	I941 R1030 S1032	I941-S1011 PolarHBondContact N-O 3.07Å; I941-S1011 PolarHBondContact O-N 3.45Å; S1011-R1030 VanDerWaalsContact OG-CD 3.27Å; S1011-R1030 WeakPolarHBondContact OG-CD 3.36Å; S1011-R1030 WeakPolarHBondContact OG-CG 3.21Å; S1011-S1032 PolarHBondContact OG-OG 2.89Å; S1011-S1032 VanDerWaalsContact OG-OG 3.13Å
1012	V	66.4	Low	60.3	Low	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134	178.2	-175.9	0	0	0	0	111	L898 I900 W915 F938 L1031 S1032	L898-V1012 HydrophobicContact CD2-CB 4.31Å; L898-V1012 HydrophobicContact CD2-CG1 4.27Å; I900-V1012 HydrophobicContact CD1-CG2 4.2Å; I900-V1012 HydrophobicContact CG1-CG2 4.18Å; W915-V1012 HydrophobicContact CD2-CG1 4.39Å; W915-V1012 HydrophobicContact CD2-CG2 4.11Å; W915-V1012 HydrophobicContact CE3-CG2 4.03Å; W915-V1012 HydrophobicContact CZ2-CG1 4.32Å; W915-V1012 HydrophobicContact CZ3-CG2 4.4Å; F938-V1012 HydrophobicContact CD1-CG1 4.3Å; V1012-L1031 PolarHBondContact O-N 2.92Å; V1012-S1032 PolarHBondContact N-OG 2.88Å; V1012-S1032 PolarHBondContact O-N 2.87Å
1013	Y	63.8	Low	58.6	Low	17 Å²	17	56.1 Å²	56.1	7%	0.067	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	152.8	179.7	-80.6	-102.1	0	0	0	110.8	F938 N939 I941 W959 T1029 R1030	F938-Y1013 CarbonylContact C-O 3.4Å; F938-Y1013 WeakPolarHBondContact CA-O 3.41Å; N939-Y1013 PolarHBondContact N-O 3.14Å; N939-Y1013 PolarHBondContact O-N 3.09Å; I941-Y1013 HydrophobicContact CB-CD2 4.42Å; I941-Y1013 HydrophobicContact CB-CE2 4.45Å; I941-Y1013 HydrophobicContact CD1-CD1 4.49Å; I941-Y1013 HydrophobicContact CD1-CD2 3.67Å; I941-Y1013 HydrophobicContact CD1-CE2 3.76Å; I941-Y1013 HydrophobicContact CD1-CG 4.1Å; I941-Y1013 HydrophobicContact CG1-CD2 3.85Å; I941-Y1013 HydrophobicContact CG1-CE2 4.19Å; W959-Y1013 HydrophobicContact CE3-CE2 4.41Å; W959-Y1013 AromaticContact CE3-CZ 3.92Å; W959-Y1013 HydrophobicContact CH2-CE2 4.44Å; W959-Y1013 AromaticContact CZ3-CE2 3.89Å; W959-Y1013 HydrophobicContact CZ3-CE2 3.89Å; W959-Y1013 AromaticContact CZ3-CZ 3.84Å; W959-Y1013 WeakPolarHBondContact CZ3-OH 3.38Å; Y1013-T1029 CarbonylContact C-O 3.56Å; Y1013-T1029 WeakPolarHBondContact CA-O 3.5Å; Y1013-T1029 VanDerWaalsContact CD1-C 3.45Å; Y1013-T1029 WeakPolarHBondContact CD1-O 3.33Å; Y1013-R1030 HydrophobicContact CD1-CB 4.2Å; Y1013-R1030 HydrophobicContact CD2-CG 4.27Å; Y1013-R1030 HydrophobicContact CE1-CB 3.58Å; Y1013-R1030 HydrophobicContact CE1-CG 4.07Å; Y1013-R1030 HydrophobicContact CE2-CB 4.11Å; Y1013-R1030 HydrophobicContact CE2-CG 3.61Å; Y1013-R1030 VanDerWaalsContact CZ-CB 3.48Å; Y1013-R1030 VanDerWaalsContact CZ-CG 3.46Å; Y1013-R1030 WeakPolarHBondContact OH-CB 2.88Å; Y1013-R1030 WeakPolarHBondContact OH-CD 3.28Å; Y1013-R1030 WeakPolarHBondContact OH-CG 3.48Å
1014	I	60.4	Low	57.2	Low	10 Å²	10	54.8 Å²	54.8	5%	0.051	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	141	163.1	-159.9	165.5	0	0	0	109.7	L936 T937 F938 V1016 F1028 T1029 L1031	L936-I1014 HydrophobicContact CB-CD1 4.27Å; L936-I1014 HydrophobicContact CD1-CD1 4.41Å; L936-I1014 HydrophobicContact CD2-CD1 4.02Å; L936-I1014 HydrophobicContact CG-CD1 4.47Å; T937-I1014 CarbonylContact O-C 3.59Å; T937-I1014 WeakPolarHBondContact O-CA 3.44Å; T937-I1014 WeakPolarHBondContact O-CG1 3.29Å; F938-I1014 HydrophobicContact CD1-CG1 4.45Å; F938-I1014 HydrophobicContact CE1-CB 4.47Å; F938-I1014 HydrophobicContact CE1-CD1 4.02Å; F938-I1014 HydrophobicContact CE1-CG1 4.23Å; F938-I1014 HydrophobicContact CE2-CD1 4.38Å; F938-I1014 HydrophobicContact CZ-CD1 3.84Å; F938-I1014 HydrophobicContact CZ-CG1 4.32Å; I1014-V1016 HydrophobicContact CG2-CG2 4.4Å; I1014-F1028 WeakPolarHBondContact O-CA 3.33Å; I1014-T1029 PolarHBondContact N-O 3.12Å; I1014-T1029 PolarHBondContact O-N 2.94Å; I1014-L1031 HydrophobicContact CB-CD1 3.58Å; I1014-L1031 HydrophobicContact CB-CG 3.95Å; I1014-L1031 HydrophobicContact CD1-CD1 3.95Å; I1014-L1031 HydrophobicContact CG1-CD1 4.34Å; I1014-L1031 HydrophobicContact CG2-CD1 3.72Å; I1014-L1031 HydrophobicContact CG2-CD2 3.99Å; I1014-L1031 HydrophobicContact CG2-CG 3.73Å
1015	E	56.5	Low	56	Low	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	108.5	172.7	169.4	-169.6	155.8	0	0	107.8	T937 N939 R987 K1026 Y1027 F1028	T937-E1015 PolarHBondContact N-O 2.79Å; T937-E1015 PolarHBondContact O-N 2.77Å; T937-E1015 VanDerWaalsContact OG1-CB 3.3Å; T937-E1015 WeakPolarHBondContact OG1-CB 3.42Å; T937-E1015 VanDerWaalsContact OG1-CD 3.27Å; T937-E1015 WeakPolarHBondContact OG1-CG 3.29Å; T937-E1015 PolarHBondContact OG1-O 3.18Å; N939-E1015 VanDerWaalsContact ND2-CB 3.25Å; N939-E1015 WeakPolarHBondContact ND2-CB 3.39Å; N939-E1015 PolarHBondContact ND2-OE2 3.25Å; R987-E1015 IonicContact CZ-OE1 3.54Å; R987-E1015 VanDerWaalsContact CZ-OE1 3.27Å; R987-E1015 IonicContact CZ-OE2 2.64Å; R987-E1015 IonicContact NE-OE1 3.67Å; R987-E1015 PolarHBondContact NE-OE1 2.94Å; R987-E1015 IonicContact NE-OE2 2.83Å; R987-E1015 PolarHBondContact NE-OE2 2.78Å; R987-E1015 IonicContact NH2-OE1 3.95Å; R987-E1015 PolarHBondContact NH2-OE1 3.27Å; R987-E1015 IonicContact NH2-OE2 3.66Å; R987-E1015 PolarHBondContact NH2-OE2 3.46Å; E1015-K1026 HydrophobicContact CG-CB 4.34Å; E1015-K1026 HydrophobicContact CG-CG 4.46Å; E1015-K1026 VanDerWaalsContact OE1-CD 3.23Å; E1015-K1026 WeakPolarHBondContact OE1-CD 3.45Å; E1015-K1026 WeakPolarHBondContact OE1-CE 3.44Å; E1015-K1026 IonicContact OE1-NZ 2.62Å; E1015-K1026 PolarHBondContact OE1-NZ 3.1Å; E1015-Y1027 VanDerWaalsContact CA-O 3.24Å; E1015-Y1027 WeakPolarHBondContact CA-O 3.31Å; E1015-F1028 HydrophobicContact CB-CD1 3.92Å; E1015-F1028 HydrophobicContact CB-CE1 3.79Å; E1015-F1028 HydrophobicContact CB-CZ 4.32Å; E1015-F1028 HydrophobicContact CG-CD1 4.34Å; E1015-F1028 HydrophobicContact CG-CE1 3.87Å; E1015-F1028 HydrophobicContact CG-CE2 4.38Å; E1015-F1028 HydrophobicContact CG-CZ 3.88Å; E1015-F1028 VanDerWaalsContact OE2-CE1 3.26Å; E1015-F1028 WeakPolarHBondContact OE2-CE1 3.49Å; E1015-F1028 WeakPolarHBondContact OE2-CZ 3.23Å
1016	V	50.8	Low	54.5	Low	28 Å²	28	54 Å²	54	17%	0.17	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	124.7	177.2	-173.5	0	0	0	0	108.3	F933 L936 I1014 K1026 Y1027	F933-V1016 HydrophobicContact CD1-CG1 4.4Å; F933-V1016 HydrophobicContact CE1-CG1 4.14Å; L936-V1016 HydrophobicContact CD2-CB 4.36Å; L936-V1016 HydrophobicContact CD2-CG1 4.12Å; L936-V1016 HydrophobicContact CD2-CG2 3.89Å; I1014-V1016 HydrophobicContact CG2-CG2 4.4Å; V1016-K1026 WeakPolarHBondContact O-CA 3.44Å; V1016-Y1027 PolarHBondContact N-O 3.06Å; V1016-Y1027 PolarHBondContact O-N 3.37Å; V1016-Y1027 VanDerWaalsContact O-N 3.08Å
1017	T	46.3	Very low	53.2	Low	11 Å²	11	54.8 Å²	54.8	7%	0.067	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.8	175.2	-45.7	0	0	0	0	109.4	D935 Q1025 K1026	D935-T1017 PolarHBondContact O-OG1 3.06Å; T1017-Q1025 CarbonylContact C-O 3.58Å; T1017-Q1025 WeakPolarHBondContact CA-O 3.4Å; T1017-K1026 HydrophobicContact CG2-CG 4.15Å; T1017-K1026 PolarHBondContact OG1-NZ 3.04Å
1018	K	42.4	Very low	51.8	Low	50 Å²	50	54.7 Å²	54.7	22%	0.217	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.7	175.2	-154.4	177.3	-168.1	-171.3	0	109.9	Y1020 S1024 Q1025 Y1027	K1018-Y1020 HydrophobicContact CD-CE2 3.77Å; K1018-Y1020 VanDerWaalsContact CE-OH 3.32Å; K1018-Y1020 WeakPolarHBondContact CE-OH 3.5Å; K1018-Y1020 HydrophobicContact CG-CE2 4.23Å; K1018-Y1020 PolarHBondContact NZ-OH 3.2Å; K1018-S1024 WeakPolarHBondContact O-CA 3.22Å; K1018-Q1025 PolarHBondContact N-O 2.83Å; K1018-Q1025 PolarHBondContact O-N 3.4Å; K1018-Y1027 HydrophobicContact CB-CE2 4.05Å
1019	I	39.2	Very low	50.5	Low	102 Å²	102	55.3 Å²	55.3	52%	0.523	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	107.5	-177.5	-55	174.9	0	0	0	108.6
1020	Y	35.6	Very low	49.5	Very low	142 Å²	142	59 Å²	59	56%	0.557	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	156.9	158.4	-72.5	-70.6	0	0	0	108.5	K1018 Y1022 Q1023	K1018-Y1020 HydrophobicContact CD-CE2 3.77Å; K1018-Y1020 VanDerWaalsContact CE-OH 3.32Å; K1018-Y1020 WeakPolarHBondContact CE-OH 3.5Å; K1018-Y1020 HydrophobicContact CG-CE2 4.23Å; K1018-Y1020 PolarHBondContact NZ-OH 3.2Å; Y1020-Y1022 PolarHBondContact O-N 3.24Å; Y1020-Q1023 PolarHBondContact N-O 2.86Å; Y1020-Q1023 PolarHBondContact O-N 3.41Å; Y1020-Q1023 VanDerWaalsContact O-N 3.09Å; Y1020-Q1023 VanDerWaalsContact O-O 3.04Å
1021	H	36.4	Very low	48.7	Very low	185 Å²	185	60.1 Å²	60.1	86%	0.856	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.7	109.2	-171.1	-77.6	-57.8	0	0	0	113.1
1022	Y	39.9	Very low	48.3	Very low	228 Å²	228	60.4 Å²	60.4	89%	0.894	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	1.9	176.2	-54	-77.5	0	0	0	119.3	Y1020	Y1020-Y1022 PolarHBondContact O-N 3.24Å
1023	Q	35.8	Very low	48	Very low	119 Å²	119	66.2 Å²	66.2	56%	0.556	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.7	140.3	165.8	-76	-171.1	-28.5	0	0	113.1	E967 Y1020	E967-Q1023 PolarHBondContact OE2-NE2 2.84Å; Y1020-Q1023 PolarHBondContact N-O 2.86Å; Y1020-Q1023 PolarHBondContact O-N 3.41Å; Y1020-Q1023 VanDerWaalsContact O-N 3.09Å; Y1020-Q1023 VanDerWaalsContact O-O 3.04Å
1024	S	41.2	Very low	48.2	Very low	72 Å²	72	67.8 Å²	67.8	50%	0.503	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	118.1	-179.7	61.3	0	0	0	0	111.5	K1018	K1018-S1024 WeakPolarHBondContact O-CA 3.22Å
1025	Q	43.4	Very low	48.4	Very low	55 Å²	55	69.5 Å²	69.5	26%	0.257	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	147.2	176.1	-61	-172.6	-68.3	0	0	110.9	N965 T1017 K1018 Y1027	N965-Q1025 PolarHBondContact OD1-NE2 3.42Å; T1017-Q1025 CarbonylContact C-O 3.58Å; T1017-Q1025 WeakPolarHBondContact CA-O 3.4Å; K1018-Q1025 PolarHBondContact N-O 2.83Å; K1018-Q1025 PolarHBondContact O-N 3.4Å; Q1025-Y1027 HydrophobicContact CB-CE2 3.88Å
1026	K	44	Very low	49.2	Very low	55 Å²	55	73 Å²	73	24%	0.239	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	121.7	-175.8	-74.1	173.9	168.2	-63	0	111.1	F964 E1015 V1016 T1017 F1028	F964-K1026 PolarHBondContact N-O 2.03Å; F964-K1026 VanDerWaalsContact N-O 3.17Å; E1015-K1026 HydrophobicContact CG-CB 4.34Å; E1015-K1026 HydrophobicContact CG-CG 4.46Å; E1015-K1026 VanDerWaalsContact OE1-CD 3.23Å; E1015-K1026 WeakPolarHBondContact OE1-CD 3.45Å; E1015-K1026 WeakPolarHBondContact OE1-CE 3.44Å; E1015-K1026 IonicContact OE1-NZ 2.62Å; E1015-K1026 PolarHBondContact OE1-NZ 3.1Å; V1016-K1026 WeakPolarHBondContact O-CA 3.44Å; T1017-K1026 HydrophobicContact CG2-CG 4.15Å; T1017-K1026 PolarHBondContact OG1-NZ 3.04Å; K1026-F1028 HydrophobicContact CB-CE2 4.33Å
1027	Y	45	Very low	50.2	Low	26 Å²	26	74.8 Å²	74.8	10%	0.102	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.6	-174.5	-60.3	-99.8	0	0	0	110.2	Q864 I963 E1015 V1016 K1018 Q1025	Q864-Y1027 PolarHBondContact OE1-OH 3.3Å; I963-Y1027 HydrophobicContact CD1-CE1 4.47Å; I963-Y1027 HydrophobicContact CG1-CD1 4.26Å; I963-Y1027 HydrophobicContact CG1-CE1 4.41Å; I963-Y1027 HydrophobicContact CG2-CE1 4.44Å; E1015-Y1027 VanDerWaalsContact CA-O 3.24Å; E1015-Y1027 WeakPolarHBondContact CA-O 3.31Å; V1016-Y1027 PolarHBondContact N-O 3.06Å; V1016-Y1027 PolarHBondContact O-N 3.37Å; V1016-Y1027 VanDerWaalsContact O-N 3.08Å; K1018-Y1027 HydrophobicContact CB-CE2 4.05Å; Q1025-Y1027 HydrophobicContact CB-CE2 3.88Å
1028	F	46.3	Very low	51.4	Low	41 Å²	41	79 Å²	79	18%	0.18	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	110.1	-176.9	-66.2	-98.2	0	0	0	112	F964 I1014 E1015 K1026	F964-F1028 HydrophobicContact CD2-CD2 4.24Å; F964-F1028 AromaticContact CD2-CE2 3.8Å; F964-F1028 HydrophobicContact CD2-CE2 3.8Å; F964-F1028 HydrophobicContact CE2-CE2 4.42Å; I1014-F1028 WeakPolarHBondContact O-CA 3.33Å; E1015-F1028 HydrophobicContact CB-CD1 3.92Å; E1015-F1028 HydrophobicContact CB-CE1 3.79Å; E1015-F1028 HydrophobicContact CB-CZ 4.32Å; E1015-F1028 HydrophobicContact CG-CD1 4.34Å; E1015-F1028 HydrophobicContact CG-CE1 3.87Å; E1015-F1028 HydrophobicContact CG-CE2 4.38Å; E1015-F1028 HydrophobicContact CG-CZ 3.88Å; E1015-F1028 VanDerWaalsContact OE2-CE1 3.26Å; E1015-F1028 WeakPolarHBondContact OE2-CE1 3.49Å; E1015-F1028 WeakPolarHBondContact OE2-CZ 3.23Å; K1026-F1028 HydrophobicContact CB-CE2 4.33Å
1029	T	48.9	Very low	52.9	Low	19 Å²	19	76.8 Å²	76.8	12%	0.117	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.9	178.9	-62.6	0	0	0	0	110.8	Q866 Y1013 I1014 L1031	Q866-T1029 PolarHBondContact OE1-OG1 2.68Å; Y1013-T1029 CarbonylContact C-O 3.56Å; Y1013-T1029 WeakPolarHBondContact CA-O 3.5Å; Y1013-T1029 VanDerWaalsContact CD1-C 3.45Å; Y1013-T1029 WeakPolarHBondContact CD1-O 3.33Å; I1014-T1029 PolarHBondContact N-O 3.12Å; I1014-T1029 PolarHBondContact O-N 2.94Å; T1029-L1031 HydrophobicContact CG2-CD2 4.37Å
1030	R	53	Low	54.3	Low	77 Å²	77	75.9 Å²	75.9	29%	0.291	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	127.2	176	-159.8	174.8	98.3	-173.2	-2.2	109.5	S1011 Y1013 S1032	S1011-R1030 VanDerWaalsContact OG-CD 3.27Å; S1011-R1030 WeakPolarHBondContact OG-CD 3.36Å; S1011-R1030 WeakPolarHBondContact OG-CG 3.21Å; Y1013-R1030 HydrophobicContact CD1-CB 4.2Å; Y1013-R1030 HydrophobicContact CD2-CG 4.27Å; Y1013-R1030 HydrophobicContact CE1-CB 3.58Å; Y1013-R1030 HydrophobicContact CE1-CG 4.07Å; Y1013-R1030 HydrophobicContact CE2-CB 4.11Å; Y1013-R1030 HydrophobicContact CE2-CG 3.61Å; Y1013-R1030 VanDerWaalsContact CZ-CB 3.48Å; Y1013-R1030 VanDerWaalsContact CZ-CG 3.46Å; Y1013-R1030 WeakPolarHBondContact OH-CB 2.88Å; Y1013-R1030 WeakPolarHBondContact OH-CD 3.28Å; Y1013-R1030 WeakPolarHBondContact OH-CG 3.48Å; R1030-S1032 PolarHBondContact NE-O 2.79Å
1031	L	57.3	Low	55.4	Low	26 Å²	26	72.6 Å²	72.6	14%	0.136	36%	0.355	C	S	.	.			trans	-107.7	-21.1	178.3	-66.7	-168.5	0	0	0	114.1	L898 F938 V1012 I1014 T1029	L898-L1031 HydrophobicContact CB-CB 3.86Å; L898-L1031 HydrophobicContact CD1-CB 3.9Å; L898-L1031 HydrophobicContact CD1-CD1 3.67Å; L898-L1031 HydrophobicContact CD1-CG 4.48Å; L898-L1031 HydrophobicContact CG-CB 4.32Å; F938-L1031 HydrophobicContact CE1-CD1 4.1Å; V1012-L1031 PolarHBondContact O-N 2.92Å; I1014-L1031 HydrophobicContact CB-CD1 3.58Å; I1014-L1031 HydrophobicContact CB-CG 3.95Å; I1014-L1031 HydrophobicContact CD1-CD1 3.95Å; I1014-L1031 HydrophobicContact CG1-CD1 4.34Å; I1014-L1031 HydrophobicContact CG2-CD1 3.72Å; I1014-L1031 HydrophobicContact CG2-CD2 3.99Å; I1014-L1031 HydrophobicContact CG2-CG 3.73Å; T1029-L1031 HydrophobicContact CG2-CD2 4.37Å
1032	S	62.9	Low	56.1	Low	5 Å²	5	71 Å²	71	4%	0.035	35%	0.345	C	S	.	.	S	Bend	trans	-106.8	168.7	177.6	77.9	0	0	0	0	113.7	L898 I900 S1011 V1012 R1030	L898-S1032 WeakPolarHBondContact O-CA 3.34Å; I900-S1032 WeakPolarHBondContact CD1-OG 3.49Å; S1011-S1032 PolarHBondContact OG-OG 2.89Å; S1011-S1032 VanDerWaalsContact OG-OG 3.13Å; V1012-S1032 PolarHBondContact N-OG 2.88Å; V1012-S1032 PolarHBondContact O-N 2.87Å; R1030-S1032 PolarHBondContact NE-O 2.79Å
1033	N	59.8	Low	56.4	Low	122 Å²	122	66.8 Å²	66.8	65%	0.652	34%	0.337	S	S	*	.			trans	-66.7	158.7	158.1	-69.6	-23	0	0	0	110.7
1034	E	66.2	Low	56.7	Low	50 Å²	50	68.6 Å²	68.6	23%	0.234	35%	0.349	C	S	.	.			trans	-79.6	121.6	167.1	-176.6	173.3	-176.4	0	0	108.3	R943 W959 A1009	R943-E1034 IonicContact CZ-OE1 2.58Å; R943-E1034 IonicContact NE-OE1 2.77Å; R943-E1034 PolarHBondContact NE-OE1 2.9Å; R943-E1034 IonicContact NH2-OE1 3.51Å; R943-E1034 PolarHBondContact NH2-OE1 2.97Å; R943-E1034 IonicContact NH2-OE2 2.79Å; W959-E1034 HydrophobicContact CZ2-CG 4.24Å; W959-E1034 PolarHBondContact NE1-OE2 2.99Å; A1009-E1034 HydrophobicContact CB-CG 4.06Å; A1009-E1034 VanDerWaalsContact CB-OE1 3.27Å; A1009-E1034 WeakPolarHBondContact CB-OE1 3.26Å
1035	V	65.3	Low	56.3	Low	47 Å²	47	70 Å²	70	29%	0.285	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	139.5	-179.4	-178.1	0	0	0	0	108.9	I900 I903 V1010	I900-V1035 HydrophobicContact CB-CG2 4.24Å; I900-V1035 HydrophobicContact CD1-CB 4.4Å; I900-V1035 HydrophobicContact CD1-CG2 3.92Å; I900-V1035 HydrophobicContact CG2-CG2 4.36Å; I903-V1035 HydrophobicContact CD1-CB 3.71Å; I903-V1035 HydrophobicContact CD1-CG1 3.62Å; I903-V1035 HydrophobicContact CG1-CB 4.49Å; I903-V1035 HydrophobicContact CG1-CG1 4.03Å; V1010-V1035 PolarHBondContact N-O 2.9Å; V1010-V1035 PolarHBondContact O-N 3.27Å
1036	V	73.3	Confident	55.7	Low	74 Å²	74	75.5 Å²	75.5	45%	0.448	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.2	-172.9	179.7	0	0	0	0	109.7	L945 T1007 Y1008 A1009	L945-V1036 HydrophobicContact CD1-CG1 3.85Å; L945-V1036 HydrophobicContact CD1-CG2 4.07Å; T1007-V1036 HydrophobicContact CG2-CG1 3.35Å; Y1008-V1036 WeakPolarHBondContact O-CA 3.19Å; A1009-V1036 HydrophobicContact CB-CG2 4.12Å
1037	Q	73	Confident	54.9	Low	65 Å²	65	77.8 Å²	77.8	30%	0.304	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	142.3	178	-173.4	64.2	5	0	0	110.6	I903 T905 L911 Y1008	I903-Q1037 HydrophobicContact CB-CB 4.4Å; I903-Q1037 HydrophobicContact CG2-CB 3.75Å; I903-Q1037 HydrophobicContact CG2-CG 3.92Å; T905-Q1037 HydrophobicContact CG2-CG 3.83Å; L911-Q1037 HydrophobicContact CD2-CB 4.03Å; L911-Q1037 HydrophobicContact CD2-CG 3.57Å; Y1008-Q1037 PolarHBondContact N-O 2.89Å; Y1008-Q1037 PolarHBondContact O-N 2.86Å
1038	K	71.5	Confident	54.3	Low	100 Å²	100	84 Å²	84	44%	0.435	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.9	178.8	-170.2	-178.2	177.8	-170	0	111.1	T905 N1005 V1006	T905-K1038 VanDerWaalsContact CG2-O 3.24Å; T905-K1038 WeakPolarHBondContact CG2-O 3.28Å; N1005-K1038 VanDerWaalsContact C-CE 3.46Å; N1005-K1038 WeakPolarHBondContact O-CE 3.05Å; N1005-K1038 WeakPolarHBondContact OD1-CE 3.02Å; N1005-K1038 PolarHBondContact OD1-NZ 2.87Å; V1006-K1038 WeakPolarHBondContact O-CA 3.43Å
1039	T	72.3	Confident	53.5	Low	2 Å²	2	88.7 Å²	88.7	1%	0.012	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-66.7	150.7	175.3	55.4	0	0	0	0	111.5	L911 L1002 Q1003 P1004 N1005 V1006 Y1008	L911-T1039 HydrophobicContact CG-CG2 4.42Å; L1002-T1039 HydrophobicContact CB-CG2 4.07Å; L1002-T1039 HydrophobicContact CD1-CG2 4.07Å; Q1003-T1039 PolarHBondContact O-OG1 2.92Å; P1004-T1039 WeakPolarHBondContact CA-OG1 3.06Å; N1005-T1039 WeakPolarHBondContact CA-O 3.42Å; N1005-T1039 PolarHBondContact N-O 3.01Å; N1005-T1039 PolarHBondContact N-OG1 3.33Å; N1005-T1039 VanDerWaalsContact N-OG1 3.12Å; V1006-T1039 PolarHBondContact N-OG1 3.26Å; V1006-T1039 PolarHBondContact O-N 2.87Å; V1006-T1039 PolarHBondContact O-OG1 2.85Å; Y1008-T1039 HydrophobicContact CD2-CG2 4.02Å; Y1008-T1039 HydrophobicContact CE2-CG2 4.11Å
1040	L	68.4	Low	52.4	Low	83 Å²	83	95.5 Å²	95.5	44%	0.435	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-60.8	145.2	179.9	-97.5	74.2	0	0	0	111.3	T905 P1004 N1005	T905-L1040 HydrophobicContact CG2-CD1 4.13Å; T905-L1040 VanDerWaalsContact OG1-CD1 3.28Å; T905-L1040 WeakPolarHBondContact OG1-CD1 3.5Å; P1004-L1040 WeakPolarHBondContact CB-O 3.22Å; N1005-L1040 PolarHBondContact N-O 3.07Å
1041	P	60.2	Low	51.3	Low	74 Å²	74	97.3 Å²	97.3	48%	0.481	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-64.4	141.4	173.3	28.2	-34	0	0	0	110.9	N1005 L1043	N1005-P1041 HydrophobicContact CB-CB 4.22Å; P1041-L1043 PolarHBondContact O-N 3.5Å
1042	K	50.9	Low	50.1	Low	150 Å²	150	105.2 Å²	105.2	65%	0.652	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-61.8	118.1	175.2	-169.5	172.1	-171.8	173.9	0	109	P1004 I1044	P1004-K1042 HydrophobicContact CB-CB 4.04Å; P1004-K1042 HydrophobicContact CG-CB 3.94Å; P1004-K1042 HydrophobicContact CG-CD 4.33Å; K1042-I1044 PolarHBondContact O-N 2.91Å
1043	L	46.4	Very low	48.4	Very low	140 Å²	140	112.9 Å²	112.9	73%	0.733	59%	0.588	S	S	*	*			trans	-63.5	113.4	178.8	-134.8	83.7	0	0	0	109	P1041 S1045	P1041-L1043 PolarHBondContact O-N 3.5Å; L1043-S1045 PolarHBondContact O-N 3.22Å
1044	I	40.8	Very low	46.9	Very low	157 Å²	157	115.8 Å²	115.8	81%	0.805	60%	0.595	S	S	*	*			trans	-74.7	97.9	168.3	-60.8	178.1	0	0	0	106.1	K1042 L1046	K1042-I1044 PolarHBondContact O-N 2.91Å; I1044-L1046 PolarHBondContact O-N 2.65Å
1045	S	33.6	Very low	45.3	Very low	103 Å²	103	119.6 Å²	119.6	72%	0.72	62%	0.622	S	S	*	*			trans	-64.8	98	171.4	54.5	0	0	0	0	109	L1043 S1047	L1043-S1045 PolarHBondContact O-N 3.22Å; S1045-S1047 PolarHBondContact O-N 2.97Å
1046	L	31	Very low	43.4	Very low	169 Å²	169	126 Å²	126	89%	0.885	65%	0.646	S	S	*	*			trans	-58.7	107.4	161.8	-89.3	162.1	0	0	0	107.7	I1044	I1044-L1046 PolarHBondContact O-N 2.65Å
1047	S	26.4	Very low	41.4	Very low	103 Å²	103	129.8 Å²	129.8	72%	0.72	66%	0.663	S	S	*	*			trans	-67.9	128.3	178.3	52.7	0	0	0	0	111	S1045	S1045-S1047 PolarHBondContact O-N 2.97Å
1048	I	32	Very low	39.2	Very low	158 Å²	158	131.5 Å²	131.5	81%	0.81	68%	0.683	S	S	*	*			trans	-166.8	127.1	141.3	-96.7	144.9	0	0	0	108.6
1049	N	29.2	Very low	37.2	Very low	138 Å²	138	133.1 Å²	133.1	74%	0.738	70%	0.701	S	S	*	*			trans	16	121.7	159.4	-52.3	2.6	0	0	0	118.9
1050	E	26.7	Very low	35.1	Very low	162 Å²	162	139.6 Å²	139.6	76%	0.757	74%	0.735	S	S	*	*				90.5	140.8	52.2	-81.7	-160.5	176.9	0	0	116.3
1051	N	29.2	Very low	33.3	Very low	116 Å²	116	143 Å²	143	62%	0.62	75%	0.749	S	S	*	*			trans	83.5	92.5	154.5	-60.8	-43.2	0	0	0	121.8
1052	Q	33.1	Very low	32	Very low	191 Å²	191	145.4 Å²	145.4	89%	0.893	76%	0.758	S	S	*	*				-177.9	108.9	116.8	-95.5	169	17.1	0	0	109.4
1053	F	26.5	Very low	30.9	Very low	166 Å²	166	145.1 Å²	145.1	73%	0.728	76%	0.762	S	S	*	*				72.7	106.4	72.4	-95.7	-86.1	0	0	0	116.7
1054	F	29.8	Very low	30.2	Very low	183 Å²	183	145.3 Å²	145.3	80%	0.803	76%	0.764	S	S	*	*				174.4	122.5	109.1	-108	-89.1	0	0	0	116.9
1055	V	31.7	Very low	29.8	Very low	130 Å²	130	146.8 Å²	146.8	79%	0.788	77%	0.767	S	S	*	*			trans	71.8	154.2	141.2	157	0	0	0	0	124.3
1056	K	26.3	Very low	29.5	Very low	182 Å²	182	150 Å²	150	79%	0.791	78%	0.776	S	S	*	*			trans	-104.9	171.7	-178.9	-48.8	176.9	177.9	179.2	0	110.9
1057	N	30.7	Very low	29.2	Very low	154 Å²	154	149.6 Å²	149.6	82%	0.824	77%	0.771	S	S	*	*				-174.6	-176.1	60.3	-123.1	7.8	0	0	0	111.3
1058	S	27.1	Very low	29.1	Very low	101 Å²	101	152.3 Å²	152.3	71%	0.706	77%	0.774	S	S	*	*			trans	-118.4	155.2	-160.2	57.1	0	0	0	0	118.2
1059	T	29.1	Very low	28.8	Very low	134 Å²	134	150.7 Å²	150.7	82%	0.822	77%	0.772	S	S	*	*			trans	-168.9	135.2	135.9	24.2	0	0	0	0	115.8
1060	N	27.1	Very low	28.5	Very low	137 Å²	137	149.3 Å²	149.3	73%	0.733	76%	0.764	S	S	*	*			trans	62.6	138.4	144.6	-79.6	29.9	0	0	0	127.8
1061	E	32.1	Very low	28.3	Very low	155 Å²	155	146.8 Å²	146.8	72%	0.724	77%	0.765	S	S	*	*			trans	98.5	127.7	139.6	-84.8	169.7	-120.2	0	0	124.6
1062	N	32.7	Very low	28	Very low	124 Å²	124	147.5 Å²	147.5	66%	0.663	76%	0.762	S	S	*	*			trans	50.1	88.9	155.6	-56.1	-39.4	0	0	0	119
1063	I	27.6	Very low	27.8	Very low	145 Å²	145	144.4 Å²	144.4	74%	0.744	76%	0.756	S	S	*	*				68.1	86.5	73.3	-52.9	164.9	0	0	0	114.7
1064	N	31.6	Very low	27.8	Very low	144 Å²	144	145.3 Å²	145.3	77%	0.77	76%	0.763	S	S	*	*				-176.4	148.5	115.2	-111.3	-44.3	0	0	0	115.4
1065	Q	32.2	Very low	27.4	Very low	187 Å²	187	140.2 Å²	140.2	87%	0.874	75%	0.749	S	S	*	*			trans	65	154.8	163.9	-64.6	-179.4	-3.8	0	0	118.4
1066	L	27.5	Very low	27.2	Very low	171 Å²	171	139.4 Å²	139.4	90%	0.895	75%	0.745	S	S	*	*			trans	-152.3	137.6	-142.9	-173.3	78.5	0	0	0	112.1
1067	M	25.1	Very low	27.2	Very low	161 Å²	161	135.5 Å²	135.5	79%	0.793	74%	0.741	S	S	*	*			trans	-140	123.8	169	-90.7	-79.6	-82.3	0	0	111.1
1068	M	24	Very low	27	Very low	159 Å²	159	134.6 Å²	134.6	78%	0.783	74%	0.736	S	S	*	*			trans	51.8	108.9	157	-67.9	-171.4	170.1	0	0	122.2
1069	V	24.8	Very low	27	Very low	125 Å²	125	138.2 Å²	138.2	76%	0.758	74%	0.744	S	S	*	*				90.3	130.9	126.6	177.6	0	0	0	0	120.6
1070	D	23.2	Very low	26.7	Very low	109 Å²	109	140 Å²	140	58%	0.583	74%	0.74	S	S	*	*			trans	84	138.8	157.7	-88.4	-32.7	0	0	0	124.5
1071	S	23.8	Very low	26.7	Very low	109 Å²	109	138 Å²	138	76%	0.762	74%	0.737	S	S	*	*			trans	63.4	153.6	173.3	74.8	0	0	0	0	118.6
1072	F	22.6	Very low	26.4	Very low	131 Å²	131	140 Å²	140	58%	0.575	74%	0.743	S	S	*	*				-168.5	125.6	-50.1	-139.1	-90.5	0	0	0	105.8
1073	V	28.5	Very low	26	Very low	125 Å²	125	141.6 Å²	141.6	76%	0.758	75%	0.749	S	S	*	*			trans	10.4	109.7	161.6	-171.1	0	0	0	0	118.9
1074	Q	25.6	Very low	25.8	Very low	186 Å²	186	141.6 Å²	141.6	87%	0.869	76%	0.755	S	S	*	*			trans	-142.4	151.4	137.5	-87.1	-159.8	-20.4	0	0	111.1
1075	S	23.2	Very low	25.7	Very low	75 Å²	75	138.1 Å²	138.1	52%	0.524	75%	0.753	S	S	.	*			cis	-173.1	176.5	-32	55.1	0	0	0	0	109.1
1076	T	25.6	Very low	25.5	Very low	113 Å²	113	138.2 Å²	138.2	69%	0.693	75%	0.754	S	S	*	*			trans	44.9	101.5	147.5	52.1	0	0	0	0	118.6
1077	S	27.5	Very low	25.4	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	75%	0.753	S	S	*	*				58.6	104.4	74.5	82.2	0	0	0	0	115.8
1078	N	25.4	Very low	25.6	Very low	136 Å²	136	132.2 Å²	132.2	73%	0.727	75%	0.746	S	S	*	*			trans	-166.9	147.8	149.9	-93.4	-46.9	0	0	0	107.2
1079	M	27.5	Very low	25.7	Very low	176 Å²	176	131 Å²	131	87%	0.867	74%	0.743	S	S	*	*			cis	-115.3	149.4	1.2	-66.1	-173.2	178.8	0	0	110
1080	K	23.7	Very low	26	Very low	171 Å²	171	131.9 Å²	131.9	74%	0.743	74%	0.743	S	S	*	*				62.8	92.8	57	-88	-178.4	175	174.8	0	114.7
1081	S	26.4	Very low	26.2	Very low	95 Å²	95	134.9 Å²	134.9	66%	0.664	75%	0.751	S	S	*	*			trans	45.9	108.7	132.1	61.9	0	0	0	0	120.1
1082	K	27	Very low	26.5	Very low	199 Å²	199	135.8 Å²	135.8	87%	0.865	75%	0.747	S	S	*	*				-150.9	125.5	128.1	-108.8	173.3	-177.9	179	0	107.1
1083	M	23.5	Very low	26.9	Very low	157 Å²	157	136.7 Å²	136.7	77%	0.773	76%	0.758	S	S	*	*			cis	55	110.3	47.3	-55.7	175.7	143.5	0	0	110.1
1084	T	24	Very low	26.9	Very low	144 Å²	144	138.1 Å²	138.1	88%	0.883	76%	0.76	S	S	*	*				-166.1	145.6	64.6	42	0	0	0	0	111.2
1085	G	27.8	Very low	26.7	Very low	71 Å²	71	135.1 Å²	135.1	73%	0.732	76%	0.755	S	S	*	*			trans	175.4	79.3	172.8	0	0	0	0	0	116.3
1086	Q	28.8	Very low	26.8	Very low	189 Å²	189	136.9 Å²	136.9	88%	0.883	77%	0.767	S	S	*	*			trans	62.9	131	167.4	-65.8	165.4	-22.1	0	0	116.2
1087	V	24.4	Very low	26.8	Very low	143 Å²	143	140.8 Å²	140.8	87%	0.867	78%	0.775	S	S	*	*			cis	85	114.3	40.1	178.1	0	0	0	0	112.8
1088	G	29.9	Very low	26.8	Very low	63 Å²	63	142.9 Å²	142.9	65%	0.649	78%	0.777	S	S	*	*			trans	134.5	88.8	-177.3	0	0	0	0	0	110.4
1089	N	27.3	Very low	26.8	Very low	134 Å²	134	142.5 Å²	142.5	72%	0.717	78%	0.78	S	S	*	*				50.9	113	82.6	-62.3	-23.6	0	0	0	111.2
1090	N	30.7	Very low	26.7	Very low	144 Å²	144	143 Å²	143	77%	0.77	78%	0.777	S	S	*	*			cis	-141	159.3	46.8	-69.2	-45.1	0	0	0	112
1091	K	26.2	Very low	26.8	Very low	171 Å²	171	141 Å²	141	74%	0.743	78%	0.775	S	S	*	*			cis	66.4	123.2	45.6	-78	-174.3	178.4	-175.6	0	112.1
1092	N	30.1	Very low	27	Very low	129 Å²	129	144.9 Å²	144.9	69%	0.69	78%	0.776	S	S	*	*			cis	-144.4	176.6	17.2	-65.8	-51.9	0	0	0	111.6
1093	D	31.7	Very low	27.2	Very low	150 Å²	150	144.4 Å²	144.4	80%	0.802	78%	0.777	S	S	*	*			trans	64.2	138.9	156.8	-61.6	-16.7	0	0	0	119.4
1094	L	27.8	Very low	27.5	Very low	154 Å²	154	143.2 Å²	143.2	81%	0.806	77%	0.77	S	S	*	*			cis	-144.3	131.7	-4.3	-171.7	70.7	0	0	0	110.9
1095	T	22.6	Very low	28.1	Very low	124 Å²	124	141.9 Å²	141.9	76%	0.761	76%	0.757	S	S	*	*			trans	-102.2	150.2	167.2	47.9	0	0	0	0	111.9
1096	S	24.1	Very low	28.8	Very low	111 Å²	111	143.2 Å²	143.2	78%	0.776	76%	0.755	S	S	*	*			trans	65	90.7	164.1	62.7	0	0	0	0	118.9
1097	K	25.7	Very low	29.7	Very low	196 Å²	196	142.7 Å²	142.7	85%	0.852	75%	0.746	S	S	*	*			trans	-158.2	133.4	134.5	-118.2	171.2	-174.7	174.9	0	111.2
1098	L	29.2	Very low	31.1	Very low	143 Å²	143	139.4 Å²	139.4	75%	0.749	73%	0.726	S	S	*	*			trans	61.3	130.2	-171.1	-65	80	0	0	0	113.5
1099	T	25.3	Very low	32.4	Very low	129 Å²	129	141.8 Å²	141.8	79%	0.791	72%	0.723	S	S	*	*			cis	59.7	115.8	-6	50.5	0	0	0	0	118.8
1100	K	25.1	Very low	34.1	Very low	185 Å²	185	140.8 Å²	140.8	80%	0.804	72%	0.717	S	S	*	*			trans	81.7	134.3	-177.9	-57.2	-174.3	176	-175.8	0	115.6
1101	N	24.9	Very low	36.1	Very low	129 Å²	129	138.2 Å²	138.2	69%	0.69	71%	0.706	S	S	*	*			trans	68.9	134.3	173.4	-48.6	-3	0	0	0	114.2
1102	Y	31.2	Very low	38.5	Very low	177 Å²	177	134.2 Å²	134.2	69%	0.694	69%	0.692	S	S	*	*			cis	-124.4	116	2.8	-81.8	-86.5	0	0	0	112.8	H1104	Y1102-H1104 HydrophobicContact CD1-CB 4.46Å
1103	Q	31	Very low	40.6	Very low	190 Å²	190	133.2 Å²	133.2	89%	0.888	69%	0.686	S	S	*	*			trans	-81.2	104.5	139.8	-72.3	170.3	-96.2	0	0	106.2
1104	H	30.5	Very low	42.9	Very low	132 Å²	132	128.3 Å²	128.3	61%	0.611	67%	0.671	S	S	*	*			trans	-167.5	-35.1	158.2	-104.2	-57.2	0	0	0	114.6	Y1102 S1106 Y1107	Y1102-H1104 HydrophobicContact CD1-CB 4.46Å; H1104-S1106 VanDerWaalsContact C-N 3.28Å; H1104-S1106 PolarHBondContact O-N 2.86Å; H1104-S1106 VanDerWaalsContact O-N 3.13Å; H1104-Y1107 PolarHBondContact O-N 2.71Å
1105	D	36.8	Very low	45.7	Very low	115 Å²	115	124.1 Å²	124.1	62%	0.615	66%	0.655	S	S	*	*	H	α-helix	trans	-66.9	-23	-163.2	-58.6	-34.7	0	0	0	115.1	Y1107 V1108	D1105-Y1107 VanDerWaalsContact C-N 3.31Å; D1105-Y1107 PolarHBondContact O-N 2.72Å; D1105-V1108 PolarHBondContact O-N 2.76Å
1106	S	42.5	Very low	48.6	Very low	100 Å²	100	123.3 Å²	123.3	70%	0.699	65%	0.645	S	S	*	*	H	α-helix	trans	-67.5	-27	173.8	-46.2	0	0	0	0	113.7	H1104	H1104-S1106 VanDerWaalsContact C-N 3.28Å; H1104-S1106 PolarHBondContact O-N 2.86Å; H1104-S1106 VanDerWaalsContact O-N 3.13Å
1107	Y	46.1	Very low	51.4	Low	177 Å²	177	120.8 Å²	120.8	69%	0.694	63%	0.631	S	S	*	*	H	α-helix	trans	-80.8	-33.6	176.8	-96.6	-91.1	0	0	0	112.2	H1104 D1105 L1109 I1110 V1111	H1104-Y1107 PolarHBondContact O-N 2.71Å; D1105-Y1107 VanDerWaalsContact C-N 3.31Å; D1105-Y1107 PolarHBondContact O-N 2.72Å; Y1107-L1109 VanDerWaalsContact C-N 3.33Å; Y1107-L1109 PolarHBondContact O-N 2.66Å; Y1107-I1110 PolarHBondContact O-N 2.79Å; Y1107-V1111 WeakPolarHBondContact O-CG2 3.45Å; Y1107-V1111 PolarHBondContact O-N 3.02Å
1108	V	55.5	Low	54.4	Low	74 Å²	74	113 Å²	113	45%	0.448	61%	0.607	S	S	.	*	H	α-helix	trans	-61.9	-42.2	-179.2	179.7	0	0	0	0	110.9	D1105 I1110 V1111 I1112	D1105-V1108 PolarHBondContact O-N 2.76Å; V1108-I1110 PolarHBondContact O-N 3.2Å; V1108-V1111 PolarHBondContact O-N 2.91Å; V1108-I1112 HydrophobicContact CG1-CD1 3.79Å; V1108-I1112 HydrophobicContact CG1-CG1 4.39Å; V1108-I1112 VanDerWaalsContact O-CG1 3.3Å; V1108-I1112 WeakPolarHBondContact O-CG1 3.2Å; V1108-I1112 PolarHBondContact O-N 3.33Å
1109	L	55.7	Low	57.3	Low	113 Å²	113	110.2 Å²	110.2	59%	0.592	60%	0.595	S	S	*	*	H	α-helix	trans	-62.8	-41.2	178	-163.3	74.8	0	0	0	112.5	Y1107 I1112 L1113	Y1107-L1109 VanDerWaalsContact C-N 3.33Å; Y1107-L1109 PolarHBondContact O-N 2.66Å; L1109-I1112 PolarHBondContact O-N 3.21Å; L1109-L1113 HydrophobicContact CG-CD1 4.33Å; L1109-L1113 WeakPolarHBondContact O-CG 3.25Å; L1109-L1113 PolarHBondContact O-N 3.04Å
1110	I	63.6	Low	60.3	Low	113 Å²	113	109.4 Å²	109.4	58%	0.579	59%	0.586	S	S	*	*	H	α-helix	trans	-66.6	-41.6	177.9	-64	172.3	0	0	0	110.7	Y1107 V1108 L1113 G1114	Y1107-I1110 PolarHBondContact O-N 2.79Å; V1108-I1110 PolarHBondContact O-N 3.2Å; I1110-L1113 PolarHBondContact O-N 2.77Å; I1110-G1114 PolarHBondContact O-N 2.9Å
1111	V	72.4	Confident	63.3	Low	90 Å²	90	105.8 Å²	105.8	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-64.8	-40.5	175.4	172	0	0	0	0	111.4	Y1107 V1108 G1114 S1115	Y1107-V1111 WeakPolarHBondContact O-CG2 3.45Å; Y1107-V1111 PolarHBondContact O-N 3.02Å; V1108-V1111 PolarHBondContact O-N 2.91Å; V1111-G1114 PolarHBondContact O-N 3.36Å; V1111-S1115 VanDerWaalsContact O-CB 3.29Å; V1111-S1115 WeakPolarHBondContact O-CB 3.19Å; V1111-S1115 PolarHBondContact O-N 2.67Å; V1111-S1115 PolarHBondContact O-OG 2.95Å
1112	I	77.1	Confident	66.5	Low	88 Å²	88	104.5 Å²	104.5	45%	0.451	57%	0.567	S	S	.	*	H	α-helix	trans	-63.6	-46	176.2	-72	168.6	0	0	0	111.1	V1108 L1109 S1115 L1116	V1108-I1112 HydrophobicContact CG1-CD1 3.79Å; V1108-I1112 HydrophobicContact CG1-CG1 4.39Å; V1108-I1112 VanDerWaalsContact O-CG1 3.3Å; V1108-I1112 WeakPolarHBondContact O-CG1 3.2Å; V1108-I1112 PolarHBondContact O-N 3.33Å; L1109-I1112 PolarHBondContact O-N 3.21Å; I1112-S1115 WeakPolarHBondContact O-CB 3.21Å; I1112-S1115 PolarHBondContact O-N 3.11Å; I1112-L1116 PolarHBondContact O-N 3.17Å
1113	L	74.1	Confident	69.3	Low	108 Å²	108	100.1 Å²	100.1	57%	0.565	55%	0.554	S	S	*	*	H	α-helix	trans	-65.3	-41.9	178.6	-71.3	167.9	0	0	0	112.1	L1109 I1110 S1115 L1116 A1117	L1109-L1113 HydrophobicContact CG-CD1 4.33Å; L1109-L1113 WeakPolarHBondContact O-CG 3.25Å; L1109-L1113 PolarHBondContact O-N 3.04Å; I1110-L1113 PolarHBondContact O-N 2.77Å; L1113-S1115 VanDerWaalsContact C-N 3.33Å; L1113-S1115 PolarHBondContact O-N 3.14Å; L1113-L1116 PolarHBondContact O-N 3.42Å; L1113-A1117 PolarHBondContact O-N 3.14Å; L1113-A1117 VanDerWaalsContact O-N 3.08Å
1114	G	81	Confident	72.3	Confident	47 Å²	47	97.6 Å²	97.6	49%	0.485	54%	0.541	S	S	.	.	H	α-helix	trans	-62.5	-38.5	172.4	0	0	0	0	0	112.9	I1110 V1111 A1117 G1118	I1110-G1114 PolarHBondContact O-N 2.9Å; V1111-G1114 PolarHBondContact O-N 3.36Å; G1114-A1117 PolarHBondContact O-N 3.35Å; G1114-G1118 PolarHBondContact O-N 3.01Å
1115	S	86.3	Confident	75.2	Confident	66 Å²	66	95.7 Å²	95.7	46%	0.462	53%	0.534	S	S	.	.	H	α-helix	trans	-64.7	-42.9	175.1	-58.7	0	0	0	0	111.6	V1111 I1112 L1113 A1117 G1118 V1119	V1111-S1115 VanDerWaalsContact O-CB 3.29Å; V1111-S1115 WeakPolarHBondContact O-CB 3.19Å; V1111-S1115 PolarHBondContact O-N 2.67Å; V1111-S1115 PolarHBondContact O-OG 2.95Å; I1112-S1115 WeakPolarHBondContact O-CB 3.21Å; I1112-S1115 PolarHBondContact O-N 3.11Å; L1113-S1115 VanDerWaalsContact C-N 3.33Å; L1113-S1115 PolarHBondContact O-N 3.14Å; S1115-A1117 PolarHBondContact O-N 3.25Å; S1115-G1118 PolarHBondContact O-N 3.4Å; S1115-V1119 WeakPolarHBondContact O-CG2 3.43Å; S1115-V1119 PolarHBondContact O-N 2.97Å
1116	L	83.3	Confident	77.8	Confident	106 Å²	106	94.2 Å²	94.2	56%	0.555	53%	0.529	S	S	*	.	H	α-helix	trans	-61.3	-44.7	176.7	-124.2	91	0	0	0	111.7	I1112 L1113 V1119 L1120	I1112-L1116 PolarHBondContact O-N 3.17Å; L1113-L1116 PolarHBondContact O-N 3.42Å; L1116-V1119 PolarHBondContact O-N 3.33Å; L1116-L1120 WeakPolarHBondContact O-CG 3.21Å; L1116-L1120 PolarHBondContact O-N 3.2Å
1117	A	82.6	Confident	80.2	Confident	59 Å²	59	94.2 Å²	94.2	49%	0.488	52%	0.52	S	S	.	.	H	α-helix	trans	-62.5	-41.7	176.3	0	0	0	0	0	111.9	L1113 G1114 S1115 L1120 L1121	L1113-A1117 PolarHBondContact O-N 3.14Å; L1113-A1117 VanDerWaalsContact O-N 3.08Å; G1114-A1117 PolarHBondContact O-N 3.35Å; S1115-A1117 PolarHBondContact O-N 3.25Å; A1117-L1120 PolarHBondContact O-N 3.33Å; A1117-L1121 WeakPolarHBondContact O-CB 3.35Å; A1117-L1121 PolarHBondContact O-N 2.87Å
1118	G	87.7	Confident	82.3	Confident	33 Å²	33	89.7 Å²	89.7	34%	0.34	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-45.4	174.3	0	0	0	0	0	113	G1114 S1115 L1121 I1122	G1114-G1118 PolarHBondContact O-N 3.01Å; S1115-G1118 PolarHBondContact O-N 3.4Å; G1118-L1121 PolarHBondContact O-N 2.96Å; G1118-I1122 VanDerWaalsContact O-CG1 3.31Å; G1118-I1122 WeakPolarHBondContact O-CG1 3.41Å; G1118-I1122 PolarHBondContact O-N 3.42Å
1119	V	90.5	Very high	83.8	Confident	83 Å²	83	89.7 Å²	89.7	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-43.7	177.3	169.4	0	0	0	0	111.5	S1115 L1116 L1121 I1122 I1123	S1115-V1119 WeakPolarHBondContact O-CG2 3.43Å; S1115-V1119 PolarHBondContact O-N 2.97Å; L1116-V1119 PolarHBondContact O-N 3.33Å; V1119-L1121 VanDerWaalsContact C-N 3.34Å; V1119-L1121 PolarHBondContact O-N 2.03Å; V1119-I1122 PolarHBondContact O-N 2.82Å; V1119-I1123 HydrophobicContact CG1-CD1 3.84Å; V1119-I1123 HydrophobicContact CG1-CG1 4.48Å; V1119-I1123 VanDerWaalsContact O-CG1 3.31Å; V1119-I1123 WeakPolarHBondContact O-CG1 3.47Å; V1119-I1123 PolarHBondContact O-N 2.91Å
1120	L	87.8	Confident	85.4	Confident	112 Å²	112	89.7 Å²	89.7	59%	0.586	50%	0.503	S	S	*	.	H	α-helix	trans	-62.2	-40.5	176.2	-72.6	169.8	0	0	0	112.2	L1116 A1117 I1123 F1124	L1116-L1120 WeakPolarHBondContact O-CG 3.21Å; L1116-L1120 PolarHBondContact O-N 3.2Å; A1117-L1120 PolarHBondContact O-N 3.33Å; L1120-I1123 PolarHBondContact O-N 2.83Å; L1120-F1124 PolarHBondContact O-N 2.81Å
1121	L	89.9	Confident	86.4	Confident	109 Å²	109	88 Å²	88	57%	0.571	50%	0.5	S	S	*	.	H	α-helix	trans	-66.1	-40.3	176.4	-170.2	151.7	0	0	0	111.6	A1117 G1118 V1119 F1124 I1125	A1117-L1121 WeakPolarHBondContact O-CB 3.35Å; A1117-L1121 PolarHBondContact O-N 2.87Å; G1118-L1121 PolarHBondContact O-N 2.96Å; V1119-L1121 VanDerWaalsContact C-N 3.34Å; V1119-L1121 PolarHBondContact O-N 2.03Å; L1121-F1124 PolarHBondContact O-N 3.5Å; L1121-I1125 HydrophobicContact CD2-CD1 3.61Å; L1121-I1125 HydrophobicContact CD2-CG1 4.35Å; L1121-I1125 WeakPolarHBondContact O-CG1 3.37Å; L1121-I1125 PolarHBondContact O-N 2.9Å
1122	I	90.6	Very high	87	Confident	103 Å²	103	88.1 Å²	88.1	53%	0.528	50%	0.497	S	S	.	.	H	α-helix	trans	-63	-45.4	173.6	-69.3	164.5	0	0	0	110.9	G1118 V1119 F1124 I1125 V1126	G1118-I1122 VanDerWaalsContact O-CG1 3.31Å; G1118-I1122 WeakPolarHBondContact O-CG1 3.41Å; G1118-I1122 PolarHBondContact O-N 3.42Å; V1119-I1122 PolarHBondContact O-N 2.82Å; I1122-F1124 VanDerWaalsContact C-N 3.27Å; I1122-F1124 PolarHBondContact O-N 3.36Å; I1122-I1125 PolarHBondContact O-N 2.87Å; I1122-V1126 HydrophobicContact CG2-CG2 4.32Å; I1122-V1126 WeakPolarHBondContact O-CG2 3.44Å; I1122-V1126 PolarHBondContact O-N 3.13Å
1123	I	91.4	Very high	87.4	Confident	84 Å²	84	90.5 Å²	90.5	43%	0.431	50%	0.5	S	S	.	.	H	α-helix	trans	-58.6	-41	175.9	-69.6	165	0	0	0	110.7	V1119 L1120 V1126 L1127	V1119-I1123 HydrophobicContact CG1-CD1 3.84Å; V1119-I1123 HydrophobicContact CG1-CG1 4.48Å; V1119-I1123 VanDerWaalsContact O-CG1 3.31Å; V1119-I1123 WeakPolarHBondContact O-CG1 3.47Å; V1119-I1123 PolarHBondContact O-N 2.91Å; L1120-I1123 PolarHBondContact O-N 2.83Å; I1123-V1126 PolarHBondContact O-N 3.13Å; I1123-L1127 HydrophobicContact CG2-CD1 4.13Å; I1123-L1127 WeakPolarHBondContact O-CG 3.41Å; I1123-L1127 PolarHBondContact O-N 2.95Å
1124	F	92.3	Very high	87.6	Confident	138 Å²	138	91.7 Å²	91.7	61%	0.605	50%	0.498	S	S	*	.	H	α-helix	trans	-65.2	-40.6	177.7	-154.9	-104.6	0	0	0	112.3	L1120 L1121 I1122 L1127 I1128	L1120-F1124 PolarHBondContact O-N 2.81Å; L1121-F1124 PolarHBondContact O-N 3.5Å; I1122-F1124 VanDerWaalsContact C-N 3.27Å; I1122-F1124 PolarHBondContact O-N 3.36Å; F1124-L1127 PolarHBondContact O-N 2.87Å; F1124-I1128 HydrophobicContact CD1-CD1 3.66Å; F1124-I1128 HydrophobicContact CD1-CG1 4.48Å; F1124-I1128 HydrophobicContact CE1-CD1 3.68Å; F1124-I1128 WeakPolarHBondContact O-CG1 3.45Å; F1124-I1128 PolarHBondContact O-N 2.94Å
1125	I	91.8	Very high	87.1	Confident	92 Å²	92	99 Å²	99	47%	0.472	51%	0.511	S	S	.	.	H	α-helix	trans	-66.1	-39.6	173.1	-68.4	175.6	0	0	0	111.4	L1121 I1122 I1128 T1129	L1121-I1125 HydrophobicContact CD2-CD1 3.61Å; L1121-I1125 HydrophobicContact CD2-CG1 4.35Å; L1121-I1125 WeakPolarHBondContact O-CG1 3.37Å; L1121-I1125 PolarHBondContact O-N 2.9Å; I1122-I1125 PolarHBondContact O-N 2.87Å; I1125-I1128 PolarHBondContact O-N 2.81Å; I1125-T1129 HydrophobicContact CG2-CG2 4.29Å; I1125-T1129 WeakPolarHBondContact O-CB 3.36Å; I1125-T1129 WeakPolarHBondContact O-CG2 3.26Å; I1125-T1129 PolarHBondContact O-N 3.1Å; I1125-T1129 PolarHBondContact O-OG1 3.18Å
1126	V	92	Very high	86.2	Confident	84 Å²	84	101.2 Å²	101.2	51%	0.509	52%	0.517	S	S	.	.	H	α-helix	trans	-63.2	-40.3	174.8	170.3	0	0	0	0	111.1	I1122 I1123 T1129 F1130	I1122-V1126 HydrophobicContact CG2-CG2 4.32Å; I1122-V1126 WeakPolarHBondContact O-CG2 3.44Å; I1122-V1126 PolarHBondContact O-N 3.13Å; I1123-V1126 PolarHBondContact O-N 3.13Å; V1126-T1129 WeakPolarHBondContact CA-OG1 3.4Å; V1126-T1129 PolarHBondContact O-OG1 3.37Å; V1126-F1130 WeakPolarHBondContact O-CB 3.44Å; V1126-F1130 PolarHBondContact O-N 3.47Å
1127	L	91.9	Very high	85.2	Confident	99 Å²	99	100.4 Å²	100.4	52%	0.518	51%	0.511	S	S	.	.	H	α-helix	trans	-68.1	-40.8	175.2	-72.3	170.6	0	0	0	112.7	I1123 F1124 C1131	I1123-L1127 HydrophobicContact CG2-CD1 4.13Å; I1123-L1127 WeakPolarHBondContact O-CG 3.41Å; I1123-L1127 PolarHBondContact O-N 2.95Å; F1124-L1127 PolarHBondContact O-N 2.87Å; L1127-C1131 WeakPolarHBondContact O-CB 3.43Å; L1127-C1131 PolarHBondContact O-N 2.63Å; L1127-C1131 PolarHBondContact O-SG 3.2Å
1128	I	90.7	Very high	83.7	Confident	82 Å²	82	103 Å²	103	42%	0.421	52%	0.516	S	S	.	.	H	α-helix	trans	-64.5	-46.9	174.9	-71.7	168.6	0	0	0	110.8	F1124 I1125 C1131 I1132	F1124-I1128 HydrophobicContact CD1-CD1 3.66Å; F1124-I1128 HydrophobicContact CD1-CG1 4.48Å; F1124-I1128 HydrophobicContact CE1-CD1 3.68Å; F1124-I1128 WeakPolarHBondContact O-CG1 3.45Å; F1124-I1128 PolarHBondContact O-N 2.94Å; I1125-I1128 PolarHBondContact O-N 2.81Å; I1128-C1131 PolarHBondContact O-N 2.86Å; I1128-I1132 HydrophobicContact CG2-CD1 3.77Å; I1128-I1132 VanDerWaalsContact O-CG1 3.32Å; I1128-I1132 WeakPolarHBondContact O-CG1 3.41Å; I1128-I1132 PolarHBondContact O-N 2.85Å
1129	T	88	Confident	81.4	Confident	75 Å²	75	110.3 Å²	110.3	46%	0.46	54%	0.538	S	S	.	.	H	α-helix	trans	-68.1	-34.3	178.7	50	0	0	0	0	112.1	I1125 V1126 I1132 W1133	I1125-T1129 HydrophobicContact CG2-CG2 4.29Å; I1125-T1129 WeakPolarHBondContact O-CB 3.36Å; I1125-T1129 WeakPolarHBondContact O-CG2 3.26Å; I1125-T1129 PolarHBondContact O-N 3.1Å; I1125-T1129 PolarHBondContact O-OG1 3.18Å; V1126-T1129 WeakPolarHBondContact CA-OG1 3.4Å; V1126-T1129 PolarHBondContact O-OG1 3.37Å; T1129-I1132 PolarHBondContact O-N 3.25Å; T1129-W1133 WeakPolarHBondContact O-CB 3.29Å; T1129-W1133 PolarHBondContact O-N 2.79Å
1130	F	89.1	Confident	78.7	Confident	113 Å²	113	110 Å²	110	50%	0.496	54%	0.539	S	S	.	.	H	α-helix	trans	-65	-42.9	170.4	-174.8	-97.9	0	0	0	111.9	V1126 I1132 W1133 Y1134	V1126-F1130 WeakPolarHBondContact O-CB 3.44Å; V1126-F1130 PolarHBondContact O-N 3.47Å; F1130-I1132 PolarHBondContact O-N 2.84Å; F1130-W1133 HydrophobicContact CD2-CE3 4.13Å; F1130-W1133 HydrophobicContact CE2-CE3 4.01Å; F1130-W1133 AromaticContact CE2-CZ3 3.95Å; F1130-W1133 HydrophobicContact CE2-CZ3 3.95Å; F1130-W1133 PolarHBondContact O-N 2.81Å; F1130-Y1134 WeakPolarHBondContact O-CB 3.35Å; F1130-Y1134 PolarHBondContact O-N 2.99Å
1131	C	84.3	Confident	76.1	Confident	76 Å²	76	112 Å²	112	51%	0.514	55%	0.546	S	S	.	.	H	α-helix	trans	-62	-40.8	174	-76	0	0	0	0	112.5	L1127 I1128 R1135	L1127-C1131 WeakPolarHBondContact O-CB 3.43Å; L1127-C1131 PolarHBondContact O-N 2.63Å; L1127-C1131 PolarHBondContact O-SG 3.2Å; I1128-C1131 PolarHBondContact O-N 2.86Å; C1131-R1135 VanDerWaalsContact O-CB 3.32Å; C1131-R1135 WeakPolarHBondContact O-CB 3.43Å; C1131-R1135 WeakPolarHBondContact O-CG 3.26Å; C1131-R1135 PolarHBondContact O-N 3.21Å
1132	I	84.7	Confident	73.3	Confident	93 Å²	93	117.4 Å²	117.4	48%	0.477	56%	0.56	S	S	.	*	H	α-helix	trans	-68.2	-44.6	175.8	-68.9	167.2	0	0	0	110.6	I1128 T1129 F1130 R1135 L1136	I1128-I1132 HydrophobicContact CG2-CD1 3.77Å; I1128-I1132 VanDerWaalsContact O-CG1 3.32Å; I1128-I1132 WeakPolarHBondContact O-CG1 3.41Å; I1128-I1132 PolarHBondContact O-N 2.85Å; T1129-I1132 PolarHBondContact O-N 3.25Å; F1130-I1132 PolarHBondContact O-N 2.84Å; I1132-R1135 PolarHBondContact O-N 2.94Å; I1132-L1136 HydrophobicContact CG2-CD1 3.89Å; I1132-L1136 WeakPolarHBondContact O-CB 3.48Å; I1132-L1136 VanDerWaalsContact O-CG 3.3Å; I1132-L1136 WeakPolarHBondContact O-CG 3.44Å; I1132-L1136 PolarHBondContact O-N 2.97Å
1133	W	84.6	Confident	70.5	Confident	138 Å²	138	118 Å²	118	52%	0.523	57%	0.571	S	S	.	*	H	α-helix	trans	-61.3	-46.8	176.3	179.4	81.5	0	0	0	111.2	T1129 F1130 R1135 L1136 H1137	T1129-W1133 WeakPolarHBondContact O-CB 3.29Å; T1129-W1133 PolarHBondContact O-N 2.79Å; F1130-W1133 HydrophobicContact CD2-CE3 4.13Å; F1130-W1133 HydrophobicContact CE2-CE3 4.01Å; F1130-W1133 AromaticContact CE2-CZ3 3.95Å; F1130-W1133 HydrophobicContact CE2-CZ3 3.95Å; F1130-W1133 PolarHBondContact O-N 2.81Å; W1133-R1135 PolarHBondContact O-N 3.14Å; W1133-L1136 CarbonylContact O-C 3.56Å; W1133-L1136 PolarHBondContact O-N 3.46Å; W1133-H1137 AromaticContact CE2-CD2 3.5Å; W1133-H1137 AromaticContact CZ2-CD2 3.4Å; W1133-H1137 WeakPolarHBondContact CZ2-CD2 3.43Å; W1133-H1137 AromaticContact CZ2-NE2 3.75Å; W1133-H1137 AromaticContact NE1-CD2 3.61Å; W1133-H1137 WeakPolarHBondContact O-CB 3.37Å; W1133-H1137 PolarHBondContact O-N 2.87Å
1134	Y	79.7	Confident	67.4	Low	133 Å²	133	126.2 Å²	126.2	52%	0.522	60%	0.596	S	S	.	*	H	α-helix	trans	-60.7	-43.3	175.9	-171.9	-108.3	0	0	0	111.9	F1130 L1136 H1137 L1138	F1130-Y1134 WeakPolarHBondContact O-CB 3.35Å; F1130-Y1134 PolarHBondContact O-N 2.99Å; Y1134-L1136 VanDerWaalsContact C-N 3.26Å; Y1134-L1136 PolarHBondContact O-N 3.23Å; Y1134-H1137 PolarHBondContact O-N 3.12Å; Y1134-L1138 HydrophobicContact CD1-CD1 3.8Å; Y1134-L1138 HydrophobicContact CE1-CD1 3.48Å; Y1134-L1138 VanDerWaalsContact CE1-CD1 3.48Å; Y1134-L1138 HydrophobicContact CE2-CD1 4.33Å; Y1134-L1138 HydrophobicContact CG-CD1 4.35Å; Y1134-L1138 WeakPolarHBondContact O-CB 3.26Å; Y1134-L1138 WeakPolarHBondContact O-CG 3.48Å; Y1134-L1138 PolarHBondContact O-N 3.43Å
1135	R	70.3	Confident	64.3	Low	200 Å²	200	122.6 Å²	122.6	76%	0.755	60%	0.597	S	S	*	*	H	α-helix	trans	-61.7	-28.6	172.3	-76.3	-83.4	-166.1	171.3	3.4	113.6	C1131 I1132 W1133	C1131-R1135 VanDerWaalsContact O-CB 3.32Å; C1131-R1135 WeakPolarHBondContact O-CB 3.43Å; C1131-R1135 WeakPolarHBondContact O-CG 3.26Å; C1131-R1135 PolarHBondContact O-N 3.21Å; I1132-R1135 PolarHBondContact O-N 2.94Å; W1133-R1135 PolarHBondContact O-N 3.14Å
1136	L	68.2	Low	61.3	Low	113 Å²	113	128.9 Å²	128.9	59%	0.592	62%	0.617	S	S	*	*	H	α-helix	trans	-85.6	-41.9	177.2	-72.5	167.1	0	0	0	112	I1132 W1133 Y1134 L1138 K1139	I1132-L1136 HydrophobicContact CG2-CD1 3.89Å; I1132-L1136 WeakPolarHBondContact O-CB 3.48Å; I1132-L1136 VanDerWaalsContact O-CG 3.3Å; I1132-L1136 WeakPolarHBondContact O-CG 3.44Å; I1132-L1136 PolarHBondContact O-N 2.97Å; W1133-L1136 CarbonylContact O-C 3.56Å; W1133-L1136 PolarHBondContact O-N 3.46Å; Y1134-L1136 VanDerWaalsContact C-N 3.26Å; Y1134-L1136 PolarHBondContact O-N 3.23Å; L1136-L1138 PolarHBondContact O-N 3.41Å; L1136-K1139 WeakPolarHBondContact O-CA 3.48Å; L1136-K1139 WeakPolarHBondContact O-CB 3.39Å; L1136-K1139 PolarHBondContact O-N 3.31Å
1137	H	60.7	Low	58.4	Low	90 Å²	90	135.7 Å²	135.7	42%	0.417	64%	0.64	S	S	.	*	H	α-helix	trans	-68.5	-34.4	-179.3	-132.9	-81.6	0	0	0	112.1	W1133 Y1134 K1139 S1140	W1133-H1137 AromaticContact CE2-CD2 3.5Å; W1133-H1137 AromaticContact CZ2-CD2 3.4Å; W1133-H1137 WeakPolarHBondContact CZ2-CD2 3.43Å; W1133-H1137 AromaticContact CZ2-NE2 3.75Å; W1133-H1137 AromaticContact NE1-CD2 3.61Å; W1133-H1137 WeakPolarHBondContact O-CB 3.37Å; W1133-H1137 PolarHBondContact O-N 2.87Å; Y1134-H1137 PolarHBondContact O-N 3.12Å; H1137-K1139 PolarHBondContact O-N 3.14Å; H1137-K1139 VanDerWaalsContact O-N 3.14Å; H1137-S1140 PolarHBondContact O-N 3.41Å; H1137-S1140 PolarHBondContact O-OG 3.32Å; H1137-S1140 VanDerWaalsContact O-OG 3.09Å
1138	L	51.7	Low	55.3	Low	113 Å²	113	134.8 Å²	134.8	59%	0.592	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-8.1	169.2	-80.6	168.6	0	0	0	114	Y1134 L1136	Y1134-L1138 HydrophobicContact CD1-CD1 3.8Å; Y1134-L1138 HydrophobicContact CE1-CD1 3.48Å; Y1134-L1138 VanDerWaalsContact CE1-CD1 3.48Å; Y1134-L1138 HydrophobicContact CE2-CD1 4.33Å; Y1134-L1138 HydrophobicContact CG-CD1 4.35Å; Y1134-L1138 WeakPolarHBondContact O-CB 3.26Å; Y1134-L1138 WeakPolarHBondContact O-CG 3.48Å; Y1134-L1138 PolarHBondContact O-N 3.43Å; L1136-L1138 PolarHBondContact O-N 3.41Å
1139	K	39.5	Very low	52.3	Low	187 Å²	187	134.4 Å²	134.4	81%	0.813	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	1.9	171.8	-75.9	-171	171	-174.3	0	114.1	L1136 H1137	L1136-K1139 WeakPolarHBondContact O-CA 3.48Å; L1136-K1139 WeakPolarHBondContact O-CB 3.39Å; L1136-K1139 PolarHBondContact O-N 3.31Å; H1137-K1139 PolarHBondContact O-N 3.14Å; H1137-K1139 VanDerWaalsContact O-N 3.14Å
1140	S	34.7	Very low	49.7	Very low	75 Å²	75	139.1 Å²	139.1	52%	0.524	69%	0.693	S	S	.	*	S	Bend	trans	-116.5	20.1	-176.9	63.6	0	0	0	0	115.2	H1137	H1137-S1140 PolarHBondContact O-N 3.41Å; H1137-S1140 PolarHBondContact O-OG 3.32Å; H1137-S1140 VanDerWaalsContact O-OG 3.09Å
1141	Q	31.9	Very low	46.8	Very low	155 Å²	155	141.4 Å²	141.4	72%	0.724	71%	0.71	S	S	*	*	S	Bend	trans	-155.1	96.1	170.4	-109.8	164.8	6.9	0	0	112.1
1142	Y	30.9	Very low	44.1	Very low	223 Å²	223	145.3 Å²	145.3	88%	0.875	73%	0.726	S	S	*	*			trans	-178.6	149	133	-92.2	-60.7	0	0	0	109
1143	P	31.7	Very low	41.5	Very low	115 Å²	115	146 Å²	146	75%	0.747	74%	0.739	S	S	*	*			trans	-89.4	164.8	-164	35.5	-35.9	0	0	0	114.4	G1145	P1143-G1145 PolarHBondContact O-N 3.18Å
1144	R	27.2	Very low	39	Very low	257 Å²	257	148.2 Å²	148.2	97%	0.97	76%	0.755	S	S	*	*			trans	-64.5	127.5	174	-65.7	172	174	156.4	-4	111.5
1145	G	27.2	Very low	36.7	Very low	61 Å²	61	150 Å²	150	63%	0.629	77%	0.773	S	S	*	*			trans	-179.5	146.6	166.8	0	0	0	0	0	112.7	P1143	P1143-G1145 PolarHBondContact O-N 3.18Å
1146	Y	28.9	Very low	34.7	Very low	224 Å²	224	146.6 Å²	146.6	88%	0.878	77%	0.774	S	S	*	*			trans	55.3	64.2	163.9	-60.7	-79.2	0	0	0	118.7
1147	F	30.3	Very low	32.9	Very low	227 Å²	227	150.6 Å²	150.6	100%	0.996	79%	0.79	S	S	*	*				-142.6	92.8	127.1	-100.4	-72.1	0	0	0	109.6
1148	G	26.8	Very low	31.3	Very low	81 Å²	81	152.5 Å²	152.5	84%	0.835	81%	0.808	S	S	*	*			trans	-137.9	131.2	166.3	0	0	0	0	0	107.5
1149	G	29.2	Very low	30.4	Very low	74 Å²	74	153.1 Å²	153.1	76%	0.763	82%	0.819	S	S	*	*			trans	149.9	26.1	-173.5	0	0	0	0	0	117.8
1150	L	31.4	Very low	29.9	Very low	174 Å²	174	153.2 Å²	153.2	91%	0.911	82%	0.819	S	S	*	*	S	Bend	trans	-133.9	132.6	153.6	-89.5	173.2	0	0	0	107.5
1151	N	29.3	Very low	29.5	Very low	161 Å²	161	157.4 Å²	157.4	86%	0.861	83%	0.831	S	S	*	*			trans	-88.5	142	-165.9	-75	-14.8	0	0	0	113
1152	D	27.5	Very low	29.3	Very low	157 Å²	157	160 Å²	160	84%	0.84	83%	0.834	S	S	*	*			trans	-67.9	147.5	161.3	-63	-67.9	0	0	0	112
1153	S	31	Very low	29.1	Very low	108 Å²	108	154.7 Å²	154.7	76%	0.755	83%	0.825	S	S	*	*				178.7	149.6	116.5	41.9	0	0	0	0	111.8
1154	Q	31.4	Very low	28.8	Very low	185 Å²	185	156.2 Å²	156.2	86%	0.864	83%	0.825	S	S	*	*	S	Bend	trans	62.9	99.3	177.6	-50.9	-177.5	3.9	0	0	113.4
1155	L	31.8	Very low	28.8	Very low	171 Å²	171	149.1 Å²	149.1	90%	0.895	81%	0.81	S	S	*	*				-138.2	155.7	53.9	-129.2	74.1	0	0	0	114
1156	T	27	Very low	28.9	Very low	127 Å²	127	154 Å²	154	78%	0.779	82%	0.817	S	S	*	*			trans	-96.3	130.2	175.4	47.7	0	0	0	0	112.1
1157	E	31.4	Very low	28.7	Very low	197 Å²	197	153.9 Å²	153.9	92%	0.921	82%	0.815	S	S	*	*				-167.9	160.9	128.9	-109.8	168.2	-153.9	0	0	111.8
1158	T	26.9	Very low	28.6	Very low	131 Å²	131	150.8 Å²	150.8	80%	0.804	80%	0.804	S	S	*	*			trans	-120.6	155.5	-170.3	64.4	0	0	0	0	111.4
1159	P	32.6	Very low	28.5	Very low	125 Å²	125	154.7 Å²	154.7	81%	0.812	81%	0.806	S	S	*	*				-147.3	166.3	100.1	37.4	-21.8	0	0	0	116.8
1160	K	29.1	Very low	28.4	Very low	190 Å²	190	159.6 Å²	159.6	83%	0.826	81%	0.806	S	S	*	*			trans	-79.3	139.5	164.5	-69.2	169.9	-175.6	171.1	0	108.8
1161	Q	26.7	Very low	28.2	Very low	162 Å²	162	158.8 Å²	158.8	76%	0.757	80%	0.797	S	S	*	*				80.8	124.3	63.1	-147.8	-162.2	28.4	0	0	114.5
1162	R	26.8	Very low	28.1	Very low	209 Å²	209	156.8 Å²	156.8	79%	0.789	79%	0.792	S	S	*	*			trans	86.8	130.6	158.6	-85.2	-176.1	175.1	176	-1.8	122.6
1163	T	28.1	Very low	28.2	Very low	112 Å²	112	157.9 Å²	157.9	69%	0.687	79%	0.791	S	S	*	*			trans	66.5	141.6	141.1	58	0	0	0	0	118
1164	I	24.7	Very low	28.1	Very low	148 Å²	148	158.1 Å²	158.1	76%	0.759	79%	0.79	S	S	*	*				61.4	123.8	50.3	-52.9	171.4	0	0	0	108.9
1165	T	27.1	Very low	27.8	Very low	107 Å²	107	155.6 Å²	155.6	66%	0.656	78%	0.782	S	S	*	*			cis	-138.8	179.4	20.8	-16.4	0	0	0	0	110.6
1166	E	28.3	Very low	27.5	Very low	164 Å²	164	153.2 Å²	153.2	77%	0.766	77%	0.774	S	S	*	*			trans	66.9	152.5	157.3	-73.3	149.7	-124.9	0	0	118.2
1167	W	24.4	Very low	27.4	Very low	221 Å²	221	152.3 Å²	152.3	84%	0.837	77%	0.769	S	S	*	*			cis	-156.8	172.9	-37.7	-130.7	44.9	0	0	0	107.6
1168	E	29.1	Very low	27.2	Very low	163 Å²	163	148.3 Å²	148.3	76%	0.762	76%	0.758	S	S	*	*			trans	62.1	128.2	168	-62.9	-178.6	171.7	0	0	120.1
1169	N	25.8	Very low	27.2	Very low	163 Å²	163	148 Å²	148	87%	0.872	75%	0.751	S	S	*	*			trans	-108.7	117.3	164.9	-92.4	-40	0	0	0	108.8
1170	F	27	Very low	27.1	Very low	176 Å²	176	148.1 Å²	148.1	77%	0.772	75%	0.745	S	S	*	*			trans	-146.6	108.2	164.4	-111.6	-83.4	0	0	0	113.9
1171	Q	25.3	Very low	27.1	Very low	157 Å²	157	146.1 Å²	146.1	73%	0.734	74%	0.738	S	S	*	*			trans	57.6	163.5	142.4	-67.6	-172.6	-9.1	0	0	122.7
1172	T	27.5	Very low	27.3	Very low	120 Å²	120	145.6 Å²	145.6	74%	0.736	74%	0.736	S	S	*	*			trans	61.6	112.6	164.4	52.6	0	0	0	0	119.6
1173	Q	31	Very low	27.4	Very low	179 Å²	179	142.5 Å²	142.5	84%	0.836	74%	0.741	S	S	*	*				-66.8	139.7	129.1	-63.7	-178.3	-12	0	0	107.2
1174	P	27.9	Very low	27.1	Very low	113 Å²	113	145.6 Å²	145.6	73%	0.734	75%	0.745	S	S	*	*				-139	138.8	83.7	36.3	-22	0	0	0	116.5
1175	I	25.4	Very low	27.4	Very low	133 Å²	133	144.6 Å²	144.6	68%	0.682	75%	0.748	S	S	*	*			trans	3.4	144.9	133	-67.4	165.8	0	0	0	118.9
1176	T	24.8	Very low	27.2	Very low	121 Å²	121	149.9 Å²	149.9	74%	0.742	76%	0.756	S	S	*	*			trans	70	144.8	164.7	54.8	0	0	0	0	117.6
1177	T	26.3	Very low	27.3	Very low	108 Å²	108	149 Å²	149	66%	0.663	76%	0.762	S	S	*	*			cis	-155.5	139.3	-5.7	12.8	0	0	0	0	108.9
1178	T	27.4	Very low	27.3	Very low	112 Å²	112	143 Å²	143	69%	0.687	76%	0.76	S	S	*	*				38.4	133.5	104.7	80.9	0	0	0	0	117.8
1179	D	26.6	Very low	27.3	Very low	125 Å²	125	138.8 Å²	138.8	67%	0.668	76%	0.759	S	S	*	*				174.9	134.3	126.6	-85.1	-5.2	0	0	0	106.3
1180	N	29.9	Very low	27.4	Very low	127 Å²	127	138.1 Å²	138.1	68%	0.679	76%	0.756	S	S	*	*				-161.5	159.5	52.3	-81.9	-74.8	0	0	0	107.6
1181	H	30	Very low	27.4	Very low	148 Å²	148	136 Å²	136	69%	0.685	75%	0.752	S	S	*	*			cis	-151.7	168.1	8.6	-92.1	-31.1	0	0	0	106.2
1182	Q	30.5	Very low	27.6	Very low	152 Å²	152	136.1 Å²	136.1	71%	0.71	75%	0.752	S	S	*	*			cis	-160.8	126.2	9.1	-125	158.6	30.2	0	0	109.1
1183	T	28.2	Very low	27.7	Very low	144 Å²	144	135.2 Å²	135.2	88%	0.883	74%	0.742	S	S	*	*			trans	159.7	121.8	133.8	38.7	0	0	0	0	111.9
1184	F	21.5	Very low	27.4	Very low	177 Å²	177	134.6 Å²	134.6	78%	0.776	74%	0.739	S	S	*	*			trans	-133.1	164.8	178.1	-107.9	-65	0	0	0	106.1
1185	P	30.6	Very low	27.5	Very low	126 Å²	126	134.1 Å²	134.1	82%	0.818	74%	0.738	S	S	*	*				-150.2	-176.1	61.5	38.9	-16.2	0	0	0	117.4
1186	R	24.4	Very low	27.6	Very low	218 Å²	218	134.2 Å²	134.2	82%	0.823	74%	0.74	S	S	*	*			trans	-99.7	155.8	178.3	-68	169.8	162.3	162.6	-6.8	113
1187	T	29.7	Very low	27.8	Very low	147 Å²	147	132.4 Å²	132.4	90%	0.902	73%	0.732	S	S	*	*			trans	177.9	153.4	142.6	25.4	0	0	0	0	108.3
1188	A	24.9	Very low	27.9	Very low	95 Å²	95	133.2 Å²	133.2	79%	0.785	73%	0.732	S	S	*	*			cis	-164.7	150.1	-26.8	0	0	0	0	0	110
1189	G	28.5	Very low	28.1	Very low	73 Å²	73	134.3 Å²	134.3	75%	0.753	73%	0.729	S	S	*	*			trans	77.1	174	173.9	0	0	0	0	0	116.2
1190	N	27.8	Very low	28.2	Very low	149 Å²	149	135.4 Å²	135.4	80%	0.797	73%	0.73	S	S	*	*			cis	-166.2	140.5	-15.6	-135.5	3	0	0	0	111.8
1191	L	26.6	Very low	28.2	Very low	132 Å²	132	135.4 Å²	135.4	69%	0.691	73%	0.731	S	S	*	*			trans	60.9	167.2	165.5	-64.4	149.8	0	0	0	116.6	L1193	L1191-L1193 HydrophobicContact CD2-CD1 3.81Å; L1191-L1193 HydrophobicContact CD2-CG 4.4Å
1192	H	29.6	Very low	27.9	Very low	159 Å²	159	135.3 Å²	135.3	74%	0.736	74%	0.735	S	S	*	*			cis	-142.6	113.2	7.5	-142.6	-95.5	0	0	0	106.7
1193	L	29.4	Very low	27.7	Very low	102 Å²	102	134.8 Å²	134.8	53%	0.534	74%	0.735	S	S	.	*				79.1	115.7	91.8	-83.2	165.8	0	0	0	118.1	L1191	L1191-L1193 HydrophobicContact CD2-CD1 3.81Å; L1191-L1193 HydrophobicContact CD2-CG 4.4Å
1194	Q	26.4	Very low	27.7	Very low	165 Å²	165	133 Å²	133	77%	0.771	72%	0.724	S	S	*	*			trans	63.8	153	139.3	-76.2	172	-11.6	0	0	120.3	L1196	Q1194-L1196 HydrophobicContact CG-CD1 4.47Å
1195	S	29.4	Very low	27.9	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	72%	0.718	S	S	*	*			cis	-137.7	151.5	26.2	60.2	0	0	0	0	117
1196	L	27.3	Very low	27.7	Very low	136 Å²	136	130.6 Å²	130.6	71%	0.712	71%	0.711	S	S	*	*			trans	23.1	144.7	135.6	-72.8	77.7	0	0	0	120	Q1194	Q1194-L1196 HydrophobicContact CG-CD1 4.47Å
1197	S	27.9	Very low	27.8	Very low	82 Å²	82	126 Å²	126	57%	0.573	70%	0.703	S	S	*	*			cis	-166.8	159.7	4.7	-119	0	0	0	0	112.2
1198	D	29.6	Very low	27.6	Very low	125 Å²	125	125 Å²	125	67%	0.668	69%	0.692	S	S	*	*			trans	47.2	143.8	139.8	-56.8	-51.8	0	0	0	121.8
1199	Q	30.6	Very low	27.5	Very low	135 Å²	135	130.1 Å²	130.1	63%	0.631	70%	0.697	S	S	*	*			cis	-164.7	144.3	-1.7	-117.8	168.8	16.6	0	0	111.1
1200	Q	29.8	Very low	27.3	Very low	148 Å²	148	130.6 Å²	130.6	69%	0.692	69%	0.694	S	S	*	*			trans	50.9	168	140.7	-63.3	163.7	1.8	0	0	120.9
1201	N	28.5	Very low	27.2	Very low	128 Å²	128	130.5 Å²	130.5	68%	0.684	70%	0.699	S	S	*	*			cis	-156.4	143.1	-42	-92.2	-9.7	0	0	0	104.2
1202	L	24.4	Very low	27	Very low	146 Å²	146	132.1 Å²	132.1	76%	0.764	71%	0.707	S	S	*	*			cis	75.6	139.6	47.3	-146.7	155.5	0	0	0	113
1203	I	27.6	Very low	26.7	Very low	140 Å²	140	133.8 Å²	133.8	72%	0.718	72%	0.715	S	S	*	*			trans	92.9	130.8	177.8	-53.3	169	0	0	0	114.6
1204	T	26.5	Very low	26.4	Very low	106 Å²	106	137.8 Å²	137.8	65%	0.65	73%	0.731	S	S	*	*			cis	-160.7	-158	-34.3	47.5	0	0	0	0	107.2
1205	D	27.1	Very low	26.6	Very low	123 Å²	123	134.6 Å²	134.6	66%	0.658	73%	0.725	S	S	*	*			cis	-163.1	159.8	4.1	-127.3	-31.8	0	0	0	118.1
1206	I	26.2	Very low	26.4	Very low	131 Å²	131	135.4 Å²	135.4	67%	0.672	73%	0.725	S	S	*	*			trans	40.8	118.5	139.9	-84.7	167.3	0	0	0	126.8
1207	N	25.8	Very low	26.2	Very low	122 Å²	122	134.9 Å²	134.9	65%	0.652	72%	0.719	S	S	*	*			trans	71.8	114.9	130.1	-64.8	-1.8	0	0	0	127.4
1208	N	25.8	Very low	26	Very low	126 Å²	126	141.6 Å²	141.6	67%	0.674	73%	0.732	S	S	*	*				100.3	137.4	110.2	-78.5	-8.7	0	0	0	126.5
1209	F	23.6	Very low	25.8	Very low	201 Å²	201	141 Å²	141	88%	0.882	73%	0.728	S	S	*	*			trans	68.2	155.6	150.8	-82.6	-68.1	0	0	0	122.1
1210	A	24	Very low	25.6	Very low	83 Å²	83	143.6 Å²	143.6	69%	0.686	74%	0.74	S	S	*	*			trans	-118.8	156.5	-154.9	0	0	0	0	0	114
1211	T	24.5	Very low	25.2	Very low	148 Å²	148	144.3 Å²	144.3	91%	0.908	74%	0.743	S	S	*	*			trans	-168.3	-174.7	130.1	15	0	0	0	0	111
1212	L	23.6	Very low	25	Very low	165 Å²	165	142.7 Å²	142.7	86%	0.864	74%	0.742	S	S	*	*			trans	-84.7	166.5	-165.1	-73.6	127	0	0	0	115.5
1213	Q	23.2	Very low	25.2	Very low	195 Å²	195	143.7 Å²	143.7	91%	0.911	74%	0.743	S	S	*	*			trans	93.9	140.3	163.5	-58.4	-173.9	-31.4	0	0	119
1214	H	22.5	Very low	25	Very low	186 Å²	186	144.4 Å²	144.4	86%	0.861	75%	0.747	S	S	*	*			trans	-89	174.9	178	-76.5	-83.8	0	0	0	111.6
1215	P	31.2	Very low	25.1	Very low	98 Å²	98	144.7 Å²	144.7	64%	0.636	75%	0.75	S	S	*	*			cis	-132.8	-169.4	-20.9	30.9	-9.6	0	0	0	113.3
1216	T	24.4	Very low	25.1	Very low	119 Å²	119	144.4 Å²	144.4	73%	0.73	76%	0.756	S	S	*	*			trans	66	151.7	154.1	40.6	0	0	0	0	119.1
1217	Q	24.2	Very low	25.3	Very low	126 Å²	126	146 Å²	146	59%	0.589	76%	0.761	S	S	*	*			cis	-169.5	133.4	-23.5	-151.8	177.2	-7.7	0	0	111.2
1218	W	23.2	Very low	25.4	Very low	222 Å²	222	150.5 Å²	150.5	84%	0.841	77%	0.769	S	S	*	*			trans	54.6	-175.9	159.8	-56.1	-20	0	0	0	117.5
1219	I	24.8	Very low	25.4	Very low	113 Å²	113	153.8 Å²	153.8	58%	0.579	78%	0.777	S	S	*	*			cis	-139.3	144.6	7.4	-82.5	90.8	0	0	0	110.5	Q1221	I1219-Q1221 HydrophobicContact CG2-CB 4.11Å; I1219-Q1221 HydrophobicContact CG2-CG 3.91Å
1220	Q	25.8	Very low	25.6	Very low	190 Å²	190	149.1 Å²	149.1	89%	0.888	77%	0.768	S	S	*	*			trans	-167.4	129.4	135.1	-104.4	176	11.6	0	0	107.2
1221	Q	23	Very low	25.5	Very low	162 Å²	162	154.9 Å²	154.9	76%	0.757	77%	0.772	S	S	*	*			cis	68.6	129.5	24	-68.2	-171.7	-1.3	0	0	114.3	I1219	I1219-Q1221 HydrophobicContact CG2-CB 4.11Å; I1219-Q1221 HydrophobicContact CG2-CG 3.91Å
1222	S	23.4	Very low	25.6	Very low	95 Å²	95	153.5 Å²	153.5	66%	0.664	76%	0.76	S	S	*	*			cis	-163.6	-173.7	6.8	54.2	0	0	0	0	113.6
1223	Q	28.4	Very low	25.5	Very low	167 Å²	167	150.3 Å²	150.3	78%	0.78	75%	0.751	S	S	*	*			trans	87.2	127.7	170	-52.8	176	12.8	0	0	115.9
1224	I	23.1	Very low	25.5	Very low	155 Å²	155	149.5 Å²	149.5	80%	0.795	75%	0.749	S	S	*	*			cis	86	127.9	35.4	-63	168.5	0	0	0	110.7
1225	P	30.3	Very low	25.5	Very low	111 Å²	111	146.6 Å²	146.6	72%	0.721	74%	0.744	S	S	*	*			cis	-144.4	172	44.6	35.4	-12.7	0	0	0	120.8
1226	C	26	Very low	25	Very low	117 Å²	117	149 Å²	149	79%	0.791	75%	0.751	S	S	*	*			trans	47.6	117.9	146.4	-67.4	0	0	0	0	123.4
1227	E	30.4	Very low	24.9	Very low	166 Å²	166	149.6 Å²	149.6	78%	0.776	75%	0.75	S	S	*	*				-153.6	155.1	88	-90	-146.6	112	0	0	111.5
1228	R	28.2	Very low	25	Very low	215 Å²	215	151 Å²	151	81%	0.811	76%	0.756	S	S	*	*			trans	32.7	106.1	169.3	-57.9	-178.5	-171.7	-162.1	-0.9	117.9
1229	K	25.9	Very low	25	Very low	196 Å²	196	145.6 Å²	145.6	85%	0.852	75%	0.748	S	S	*	*			cis	55.9	137	46.4	-61.5	-173	178.8	177.6	0	114.2
1230	C	26.8	Very low	24.9	Very low	103 Å²	103	146.1 Å²	146.1	70%	0.696	75%	0.751	S	S	*	*			cis	-122.1	167	-1	-79.8	0	0	0	0	110
1231	R	22.6	Very low	25	Very low	203 Å²	203	144.6 Å²	144.6	77%	0.766	74%	0.742	S	S	*	*			cis	84.2	151.7	19.2	-150.5	-169.4	179.7	-75.1	1.4	115.9
1232	N	26.1	Very low	24.9	Very low	120 Å²	120	141.8 Å²	141.8	64%	0.642	74%	0.736	S	S	*	*			trans	82	129.8	-178.7	-50.4	-5.6	0	0	0	112.8
1233	S	22.2	Very low	25	Very low	97 Å²	97	147.2 Å²	147.2	68%	0.678	74%	0.743	S	S	*	*			cis	82.5	75.8	11.4	94.6	0	0	0	0	118
1234	M	22.8	Very low	24.7	Very low	179 Å²	179	150.1 Å²	150.1	88%	0.882	75%	0.747	S	S	*	*			trans	-165.3	126.9	142.5	-106.7	167.4	168.4	0	0	106.9
1235	V	22.3	Very low	24.9	Very low	125 Å²	125	147.1 Å²	147.1	76%	0.758	74%	0.737	S	S	*	*				79	149.1	87.6	170	0	0	0	0	112.3
1236	L	22.3	Very low	24.7	Very low	148 Å²	148	148.6 Å²	148.6	78%	0.775	74%	0.738	S	S	*	*			trans	-35.3	149.7	174.2	-61.8	127.4	0	0	0	113.3
1237	D	22	Very low	24.5	Very low	131 Å²	131	149.1 Å²	149.1	70%	0.701	73%	0.732	S	S	*	*			cis	-160	-169	34.8	-144.6	-34.8	0	0	0	112.8
1238	E	24.8	Very low	24.4	Very low	156 Å²	156	148.4 Å²	148.4	73%	0.729	73%	0.733	S	S	*	*			trans	60	102.2	156.1	-67.8	-176.2	165.8	0	0	118.7
1239	T	23.5	Very low	24.4	Very low	108 Å²	108	142.4 Å²	142.4	66%	0.663	72%	0.724	S	S	*	*				76.7	164.9	67.6	76.6	0	0	0	0	115.5
1240	L	23.8	Very low	24.5	Very low	124 Å²	124	139.2 Å²	139.2	65%	0.649	72%	0.716	S	S	*	*			trans	61.7	114.9	165	-63.7	165.5	0	0	0	116.7
1241	K	26.2	Very low	24.5	Very low	158 Å²	158	140.5 Å²	140.5	69%	0.687	72%	0.716	S	S	*	*			cis	-151.9	151.9	29.4	-83.2	111.6	-180	169.5	0	109.8
1242	T	22.3	Very low	24.5	Very low	104 Å²	104	135.5 Å²	135.5	64%	0.638	72%	0.718	S	S	*	*			cis	68.6	77	37.2	76	0	0	0	0	116
1243	Y	24.9	Very low	24.4	Very low	208 Å²	208	139.1 Å²	139.1	82%	0.816	73%	0.728	S	S	*	*			trans	-153.4	123.1	154.3	-86.7	-63.7	0	0	0	105.8
1244	W	21.9	Very low	24.4	Very low	229 Å²	229	140 Å²	140	87%	0.867	73%	0.73	S	S	*	*			cis	55.6	152.2	23.2	-81	63	0	0	0	113.8
1245	P	28	Very low	24.4	Very low	91 Å²	91	136.9 Å²	136.9	59%	0.591	72%	0.72	S	S	*	*			cis	-99	-160.4	-21.8	23.2	-2.1	0	0	0	109.3
1246	I	24.8	Very low	24.4	Very low	142 Å²	142	139.1 Å²	139.1	73%	0.728	72%	0.72	S	S	*	*				-165.8	109.9	60.8	-84.9	177.3	0	0	0	105.5
1247	I	23.7	Very low	24.4	Very low	129 Å²	129	138.8 Å²	138.8	66%	0.662	72%	0.717	S	S	*	*				79.2	137.4	96	-71.3	166.4	0	0	0	112.9
1248	N	28.1	Very low	24.7	Very low	151 Å²	151	140.8 Å²	140.8	81%	0.807	72%	0.719	S	S	*	*			trans	83.1	135.3	-179.3	-63.4	-18.5	0	0	0	116.8
1249	S	27.4	Very low	24.8	Very low	89 Å²	89	139 Å²	139	62%	0.622	72%	0.715	S	S	*	*			cis	-170.4	160.8	-14.6	47.7	0	0	0	0	110.8
1250	N	28	Very low	25.2	Very low	129 Å²	129	140.8 Å²	140.8	69%	0.69	72%	0.715	S	S	*	*			trans	74.1	140	152.1	-77.2	35	0	0	0	120
1251	D	27.4	Very low	25.5	Very low	130 Å²	130	140.3 Å²	140.3	70%	0.695	71%	0.713	S	S	*	*			trans	52.8	111.1	132.4	-47.1	-23.5	0	0	0	117.6
1252	A	22.4	Very low	25.6	Very low	97 Å²	97	141 Å²	141	80%	0.802	72%	0.719	S	S	*	*			cis	60.2	152.6	40.8	0	0	0	0	0	114.6
1253	K	22.8	Very low	25.9	Very low	197 Å²	197	139.6 Å²	139.6	86%	0.857	73%	0.725	S	S	*	*			trans	-57.8	142.8	-177.9	-53.6	155.3	-178.9	171.3	0	111.8
1254	V	23.6	Very low	25.9	Very low	116 Å²	116	137 Å²	137	70%	0.703	72%	0.724	S	S	*	*				-177	108	127.4	143.2	0	0	0	0	106.5
1255	T	23	Very low	26.2	Very low	112 Å²	112	132.7 Å²	132.7	69%	0.687	72%	0.717	S	S	*	*				57	77.8	63.8	75.1	0	0	0	0	115
1256	F	21.5	Very low	26	Very low	173 Å²	173	136.5 Å²	136.5	76%	0.759	72%	0.724	S	S	*	*			trans	-84.8	109.2	143.8	-91.2	-101.9	0	0	0	107.5
1257	M	22.6	Very low	26	Very low	141 Å²	141	138.2 Å²	138.2	70%	0.695	73%	0.729	S	S	*	*				74.1	111.9	88.5	-79.3	-158.3	-164.4	0	0	110.7
1258	K	27.6	Very low	26	Very low	172 Å²	172	135.5 Å²	135.5	75%	0.748	73%	0.733	S	S	*	*			cis	-155	151.8	38.1	-94.2	160.1	-179	173.7	0	113.1
1259	N	28.1	Very low	26.1	Very low	120 Å²	120	134.1 Å²	134.1	64%	0.642	74%	0.735	S	S	*	*			trans	57.4	142.5	136	-59.5	20.1	0	0	0	120
1260	H	31.8	Very low	26.1	Very low	144 Å²	144	135 Å²	135	67%	0.667	74%	0.739	S	S	*	*			cis	-150.8	156.1	4.9	-104.2	-46.5	0	0	0	112.1
1261	N	28.5	Very low	25.8	Very low	115 Å²	115	137.1 Å²	137.1	62%	0.615	75%	0.749	S	S	*	*			trans	12.7	149.1	130.3	-51.5	32.4	0	0	0	119.3
1262	H	29.9	Very low	25.7	Very low	173 Å²	173	137.8 Å²	137.8	80%	0.801	75%	0.752	S	S	*	*			cis	-142.3	158.9	0.7	-92.4	-60.2	0	0	0	107.4
1263	G	27.9	Very low	26	Very low	74 Å²	74	138.9 Å²	138.9	76%	0.763	75%	0.751	S	S	*	*				72	149.7	76.6	0	0	0	0	0	113.5
1264	N	25	Very low	26.1	Very low	152 Å²	152	135.7 Å²	135.7	81%	0.813	74%	0.742	S	S	*	*			cis	-174.4	177.2	-11.2	-160.8	-5	0	0	0	108.3
1265	I	28.7	Very low	26.2	Very low	139 Å²	139	140.1 Å²	140.1	71%	0.713	75%	0.747	S	S	*	*			trans	80.8	107.6	155.9	-57	153.8	0	0	0	121.1
1266	K	23.6	Very low	26.5	Very low	171 Å²	171	140.3 Å²	140.3	74%	0.743	74%	0.739	S	S	*	*			trans	21.4	148.5	131.3	-50.7	-176.3	175.5	-174.1	0	125.3
1267	H	24.1	Very low	26.7	Very low	178 Å²	178	136.9 Å²	136.9	82%	0.824	73%	0.728	S	S	*	*			trans	72.6	140	144.3	-69.5	-54.9	0	0	0	121.3
1268	G	24.3	Very low	26.9	Very low	73 Å²	73	139 Å²	139	75%	0.753	73%	0.73	S	S	*	*			trans	106.5	92.5	146.2	0	0	0	0	0	117.2
1269	S	29.3	Very low	26.7	Very low	121 Å²	121	137.9 Å²	137.9	85%	0.846	73%	0.731	S	S	*	*			trans	-75.6	137.5	163.3	54.6	0	0	0	0	111.3
1270	P	27	Very low	26.7	Very low	108 Å²	108	138.7 Å²	138.7	70%	0.701	74%	0.735	S	S	*	*				-149.9	155.6	120.9	37.4	-21.8	0	0	0	116.8
1271	L	23.3	Very low	26.5	Very low	174 Å²	174	139.8 Å²	139.8	91%	0.911	74%	0.738	S	S	*	*			trans	69.6	151.4	149.5	-69.3	162.9	0	0	0	121
1272	L	25.5	Very low	26.2	Very low	144 Å²	144	143 Å²	143	75%	0.754	75%	0.749	S	S	*	*			trans	-146.5	141.8	-176.2	-161.3	94.7	0	0	0	109.2
1273	P	28.2	Very low	26.1	Very low	119 Å²	119	139.5 Å²	139.5	77%	0.773	75%	0.75	S	S	*	*			trans	-130.6	129.6	142.9	13.7	7.4	0	0	0	111.1
1274	I	25.5	Very low	26	Very low	130 Å²	130	145.3 Å²	145.3	67%	0.667	75%	0.754	S	S	*	*				75.9	123.1	58.3	-63.5	162.9	0	0	0	112.9
1275	Y	25.9	Very low	26.1	Very low	210 Å²	210	145.5 Å²	145.5	82%	0.824	75%	0.75	S	S	*	*			trans	173.5	126.4	134.5	-113.7	-112.6	0	0	0	105.7
1276	K	27.3	Very low	25.9	Very low	116 Å²	116	146.8 Å²	146.8	50%	0.504	75%	0.753	S	S	.	*			cis	-153.2	168.7	-7	-103.5	-178.1	154.2	-74.1	0	105.3
1277	D	27.2	Very low	26	Very low	101 Å²	101	143.2 Å²	143.2	54%	0.54	75%	0.75	S	S	.	*			cis	-160.8	175.3	2.6	-110.4	-21.4	0	0	0	106.1
1278	Y	26.6	Very low	26.1	Very low	184 Å²	184	141.6 Å²	141.6	72%	0.722	75%	0.746	S	S	*	*			cis	-146.9	-165.5	-3.9	-128.5	-47.6	0	0	0	108.4
1279	L	23.7	Very low	26.2	Very low	150 Å²	150	145.7 Å²	145.7	79%	0.785	75%	0.751	S	S	*	*			trans	-150.1	157.3	-176.1	-68.7	163.9	0	0	0	111.5
1280	L	27.9	Very low	25.9	Very low	137 Å²	137	142.7 Å²	142.7	72%	0.717	74%	0.739	S	S	*	*				154.3	135	118.5	-83.5	151	0	0	0	116.4
1281	K	26.9	Very low	25.9	Very low	167 Å²	167	144.2 Å²	144.2	73%	0.726	75%	0.746	S	S	*	*			trans	33.4	126.3	142	-68.2	175.5	-173.2	175.1	0	120.9
1282	Q	22.3	Very low	26.1	Very low	181 Å²	181	143.1 Å²	143.1	85%	0.846	74%	0.74	S	S	*	*				66.9	111.4	67.8	-71.2	-175.8	-19.8	0	0	116.8
1283	A	27.5	Very low	26.3	Very low	101 Å²	101	140.5 Å²	140.5	84%	0.835	73%	0.734	S	S	*	*			trans	179.9	131.3	131.8	0	0	0	0	0	116.2
1284	K	25.7	Very low	26.4	Very low	195 Å²	195	142 Å²	142	85%	0.848	74%	0.735	S	S	*	*			trans	25.6	128.4	146.6	-61.3	-173.5	175.9	-176.7	0	124.9
1285	H	27	Very low	26.4	Very low	156 Å²	156	138.3 Å²	138.3	72%	0.722	73%	0.73	S	S	*	*			trans	50.1	128.3	130.5	-70	-88.8	0	0	0	124.5
1286	Q	25.5	Very low	26.6	Very low	166 Å²	166	138.1 Å²	138.1	78%	0.776	74%	0.736	S	S	*	*				32	141.2	120.6	-71.5	165.1	-38.6	0	0	120.5
1287	S	25.6	Very low	26.6	Very low	96 Å²	96	135.9 Å²	135.9	67%	0.671	75%	0.746	S	S	*	*			cis	-177.3	162.6	3.6	49.1	0	0	0	0	114
1288	I	26.4	Very low	26.7	Very low	144 Å²	144	139.6 Å²	139.6	74%	0.738	76%	0.76	S	S	*	*			trans	81.7	118.5	155.2	-67.3	154.3	0	0	0	119.9
1289	N	24.8	Very low	26.8	Very low	160 Å²	160	136.2 Å²	136.2	86%	0.856	76%	0.755	S	S	*	*			trans	27.1	151.4	139.5	-46.9	-5.2	0	0	0	122
1290	G	24.8	Very low	26.9	Very low	58 Å²	58	135.3 Å²	135.3	60%	0.598	75%	0.746	S	S	*	*			cis	153.2	-176.9	-0.9	0	0	0	0	0	112.8
1291	T	25.1	Very low	26.9	Very low	139 Å²	139	137.5 Å²	137.5	85%	0.853	75%	0.75	S	S	*	*			trans	65.5	159	177.4	70.1	0	0	0	0	116
1292	L	28.8	Very low	26.9	Very low	152 Å²	152	133.1 Å²	133.1	80%	0.796	75%	0.752	S	S	*	*			cis	-123	171.8	-3.1	-83	90.8	0	0	0	108.2
1293	S	29.4	Very low	26.9	Very low	88 Å²	88	129.5 Å²	129.5	62%	0.615	75%	0.747	S	S	*	*			cis	-166.3	-157.2	-23.4	56.4	0	0	0	0	105.2
1294	D	29.4	Very low	26.7	Very low	150 Å²	150	132.1 Å²	132.1	80%	0.802	75%	0.746	S	S	*	*			cis	-159.1	175.8	-1.8	-120.5	-49	0	0	0	106.6
1295	G	27.4	Very low	26.7	Very low	53 Å²	53	129.8 Å²	129.8	55%	0.546	74%	0.743	S	S	.	*			cis	-173.8	169.4	-2.1	0	0	0	0	0	113.6
1296	Q	28.6	Very low	26.6	Very low	207 Å²	207	125.3 Å²	125.3	97%	0.967	74%	0.74	S	S	*	*			trans	65	127.1	175.2	-58.7	-177	-21	0	0	117.8
1297	G	27.9	Very low	26.5	Very low	68 Å²	68	124.2 Å²	124.2	70%	0.701	74%	0.737	S	S	*	*			cis	174.1	155.6	-11.3	0	0	0	0	0	115.3
1298	E	28.6	Very low	26.3	Very low	180 Å²	180	128.5 Å²	128.5	84%	0.841	74%	0.744	S	S	*	*			trans	65.4	151.9	156	-56.7	-156.4	-164.2	0	0	120.4
1299	N	28.4	Very low	26.4	Very low	113 Å²	113	131.2 Å²	131.2	60%	0.604	75%	0.754	S	S	*	*			cis	-174	165.3	-18.2	-101.3	-30.5	0	0	0	108.5
1300	Q	26.8	Very low	26.2	Very low	130 Å²	130	130.8 Å²	130.8	61%	0.607	75%	0.752	S	S	*	*			cis	-167.9	167.5	-27.7	-156.3	175.6	122.2	0	0	109.6
1301	F	27.2	Very low	26.2	Very low	183 Å²	183	134.5 Å²	134.5	80%	0.803	76%	0.756	S	S	*	*			trans	69.3	155.1	174.1	-50.9	-75.6	0	0	0	118.4
1302	G	27.1	Very low	26.1	Very low	75 Å²	75	133.6 Å²	133.6	77%	0.773	75%	0.751	S	S	*	*			cis	116.6	150.6	-7.2	0	0	0	0	0	114.9
1303	S	23.6	Very low	25.7	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	76%	0.755	S	S	*	*			cis	179.3	145.8	-23.8	-176.8	0	0	0	0	110.2
1304	L	23.3	Very low	25.4	Very low	155 Å²	155	132.7 Å²	132.7	81%	0.812	76%	0.762	S	S	*	*			trans	63.9	157.9	169.4	-64.3	154.4	0	0	0	116.4
1305	D	25.6	Very low	25.1	Very low	146 Å²	146	134.2 Å²	134.2	78%	0.781	76%	0.764	S	S	*	*			cis	-142.7	-155.1	-5	-136.7	-35.7	0	0	0	108.3
1306	G	24.6	Very low	24.9	Very low	63 Å²	63	138.5 Å²	138.5	65%	0.649	77%	0.77	S	S	*	*			cis	131.1	138	1.9	0	0	0	0	0	112.6
1307	I	23.1	Very low	24.6	Very low	142 Å²	142	136.4 Å²	136.4	73%	0.728	76%	0.758	S	S	*	*			cis	-164.6	158.2	-12.7	-159.1	173.4	0	0	0	111.3
1308	F	22.2	Very low	24.3	Very low	186 Å²	186	140.4 Å²	140.4	82%	0.816	76%	0.764	S	S	*	*			trans	47.9	120.5	166.2	-73	-59.8	0	0	0	123.2
1309	Q	26.9	Very low	24	Very low	202 Å²	202	135.2 Å²	135.2	94%	0.944	76%	0.758	S	S	*	*				-165.5	-175.3	114.1	-109.3	-179.8	1.9	0	0	112
1310	D	21.6	Very low	23.8	Very low	151 Å²	151	133.9 Å²	133.9	81%	0.807	76%	0.763	S	S	*	*			trans	-138	176.7	-149.6	-162	0.1	0	0	0	114
1311	I	24.4	Very low	23.6	Very low	136 Å²	136	135 Å²	135	70%	0.697	77%	0.773	S	S	*	*			trans	93.6	95	161.8	-60.3	173.4	0	0	0	119.6
1312	T	22.6	Very low	23.5	Very low	119 Å²	119	134.4 Å²	134.4	73%	0.73	77%	0.77	S	S	*	*			trans	66.4	125.9	136.8	63.7	0	0	0	0	126
1313	V	21.3	Very low	23.3	Very low	147 Å²	147	137.3 Å²	137.3	89%	0.891	77%	0.767	S	S	*	*			trans	74.7	124.2	132.5	174.1	0	0	0	0	120.2
1314	G	22.6	Very low	23.4	Very low	74 Å²	74	137 Å²	137	76%	0.763	77%	0.765	S	S	*	*			trans	174.7	122.9	166	0	0	0	0	0	115.3
1315	E	23.9	Very low	23.6	Very low	182 Å²	182	135 Å²	135	85%	0.85	76%	0.755	S	S	*	*			trans	-53.6	168.8	161	-76.4	168.3	165.2	0	0	113.6
1316	Q	21.9	Very low	23.8	Very low	144 Å²	144	137 Å²	137	67%	0.673	76%	0.757	S	S	*	*			cis	-179.7	166	-17	-172.2	-176.7	60.7	0	0	106.6
1317	F	22.2	Very low	24	Very low	163 Å²	163	138.7 Å²	138.7	72%	0.715	75%	0.751	S	S	*	*			trans	63.3	129	164.1	-77.7	-62.6	0	0	0	123.5
1318	N	21.9	Very low	24.3	Very low	152 Å²	152	138.9 Å²	138.9	81%	0.813	75%	0.752	S	S	*	*			trans	42.8	145.6	133.8	-67.1	-5.2	0	0	0	124.3
1319	G	23.3	Very low	24.5	Very low	70 Å²	70	136.4 Å²	136.4	72%	0.722	74%	0.743	S	S	*	*			trans	106.8	67.9	154.7	0	0	0	0	0	114.5
1320	A	22.9	Very low	24.4	Very low	85 Å²	85	130.2 Å²	130.2	70%	0.702	72%	0.716	S	S	*	*				67	113.5	73.3	0	0	0	0	0	115.1
1321	N	23.6	Very low	24.7	Very low	154 Å²	154	127.2 Å²	127.2	82%	0.824	70%	0.703	S	S	*	*			trans	73.6	162.2	168.4	-50	-52.6	0	0	0	115
1322	K	24	Very low	24.7	Very low	171 Å²	171	122.7 Å²	122.7	74%	0.743	68%	0.681	S	S	*	*			cis	-160.3	138.1	18.8	-155.5	165.1	179.5	-176.8	0	113.4
1323	L	24.7	Very low	24.9	Very low	136 Å²	136	121.1 Å²	121.1	71%	0.712	67%	0.668	S	S	*	*			trans	60.9	173.5	151.3	-101.3	57.1	0	0	0	117.1
1324	S	25.3	Very low	25.3	Very low	100 Å²	100	117.6 Å²	117.6	70%	0.699	64%	0.642	S	S	*	*			cis	-168.6	169.1	4	27.5	0	0	0	0	107.5
1325	N	27.8	Very low	25.4	Very low	112 Å²	112	116.1 Å²	116.1	60%	0.599	62%	0.619	S	S	*	*			cis	-166.8	175.3	-13.9	-106.7	29.8	0	0	0	106.4	D1327	N1325-D1327 PolarHBondContact ND2-OD1 2.88Å
1326	K	28.6	Very low	25.4	Very low	189 Å²	189	110.4 Å²	110.4	82%	0.822	60%	0.6	S	S	*	*				159.1	142.1	111.3	-79.1	-146	170.4	-177.7	0	113
1327	D	28.8	Very low	25.6	Very low	98 Å²	98	106.7 Å²	106.7	52%	0.524	59%	0.589	S	S	.	*			cis	-173.3	-176.9	-20.4	-102.3	-8.6	0	0	0	108.6	N1325	N1325-D1327 PolarHBondContact ND2-OD1 2.88Å
1328	I	29.2	Very low	25.7	Very low	145 Å²	145	103.1 Å²	103.1	74%	0.744	58%	0.577	S	S	*	*			trans	78.9	142.4	166.6	-67.1	162.8	0	0	0	116.2
1329	Q	26.2	Very low	25.8	Very low	135 Å²	135	104.9 Å²	104.9	63%	0.631	57%	0.573	S	S	*	*			cis	-158.3	154.3	-29.3	-90.6	-171.4	-1.3	0	0	106.5	P1470	Q1329-P1470 VanDerWaalsContact N-CG 3.33Å; Q1329-P1470 WeakPolarHBondContact O-CB 3.21Å
1330	L	25.8	Very low	25.9	Very low	71 Å²	71	104.4 Å²	104.4	37%	0.372	56%	0.559	S	S	.	*			cis	-153.2	179.7	-9.9	-111.7	167.8	0	0	0	111.7	N1468	L1330-N1468 HydrophobicContact CD2-CB 3.92Å; L1330-N1468 WeakPolarHBondContact CD2-OD1 3.42Å
1331	T	26.9	Very low	26	Very low	89 Å²	89	107 Å²	107	55%	0.546	56%	0.557	S	S	.	*			trans	62.6	101.1	147.3	49.2	0	0	0	0	125.8	N1468	T1331-N1468 WeakPolarHBondContact CA-OD1 3.48Å; T1331-N1468 WeakPolarHBondContact CG2-OD1 3.19Å; T1331-N1468 PolarHBondContact N-OD1 3.29Å
1332	N	26.1	Very low	26.1	Very low	41 Å²	41	105.8 Å²	105.8	22%	0.219	55%	0.548	C	S	.	.				67	112.7	111.8	-72.8	-8.4	0	0	0	125	N1466 G1467 N1468 L1469	N1332-N1466 HydrophobicContact CB-CB 4.37Å; N1332-N1466 WeakPolarHBondContact CB-OD1 3.43Å; N1332-N1466 VanDerWaalsContact CG-OD1 3.24Å; N1332-N1466 WeakPolarHBondContact ND2-CB 3.42Å; N1332-G1467 PolarHBondContact OD1-N 3.32Å; N1332-N1468 PolarHBondContact ND2-OD1 2.82Å; N1332-N1468 PolarHBondContact OD1-N 3.21Å; N1332-L1469 VanDerWaalsContact N-CD1 3.26Å
1333	D	26.7	Very low	26.1	Very low	85 Å²	85	104.2 Å²	104.2	46%	0.455	55%	0.548	S	S	.	.				-179.1	171	98.3	-96.1	-75.9	0	0	0	116.1	P1464 F1465 N1466	D1333-P1464 HydrophobicContact CB-CB 4.06Å; D1333-P1464 WeakPolarHBondContact OD1-CA 3.48Å; D1333-P1464 WeakPolarHBondContact OD1-CB 3.26Å; D1333-F1465 VanDerWaalsContact CA-CD1 3.43Å; D1333-F1465 WeakPolarHBondContact O-CD1 3.2Å; D1333-F1465 PolarHBondContact OD1-N 2.72Å; D1333-N1466 PolarHBondContact OD1-ND2 3.2Å; D1333-N1466 PolarHBondContact OD1-OD1 2.93Å; D1333-N1466 PolarHBondContact OD2-ND2 3.18Å; D1333-N1466 PolarHBondContact OD2-OD1 3.45Å
1334	Q	28.1	Very low	26.1	Very low	74 Å²	74	103 Å²	103	35%	0.346	55%	0.551	S	S	.	*				163.5	50.7	-94.9	158.9	85.5	42.6	0	0	128.5	Y1463 P1464 F1465	Q1334-Y1463 HydrophobicContact CB-CD1 3.91Å; Q1334-Y1463 VanDerWaalsContact OE1-CD1 3.27Å; Q1334-P1464 CarbonylContact C-O 3.56Å; Q1334-P1464 CarbonylContact O-C 3.22Å; Q1334-P1464 VanDerWaalsContact O-C 3.22Å; Q1334-F1465 VanDerWaalsContact CA-CA 3.48Å; Q1334-F1465 VanDerWaalsContact CA-CG 3.49Å; Q1334-F1465 HydrophobicContact CB-CB 4.33Å; Q1334-F1465 HydrophobicContact CB-CD1 3.6Å; Q1334-F1465 HydrophobicContact CB-CD2 3.88Å; Q1334-F1465 HydrophobicContact CB-CE1 3.92Å; Q1334-F1465 HydrophobicContact CB-CE2 4.16Å; Q1334-F1465 HydrophobicContact CB-CG 3.52Å; Q1334-F1465 HydrophobicContact CB-CZ 4.16Å; Q1334-F1465 HydrophobicContact CG-CB 4.37Å; Q1334-F1465 HydrophobicContact CG-CD1 3.88Å; Q1334-F1465 HydrophobicContact CG-CD2 3.18Å; Q1334-F1465 HydrophobicContact CG-CE1 4.03Å; Q1334-F1465 HydrophobicContact CG-CE2 3.34Å; Q1334-F1465 HydrophobicContact CG-CG 3.42Å; Q1334-F1465 VanDerWaalsContact CG-CG 3.42Å; Q1334-F1465 HydrophobicContact CG-CZ 3.76Å; Q1334-F1465 VanDerWaalsContact N-N 3.16Å; Q1334-F1465 WeakPolarHBondContact O-CA 3.35Å
1335	S	24.9	Very low	26.1	Very low	42 Å²	42	106 Å²	106	29%	0.294	56%	0.559	S	S	.	*			trans	111.2	143.7	167.6	-78.7	0	0	0	0	122.4	Y1463 P1464	S1335-Y1463 VanDerWaalsContact C-CA 3.49Å; S1335-P1464 VanDerWaalsContact N-N 3.12Å; S1335-P1464 WeakPolarHBondContact O-CD 3.08Å
1336	S	25.5	Very low	26	Very low	63 Å²	63	106.1 Å²	106.1	44%	0.441	57%	0.569	S	S	.	*			cis	179.6	131.8	-9.3	57	0	0	0	0	119	L1461	S1336-L1461 CarbonylContact C-O 3.59Å
1337	S	25.3	Very low	25.9	Very low	65 Å²	65	102.6 Å²	102.6	46%	0.455	56%	0.563	S	S	.	*			trans	62.5	159	140.3	71.4	0	0	0	0	126.5	L1461	S1337-L1461 PolarHBondContact N-O 3.13Å
1338	I	24.8	Very low	25.9	Very low	89 Å²	89	103.9 Å²	103.9	46%	0.456	58%	0.575	S	S	.	*			trans	136.6	131	143.9	-71.3	174.2	0	0	0	117.9	L1458 R1459 H1460	I1338-L1458 HydrophobicContact CG2-CD2 4.45Å; I1338-R1459 CarbonylContact O-C 3.6Å; I1338-H1460 VanDerWaalsContact O-CA 3.22Å; I1338-H1460 WeakPolarHBondContact O-CA 3.36Å; I1338-H1460 WeakPolarHBondContact O-CB 3.46Å; I1338-H1460 PolarHBondContact O-CD2 3.05Å; I1338-H1460 PolarHBondContact O-CE1 2.74Å; I1338-H1460 PolarHBondContact O-N 3.15Å; I1338-H1460 PolarHBondContact O-ND1 2.74Å; I1338-H1460 PolarHBondContact O-NE2 2.8Å
1339	Y	24.3	Very low	25.7	Very low	188 Å²	188	102.6 Å²	102.6	74%	0.737	57%	0.569	S	S	*	*			trans	-83.7	173.8	-160.9	-119.7	-98.6	0	0	0	120
1340	S	25.5	Very low	25.7	Very low	60 Å²	60	103.9 Å²	103.9	42%	0.42	58%	0.575	S	S	.	*			trans	79.5	151	144.1	68.4	0	0	0	0	123.1	R1459	S1340-R1459 PolarHBondContact O-NE 3.49Å; S1340-R1459 PolarHBondContact O-NH2 3.17Å
1341	H	24.2	Very low	25.7	Very low	141 Å²	141	108.5 Å²	108.5	65%	0.653	60%	0.599	S	S	*	*			trans	84.4	146.3	-177.1	-67.1	-82	0	0	0	119.6	R1459	H1341-R1459 PolarHBondContact O-NH2 3.16Å
1342	I	24.9	Very low	25.7	Very low	127 Å²	127	108.7 Å²	108.7	65%	0.651	61%	0.605	S	S	*	*			cis	173.7	139.2	-42.2	-101.8	163.9	0	0	0	108.7
1343	D	24.8	Very low	25.7	Very low	139 Å²	139	114.8 Å²	114.8	74%	0.743	63%	0.632	S	S	*	*			trans	48.1	153	159.7	-58.9	-10.5	0	0	0	124
1344	S	23.9	Very low	25.9	Very low	111 Å²	111	119.9 Å²	119.9	78%	0.776	65%	0.65	S	S	*	*			trans	55.4	101.9	150.7	58.8	0	0	0	0	119.8	S1346	S1344-S1346 PolarHBondContact O-N 2.99Å
1345	D	25.4	Very low	25.7	Very low	162 Å²	162	123.3 Å²	123.3	87%	0.866	67%	0.666	S	S	*	*			trans	-77.4	108.4	156.6	-92.9	-49.8	0	0	0	111.4
1346	S	25.4	Very low	25.8	Very low	114 Å²	114	127.8 Å²	127.8	80%	0.797	69%	0.686	S	S	*	*			trans	-116.9	128.9	141	63.5	0	0	0	0	107.3	S1344	S1344-S1346 PolarHBondContact O-N 2.99Å
1347	T	27.8	Very low	25.7	Very low	115 Å²	115	129.8 Å²	129.8	71%	0.706	69%	0.691	S	S	*	*			trans	-86.5	141.8	-142.6	48.6	0	0	0	0	117.5
1348	V	28.1	Very low	25.8	Very low	126 Å²	126	134.2 Å²	134.2	76%	0.764	70%	0.698	S	S	*	*			trans	92.2	118	134.5	159.4	0	0	0	0	121.4
1349	N	25.9	Very low	25.9	Very low	117 Å²	117	137.3 Å²	137.3	63%	0.626	71%	0.709	S	S	*	*			trans	82.1	112	147.4	-76.1	32.5	0	0	0	125.8
1350	E	24.4	Very low	26	Very low	162 Å²	162	131.4 Å²	131.4	76%	0.757	69%	0.69	S	S	*	*				74.6	106.6	124.2	-65	176.5	143	0	0	122.8
1351	L	26.9	Very low	26.1	Very low	168 Å²	168	131.5 Å²	131.5	88%	0.88	69%	0.691	S	S	*	*				177.6	139.7	107.2	-94.9	155.4	0	0	0	115.1
1352	S	27.2	Very low	26.2	Very low	94 Å²	94	131 Å²	131	66%	0.657	70%	0.698	S	S	*	*			trans	12.2	124.1	160.1	53.6	0	0	0	0	121.7
1353	Q	25.5	Very low	26.3	Very low	169 Å²	169	133.6 Å²	133.6	79%	0.79	71%	0.712	S	S	*	*				75.6	118.2	65.5	-75.9	-169.9	-13.9	0	0	118
1354	F	30.4	Very low	26.3	Very low	192 Å²	192	131.9 Å²	131.9	84%	0.842	71%	0.711	S	S	*	*				173.1	-174.5	116.5	-106.7	-80.6	0	0	0	114.7
1355	H	25.7	Very low	26.7	Very low	146 Å²	146	131.6 Å²	131.6	68%	0.676	71%	0.706	S	S	*	*			trans	-133.1	158.4	-150.8	-100.4	-82.2	0	0	0	117.4
1356	L	25.2	Very low	26.8	Very low	136 Å²	136	129.8 Å²	129.8	71%	0.712	70%	0.701	S	S	*	*			trans	70.1	116.1	140.5	-75.3	163.6	0	0	0	124.6
1357	N	25	Very low	26.9	Very low	104 Å²	104	130.2 Å²	130.2	56%	0.556	70%	0.699	S	S	*	*				55.9	116.5	125.6	-85.7	-20.1	0	0	0	124.6
1358	R	26.2	Very low	26.8	Very low	159 Å²	159	131.7 Å²	131.7	60%	0.6	70%	0.702	S	S	*	*				70.6	111.2	118.1	-163.9	-170.6	-167.1	177.7	5	120.8
1359	F	26.4	Very low	26.7	Very low	154 Å²	154	129.4 Å²	129.4	68%	0.675	69%	0.692	S	S	*	*				-178.7	173.8	111.3	-103.4	-67.8	0	0	0	113.2
1360	N	27.1	Very low	26.6	Very low	64 Å²	64	130.5 Å²	130.5	34%	0.342	70%	0.698	S	S	.	*			trans	-133.3	158.2	-176.3	-86.8	-90.6	0	0	0	109.7	F1451 Y1452 T1453	N1360-F1451 HydrophobicContact CB-CB 4.13Å; N1360-Y1452 HydrophobicContact CB-CD2 3.99Å; N1360-Y1452 VanDerWaalsContact CG-CD2 3.41Å; N1360-Y1452 WeakPolarHBondContact ND2-CB 3.47Å; N1360-Y1452 PolarHBondContact ND2-O 3.29Å; N1360-Y1452 VanDerWaalsContact ND2-O 3.13Å; N1360-Y1452 VanDerWaalsContact OD1-CD2 3.26Å; N1360-Y1452 WeakPolarHBondContact OD1-CD2 3.22Å; N1360-T1453 PolarHBondContact ND2-OG1 3.44Å
1361	S	28.1	Very low	26.8	Very low	62 Å²	62	133.7 Å²	133.7	43%	0.434	70%	0.704	S	S	.	*			cis	-163	179.6	-3.4	47.1	0	0	0	0	110.8
1362	T	25.8	Very low	26.6	Very low	131 Å²	131	131 Å²	131	80%	0.804	70%	0.699	S	S	*	*			trans	62.6	113	156.3	48.2	0	0	0	0	119.9
1363	L	27.7	Very low	26.7	Very low	180 Å²	180	130 Å²	130	94%	0.942	70%	0.704	S	S	*	*				-152.7	140.4	122.5	-111	167.9	0	0	0	109.5
1364	S	24.9	Very low	26.8	Very low	103 Å²	103	130.6 Å²	130.6	72%	0.72	71%	0.711	S	S	*	*			trans	-134.6	165.5	179.3	60.8	0	0	0	0	110.3
1365	P	31.1	Very low	26.7	Very low	106 Å²	106	124.5 Å²	124.5	69%	0.688	70%	0.702	S	S	*	*			trans	-139.4	135.8	150.2	35.1	-20.2	0	0	0	114.6
1366	T	28.1	Very low	26.9	Very low	124 Å²	124	126.9 Å²	126.9	76%	0.761	71%	0.711	S	S	*	*			trans	59.3	140.7	142.8	60.2	0	0	0	0	120.2
1367	T	27.9	Very low	27.1	Very low	123 Å²	123	127.3 Å²	127.3	76%	0.755	71%	0.714	S	S	*	*			cis	-172.6	170.5	-5.5	23.4	0	0	0	0	106.4
1368	L	26	Very low	27.1	Very low	146 Å²	146	129.2 Å²	129.2	76%	0.764	72%	0.723	S	S	*	*			cis	-153.4	173.9	7.8	-157	66.4	0	0	0	109.8
1369	S	25.4	Very low	27.1	Very low	78 Å²	78	129.4 Å²	129.4	55%	0.545	73%	0.734	S	S	.	*			trans	33.4	127.4	145.9	61.8	0	0	0	0	122.9
1370	D	24.1	Very low	27.1	Very low	140 Å²	140	127.8 Å²	127.8	75%	0.749	73%	0.733	S	S	*	*				44.2	121.1	127.2	-43.1	-34.3	0	0	0	121
1371	Y	28.4	Very low	26.9	Very low	229 Å²	229	129.4 Å²	129.4	90%	0.898	75%	0.749	S	S	*	*				-172.3	170.4	100.4	-114.8	-90.4	0	0	0	111.6
1372	S	23.6	Very low	26.7	Very low	110 Å²	110	133.4 Å²	133.4	77%	0.769	77%	0.765	S	S	*	*			trans	-105.6	153.2	-173.6	55.6	0	0	0	0	114.7
1373	G	27.5	Very low	26.7	Very low	74 Å²	74	134.6 Å²	134.6	76%	0.763	76%	0.762	S	S	*	*			trans	100.9	158.2	173.6	0	0	0	0	0	114.3
1374	I	29	Very low	26.6	Very low	181 Å²	181	131.7 Å²	131.7	93%	0.928	75%	0.747	S	S	*	*			cis	-147.5	147.1	1.4	-80.1	170.4	0	0	0	107.4
1375	G	28.3	Very low	26.8	Very low	65 Å²	65	133 Å²	133	67%	0.67	75%	0.745	S	S	*	*			trans	161.4	60.1	159.9	0	0	0	0	0	122.9
1376	K	29.8	Very low	26.7	Very low	195 Å²	195	134 Å²	134	85%	0.848	75%	0.745	S	S	*	*			trans	61.3	134.7	154.9	-59.1	177.7	-178.4	175	0	118
1377	N	28.9	Very low	26.7	Very low	146 Å²	146	134.3 Å²	134.3	78%	0.781	74%	0.742	S	S	*	*			cis	-148.3	148.5	-3.7	-86.8	-19.6	0	0	0	108.2
1378	I	24.7	Very low	26.8	Very low	144 Å²	144	135 Å²	135	74%	0.738	74%	0.742	S	S	*	*			trans	-142.4	136.2	175.7	-58.7	174.3	0	0	0	109.2
1379	L	26.6	Very low	27	Very low	162 Å²	162	134.6 Å²	134.6	85%	0.848	74%	0.74	S	S	*	*			trans	-173.2	127.7	142.4	-123.3	61.5	0	0	0	107.4
1380	N	25.2	Very low	27.1	Very low	121 Å²	121	138.4 Å²	138.4	65%	0.647	75%	0.751	S	S	*	*			cis	80.6	91	38	-67.8	3.6	0	0	0	115.8
1381	S	23.1	Very low	27.3	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	74%	0.743	S	S	*	*				49.2	132.3	121.2	66.6	0	0	0	0	123.1
1382	L	23.8	Very low	27.3	Very low	146 Å²	146	133.2 Å²	133.2	76%	0.764	74%	0.739	S	S	*	*			trans	88.8	109.2	143.2	-70.2	162.4	0	0	0	122.1
1383	Q	26.5	Very low	27.3	Very low	157 Å²	157	137.2 Å²	137.2	73%	0.734	74%	0.737	S	S	*	*			trans	71.3	120.8	131.1	-79.2	-177.3	-33.1	0	0	124.7
1384	N	26.4	Very low	27.3	Very low	119 Å²	119	143.1 Å²	143.1	64%	0.636	74%	0.742	S	S	*	*			trans	86.1	98.8	130.4	-69.4	7.4	0	0	0	123.1
1385	N	27.8	Very low	27.1	Very low	129 Å²	129	140.6 Å²	140.6	69%	0.69	73%	0.726	S	S	*	*				96.9	129	112.1	-71.6	1.7	0	0	0	123.5
1386	N	29.1	Very low	27.1	Very low	127 Å²	127	145.2 Å²	145.2	68%	0.679	73%	0.734	S	S	*	*			trans	92	89.9	141.5	-66.7	-1.6	0	0	0	121.7
1387	N	28.5	Very low	26.8	Very low	132 Å²	132	142.3 Å²	142.3	71%	0.706	73%	0.727	S	S	*	*				57.1	122	117.8	-58.7	-3.4	0	0	0	121
1388	N	29.9	Very low	26.6	Very low	138 Å²	138	145.5 Å²	145.5	74%	0.738	73%	0.728	S	S	*	*				-168.9	128.4	99.5	-100.6	-39.9	0	0	0	114.7
1389	N	30.8	Very low	26.6	Very low	136 Å²	136	145.9 Å²	145.9	73%	0.727	73%	0.731	S	S	*	*				46	136.8	122.4	-78.8	-4.7	0	0	0	121.6
1390	M	27.1	Very low	26.3	Very low	158 Å²	158	145 Å²	145	78%	0.778	73%	0.727	S	S	*	*			cis	-152.5	-161.5	-9.6	-61.4	-163	-70.2	0	0	107
1391	N	27.9	Very low	26.4	Very low	108 Å²	108	145 Å²	145	58%	0.578	74%	0.737	S	S	*	*			cis	-160.3	147.2	0.2	-169.2	20.2	0	0	0	110.5
1392	N	28.7	Very low	26.4	Very low	153 Å²	153	148.6 Å²	148.6	82%	0.818	74%	0.743	S	S	*	*				176.9	154.6	122.6	-93.1	-24	0	0	0	112.4
1393	R	24.9	Very low	26.8	Very low	193 Å²	193	146.7 Å²	146.7	73%	0.728	74%	0.739	S	S	*	*			trans	-119.1	157.5	-169.5	-63.2	-173.5	-177.9	-179.1	2.9	114.9	E1395	R1393-E1395 VanDerWaalsContact CD-OE1 3.3Å; R1393-E1395 WeakPolarHBondContact CD-OE1 3.4Å; R1393-E1395 IonicContact CZ-OE1 3.22Å; R1393-E1395 IonicContact NE-OE1 2.64Å; R1393-E1395 IonicContact NH1-OE1 2.69Å; R1393-E1395 PolarHBondContact NH1-OE1 2.85Å
1394	K	27	Very low	26.6	Very low	198 Å²	198	146 Å²	146	86%	0.861	75%	0.745	S	S	*	*			trans	-174.3	128.1	132.7	-101.2	164	-175.9	-177.4	0	106.8
1395	E	24.1	Very low	26.5	Very low	129 Å²	129	145.4 Å²	145.4	60%	0.603	75%	0.751	S	S	*	*			cis	59.1	118	48.4	-54.6	175.8	-163.7	0	0	109.6	R1393	R1393-E1395 VanDerWaalsContact CD-OE1 3.3Å; R1393-E1395 WeakPolarHBondContact CD-OE1 3.4Å; R1393-E1395 IonicContact CZ-OE1 3.22Å; R1393-E1395 IonicContact NE-OE1 2.64Å; R1393-E1395 IonicContact NH1-OE1 2.69Å; R1393-E1395 PolarHBondContact NH1-OE1 2.85Å
1396	I	28.6	Very low	26.2	Very low	161 Å²	161	147.1 Å²	147.1	83%	0.826	76%	0.759	S	S	*	*				-163.1	170.8	56.1	-78.5	169.5	0	0	0	108.4
1397	L	23.6	Very low	25.9	Very low	134 Å²	134	145.7 Å²	145.7	70%	0.702	76%	0.759	S	S	*	*			cis	173	129.9	-44.8	-148.7	175.2	0	0	0	107.6
1398	R	23.6	Very low	25.6	Very low	213 Å²	213	150 Å²	150	80%	0.804	77%	0.767	S	S	*	*			trans	68.3	163.5	171.5	-91.1	170.1	-159.7	-178.5	4.4	116.2
1399	D	24.6	Very low	25.2	Very low	152 Å²	152	149.1 Å²	149.1	81%	0.813	77%	0.766	S	S	*	*			cis	-126.5	171.5	28.3	-92.9	-49.2	0	0	0	117.9
1400	L	21.7	Very low	25	Very low	143 Å²	143	147.5 Å²	147.5	75%	0.749	77%	0.772	S	S	*	*			trans	-108	142.8	164	-79.1	78.7	0	0	0	110.2
1401	S	25.8	Very low	24.9	Very low	123 Å²	123	145.6 Å²	145.6	86%	0.86	76%	0.764	S	S	*	*			trans	-141.9	135	149.5	53.5	0	0	0	0	111.3
1402	Q	23.7	Very low	24.6	Very low	172 Å²	172	146 Å²	146	80%	0.804	78%	0.776	S	S	*	*			trans	-105.7	-176	172.6	-68.5	-175.1	-20.6	0	0	108.4
1403	P	31.7	Very low	24.5	Very low	105 Å²	105	144.6 Å²	144.6	68%	0.682	77%	0.767	S	S	*	*				-131	161.7	-57.2	36.1	-23.1	0	0	0	111.6
1404	T	22.5	Very low	24.3	Very low	142 Å²	142	146.1 Å²	146.1	87%	0.871	78%	0.775	S	S	*	*			trans	177.2	112.1	138.3	40.6	0	0	0	0	112.5
1405	S	24.4	Very low	24.2	Very low	107 Å²	107	141.6 Å²	141.6	75%	0.748	77%	0.765	S	S	*	*			trans	-166.8	124.8	145	56.1	0	0	0	0	109.2	S1407	S1405-S1407 PolarHBondContact O-N 2.89Å; S1405-S1407 VanDerWaalsContact O-N 3.16Å
1406	L	21.3	Very low	24.1	Very low	166 Å²	166	144.2 Å²	144.2	87%	0.869	78%	0.775	S	S	*	*			trans	-78.6	95.9	174.7	-81.3	71.9	0	0	0	109.3
1407	S	23.2	Very low	23.8	Very low	97 Å²	97	145 Å²	145	68%	0.678	78%	0.777	S	S	*	*			trans	-85.6	118.9	162.3	48.7	0	0	0	0	109.4	S1405 V1409	S1405-S1407 PolarHBondContact O-N 2.89Å; S1405-S1407 VanDerWaalsContact O-N 3.16Å; S1407-V1409 PolarHBondContact O-N 3.13Å
1408	Y	22.7	Very low	23.9	Very low	223 Å²	223	145.4 Å²	145.4	88%	0.875	78%	0.779	S	S	*	*			trans	-65.8	104.3	172	-97.4	-102.8	0	0	0	109.2	A1410	Y1408-A1410 PolarHBondContact O-N 2.81Å
1409	V	21.5	Very low	23.9	Very low	119 Å²	119	141.5 Å²	141.5	72%	0.721	77%	0.768	S	S	*	*			trans	-68	100.4	168.8	178.1	0	0	0	0	107.6	S1407 N1411	S1407-V1409 PolarHBondContact O-N 3.13Å; V1409-N1411 PolarHBondContact O-N 2.88Å
1410	A	25.5	Very low	23.8	Very low	101 Å²	101	139.7 Å²	139.7	84%	0.835	76%	0.764	S	S	*	*			trans	-74.7	65.8	179.7	0	0	0	0	0	111.7	Y1408 S1412	Y1408-A1410 PolarHBondContact O-N 2.81Å; A1410-S1412 PolarHBondContact O-N 2.78Å
1411	N	25.2	Very low	24	Very low	118 Å²	118	140 Å²	140	63%	0.631	77%	0.767	S	S	*	*			trans	5	98.6	158.7	-85.3	-20.8	0	0	0	116.4	V1409 I1413	V1409-N1411 PolarHBondContact O-N 2.88Å; N1411-I1413 HydrophobicContact CB-CD1 3.75Å; N1411-I1413 HydrophobicContact CB-CG1 3.91Å; N1411-I1413 PolarHBondContact O-N 2.76Å
1412	S	23	Very low	23.9	Very low	118 Å²	118	139 Å²	139	83%	0.825	75%	0.752	S	S	*	*			trans	-71.1	66.8	161.5	57.4	0	0	0	0	110.8	A1410 Y1414	A1410-S1412 PolarHBondContact O-N 2.78Å; S1412-Y1414 PolarHBondContact O-N 2.85Å
1413	I	25.1	Very low	23.9	Very low	123 Å²	123	139.5 Å²	139.5	63%	0.631	76%	0.759	S	S	*	*			trans	-80	109.8	177.3	-72.3	163.7	0	0	0	109.3	N1411 P1415	N1411-I1413 HydrophobicContact CB-CD1 3.75Å; N1411-I1413 HydrophobicContact CB-CG1 3.91Å; N1411-I1413 PolarHBondContact O-N 2.76Å; I1413-P1415 WeakPolarHBondContact O-CD 2.83Å
1414	Y	22.3	Very low	23.6	Very low	224 Å²	224	139.1 Å²	139.1	88%	0.878	75%	0.754	S	S	*	*			trans	-79.4	127.1	155	-84.3	-100.1	0	0	0	109.4	S1412	S1412-Y1414 PolarHBondContact O-N 2.85Å
1415	P	23.7	Very low	23.6	Very low	103 Å²	103	137.7 Å²	137.7	67%	0.669	75%	0.75	S	S	*	*			trans	-115.4	109.5	161.4	32.3	-18	0	0	0	111	I1413	I1413-P1415 WeakPolarHBondContact O-CD 2.83Å
1416	F	22.1	Very low	23.5	Very low	185 Å²	185	139.7 Å²	139.7	81%	0.811	75%	0.752	S	S	*	*			trans	28.8	106.4	152.4	-63.3	-88.1	0	0	0	119.4	I1418	F1416-I1418 HydrophobicContact CB-CG1 4.26Å; F1416-I1418 PolarHBondContact O-N 2.91Å
1417	M	23	Very low	24.1	Very low	177 Å²	177	136.6 Å²	136.6	87%	0.872	74%	0.741	S	S	*	*			trans	-68.9	108.5	148.2	-72.1	-174.2	74.6	0	0	109.3
1418	I	24.4	Very low	24.1	Very low	142 Å²	142	139 Å²	139	73%	0.728	75%	0.746	S	S	*	*			trans	-99.3	102.7	162.7	-61.1	-179.2	0	0	0	107.9	F1416 P1420	F1416-I1418 HydrophobicContact CB-CG1 4.26Å; F1416-I1418 PolarHBondContact O-N 2.91Å; I1418-P1420 VanDerWaalsContact O-CD 3.3Å; I1418-P1420 WeakPolarHBondContact O-CD 2.96Å
1419	K	24	Very low	24.1	Very low	132 Å²	132	135.4 Å²	135.4	57%	0.574	74%	0.741	S	S	*	*			trans	-80.1	116.7	155.9	-79.5	-170.8	175.4	-167.7	0	108.4	D1421 D1422	K1419-D1421 PolarHBondContact O-N 2.89Å; K1419-D1422 HydrophobicContact CD-CB 4.02Å; K1419-D1422 WeakPolarHBondContact CD-OD2 3.2Å; K1419-D1422 IonicContact NZ-OD2 2.65Å; K1419-D1422 PolarHBondContact NZ-OD2 2.87Å
1420	P	23.8	Very low	24.4	Very low	114 Å²	114	132.8 Å²	132.8	74%	0.74	74%	0.737	S	S	*	*	S	Bend	trans	-84.7	73.8	154	34.5	-28.7	0	0	0	108	I1418	I1418-P1420 VanDerWaalsContact O-CD 3.3Å; I1418-P1420 WeakPolarHBondContact O-CD 2.96Å
1421	D	24.3	Very low	24.5	Very low	150 Å²	150	133.9 Å²	133.9	80%	0.802	73%	0.729	S	S	*	*	S	Bend	trans	162.7	73.1	161.8	-84.6	-18.9	0	0	0	109.3	K1419	K1419-D1421 PolarHBondContact O-N 2.89Å
1422	D	25	Very low	24.6	Very low	102 Å²	102	135.7 Å²	135.7	55%	0.545	73%	0.734	S	S	.	*			trans	-170	86.3	158.4	-106.5	-32.5	0	0	0	108.6	K1419 V1424	K1419-D1422 HydrophobicContact CD-CB 4.02Å; K1419-D1422 WeakPolarHBondContact CD-OD2 3.2Å; K1419-D1422 IonicContact NZ-OD2 2.65Å; K1419-D1422 PolarHBondContact NZ-OD2 2.87Å; D1422-V1424 HydrophobicContact CB-CG2 4.46Å; D1422-V1424 PolarHBondContact O-N 3.38Å
1423	L	23.8	Very low	24.7	Very low	181 Å²	181	137 Å²	137	95%	0.948	73%	0.732	S	S	*	*			trans	-82.6	56.2	-178.2	-131	173.5	0	0	0	111.1	S1425	L1423-S1425 PolarHBondContact O-N 2.75Å
1424	V	24	Very low	24.9	Very low	97 Å²	97	136.1 Å²	136.1	59%	0.588	73%	0.734	S	S	*	*			trans	-83.4	106.7	180	-178	0	0	0	0	110.1	D1422 L1426	D1422-V1424 HydrophobicContact CB-CG2 4.46Å; D1422-V1424 PolarHBondContact O-N 3.38Å; V1424-L1426 HydrophobicContact CG1-CD1 4.17Å; V1424-L1426 PolarHBondContact O-N 2.92Å; V1424-L1426 VanDerWaalsContact O-N 3.15Å
1425	S	23.6	Very low	25	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	73%	0.727	S	S	*	*			trans	-69.1	105.2	165.2	56.8	0	0	0	0	110.1	L1423	L1423-S1425 PolarHBondContact O-N 2.75Å
1426	L	22.6	Very low	25.1	Very low	149 Å²	149	135.9 Å²	135.9	78%	0.78	74%	0.735	S	S	*	*			trans	-66.3	165.4	175.3	-100.1	90	0	0	0	113.1	V1424	V1424-L1426 HydrophobicContact CG1-CD1 4.17Å; V1424-L1426 PolarHBondContact O-N 2.92Å; V1424-L1426 VanDerWaalsContact O-N 3.15Å
1427	P	32.6	Very low	25.1	Very low	100 Å²	100	137.2 Å²	137.2	65%	0.649	74%	0.736	S	S	*	*			trans	-122.4	-125.4	-140.5	43.8	-30.9	0	0	0	113.9
1428	L	23.5	Very low	25.1	Very low	147 Å²	147	133.2 Å²	133.2	77%	0.77	73%	0.725	S	S	*	*			trans	83.9	139.7	173.5	-47.7	173.2	0	0	0	115
1429	I	24	Very low	25	Very low	149 Å²	149	133.2 Å²	133.2	76%	0.764	73%	0.725	S	S	*	*			cis	-152.7	148.9	-2.7	-118	160.9	0	0	0	111.6
1430	G	26.5	Very low	25.2	Very low	63 Å²	63	135.3 Å²	135.3	65%	0.649	74%	0.737	S	S	*	*			trans	90.8	145.1	147.4	0	0	0	0	0	119.5
1431	N	28.1	Very low	25.3	Very low	125 Å²	125	136 Å²	136	67%	0.668	74%	0.744	S	S	*	*			cis	-156.5	146.6	-5.8	-104.3	4.2	0	0	0	111.2
1432	Q	27.7	Very low	25.5	Very low	156 Å²	156	131.7 Å²	131.7	73%	0.729	74%	0.736	S	S	*	*			trans	49	111.2	145.9	-66.1	166	-32.9	0	0	119.2
1433	D	23.7	Very low	25.5	Very low	145 Å²	145	135 Å²	135	78%	0.775	75%	0.753	S	S	*	*				83.8	151.1	70.2	-77.7	-48.7	0	0	0	114
1434	P	31.1	Very low	25.7	Very low	104 Å²	104	133 Å²	133	68%	0.675	74%	0.742	S	S	*	*			cis	-133.4	165	12.9	41.9	-25.6	0	0	0	117.8
1435	I	23.5	Very low	25.7	Very low	146 Å²	146	134.6 Å²	134.6	75%	0.749	75%	0.752	S	S	*	*			trans	35.4	119.2	134.9	-52.8	165.3	0	0	0	117.1
1436	Q	25	Very low	25.8	Very low	176 Å²	176	133.7 Å²	133.7	82%	0.822	75%	0.746	S	S	*	*				-167.9	170.6	66.2	-151.1	162.2	5	0	0	115
1437	Y	22.9	Very low	25.9	Very low	214 Å²	214	133.1 Å²	133.1	84%	0.839	74%	0.743	S	S	*	*			trans	-50.3	159.6	160.7	-72	-97.5	0	0	0	113.6
1438	S	22.4	Very low	25.5	Very low	92 Å²	92	133.7 Å²	133.7	64%	0.643	75%	0.745	S	S	*	*			cis	-173.9	159.2	-0.6	44.2	0	0	0	0	112.8
1439	I	23.8	Very low	25.6	Very low	142 Å²	142	133.4 Å²	133.4	73%	0.728	74%	0.744	S	S	*	*			trans	60.4	120.2	142.7	-69.9	168.7	0	0	0	120.2
1440	Q	27.6	Very low	25.6	Very low	177 Å²	177	130.8 Å²	130.8	83%	0.827	74%	0.739	S	S	*	*			trans	42.4	134.4	145.2	-62.2	173.6	-36.7	0	0	123
1441	S	25.9	Very low	25.3	Very low	127 Å²	127	134.5 Å²	134.5	89%	0.888	74%	0.738	S	S	*	*			trans	-170.6	159	130.6	24.4	0	0	0	0	108.9
1442	G	27.4	Very low	25.1	Very low	61 Å²	61	135.1 Å²	135.1	63%	0.629	73%	0.732	S	S	*	*			cis	133.9	160.1	2.2	0	0	0	0	0	111
1443	L	26.9	Very low	24.8	Very low	171 Å²	171	131 Å²	131	90%	0.895	72%	0.717	S	S	*	*			trans	-157.4	147.3	167.1	-92.9	118.2	0	0	0	111.9
1444	I	26.4	Very low	24.6	Very low	140 Å²	140	128.9 Å²	128.9	72%	0.718	71%	0.709	S	S	*	*			cis	-145.8	137.5	-45.9	-80.9	-167.7	0	0	0	105.5
1445	T	25.5	Very low	24.2	Very low	129 Å²	129	129.6 Å²	129.6	79%	0.791	71%	0.712	S	S	*	*			trans	161.9	167.2	153.3	30.1	0	0	0	0	110.3
1446	S	24.7	Very low	24.6	Very low	95 Å²	95	128 Å²	128	66%	0.664	71%	0.711	S	S	*	*				179.4	140.3	-52.1	54.9	0	0	0	0	110.4
1447	D	24.9	Very low	24.8	Very low	137 Å²	137	124.2 Å²	124.2	73%	0.733	70%	0.702	S	S	*	*			cis	-165.9	168.5	-26.4	-137.2	-61.9	0	0	0	111.8
1448	T	24.5	Very low	24.8	Very low	112 Å²	112	118.9 Å²	118.9	69%	0.687	69%	0.687	S	S	*	*			trans	65.6	137.9	164.4	62.6	0	0	0	0	122.1
1449	N	25.7	Very low	24.9	Very low	140 Å²	140	120.8 Å²	120.8	75%	0.749	68%	0.68	S	S	*	*			trans	84.3	88.2	147.4	-62.5	-13.5	0	0	0	123.8
1450	S	22.6	Very low	24.8	Very low	95 Å²	95	118.5 Å²	118.5	66%	0.664	67%	0.666	S	S	*	*				88.4	128.8	111.5	72.9	0	0	0	0	125.4
1451	F	21.5	Very low	24.7	Very low	141 Å²	141	116.2 Å²	116.2	62%	0.618	66%	0.659	S	S	*	*			trans	78.4	170.2	145.2	-72.2	-52.1	0	0	0	124.2	N1360	N1360-F1451 HydrophobicContact CB-CB 4.13Å
1452	Y	22.5	Very low	24.5	Very low	138 Å²	138	118.1 Å²	118.1	54%	0.541	65%	0.654	S	S	.	*				-93	176.9	-127.4	-33.3	-136.6	0	0	0	120.6	N1360	N1360-Y1452 HydrophobicContact CB-CD2 3.99Å; N1360-Y1452 VanDerWaalsContact CG-CD2 3.41Å; N1360-Y1452 WeakPolarHBondContact ND2-CB 3.47Å; N1360-Y1452 PolarHBondContact ND2-O 3.29Å; N1360-Y1452 VanDerWaalsContact ND2-O 3.13Å; N1360-Y1452 VanDerWaalsContact OD1-CD2 3.26Å; N1360-Y1452 WeakPolarHBondContact OD1-CD2 3.22Å
1453	T	21.6	Very low	24.5	Very low	69 Å²	69	122 Å²	122	42%	0.423	65%	0.65	S	S	.	*			trans	99.3	115.2	133.5	45.4	0	0	0	0	123.2	N1360	N1360-T1453 PolarHBondContact ND2-OG1 3.44Å
1454	T	21.3	Very low	24.5	Very low	100 Å²	100	117.3 Å²	117.3	61%	0.613	63%	0.631	S	S	*	*			trans	66.9	117.1	130	58.8	0	0	0	0	124.9
1455	V	21.6	Very low	24.4	Very low	119 Å²	119	116.1 Å²	116.1	72%	0.721	62%	0.62	S	S	*	*				79.8	125.5	129.9	178.7	0	0	0	0	120
1456	P	32.1	Very low	24.3	Very low	112 Å²	112	115 Å²	115	73%	0.727	61%	0.609	S	S	*	*			trans	-94.4	-155	177.3	44.5	-40.6	0	0	0	111.4
1457	P	29.8	Very low	24.6	Very low	98 Å²	98	112.9 Å²	112.9	64%	0.636	60%	0.603	S	S	*	*			cis	-141.8	-161.6	2.2	33.9	-7.1	0	0	0	116.7
1458	L	22.4	Very low	24.9	Very low	101 Å²	101	110.4 Å²	110.4	53%	0.529	59%	0.59	S	S	.	*			trans	73.4	163.5	163.6	-58.8	-176.1	0	0	0	117.6	I1338	I1338-L1458 HydrophobicContact CG2-CD2 4.45Å
1459	R	24.1	Very low	25	Very low	132 Å²	132	109.2 Å²	109.2	50%	0.498	58%	0.579	S	S	.	*			cis	-153.4	170.2	-1.4	-128.9	-76.7	-174.5	105.3	1.9	110.5	I1338 S1340 H1341	I1338-R1459 CarbonylContact O-C 3.6Å; S1340-R1459 PolarHBondContact O-NE 3.49Å; S1340-R1459 PolarHBondContact O-NH2 3.17Å; H1341-R1459 PolarHBondContact O-NH2 3.16Å
1460	H	22.8	Very low	25.2	Very low	94 Å²	94	105.3 Å²	105.3	44%	0.435	56%	0.561	S	S	.	*			trans	-37.2	132.8	-179.8	-72.2	-76.5	0	0	0	117.8	I1338	I1338-H1460 VanDerWaalsContact O-CA 3.22Å; I1338-H1460 WeakPolarHBondContact O-CA 3.36Å; I1338-H1460 WeakPolarHBondContact O-CB 3.46Å; I1338-H1460 PolarHBondContact O-CD2 3.05Å; I1338-H1460 PolarHBondContact O-CE1 2.74Å; I1338-H1460 PolarHBondContact O-N 3.15Å; I1338-H1460 PolarHBondContact O-ND1 2.74Å; I1338-H1460 PolarHBondContact O-NE2 2.8Å
1461	L	23.8	Very low	25.4	Very low	129 Å²	129	107 Å²	107	68%	0.675	56%	0.56	S	S	*	*				-163.2	-171.7	116.8	-111.7	165.7	0	0	0	112.5	S1336 S1337	S1336-L1461 CarbonylContact C-O 3.59Å; S1337-L1461 PolarHBondContact N-O 3.13Å
1462	Q	21.9	Very low	25.8	Very low	167 Å²	167	107 Å²	107	78%	0.78	57%	0.566	S	S	*	*			trans	-85.7	-173.3	-177.1	-73.1	162.2	-83.1	0	0	113.4
1463	Y	27.2	Very low	26.1	Very low	142 Å²	142	105 Å²	105	56%	0.557	57%	0.572	S	S	*	*			trans	-85.2	133.9	-161.7	-86.4	-137.6	0	0	0	116.9	Q1334 S1335	Q1334-Y1463 HydrophobicContact CB-CD1 3.91Å; Q1334-Y1463 VanDerWaalsContact OE1-CD1 3.27Å; S1335-Y1463 VanDerWaalsContact C-CA 3.49Å
1464	P	28.4	Very low	26.4	Very low	74 Å²	74	108.5 Å²	108.5	48%	0.481	59%	0.588	S	S	.	*			trans	-138.2	145.7	148.9	7.6	20.1	0	0	0	119.1	D1333 Q1334 S1335	D1333-P1464 HydrophobicContact CB-CB 4.06Å; D1333-P1464 WeakPolarHBondContact OD1-CA 3.48Å; D1333-P1464 WeakPolarHBondContact OD1-CB 3.26Å; Q1334-P1464 CarbonylContact C-O 3.56Å; Q1334-P1464 CarbonylContact O-C 3.22Å; Q1334-P1464 VanDerWaalsContact O-C 3.22Å; S1335-P1464 VanDerWaalsContact N-N 3.12Å; S1335-P1464 WeakPolarHBondContact O-CD 3.08Å
1465	F	23.3	Very low	26.6	Very low	114 Å²	114	108.9 Å²	108.9	50%	0.5	59%	0.586	S	S	.	*			trans	-85	-122.4	-162.9	-90.6	121.5	0	0	0	115.5	D1333 Q1334	D1333-F1465 VanDerWaalsContact CA-CD1 3.43Å; D1333-F1465 WeakPolarHBondContact O-CD1 3.2Å; D1333-F1465 PolarHBondContact OD1-N 2.72Å; Q1334-F1465 VanDerWaalsContact CA-CA 3.48Å; Q1334-F1465 VanDerWaalsContact CA-CG 3.49Å; Q1334-F1465 HydrophobicContact CB-CB 4.33Å; Q1334-F1465 HydrophobicContact CB-CD1 3.6Å; Q1334-F1465 HydrophobicContact CB-CD2 3.88Å; Q1334-F1465 HydrophobicContact CB-CE1 3.92Å; Q1334-F1465 HydrophobicContact CB-CE2 4.16Å; Q1334-F1465 HydrophobicContact CB-CG 3.52Å; Q1334-F1465 HydrophobicContact CB-CZ 4.16Å; Q1334-F1465 HydrophobicContact CG-CB 4.37Å; Q1334-F1465 HydrophobicContact CG-CD1 3.88Å; Q1334-F1465 HydrophobicContact CG-CD2 3.18Å; Q1334-F1465 HydrophobicContact CG-CE1 4.03Å; Q1334-F1465 HydrophobicContact CG-CE2 3.34Å; Q1334-F1465 HydrophobicContact CG-CG 3.42Å; Q1334-F1465 VanDerWaalsContact CG-CG 3.42Å; Q1334-F1465 HydrophobicContact CG-CZ 3.76Å; Q1334-F1465 VanDerWaalsContact N-N 3.16Å; Q1334-F1465 WeakPolarHBondContact O-CA 3.35Å
1466	N	24.4	Very low	26.9	Very low	105 Å²	105	110.5 Å²	110.5	56%	0.561	59%	0.586	S	S	*	*			cis	-130	140.2	24.7	-79.2	-28.5	0	0	0	116.5	N1332 D1333	N1332-N1466 HydrophobicContact CB-CB 4.37Å; N1332-N1466 WeakPolarHBondContact CB-OD1 3.43Å; N1332-N1466 VanDerWaalsContact CG-OD1 3.24Å; N1332-N1466 WeakPolarHBondContact ND2-CB 3.42Å; D1333-N1466 PolarHBondContact OD1-ND2 3.2Å; D1333-N1466 PolarHBondContact OD1-OD1 2.93Å; D1333-N1466 PolarHBondContact OD2-ND2 3.18Å; D1333-N1466 PolarHBondContact OD2-OD1 3.45Å
1467	G	30.8	Very low	26.5	Very low	52 Å²	52	112 Å²	112	54%	0.536	59%	0.588	S	S	.	*	S	Bend	trans	-161.6	-19.6	-169.6	0	0	0	0	0	121.2	N1332	N1332-G1467 PolarHBondContact OD1-N 3.32Å
1468	N	30.1	Very low	26.3	Very low	85 Å²	85	112 Å²	112	46%	0.455	60%	0.596	S	S	.	*			trans	65.6	109.5	179.2	-50.5	-62.2	0	0	0	115.5	L1330 T1331 N1332	L1330-N1468 HydrophobicContact CD2-CB 3.92Å; L1330-N1468 WeakPolarHBondContact CD2-OD1 3.42Å; T1331-N1468 WeakPolarHBondContact CA-OD1 3.48Å; T1331-N1468 WeakPolarHBondContact CG2-OD1 3.19Å; T1331-N1468 PolarHBondContact N-OD1 3.29Å; N1332-N1468 PolarHBondContact ND2-OD1 2.82Å; N1332-N1468 PolarHBondContact OD1-N 3.21Å
1469	L	27.6	Very low	26.5	Very low	87 Å²	87	114.9 Å²	114.9	46%	0.455	61%	0.612	S	S	.	*			cis	59.1	125.8	45.4	-101.4	175.3	0	0	0	114.4	N1332	N1332-L1469 VanDerWaalsContact N-CD1 3.26Å
1470	P	30.4	Very low	26.5	Very low	57 Å²	57	115.4 Å²	115.4	37%	0.37	62%	0.624	S	S	.	*				-146.2	161.4	82.1	37	-19	0	0	0	118.8	Q1329	Q1329-P1470 VanDerWaalsContact N-CG 3.33Å; Q1329-P1470 WeakPolarHBondContact O-CB 3.21Å
1471	M	26.9	Very low	26.6	Very low	130 Å²	130	119 Å²	119	64%	0.64	64%	0.641	S	S	*	*			trans	25.9	137.9	145	-47.9	-60.8	-175.4	0	0	119.5
1472	N	28.5	Very low	26.5	Very low	141 Å²	141	120.7 Å²	120.7	75%	0.754	65%	0.65	S	S	*	*			cis	-175.2	169.5	-2.6	-107	-14.2	0	0	0	106.4
1473	S	28.6	Very low	26.5	Very low	96 Å²	96	119.4 Å²	119.4	67%	0.671	64%	0.642	S	S	*	*			cis	-164.8	-166.5	-13.8	50.2	0	0	0	0	105.7
1474	L	27.7	Very low	26.3	Very low	143 Å²	143	121 Å²	121	75%	0.749	66%	0.656	S	S	*	*			cis	-156	167.4	6.7	-164.2	61.7	0	0	0	109.7
1475	D	27.3	Very low	26	Very low	108 Å²	108	123.1 Å²	123.1	58%	0.578	67%	0.673	S	S	*	*			trans	4.7	127.3	159.9	-62	-20.3	0	0	0	121.8
1476	Q	26.5	Very low	26	Very low	153 Å²	153	123 Å²	123	72%	0.715	68%	0.681	S	S	*	*				73.9	143.3	63	-69.7	-177.4	72.5	0	0	113.4
1477	N	25.2	Very low	25.9	Very low	143 Å²	143	124 Å²	124	77%	0.765	69%	0.687	S	S	*	*			cis	-159.3	167.8	-2.4	-121.8	-23.6	0	0	0	109.7
1478	A	25.6	Very low	25.7	Very low	99 Å²	99	129 Å²	129	82%	0.818	70%	0.696	S	S	*	*			trans	-156.1	119.5	173.3	0	0	0	0	0	116.4
1479	L	26.4	Very low	25.4	Very low	162 Å²	162	131 Å²	131	85%	0.848	70%	0.703	S	S	*	*			trans	-168.9	121.3	147.5	-166.8	72.2	0	0	0	112.4
1480	N	24.1	Very low	25.3	Very low	142 Å²	142	135.6 Å²	135.6	76%	0.759	72%	0.715	S	S	*	*			trans	171.8	148.8	133.2	-96.5	-34.7	0	0	0	116.5
1481	Q	24.9	Very low	25	Very low	171 Å²	171	138.2 Å²	138.2	80%	0.799	73%	0.726	S	S	*	*			trans	66.4	97.8	152	-67.7	-179.4	4.1	0	0	124.2
1482	L	21.9	Very low	24.9	Very low	163 Å²	163	138.6 Å²	138.6	85%	0.853	73%	0.73	S	S	*	*				49.3	141.2	113	-74.7	168.1	0	0	0	126.7
1483	K	21	Very low	24.9	Very low	141 Å²	141	139.9 Å²	139.9	61%	0.613	73%	0.732	S	S	*	*			trans	74.3	164.8	155.8	-76.2	-168.4	178.4	-173.7	0	120.2	D567	D567-K1483 IonicContact OD1-NZ 2.76Å; D567-K1483 PolarHBondContact OD1-NZ 2.93Å; D567-K1483 IonicContact OD2-NZ 2.66Å; D567-K1483 PolarHBondContact OD2-NZ 2.88Å
1484	M	22.2	Very low	24.7	Very low	174 Å²	174	140.9 Å²	140.9	86%	0.857	73%	0.734	S	S	*	*			trans	-114.8	167.8	-149.3	-64.4	166	53.3	0	0	115.5
1485	S	22.3	Very low	24.6	Very low	120 Å²	120	140.9 Å²	140.9	84%	0.839	73%	0.734	S	S	*	*			trans	-148.4	179.9	152.7	67.4	0	0	0	0	112.2
1486	V	23.6	Very low	24.5	Very low	111 Å²	111	142.2 Å²	142.2	67%	0.673	74%	0.739	S	S	*	*			trans	-142.6	152.3	-149.6	160.2	0	0	0	0	115.2
1487	N	22.5	Very low	24.4	Very low	126 Å²	126	142.4 Å²	142.4	67%	0.674	74%	0.74	S	S	*	*			trans	88.8	113.7	161.4	-79.1	-19	0	0	0	122.9
1488	H	26.8	Very low	24.3	Very low	158 Å²	158	143.8 Å²	143.8	73%	0.731	74%	0.742	S	S	*	*				65.2	146.8	128.6	-68.6	-23.6	0	0	0	121.6
1489	Q	24.1	Very low	24.4	Very low	127 Å²	127	144 Å²	144	59%	0.593	74%	0.738	S	S	*	*			cis	-160.5	149.5	-0.3	-117	-171.7	-94.7	0	0	111.4
1490	Y	25.3	Very low	24.5	Very low	183 Å²	183	144 Å²	144	72%	0.718	74%	0.738	S	S	*	*			trans	64.9	122.8	153.8	-83.1	-109.3	0	0	0	123.3
1491	N	24.5	Very low	24.4	Very low	112 Å²	112	144.4 Å²	144.4	60%	0.599	74%	0.74	S	S	*	*				48.9	141.5	124.1	-60.6	49.7	0	0	0	120.8
1492	D	24.5	Very low	24.4	Very low	137 Å²	137	143.3 Å²	143.3	73%	0.733	74%	0.738	S	S	*	*			cis	-159.3	-178.6	-0.2	-110.6	-23.3	0	0	0	111.8
1493	E	27.6	Very low	24.5	Very low	169 Å²	169	143.8 Å²	143.8	79%	0.79	73%	0.733	S	S	*	*			trans	81.5	100.3	165.1	-56.2	-153.6	142.7	0	0	120.7
1494	T	25.1	Very low	24.8	Very low	116 Å²	116	143.5 Å²	143.5	71%	0.712	74%	0.738	S	S	*	*			trans	79.8	130.7	132.8	62.8	0	0	0	0	123
1495	I	25.5	Very low	24.8	Very low	144 Å²	144	141.5 Å²	141.5	74%	0.738	73%	0.73	S	S	*	*			trans	73.1	106	141.4	-66.1	166.1	0	0	0	118.8
1496	I	25.4	Very low	25.1	Very low	135 Å²	135	142.8 Å²	142.8	69%	0.692	72%	0.723	S	S	*	*			trans	60.5	111.4	139	-58.1	177.8	0	0	0	119.1
1497	Q	24.1	Very low	25.2	Very low	158 Å²	158	143.6 Å²	143.6	74%	0.738	72%	0.723	S	S	*	*			trans	56.7	109.8	149.3	-63.9	173.9	-72.9	0	0	121
1498	Q	23.7	Very low	25.5	Very low	172 Å²	172	143.6 Å²	143.6	80%	0.804	72%	0.717	S	S	*	*			trans	76.5	157.5	139.8	-61.6	175	-84.3	0	0	120.3
1499	S	26.1	Very low	25.6	Very low	104 Å²	104	142.2 Å²	142.2	73%	0.727	72%	0.715	S	S	*	*			trans	73	115.5	171.6	25.1	0	0	0	0	120.6
1500	D	29.2	Very low	25.8	Very low	160 Å²	160	145.2 Å²	145.2	86%	0.856	72%	0.721	S	S	*	*			trans	81.8	158.9	133.1	-56.6	-8.6	0	0	0	122.8
1501	L	22.5	Very low	25.9	Very low	151 Å²	151	142.1 Å²	142.1	79%	0.791	72%	0.717	S	S	*	*			trans	-129.7	149.5	-161	-87.5	113.8	0	0	0	112.7
1502	I	25.3	Very low	26.1	Very low	149 Å²	149	145 Å²	145	76%	0.764	73%	0.727	S	S	*	*			trans	71.6	149.8	147.5	-75.5	166.1	0	0	0	117.3
1503	K	24.3	Very low	26.1	Very low	172 Å²	172	141.6 Å²	141.6	75%	0.748	72%	0.724	S	S	*	*			cis	179.9	150.4	-31.4	-155	170.7	-170.6	170.8	0	107.3
1504	N	25.6	Very low	26	Very low	135 Å²	135	142 Å²	142	72%	0.722	72%	0.723	S	S	*	*			trans	148	135.4	143.9	-75.3	-26.1	0	0	0	111.5
1505	L	23.9	Very low	26.1	Very low	133 Å²	133	146.9 Å²	146.9	70%	0.696	73%	0.731	S	S	*	*			cis	86.3	106.5	38.5	-162.8	-167.5	0	0	0	112.7
1506	Q	27.9	Very low	26.1	Very low	147 Å²	147	142.9 Å²	142.9	69%	0.687	73%	0.725	S	S	*	*			trans	-146.1	126.9	153.3	-75.5	-144.2	-12.3	0	0	107.8	F1508	Q1506-F1508 HydrophobicContact CB-CE2 4.49Å; Q1506-F1508 VanDerWaalsContact OE1-CZ 3.27Å
1507	L	26.3	Very low	26.1	Very low	128 Å²	128	141.5 Å²	141.5	67%	0.67	73%	0.727	S	S	*	*				75.5	152.1	71.7	-68.2	164.4	0	0	0	111.6
1508	F	28.1	Very low	26.1	Very low	125 Å²	125	141.3 Å²	141.3	55%	0.548	73%	0.731	S	S	.	*			cis	-139.1	179.4	31.4	-75	-99.1	0	0	0	111.1	Q1506	Q1506-F1508 HydrophobicContact CB-CE2 4.49Å; Q1506-F1508 VanDerWaalsContact OE1-CZ 3.27Å
1509	N	29.7	Very low	26.5	Very low	129 Å²	129	138.8 Å²	138.8	69%	0.69	73%	0.73	S	S	*	*			cis	-156.2	156.9	16.1	-115.3	-19.4	0	0	0	107
1510	R	28	Very low	26.4	Very low	190 Å²	190	142.2 Å²	142.2	72%	0.717	74%	0.739	S	S	*	*			cis	-171.8	179.3	-24.3	-139	-175.4	178.2	162	-0.8	108.6
1511	N	26.9	Very low	26.3	Very low	118 Å²	118	141.8 Å²	141.8	63%	0.631	74%	0.737	S	S	*	*			trans	71.1	156.8	155.5	-70.8	18	0	0	0	117.3
1512	Q	28	Very low	26.3	Very low	172 Å²	172	145.1 Å²	145.1	80%	0.804	74%	0.74	S	S	*	*			cis	-145.6	84.6	-5.3	-134.8	168.5	-79	0	0	114.8
1513	G	25.3	Very low	26.4	Very low	66 Å²	66	145.3 Å²	145.3	68%	0.68	74%	0.741	S	S	*	*			trans	84.6	162	158.2	0	0	0	0	0	117.5
1514	F	24.7	Very low	26.3	Very low	177 Å²	177	141.9 Å²	141.9	78%	0.776	74%	0.739	S	S	*	*			cis	-159.3	143.6	-10.8	-129.7	-74.5	0	0	0	109.7
1515	Y	27.2	Very low	26.9	Very low	220 Å²	220	141.4 Å²	141.4	86%	0.863	74%	0.741	S	S	*	*			trans	62.6	146.5	-176.3	-54.5	-83.6	0	0	0	115.6
1516	G	25.9	Very low	26.9	Very low	60 Å²	60	140.8 Å²	140.8	62%	0.619	75%	0.745	S	S	*	*			cis	172.2	110.3	-9.2	0	0	0	0	0	113.1
1517	S	25.7	Very low	26.6	Very low	106 Å²	106	141 Å²	141	74%	0.741	75%	0.75	S	S	*	*				39	143.8	126.7	58.4	0	0	0	0	121.7
1518	N	24.8	Very low	26.6	Very low	154 Å²	154	139 Å²	139	82%	0.824	75%	0.747	S	S	*	*			cis	-165.7	158.8	-3.5	-99.4	-9.3	0	0	0	108.5
1519	P	31.3	Very low	26.4	Very low	119 Å²	119	138.4 Å²	138.4	77%	0.773	75%	0.753	S	S	*	*			trans	-99.9	143.8	169.1	36.5	-30.7	0	0	0	113.3
1520	L	23.4	Very low	26.2	Very low	175 Å²	175	142.9 Å²	142.9	92%	0.916	76%	0.762	S	S	*	*			trans	-166.1	147.6	154.8	-110.6	169.4	0	0	0	109.5
1521	N	27.4	Very low	26	Very low	151 Å²	151	137.2 Å²	137.2	81%	0.807	76%	0.756	S	S	*	*			trans	-78	141.5	178.6	-77.2	-7.6	0	0	0	111.7
1522	Y	23	Very low	26.1	Very low	221 Å²	221	138.6 Å²	138.6	87%	0.867	76%	0.763	S	S	*	*				-173.1	162.5	125.4	-113	-72.7	0	0	0	112
1523	I	26.8	Very low	25.9	Very low	154 Å²	154	135.1 Å²	135.1	79%	0.79	76%	0.758	S	S	*	*			trans	76.8	138.4	161.3	-67.3	156.9	0	0	0	117.5
1524	S	21.6	Very low	25.9	Very low	100 Å²	100	139.6 Å²	139.6	70%	0.699	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-78	159.5	176.5	48.9	0	0	0	0	113.7
1525	T	38.1	Very low	25.8	Very low	124 Å²	124	137.1 Å²	137.1	76%	0.761	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-49.6	137.3	170.1	50.4	0	0	0	0	114.2
1526	P	25.3	Very low	25.6	Very low	120 Å²	120	130.5 Å²	130.5	78%	0.779	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-84.8	142.1	150.2	33.6	-29.9	0	0	0	110.9
1527	L	21.8	Very low	25.4	Very low	152 Å²	152	133.3 Å²	133.3	80%	0.796	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-61.2	136.8	162.8	-107.3	65.5	0	0	0	109.6
1528	S	25.4	Very low	25.3	Very low	87 Å²	87	135.8 Å²	135.8	61%	0.608	77%	0.765	S	S	*	*				43.6	133.2	100.5	83.6	0	0	0	0	115.6
1529	T	24	Very low	25.5	Very low	111 Å²	111	133.3 Å²	133.3	68%	0.681	76%	0.756	S	S	*	*				-169.1	151.6	88.9	28.7	0	0	0	0	107.8
1530	Y	25.5	Very low	25.1	Very low	224 Å²	224	135.3 Å²	135.3	88%	0.878	76%	0.76	S	S	*	*				-175.8	156.9	73.9	-94.9	-93.5	0	0	0	105.9
1531	A	23.9	Very low	25.2	Very low	71 Å²	71	134.3 Å²	134.3	59%	0.587	75%	0.75	S	S	*	*			cis	-156.9	-159.2	1	0	0	0	0	0	110.2
1532	D	28.8	Very low	25.2	Very low	146 Å²	146	135.7 Å²	135.7	78%	0.781	75%	0.752	S	S	*	*			trans	73	68.8	153	-54.9	-14.5	0	0	0	120
1533	S	23.7	Very low	25.3	Very low	100 Å²	100	136.5 Å²	136.5	70%	0.699	75%	0.753	S	S	*	*				25.3	157.7	115.2	70.2	0	0	0	0	123.8
1534	L	24.6	Very low	25.2	Very low	160 Å²	160	135.4 Å²	135.4	84%	0.838	75%	0.748	S	S	*	*			trans	92.8	128.4	153.6	-76	161.5	0	0	0	121.2
1535	T	22.8	Very low	25.4	Very low	124 Å²	124	138.9 Å²	138.9	76%	0.761	75%	0.753	S	S	*	*			trans	-60.2	146.5	171.3	50.1	0	0	0	0	114.4
1536	A	23.2	Very low	24.8	Very low	82 Å²	82	141 Å²	141	68%	0.678	75%	0.754	S	S	*	*				167.8	143.3	101.6	0	0	0	0	0	113.5
1537	T	22.6	Very low	24.8	Very low	119 Å²	119	142.9 Å²	142.9	73%	0.73	75%	0.754	S	S	*	*			trans	34.5	149.5	145.3	60.1	0	0	0	0	123
1538	L	23.8	Very low	24.8	Very low	157 Å²	157	140.6 Å²	140.6	82%	0.822	75%	0.751	S	S	*	*			trans	79.3	143.9	171.5	-50.9	149.8	0	0	0	113.3
1539	T	27.6	Very low	24.9	Very low	102 Å²	102	145.7 Å²	145.7	63%	0.626	76%	0.762	S	S	*	*			cis	-147.7	153.1	-4.2	-10.4	0	0	0	0	111.6	Q1541	T1539-Q1541 HydrophobicContact CG2-CB 4.41Å; T1539-Q1541 PolarHBondContact O-N 3.32Å
1540	L	24.4	Very low	25.1	Very low	162 Å²	162	146.4 Å²	146.4	85%	0.848	77%	0.769	S	S	*	*	S	Bend	trans	-73.5	52.7	168.3	-169.5	91.2	0	0	0	111.8
1541	Q	24.8	Very low	25.2	Very low	154 Å²	154	144.8 Å²	144.8	72%	0.72	77%	0.769	S	S	*	*			trans	-148	30.9	-167.8	-154.7	159.9	-9.6	0	0	115.5	T1539	T1539-Q1541 HydrophobicContact CG2-CB 4.41Å; T1539-Q1541 PolarHBondContact O-N 3.32Å
1542	Q	26.7	Very low	25.2	Very low	180 Å²	180	148.9 Å²	148.9	84%	0.841	78%	0.78	S	S	*	*	S	Bend	trans	-144.8	9.6	170.8	-114.4	164.2	14.1	0	0	115.4
1543	W	26	Very low	25.2	Very low	237 Å²	237	148 Å²	148	90%	0.898	78%	0.781	S	S	*	*	S	Bend	trans	-113.4	4	175.7	-139.5	61.1	0	0	0	113.7
1544	I	25.2	Very low	25.4	Very low	132 Å²	132	152.8 Å²	152.8	68%	0.677	79%	0.789	S	S	*	*	S	Bend	trans	-100.6	-9.9	-175.3	-71	174.6	0	0	0	112.6
1545	E	24.8	Very low	25.4	Very low	172 Å²	172	152.1 Å²	152.1	80%	0.804	79%	0.786	S	S	*	*	S	Bend	trans	-97.3	-4.8	-178.3	-64.3	-165.2	125.6	0	0	114.9
1546	H	25.9	Very low	25.7	Very low	168 Å²	168	154.2 Å²	154.2	78%	0.778	79%	0.791	S	S	*	*	S	Bend	trans	-126	70.6	-172.5	-116	-82.5	0	0	0	114
1547	M	25.2	Very low	25.8	Very low	160 Å²	160	157 Å²	157	79%	0.788	79%	0.794	S	S	*	*	S	Bend	trans	167.1	69.6	136.8	-89.8	-62.1	-171.2	0	0	112.3
1548	S	22.5	Very low	26.1	Very low	105 Å²	105	159.5 Å²	159.5	73%	0.734	80%	0.801	S	S	*	*			trans	-141.6	62.8	169.6	59.6	0	0	0	0	114.6
1549	K	26.9	Very low	26.2	Very low	194 Å²	194	161 Å²	161	84%	0.843	80%	0.801	S	S	*	*			trans	-171.8	134.9	154.1	-105.5	151.9	-171.8	177.3	0	112.4
1550	P	28.2	Very low	26.2	Very low	126 Å²	126	164 Å²	164	82%	0.818	81%	0.813	S	S	*	*			trans	-92.1	132.2	159.9	34.2	-28.1	0	0	0	110.3
1551	E	27.3	Very low	26.4	Very low	190 Å²	190	160.5 Å²	160.5	89%	0.888	80%	0.802	S	S	*	*			trans	-147.6	158.5	166.7	-140.7	160.9	-121.6	0	0	111.9
1552	L	23.4	Very low	26.5	Very low	156 Å²	156	162.4 Å²	162.4	82%	0.817	81%	0.808	S	S	*	*			trans	-141.8	99	-153	-171	160.4	0	0	0	111.5
1553	T	29.1	Very low	26.6	Very low	129 Å²	129	163 Å²	163	79%	0.791	81%	0.811	S	S	*	*			trans	-138.9	85.9	-176.3	52	0	0	0	0	114.9
1554	K	27.6	Very low	26.7	Very low	199 Å²	199	155.1 Å²	155.1	87%	0.865	80%	0.803	S	S	*	*			trans	50.2	136.3	135.9	-64.3	-179.6	178.1	176.5	0	122.3
1555	N	25.2	Very low	26.8	Very low	147 Å²	147	159 Å²	159	79%	0.786	81%	0.811	S	S	*	*			trans	-74.7	166.7	171.3	-53.1	-15.7	0	0	0	114.4
1556	I	28.2	Very low	26.9	Very low	168 Å²	168	159 Å²	159	86%	0.862	81%	0.808	S	S	*	*			trans	-127.9	104.7	139.3	-58.9	177	0	0	0	105.6
1557	D	26.8	Very low	26.8	Very low	139 Å²	139	159.8 Å²	159.8	74%	0.743	81%	0.809	S	S	*	*				74.8	100.7	73.7	-102.4	12.3	0	0	0	116.2
1558	I	27.9	Very low	26.9	Very low	172 Å²	172	159.2 Å²	159.2	88%	0.882	81%	0.808	S	S	*	*			trans	-134	117	141.8	-63	-171.8	0	0	0	110.5
1559	K	25.5	Very low	27	Very low	188 Å²	188	161.2 Å²	161.2	82%	0.817	81%	0.81	S	S	*	*			trans	-23	137.2	170.1	-60.1	162.5	-179.3	169.6	0	119.2
1560	L	28.4	Very low	26.9	Very low	165 Å²	165	157.1 Å²	157.1	86%	0.864	81%	0.806	S	S	*	*				173.5	143.1	110.2	-87.8	155.2	0	0	0	107.8
1561	S	28.5	Very low	26.9	Very low	89 Å²	89	163 Å²	163	62%	0.622	81%	0.812	S	S	*	*			cis	-171.5	148.3	-27.2	46.1	0	0	0	0	107.8
1562	K	26.4	Very low	26.8	Very low	195 Å²	195	158.7 Å²	158.7	85%	0.848	80%	0.802	S	S	*	*			trans	37	128.7	148.5	-62.5	-176.5	179.6	-175.7	0	118.6
1563	E	29.5	Very low	26.9	Very low	193 Å²	193	158.8 Å²	158.8	90%	0.902	80%	0.804	S	S	*	*			cis	-145.9	155.4	25.2	-58.6	179.3	135	0	0	108.9
1564	G	27.8	Very low	26.7	Very low	71 Å²	71	159.8 Å²	159.8	73%	0.732	80%	0.803	S	S	*	*				150.7	140.9	84	0	0	0	0	0	109
1565	Y	28.1	Very low	26.6	Very low	214 Å²	214	159.2 Å²	159.2	84%	0.839	80%	0.801	S	S	*	*			trans	-82.2	141.4	-165.7	-80.1	-116.8	0	0	0	111.6
1566	K	25.2	Very low	26.6	Very low	170 Å²	170	157.6 Å²	157.6	74%	0.739	79%	0.789	S	S	*	*			cis	89.9	124.8	41.6	-167.1	-172.2	-167.6	171.4	0	113
1567	K	24.5	Very low	26.5	Very low	186 Å²	186	158.6 Å²	158.6	81%	0.809	78%	0.783	S	S	*	*			trans	89.8	155.9	153	-135.2	-172.8	-178.8	-168.6	0	119.3
1568	I	27.5	Very low	26.5	Very low	148 Å²	148	157.8 Å²	157.8	76%	0.759	78%	0.779	S	S	*	*			trans	96.5	115.5	153.8	-63.7	157.7	0	0	0	118.3
1569	D	24.1	Very low	26.5	Very low	146 Å²	146	155.7 Å²	155.7	78%	0.781	77%	0.768	S	S	*	*			trans	-73.3	163.3	157.7	-82.4	-66.9	0	0	0	112.4
1570	S	25.8	Very low	26.4	Very low	109 Å²	109	154.4 Å²	154.4	76%	0.762	77%	0.766	S	S	*	*			trans	68.5	63.8	164.4	63.1	0	0	0	0	118.8
1571	R	28	Very low	26.3	Very low	250 Å²	250	153.4 Å²	153.4	94%	0.943	76%	0.76	S	S	*	*				25.6	122	111	-169.7	-172.2	-158.4	176.5	6.8	117.8
1572	S	24.4	Very low	26.2	Very low	98 Å²	98	155.6 Å²	155.6	69%	0.685	77%	0.765	S	S	*	*			trans	-151.4	133.6	152.7	56.5	0	0	0	0	114.1
1573	N	26.6	Very low	26.4	Very low	159 Å²	159	154.7 Å²	154.7	85%	0.85	76%	0.761	S	S	*	*			trans	172.4	76.5	160.5	-102.2	-20.8	0	0	0	106.4
1574	L	25	Very low	26.5	Very low	149 Å²	149	150.2 Å²	150.2	78%	0.78	75%	0.747	S	S	*	*				78.9	104.5	70.7	-76.6	165.6	0	0	0	114.8
1575	K	25.7	Very low	26.6	Very low	187 Å²	187	154.1 Å²	154.1	81%	0.813	75%	0.746	S	S	*	*			trans	158.5	141.1	143.9	-91.6	-178.7	177.2	-176.6	0	109.3
1576	Q	25.5	Very low	26.6	Very low	113 Å²	113	151.2 Å²	151.2	53%	0.528	74%	0.74	S	S	.	*			cis	-165.2	149.8	-11.2	-148.6	167.3	-37.7	0	0	108.4
1577	Y	25.4	Very low	26.8	Very low	189 Å²	189	150 Å²	150	74%	0.741	74%	0.737	S	S	*	*			trans	65.9	156.6	170.1	-55.6	-61.3	0	0	0	116.7
1578	D	26	Very low	27.1	Very low	123 Å²	123	146.4 Å²	146.4	66%	0.658	73%	0.727	S	S	*	*			cis	-156.5	175.7	-11.9	-126.4	-32.8	0	0	0	112.8
1579	L	27.6	Very low	27.2	Very low	127 Å²	127	145.7 Å²	145.7	67%	0.665	72%	0.723	S	S	*	*			trans	45.2	113.7	149.3	-64.6	169.1	0	0	0	119.9
1580	Q	23.5	Very low	27.2	Very low	162 Å²	162	143.8 Å²	143.8	76%	0.757	72%	0.72	S	S	*	*				87.2	156.5	76.7	-82.5	-167.5	8.2	0	0	116.8
1581	L	27.9	Very low	27.3	Very low	143 Å²	143	145.2 Å²	145.2	75%	0.749	72%	0.719	S	S	*	*			trans	73.3	130.7	-178	-69.9	104	0	0	0	116.3
1582	N	25.9	Very low	27.3	Very low	136 Å²	136	140.6 Å²	140.6	73%	0.727	71%	0.708	S	S	*	*				74.4	135.9	51.3	-78.3	-34.9	0	0	0	112.5
1583	K	30.7	Very low	27.3	Very low	176 Å²	176	141.2 Å²	141.2	77%	0.765	70%	0.704	S	S	*	*			cis	-155.4	169.2	12.8	-113.3	171.8	175	-170.6	0	107.2
1584	T	31.4	Very low	27.3	Very low	99 Å²	99	141.8 Å²	141.8	61%	0.607	70%	0.699	S	S	*	*			cis	-159.4	152.9	5.4	16.1	0	0	0	0	104.6
1585	E	30.7	Very low	27.3	Very low	152 Å²	152	145 Å²	145	71%	0.71	70%	0.701	S	S	*	*			cis	-151.6	136.9	3.7	-122.4	146.9	-156	0	0	107.1
1586	Q	27.8	Very low	27.4	Very low	153 Å²	153	143.4 Å²	143.4	72%	0.715	70%	0.696	S	S	*	*				50.9	124.2	110.9	-62.1	-166.6	26.8	0	0	115.6
1587	Q	29.8	Very low	27.4	Very low	144 Å²	144	146 Å²	146	67%	0.673	71%	0.707	S	S	*	*			cis	-160.5	173.4	11	-102.4	173.2	73.6	0	0	107.4
1588	N	29.9	Very low	27.3	Very low	112 Å²	112	146.2 Å²	146.2	60%	0.599	71%	0.712	S	S	*	*			cis	-160.3	163.9	9.3	-126	-11.4	0	0	0	114.3
1589	I	28.9	Very low	27.3	Very low	132 Å²	132	145.2 Å²	145.2	68%	0.677	72%	0.715	S	S	*	*			trans	39.9	99.8	142.6	-60.5	164.5	0	0	0	121.1
1590	C	24.8	Very low	27.4	Very low	106 Å²	106	145 Å²	145	72%	0.716	72%	0.721	S	S	*	*				55	134	117.6	-56	0	0	0	0	126
1591	N	27.5	Very low	27.4	Very low	139 Å²	139	147 Å²	147	74%	0.743	72%	0.722	S	S	*	*				96.9	114.5	128.9	-78.1	20	0	0	0	124.3
1592	E	27.5	Very low	27.4	Very low	153 Å²	153	146.8 Å²	146.8	72%	0.715	72%	0.717	S	S	*	*				72.6	115.9	124.2	-70.6	-143.3	-178.8	0	0	124.7
1593	N	25.4	Very low	27.5	Very low	112 Å²	112	145.9 Å²	145.9	60%	0.599	71%	0.712	S	S	*	*				70.5	126.8	123.8	-75.6	-43.5	0	0	0	123.9
1594	K	26.1	Very low	27.3	Very low	171 Å²	171	144 Å²	144	74%	0.743	71%	0.71	S	S	*	*			trans	79.9	110.8	142	-67.9	165	-173.9	161.1	0	121.4
1595	R	25.4	Very low	27.2	Very low	217 Å²	217	144.6 Å²	144.6	82%	0.819	72%	0.718	S	S	*	*			trans	78.3	154.2	130.4	-66.5	-177.5	171.1	-174.6	-2.8	120.5
1596	H	28.6	Very low	27.4	Very low	152 Å²	152	142.3 Å²	142.3	70%	0.704	72%	0.719	S	S	*	*			trans	84	116.8	163.7	-63.4	-67.9	0	0	0	119.8
1597	H	24.7	Very low	27.5	Very low	167 Å²	167	138.7 Å²	138.7	77%	0.773	71%	0.71	S	S	*	*			trans	26.6	129.5	142	-65.4	-62.2	0	0	0	122.7
1598	K	23.7	Very low	27.6	Very low	194 Å²	194	140.5 Å²	140.5	84%	0.843	72%	0.716	S	S	*	*			trans	76.1	147.5	149.5	-68.4	-178.9	176.9	-176.2	0	117.4
1599	S	25.5	Very low	27.4	Very low	103 Å²	103	138.9 Å²	138.9	72%	0.72	72%	0.719	S	S	*	*			trans	-28.7	138	166.3	52.5	0	0	0	0	114.9
1600	P	29.2	Very low	27.4	Very low	121 Å²	121	139.7 Å²	139.7	79%	0.786	72%	0.724	S	S	*	*				-124.2	149.7	75.6	43.2	-36.8	0	0	0	110.7
1601	R	23.7	Very low	27.5	Very low	206 Å²	206	139.1 Å²	139.1	78%	0.777	72%	0.721	S	S	*	*			cis	62.3	132.6	41.7	-143	-156.7	171.8	141.2	3.2	112.3
1602	E	27.4	Very low	27.6	Very low	137 Å²	137	135.4 Å²	135.4	64%	0.64	72%	0.716	S	S	*	*			trans	70.6	140.1	166.6	-59.5	-165.1	-145.7	0	0	115.2
1603	N	28.4	Very low	27.6	Very low	118 Å²	118	132.6 Å²	132.6	63%	0.631	71%	0.709	S	S	*	*			cis	-162.7	166.2	0.7	-101	-9.6	0	0	0	107.5
1604	L	26.7	Very low	27.6	Very low	137 Å²	137	134.9 Å²	134.9	72%	0.717	72%	0.721	S	S	*	*			cis	-163.9	-172.2	-7.9	-125.4	168.2	0	0	0	109.4
1605	S	28.7	Very low	27.7	Very low	110 Å²	110	133.6 Å²	133.6	77%	0.769	72%	0.722	S	S	*	*			trans	73.5	138.2	164.7	73.6	0	0	0	0	117
1606	S	36.1	Very low	27.9	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	72%	0.721	S	S	*	*	S	Bend	cis	-117.1	115.7	-3.4	50.9	0	0	0	0	109.9
1607	S	30.2	Very low	27.8	Very low	76 Å²	76	129.2 Å²	129.2	53%	0.531	73%	0.727	S	S	.	*				68	129.7	67.7	74.5	0	0	0	0	112.9
1608	F	30.7	Very low	28.1	Very low	182 Å²	182	127.2 Å²	127.2	80%	0.798	73%	0.726	S	S	*	*			cis	-127.3	149.9	12.1	-72.1	-94.6	0	0	0	109.4
1609	A	27.2	Very low	28.3	Very low	79 Å²	79	122.1 Å²	122.1	65%	0.653	72%	0.715	S	S	*	*				64	141.9	66.6	0	0	0	0	0	112.9
1610	D	29	Very low	28.7	Very low	148 Å²	148	123.4 Å²	123.4	79%	0.791	71%	0.714	S	S	*	*			cis	-147.5	-161.9	22.4	-133.7	-41.6	0	0	0	115
1611	S	26.3	Very low	28.7	Very low	94 Å²	94	123.9 Å²	123.9	66%	0.657	71%	0.709	S	S	*	*			trans	-54.5	170.8	170.4	57	0	0	0	0	113.5	V1613	S1611-V1613 PolarHBondContact O-N 2.77Å
1612	G	29.1	Very low	28.9	Very low	61 Å²	61	121.7 Å²	121.7	63%	0.629	71%	0.708	S	S	*	*	S	Bend		41.1	74.9	83.2	0	0	0	0	0	112.5
1613	V	26.8	Very low	29.2	Very low	94 Å²	94	120 Å²	120	57%	0.57	71%	0.711	S	S	*	*			trans	31.6	117.1	141.2	-172.5	0	0	0	0	114.9	S1611 L1615	S1611-V1613 PolarHBondContact O-N 2.77Å; V1613-L1615 HydrophobicContact CG2-CD1 4.41Å
1614	D	25.6	Very low	29.3	Very low	161 Å²	161	121.1 Å²	121.1	86%	0.861	72%	0.717	S	S	*	*	P	Polyproline II helix	cis	-101.7	155.8	45.8	-70.1	-57	0	0	0	118.6
1615	L	29.4	Very low	29.7	Very low	143 Å²	143	121.4 Å²	121.4	75%	0.749	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-85.8	161.5	176	-93.8	83.3	0	0	0	112.4	V1613	V1613-L1615 HydrophobicContact CG2-CD1 4.41Å
1616	P	28.3	Very low	30	Very low	123 Å²	123	122.7 Å²	122.7	80%	0.799	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-68.7	155.6	178.5	29.4	-36.6	0	0	0	113.9
1617	N	26.1	Very low	29.9	Very low	155 Å²	155	125 Å²	125	83%	0.829	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-76.1	169.9	177.1	-102.5	-43.1	0	0	0	113.9
1618	T	31.3	Very low	30	Very low	124 Å²	124	128.4 Å²	128.4	76%	0.761	72%	0.721	S	S	*	*			trans	73	116.1	176.3	67.5	0	0	0	0	114.5
1619	S	29.7	Very low	30.1	Very low	87 Å²	87	125.7 Å²	125.7	61%	0.608	72%	0.715	S	S	*	*			cis	72	137.4	36.9	99.1	0	0	0	0	112.5
1620	N	33.8	Very low	30.3	Very low	131 Å²	131	127.9 Å²	127.9	70%	0.701	72%	0.715	S	S	*	*			cis	-137.8	147.5	37.4	-80.7	-35.9	0	0	0	111.7
1621	L	28.9	Very low	30.4	Very low	131 Å²	131	127 Å²	127	69%	0.686	71%	0.71	S	S	*	*				62.7	140.6	75.6	-82.5	65.3	0	0	0	112.5
1622	E	28	Very low	30.7	Very low	160 Å²	160	131.3 Å²	131.3	75%	0.748	72%	0.717	S	S	*	*			cis	-142	170.9	4.6	-104.2	143	165.2	0	0	107.9
1623	S	33.9	Very low	30.8	Very low	102 Å²	102	134 Å²	134	71%	0.713	72%	0.717	S	S	*	*				179.3	160.1	50.4	52.9	0	0	0	0	107.4
1624	D	29.8	Very low	31.2	Very low	141 Å²	141	136.3 Å²	136.3	75%	0.754	73%	0.726	S	S	*	*			cis	-170.2	-171.2	-5.4	-111.1	-39.5	0	0	0	109.5
1625	I	35.1	Very low	31.5	Very low	142 Å²	142	134.1 Å²	134.1	73%	0.728	72%	0.723	S	S	*	*			trans	104.1	99.4	154.7	-57.3	-178.1	0	0	0	118.2
1626	I	35.3	Very low	32.1	Very low	138 Å²	138	133.1 Å²	133.1	71%	0.708	73%	0.726	S	S	*	*			trans	64.4	132	135.7	-64.1	-179.7	0	0	0	119
1627	E	33	Very low	32.3	Very low	154 Å²	154	134.5 Å²	134.5	72%	0.72	73%	0.725	S	S	*	*			cis	-159.3	141.7	-5.8	-117.2	174.7	-178.5	0	0	111.9
1628	H	32.1	Very low	32.5	Very low	146 Å²	146	135.1 Å²	135.1	68%	0.676	72%	0.723	S	S	*	*				44.8	145.4	129.1	-85	-103.2	0	0	0	122.9
1629	N	33.1	Very low	32.5	Very low	125 Å²	125	135.1 Å²	135.1	67%	0.668	72%	0.716	S	S	*	*			cis	-155.4	143.3	38.8	-102.1	-47.6	0	0	0	115
1630	L	31.8	Very low	32.6	Very low	126 Å²	126	140.9 Å²	140.9	66%	0.66	73%	0.725	S	S	*	*				38.9	148.4	124.6	-55.5	178	0	0	0	121.2
1631	N	31.9	Very low	32.5	Very low	129 Å²	129	140.3 Å²	140.3	69%	0.69	73%	0.726	S	S	*	*			cis	-164.5	151.9	9.3	-137.3	-16.6	0	0	0	113.4
1632	K	32	Very low	32.7	Very low	185 Å²	185	144.4 Å²	144.4	80%	0.804	73%	0.733	S	S	*	*				167.8	115.9	125.2	-95.1	-178.5	175.7	-178.1	0	113.9
1633	N	32	Very low	32.9	Very low	117 Å²	117	143.9 Å²	143.9	63%	0.626	73%	0.733	S	S	*	*			trans	56.1	133.5	138.4	-64.4	68.2	0	0	0	120.3
1634	D	34	Very low	32.8	Very low	143 Å²	143	143 Å²	143	77%	0.765	73%	0.727	S	S	*	*			cis	-150.1	-172.5	-1	-90	-36.4	0	0	0	111.9
1635	S	31.6	Very low	32.9	Very low	114 Å²	114	143.4 Å²	143.4	80%	0.797	73%	0.729	S	S	*	*			trans	-110.9	167.5	-145.3	51.6	0	0	0	0	119.6
1636	P	42.8	Very low	32.9	Very low	123 Å²	123	144 Å²	144	80%	0.799	73%	0.733	S	S	*	*			trans	-117.8	177.8	-175.5	43.7	-34	0	0	0	116.1
1637	I	31.8	Very low	32.7	Very low	152 Å²	152	144.6 Å²	144.6	78%	0.779	74%	0.735	S	S	*	*			trans	-144.8	125.5	-177.6	-81.1	-177.1	0	0	0	113.8
1638	E	31.3	Very low	32.5	Very low	168 Å²	168	148.3 Å²	148.3	79%	0.785	74%	0.743	S	S	*	*			trans	58.2	156.1	142.8	-69.6	-165.5	157	0	0	124.1
1639	I	30.5	Very low	33	Very low	123 Å²	123	146.7 Å²	146.7	63%	0.631	75%	0.745	S	S	*	*			cis	-165.6	150.2	-25	-120.7	174.1	0	0	0	113.8
1640	R	31.2	Very low	32.9	Very low	209 Å²	209	147.9 Å²	147.9	79%	0.789	75%	0.75	S	S	*	*			trans	57.6	118.9	152.7	-76	179.8	178.7	162	1.9	127.3
1641	T	32.2	Very low	32.9	Very low	119 Å²	119	148.8 Å²	148.8	73%	0.73	75%	0.751	S	S	*	*				55.4	165.1	118.6	74.3	0	0	0	0	123.4
1642	R	32.5	Very low	32.9	Very low	216 Å²	216	152.7 Å²	152.7	82%	0.815	76%	0.756	S	S	*	*			cis	-170.4	174.6	19.4	-142.7	174.2	-162.6	-172.1	5.5	114.3
1643	I	32.9	Very low	33	Very low	149 Å²	149	150.4 Å²	150.4	76%	0.764	76%	0.757	S	S	*	*			trans	85.1	152.9	154.2	-65	152.5	0	0	0	119.6
1644	S	32.1	Very low	33.1	Very low	83 Å²	83	149.7 Å²	149.7	58%	0.58	76%	0.761	S	S	*	*				174.2	140.3	-83.4	60.2	0	0	0	0	116.3
1645	N	32.4	Very low	33.4	Very low	150 Å²	150	148 Å²	148	80%	0.802	76%	0.76	S	S	*	*			trans	69.2	167.6	154	-51.9	-20.4	0	0	0	118.8
1646	I	33.9	Very low	33.3	Very low	156 Å²	156	145.5 Å²	145.5	80%	0.8	75%	0.753	S	S	*	*			cis	-147	-177.1	10.3	-12.9	171	0	0	0	108.1
1647	I	32.7	Very low	33.1	Very low	149 Å²	149	149.6 Å²	149.6	76%	0.764	78%	0.78	S	S	*	*			cis	-151.1	169.2	4.7	-5.9	159.1	0	0	0	106.3
1648	R	26.9	Very low	33.2	Very low	233 Å²	233	149.5 Å²	149.5	88%	0.879	78%	0.78	S	S	*	*			cis	76.2	149.5	11.4	-83.5	-176.3	-178.6	-154.6	0.4	118.1
1649	P	42.6	Very low	33.3	Very low	111 Å²	111	148.5 Å²	148.5	72%	0.721	78%	0.78	S	S	*	*			cis	-144.6	-151.7	0.4	40.7	-16.8	0	0	0	116.7
1650	I	31.3	Very low	33.4	Very low	151 Å²	151	149.9 Å²	149.9	77%	0.774	79%	0.788	S	S	*	*			trans	101.3	107.9	169.3	-58.1	170.2	0	0	0	113.7
1651	E	31.7	Very low	33.6	Very low	144 Å²	144	146.5 Å²	146.5	67%	0.673	79%	0.788	S	S	*	*				76.7	143.7	58.7	-76.2	-169.8	-143.6	0	0	116
1652	R	31.9	Very low	33.7	Very low	212 Å²	212	148.2 Å²	148.2	80%	0.8	79%	0.791	S	S	*	*			cis	-119.5	-121.6	2.5	-152.1	167.7	-73.4	155.1	-0.6	112.9
1653	V	35.2	Very low	33.7	Very low	136 Å²	136	143.7 Å²	143.7	82%	0.824	79%	0.79	S	S	*	*			cis	-144.9	-154	4.6	-157.9	0	0	0	0	108.6
1654	S	34.5	Very low	33.8	Very low	102 Å²	102	143.3 Å²	143.3	71%	0.713	79%	0.792	S	S	*	*			trans	-130.1	-173.8	-178.8	67.7	0	0	0	0	111.7
1655	S	38.4	Very low	33.9	Very low	107 Å²	107	147.9 Å²	147.9	75%	0.748	81%	0.808	S	S	*	*			cis	-164.3	165.2	14.2	8.7	0	0	0	0	111.8
1656	G	31.5	Very low	34	Very low	62 Å²	62	147.8 Å²	147.8	64%	0.639	81%	0.808	S	S	*	*			trans	-74.8	-151.9	167.8	0	0	0	0	0	114.6
1657	P	38	Very low	34.1	Very low	210 Å²	210	147 Å²	147	100%	1.364	81%	0.809	S	S	*	*			cis	-70.6	0	22.9	29.3	-37.2	0	0	0	114.8

Retrieved 1,657 of 1,657 residues in 1877.1 ms (Link to these results)

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