A0A3Q0KUY1_SCHMA Loading...

Smp_204750

AlphaFold DB , UniProt , Accession A0A3Q0KUY1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,413 aa.

						>A0A3Q0KUY1_SCHMA|A0A3Q0KUY1
MYFILLSYVLIVILWTTDCKEEPRKPLFIEYPRDAFPLHRHQLRLFCRAEGEPIVSITWYKDGKVVETQRQKPGTSNRITNAGELIFLSFNEEDEGHYYCNASNVHGWNISPSALVKAAFFDASSASGPESKSAHFGQTVLLECTPPVGSPSPTVYWKHNNQKMVVSSRTRVMESGGLRIEGVKRQDAGTYQCLAESSAGHWESKSATLTIRRKPRFKFTPMSKQAVVGDSVEFQCLGSENPNSTILWRREGNKIIQASLIDRKTLRIEHVQLSDAGDYICEVKNAVGNVEAVAHLSVVSPPIFVITPEDKTVPLGGHVSFDCLTSGSPPPSVRWLHGKFSFWVPKPNEKPLQAGRYSVFPNGTLFINSTMLSDAGLFECKASQKAGIVKSTAQLFIESVVISLPLIEIGPQNRTFFQGMVATLPCHSTVLQYTLQVSNSLVHSNIDTFTPIATQWLVNDSAVSTSSNPRVVILNSGSLQINALRVSDTGFYTCEVEVQDSSSLSRRSTSWTSFLQVIQGGSSGSSTYLLPGDEGDLLLPDPPKNVKVTNIGDTWVVLDLINNHSVEDVIKKRSLGESAFITGVQVEVTEFNTSNSWRVVESSGPYNSVRVSGLLPQTGYHILIRYVNHYGVGRPFILNKLVFTKTSGSTRNYLPTDLLVKLQSVDFSPLHIRAISPSELLAEWFLCGPSDVLALITGFKATYRSVPMSRCLTSNSNNNGYYIKESITHYPKADHNSCTFKDESMENLLDSYEDEVTPCSLPRISKQKSLDWNPPSFLSGEKVDYYIHSGVTTTSIKMAISNLRPFICYAIRIETFVDHPGHSRIFAQKSQVSVALTYDSTPTGAPQITNVRWLKNGTVLQLDWNPPNEWERGGILTGYSLKILSAALKLSRTVNMRTEQSSFHIYDLDPWSNYTLYLSAVTCHGEGVRSLPVYIFAYPTRGDFPELGVAPSKFPVMNWNQYESGNIFRKVLYDGRSLYPGSLSPQGLSEQMNSKTTDIHEEKGSLTKEPWFIVSAVMFSVLWVVICLALIIYGRHRSERQRRRHAVLDVMDAEIIAKNGRLGVVNSTQGEGTASPPIYMGNFSTSTEKEATSLISMEPLSVNASMISDRNHAPKLCDPTFGEKSYGNGFTCSMNPSYSVSMANGFSLTNNGSLQSVPTYLPQYPPGNPVLSVDNLKNHSYNNPGVIVPNIPVGGAQLLSGGTHCPSELMHSGTTHLLPNGCLPLPPTHNSQNPSSEDHATPYASVSVIQSAMFDHAPMDYGVIHQATCGRQLSLAEIIPPPPDYPPPSLPSFSPVPHHFTSWSLGDAPCSGSGEDSAYSDFRQSSSQHQGGCDVNSGSGPPVSSSHHNWLTSQHESNSALPASSHSISKTSGLSSEWLNHESLSTPHSTDQHIFAHHPSTSLSTIQPSHVAC
					

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(Predicted Aligned Error values between residue pairs)

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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	51.2	Low	62.5	Low	194 Å²	194	126.2 Å²	126.2	96%	0.956	61%	0.611	S	S	*	*				0	-58.1	0	-72.5	179.5	72.8	0	0	113.1	F3 I4 L5	M1-F3 VanDerWaalsContact C-N 3.27Å; M1-F3 PolarHBondContact O-N 3.2Å; M1-F3 VanDerWaalsContact O-N 3.12Å; M1-I4 WeakPolarHBondContact O-CB 3.39Å; M1-I4 PolarHBondContact O-N 2.97Å; M1-L5 PolarHBondContact O-N 3.11Å
2	Y	47.2	Very low	62.7	Low	199 Å²	199	122.6 Å²	122.6	78%	0.78	60%	0.602	S	S	*	*	H	α-helix	trans	-47.6	-43.6	-178.3	-125	-99.1	0	0	0	114.4	I4 L5 L6	Y2-I4 VanDerWaalsContact C-N 3.31Å; Y2-I4 PolarHBondContact O-N 2.88Å; Y2-L5 PolarHBondContact O-N 3.23Å; Y2-L6 HydrophobicContact CD1-CD1 4.23Å; Y2-L6 PolarHBondContact O-N 2.77Å
3	F	50.8	Low	62.6	Low	178 Å²	178	121.2 Å²	121.2	78%	0.781	60%	0.597	S	S	*	*	H	α-helix	trans	-57.6	-34	174.5	-83.3	-86.2	0	0	0	115.2	M1 S7	M1-F3 VanDerWaalsContact C-N 3.27Å; M1-F3 PolarHBondContact O-N 3.2Å; M1-F3 VanDerWaalsContact O-N 3.12Å; F3-S7 PolarHBondContact O-N 3.06Å; F3-S7 PolarHBondContact O-OG 3.24Å
4	I	66.9	Low	62.1	Low	114 Å²	114	120.7 Å²	120.7	59%	0.585	60%	0.597	S	S	*	*	H	α-helix	trans	-74	-43.2	-178	-60.2	173.6	0	0	0	109.7	M1 Y2 S7 Y8	M1-I4 WeakPolarHBondContact O-CB 3.39Å; M1-I4 PolarHBondContact O-N 2.97Å; Y2-I4 VanDerWaalsContact C-N 3.31Å; Y2-I4 PolarHBondContact O-N 2.88Å; I4-S7 WeakPolarHBondContact CA-OG 3.42Å; I4-S7 PolarHBondContact O-N 2.92Å; I4-S7 PolarHBondContact O-OG 3.01Å; I4-Y8 PolarHBondContact O-N 2.88Å
5	L	65	Low	61.4	Low	121 Å²	121	127.3 Å²	127.3	63%	0.634	61%	0.613	S	S	*	*	H	α-helix	trans	-62.9	-41.4	173.3	-83.7	155.2	0	0	0	111.7	M1 Y2 S7 Y8 V9	M1-L5 PolarHBondContact O-N 3.11Å; Y2-L5 PolarHBondContact O-N 3.23Å; L5-S7 PolarHBondContact O-N 3.13Å; L5-Y8 PolarHBondContact O-N 2.86Å; L5-V9 WeakPolarHBondContact O-CB 3.25Å; L5-V9 WeakPolarHBondContact O-CG2 3.28Å; L5-V9 PolarHBondContact O-N 2.86Å
6	L	61.8	Low	60.9	Low	94 Å²	94	126.3 Å²	126.3	49%	0.492	62%	0.617	S	S	.	*	H	α-helix	trans	-60	-43.4	171.9	-86.4	161.1	0	0	0	112.4	Y2 Y8 L10	Y2-L6 HydrophobicContact CD1-CD1 4.23Å; Y2-L6 PolarHBondContact O-N 2.77Å; L6-Y8 PolarHBondContact O-N 2.83Å; L6-L10 WeakPolarHBondContact O-CD1 3.42Å; L6-L10 PolarHBondContact O-N 2.75Å
7	S	70	Confident	60.1	Low	56 Å²	56	124.2 Å²	124.2	39%	0.392	61%	0.613	S	S	.	*	H	α-helix	trans	-65.3	-37.5	175.9	63.2	0	0	0	0	113.2	F3 I4 L5 L10 I11	F3-S7 PolarHBondContact O-N 3.06Å; F3-S7 PolarHBondContact O-OG 3.24Å; I4-S7 WeakPolarHBondContact CA-OG 3.42Å; I4-S7 PolarHBondContact O-N 2.92Å; I4-S7 PolarHBondContact O-OG 3.01Å; L5-S7 PolarHBondContact O-N 3.13Å; S7-L10 PolarHBondContact O-N 3.4Å; S7-I11 VanDerWaalsContact O-CG1 3.28Å; S7-I11 WeakPolarHBondContact O-CG1 3.4Å; S7-I11 PolarHBondContact O-N 3.38Å
8	Y	72	Confident	59.1	Low	163 Å²	163	126 Å²	126	64%	0.639	63%	0.626	S	S	*	*	H	α-helix	trans	-71.8	-38.8	-179.8	-133.3	-91.1	0	0	0	111.8	I4 L5 L6 I11 V12	I4-Y8 PolarHBondContact O-N 2.88Å; L5-Y8 PolarHBondContact O-N 2.86Å; L6-Y8 PolarHBondContact O-N 2.83Å; Y8-I11 PolarHBondContact O-N 3.11Å; Y8-V12 HydrophobicContact CD1-CG2 4.47Å; Y8-V12 WeakPolarHBondContact O-CG2 3.27Å; Y8-V12 PolarHBondContact O-N 3.38Å
9	V	69.6	Low	58.2	Low	82 Å²	82	124.8 Å²	124.8	50%	0.497	63%	0.63	S	S	.	*	H	α-helix	trans	-66.8	-39.4	173.7	172.6	0	0	0	0	111.2	L5 V12 I13	L5-V9 WeakPolarHBondContact O-CB 3.25Å; L5-V9 WeakPolarHBondContact O-CG2 3.28Å; L5-V9 PolarHBondContact O-N 2.86Å; V9-V12 PolarHBondContact O-N 2.9Å; V9-I13 HydrophobicContact CG1-CD1 3.79Å; V9-I13 WeakPolarHBondContact O-CB 3.33Å; V9-I13 VanDerWaalsContact O-CG1 3.28Å; V9-I13 WeakPolarHBondContact O-CG1 3.29Å; V9-I13 PolarHBondContact O-N 2.93Å
10	L	65.1	Low	57.8	Low	101 Å²	101	128.4 Å²	128.4	53%	0.529	64%	0.641	S	S	.	*	H	α-helix	trans	-61	-45.3	171.4	-105	97.9	0	0	0	112.1	L6 S7 V12 I13 L14	L6-L10 WeakPolarHBondContact O-CD1 3.42Å; L6-L10 PolarHBondContact O-N 2.75Å; S7-L10 PolarHBondContact O-N 3.4Å; L10-V12 PolarHBondContact O-N 2.91Å; L10-I13 PolarHBondContact O-N 3.2Å; L10-L14 WeakPolarHBondContact O-CB 3.38Å; L10-L14 VanDerWaalsContact O-CG 3.23Å; L10-L14 WeakPolarHBondContact O-CG 3.39Å; L10-L14 PolarHBondContact O-N 2.88Å
11	I	67.9	Low	57.8	Low	86 Å²	86	129.3 Å²	129.3	44%	0.441	64%	0.644	S	S	.	*	H	α-helix	trans	-62.7	-42.5	179.8	-70.9	164.6	0	0	0	111	S7 Y8 L14 W15	S7-I11 VanDerWaalsContact O-CG1 3.28Å; S7-I11 WeakPolarHBondContact O-CG1 3.4Å; S7-I11 PolarHBondContact O-N 3.38Å; Y8-I11 PolarHBondContact O-N 3.11Å; I11-L14 PolarHBondContact O-N 3.38Å; I11-W15 PolarHBondContact O-N 3.15Å
12	V	65.3	Low	58.3	Low	83 Å²	83	125.9 Å²	125.9	50%	0.503	63%	0.625	S	S	.	*	H	α-helix	trans	-64.8	-41.2	177	172.8	0	0	0	0	111.6	Y8 V9 L10 L14 W15	Y8-V12 HydrophobicContact CD1-CG2 4.47Å; Y8-V12 WeakPolarHBondContact O-CG2 3.27Å; Y8-V12 PolarHBondContact O-N 3.38Å; V9-V12 PolarHBondContact O-N 2.9Å; L10-V12 PolarHBondContact O-N 2.91Å; V12-L14 VanDerWaalsContact C-N 3.32Å; V12-L14 PolarHBondContact O-N 2.93Å; V12-W15 PolarHBondContact O-N 2.69Å
13	I	61.5	Low	59.6	Low	105 Å²	105	120.6 Å²	120.6	54%	0.538	62%	0.615	S	S	.	*	H	α-helix	trans	-65	-35.9	175.6	-69.1	168.4	0	0	0	111.6	V9 L10 W15	V9-I13 HydrophobicContact CG1-CD1 3.79Å; V9-I13 WeakPolarHBondContact O-CB 3.33Å; V9-I13 VanDerWaalsContact O-CG1 3.28Å; V9-I13 WeakPolarHBondContact O-CG1 3.29Å; V9-I13 PolarHBondContact O-N 2.93Å; L10-I13 PolarHBondContact O-N 3.2Å; I13-W15 VanDerWaalsContact C-N 3.26Å; I13-W15 PolarHBondContact O-N 2.97Å
14	L	55.7	Low	61.2	Low	114 Å²	114	118.6 Å²	118.6	60%	0.597	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-7.6	178.4	-73.3	168.1	0	0	0	114.5	L10 I11 V12	L10-L14 WeakPolarHBondContact O-CB 3.38Å; L10-L14 VanDerWaalsContact O-CG 3.23Å; L10-L14 WeakPolarHBondContact O-CG 3.39Å; L10-L14 PolarHBondContact O-N 2.88Å; I11-L14 PolarHBondContact O-N 3.38Å; V12-L14 VanDerWaalsContact C-N 3.32Å; V12-L14 PolarHBondContact O-N 2.93Å
15	W	51.3	Low	62.1	Low	220 Å²	220	120.2 Å²	120.2	83%	0.833	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	5.3	-179.7	-76.4	53.4	0	0	0	113.1	I11 V12 I13	I11-W15 PolarHBondContact O-N 3.15Å; V12-W15 PolarHBondContact O-N 2.69Å; I13-W15 VanDerWaalsContact C-N 3.26Å; I13-W15 PolarHBondContact O-N 2.97Å
16	T	53.8	Low	63.3	Low	111 Å²	111	114.6 Å²	114.6	68%	0.681	58%	0.576	S	S	*	*	S	Bend	trans	-128.1	22.3	178.5	66.3	0	0	0	0	113.8
17	T	47	Very low	64.7	Low	90 Å²	90	115.5 Å²	115.5	55%	0.552	58%	0.58	S	S	*	*			trans	-90.3	112.4	174.1	49.6	0	0	0	0	111.2	C19	T17-C19 PolarHBondContact O-N 3.17Å; T17-C19 VanDerWaalsContact O-N 3.17Å
18	D	41.7	Very low	65.7	Low	157 Å²	157	114.5 Å²	114.5	84%	0.84	57%	0.569	S	S	*	*			trans	-73.2	98.5	178.9	-172.1	20.8	0	0	0	111.3	K20	D18-K20 PolarHBondContact O-N 3.38Å
19	C	42.4	Very low	66.5	Low	104 Å²	104	111.8 Å²	111.8	70%	0.703	57%	0.565	S	S	*	*			trans	-84.9	97.8	-178.1	-72.8	0	0	0	0	111.1	T17 E21	T17-C19 PolarHBondContact O-N 3.17Å; T17-C19 VanDerWaalsContact O-N 3.17Å; C19-E21 PolarHBondContact O-N 3.37Å
20	K	49.7	Very low	67.5	Low	196 Å²	196	110.1 Å²	110.1	85%	0.852	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-52.5	127.5	161.5	-79.1	-175.9	172.9	-179.2	0	110.1	D18	D18-K20 PolarHBondContact O-N 3.38Å
21	E	57.5	Low	68.8	Low	148 Å²	148	110.5 Å²	110.5	69%	0.692	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-64.2	139.1	171.5	-65.1	-172	106.7	0	0	110.3	C19 E52	C19-E21 PolarHBondContact O-N 3.37Å; E21-E52 HydrophobicContact CB-CG 4.09Å
22	E	62	Low	69.9	Low	122 Å²	122	106.6 Å²	106.6	57%	0.57	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-75	139.3	-179.3	-64.3	175	129.2	0	0	110.6	R24	E22-R24 VanDerWaalsContact O-CG 3.31Å; E22-R24 WeakPolarHBondContact O-CG 3.36Å; E22-R24 PolarHBondContact O-N 2.82Å; E22-R24 IonicContact OE2-CZ 2.69Å; E22-R24 IonicContact OE2-NE 3.74Å; E22-R24 IonicContact OE2-NH2 3.69Å; E22-R24 PolarHBondContact OE2-NH2 3.04Å
23	P	75.4	Confident	71.2	Confident	87 Å²	87	110.4 Å²	110.4	57%	0.565	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-60.4	122.4	174.4	24	-33.1	0	0	0	111.1	E52 H106	P23-E52 WeakPolarHBondContact CA-O 3.42Å; P23-H106 VanDerWaalsContact CB-CE1 3.44Å; P23-H106 WeakPolarHBondContact CB-CE1 3.46Å; P23-H106 WeakPolarHBondContact CB-NE2 3.36Å
24	R	83.4	Confident	72.6	Confident	136 Å²	136	110.1 Å²	110.1	51%	0.513	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	130.1	-170.1	-76.7	164.1	-174.3	176.7	5.6	111.5	E22 G51 E52 N104	E22-R24 VanDerWaalsContact O-CG 3.31Å; E22-R24 WeakPolarHBondContact O-CG 3.36Å; E22-R24 PolarHBondContact O-N 2.82Å; E22-R24 IonicContact OE2-CZ 2.69Å; E22-R24 IonicContact OE2-NE 3.74Å; E22-R24 IonicContact OE2-NH2 3.69Å; E22-R24 PolarHBondContact OE2-NH2 3.04Å; R24-G51 WeakPolarHBondContact O-CA 3.47Å; R24-E52 PolarHBondContact N-O 2.97Å; R24-E52 PolarHBondContact O-N 2.88Å; R24-E52 VanDerWaalsContact O-N 3.12Å; R24-N104 PolarHBondContact O-ND2 2.99Å
25	K	86.3	Confident	74.2	Confident	149 Å²	149	105.3 Å²	105.3	65%	0.648	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	158	173.7	70.3	174.8	-175.2	174.3	0	111.7
26	P	90.1	Very high	75.9	Confident	2 Å²	2	97.1 Å²	97.1	1%	0.013	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	137.7	-173.6	-23.8	37	0	0	0	115.5	E50 V55 A102 N104 G107 N109	P26-E50 CarbonylContact C-O 3.55Å; P26-E50 VanDerWaalsContact CA-O 3.3Å; P26-E50 WeakPolarHBondContact CA-O 3.5Å; P26-V55 HydrophobicContact CB-CG1 3.87Å; P26-V55 HydrophobicContact CB-CG2 4.03Å; P26-V55 HydrophobicContact CG-CG1 3.99Å; P26-V55 HydrophobicContact CG-CG2 4.11Å; P26-A102 HydrophobicContact CB-CB 3.76Å; P26-A102 WeakPolarHBondContact CG-O 3.49Å; P26-N104 HydrophobicContact CG-CB 4.32Å; P26-G107 VanDerWaalsContact CD-O 3.25Å; P26-G107 WeakPolarHBondContact CD-O 3.28Å; P26-N109 HydrophobicContact CB-CB 4.46Å; P26-N109 WeakPolarHBondContact O-CB 3.47Å; P26-N109 PolarHBondContact O-ND2 3.03Å
27	L	90.4	Very high	77.5	Confident	113 Å²	113	92.4 Å²	92.4	59%	0.592	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.4	123.6	178.5	178.7	66.2	0	0	0	110.2	I29 A49 E50	L27-I29 PolarHBondContact O-N 2.92Å; L27-A49 CarbonylContact O-C 3.51Å; L27-A49 WeakPolarHBondContact O-CA 3.48Å; L27-A49 WeakPolarHBondContact O-CB 3.43Å; L27-E50 PolarHBondContact N-O 2.89Å; L27-E50 PolarHBondContact O-N 2.82Å
28	F	90.6	Very high	79.2	Confident	36 Å²	36	91.3 Å²	91.3	16%	0.158	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	125.5	-179.6	-64.5	-78.6	0	0	0	112.6	Y31 R48 A49 C100 A102 N109 S111	F28-Y31 HydrophobicContact CB-CD1 4.49Å; F28-R48 WeakPolarHBondContact CA-O 3.42Å; F28-A49 HydrophobicContact CD1-CB 3.97Å; F28-A49 HydrophobicContact CE1-CB 4.34Å; F28-A49 HydrophobicContact CG-CB 4.46Å; F28-C100 VanDerWaalsContact CE1-SG 3.56Å; F28-A102 HydrophobicContact CD1-CB 4.34Å; F28-A102 HydrophobicContact CE1-CB 3.52Å; F28-A102 HydrophobicContact CE2-CB 4.33Å; F28-A102 HydrophobicContact CZ-CB 3.52Å; F28-N109 HydrophobicContact CE2-CB 3.93Å; F28-N109 VanDerWaalsContact CZ-O 3.29Å; F28-N109 WeakPolarHBondContact CZ-O 3.43Å; F28-S111 VanDerWaalsContact CZ-N 3.31Å
29	I	89.9	Confident	81.2	Confident	106 Å²	106	87.4 Å²	87.4	54%	0.544	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-41.7	162.7	-32.1	171.1	0	0	0	109.4	L27 R48 E50	L27-I29 PolarHBondContact O-N 2.92Å; I29-R48 HydrophobicContact CD1-CB 4.26Å; I29-R48 PolarHBondContact N-O 2.84Å; I29-E50 HydrophobicContact CD1-CG 3.72Å; I29-E50 WeakPolarHBondContact CD1-OE1 3.32Å; I29-E50 HydrophobicContact CG1-CG 3.77Å
30	E	90.7	Very high	83.1	Confident	46 Å²	46	91.8 Å²	91.8	22%	0.215	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	139	-173.9	-177.6	159.2	-129.2	0	0	109.2	R33 F46 C47 R48	E30-R33 IonicContact OE1-NH2 3.14Å; E30-R33 PolarHBondContact OE1-NH2 3.06Å; E30-F46 HydrophobicContact CG-CB 3.88Å; E30-C47 WeakPolarHBondContact O-CA 3.41Å; E30-R48 HydrophobicContact CB-CB 4.24Å; E30-R48 PolarHBondContact N-O 3.11Å; E30-R48 VanDerWaalsContact N-O 3.12Å; E30-R48 PolarHBondContact O-N 2.92Å; E30-R48 VanDerWaalsContact O-O 3.09Å; E30-R48 IonicContact OE2-CZ 3.81Å; E30-R48 IonicContact OE2-NH1 2.69Å
31	Y	91.3	Very high	84.7	Confident	109 Å²	109	87.6 Å²	87.6	43%	0.427	40%	0.402	S	S	.	.			trans	-135.7	158.4	-175.7	49.3	-91.2	0	0	0	109.9	F28 F46 P112	F28-Y31 HydrophobicContact CB-CD1 4.49Å; Y31-F46 CarbonylContact C-O 3.58Å; Y31-P112 HydrophobicContact CD2-CB 4.38Å; Y31-P112 HydrophobicContact CD2-CG 3.92Å; Y31-P112 HydrophobicContact CE2-CG 4.04Å; Y31-P112 HydrophobicContact CG-CG 4.44Å
32	P	92.9	Very high	86.2	Confident	4 Å²	4	86.3 Å²	86.3	3%	0.026	40%	0.396	C	S	.	.			trans	-57.7	145.4	177	22.8	-34.6	0	0	0	111.3	L45 F46 W59 S111 A114	P32-L45 HydrophobicContact CB-CB 4.43Å; P32-F46 WeakPolarHBondContact CA-O 3.36Å; P32-F46 WeakPolarHBondContact CD-O 3.34Å; P32-W59 HydrophobicContact CB-CH2 3.82Å; P32-W59 HydrophobicContact CB-CZ3 3.78Å; P32-W59 HydrophobicContact CG-CH2 3.97Å; P32-W59 HydrophobicContact CG-CZ3 3.78Å; P32-S111 WeakPolarHBondContact CG-OG 3.49Å; P32-A114 HydrophobicContact CB-CB 3.77Å; P32-A114 HydrophobicContact CG-CB 4.48Å
33	R	91.8	Very high	87.5	Confident	164 Å²	164	81.4 Å²	81.4	62%	0.619	37%	0.374	S	S	*	.			trans	-125.4	155	175.4	-47.9	178.7	-150.2	-133.1	2.6	107.7	E30 A35 A114	E30-R33 IonicContact OE1-NH2 3.14Å; E30-R33 PolarHBondContact OE1-NH2 3.06Å; R33-A35 PolarHBondContact O-N 3.24Å; R33-A114 WeakPolarHBondContact O-CB 3.42Å
34	D	90.5	Very high	88.3	Confident	98 Å²	98	82.4 Å²	82.4	52%	0.524	37%	0.366	S	S	.	.			trans	-50.3	130.6	179.2	-60.3	-14.8	0	0	0	110.9	F36 A114 L115	D34-F36 HydrophobicContact CB-CE2 3.88Å; D34-F36 HydrophobicContact CB-CZ 4.23Å; D34-A114 WeakPolarHBondContact OD1-CA 3.33Å; D34-L115 CarbonylContact C-O 3.55Å; D34-L115 VanDerWaalsContact CA-O 3.23Å; D34-L115 WeakPolarHBondContact CA-O 3.38Å; D34-L115 PolarHBondContact OD1-N 3.46Å
35	A	89	Confident	88.7	Confident	14 Å²	14	76.1 Å²	76.1	12%	0.116	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-133.6	126.3	-171	0	0	0	0	0	111.1	R33 P37 L43 L45 L115 V116 K117	R33-A35 PolarHBondContact O-N 3.24Å; A35-P37 VanDerWaalsContact C-CD 3.45Å; A35-P37 WeakPolarHBondContact O-CD 3.42Å; A35-L43 HydrophobicContact CB-CD1 3.73Å; A35-L43 HydrophobicContact CB-CD2 4.13Å; A35-L45 HydrophobicContact CB-CD2 3.76Å; A35-L115 PolarHBondContact N-O 2.81Å; A35-V116 HydrophobicContact CB-CG2 4.33Å; A35-V116 WeakPolarHBondContact O-CA 3.04Å; A35-K117 PolarHBondContact O-N 2.85Å; A35-K117 VanDerWaalsContact O-N 3.16Å
36	F	87.2	Confident	89	Confident	48 Å²	48	72.8 Å²	72.8	21%	0.211	33%	0.328	C	S	.	.			trans	-118.7	80.7	-177.6	-56.4	-83.6	0	0	0	109.1	D34 K117 A119 S150 P151	D34-F36 HydrophobicContact CB-CE2 3.88Å; D34-F36 HydrophobicContact CB-CZ 4.23Å; F36-K117 WeakPolarHBondContact CA-O 3.45Å; F36-K117 HydrophobicContact CD1-CB 4.1Å; F36-K117 HydrophobicContact CE1-CB 4.1Å; F36-A119 HydrophobicContact CB-CB 4.09Å; F36-A119 WeakPolarHBondContact O-CB 3.47Å; F36-S150 WeakPolarHBondContact CD1-OG 3.35Å; F36-S150 WeakPolarHBondContact CE1-OG 3.49Å; F36-P151 HydrophobicContact CB-CG 4.43Å; F36-P151 HydrophobicContact CD2-CB 3.77Å; F36-P151 HydrophobicContact CD2-CG 4.17Å; F36-P151 HydrophobicContact CE2-CB 4Å; F36-P151 HydrophobicContact CG-CB 4.14Å; F36-P151 HydrophobicContact CG-CG 4.35Å
37	P	86.9	Confident	89.1	Confident	12 Å²	12	72.7 Å²	72.7	8%	0.078	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-77.5	144.2	174.4	33.6	-38.5	0	0	0	111.8	A35 L43 F90 K117 A119	A35-P37 VanDerWaalsContact C-CD 3.45Å; A35-P37 WeakPolarHBondContact O-CD 3.42Å; P37-L43 HydrophobicContact CB-CB 4.08Å; P37-L43 HydrophobicContact CB-CD1 4.46Å; P37-L43 HydrophobicContact CG-CB 4.25Å; P37-L43 HydrophobicContact CG-CD2 3.96Å; P37-L43 HydrophobicContact CG-CG 4.49Å; P37-F90 HydrophobicContact CB-CB 4.28Å; P37-F90 HydrophobicContact CB-CD1 4.4Å; P37-F90 HydrophobicContact CB-CG 4.23Å; P37-F90 HydrophobicContact CG-CB 3.99Å; P37-F90 HydrophobicContact CG-CD1 3.47Å; P37-F90 VanDerWaalsContact CG-CD1 3.47Å; P37-F90 HydrophobicContact CG-CD2 3.74Å; P37-F90 HydrophobicContact CG-CE1 3.82Å; P37-F90 HydrophobicContact CG-CE2 4.07Å; P37-F90 HydrophobicContact CG-CG 3.42Å; P37-F90 VanDerWaalsContact CG-CG 3.42Å; P37-F90 HydrophobicContact CG-CZ 4.11Å; P37-K117 WeakPolarHBondContact CD-O 3.38Å; P37-A119 WeakPolarHBondContact O-CB 3.38Å; P37-A119 PolarHBondContact O-N 3.27Å
38	L	83.5	Confident	89.1	Confident	67 Å²	67	72 Å²	72	35%	0.351	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-61.9	148.4	164.5	-78.3	167.3	0	0	0	110.6	R40 H41 A119 A199	L38-R40 PolarHBondContact O-N 2.81Å; L38-H41 HydrophobicContact CB-CB 4.36Å; L38-H41 WeakPolarHBondContact CB-ND1 3.43Å; L38-H41 WeakPolarHBondContact O-CB 3.31Å; L38-H41 PolarHBondContact O-N 2.84Å; L38-H41 VanDerWaalsContact O-N 3.14Å; L38-A119 HydrophobicContact CD2-CB 4.42Å; L38-A199 HydrophobicContact CD2-CB 4.29Å
39	H	82.9	Confident	89.1	Confident	74 Å²	74	71.2 Å²	71.2	34%	0.343	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	141.5	178.8	-131.8	84.6	0	0	0	111.6	H41 N91 E92	H39-H41 PolarHBondContact O-N 2.8Å; H39-H41 VanDerWaalsContact O-N 3.11Å; H39-H41 PolarHBondContact O-ND1 2.78Å; H39-N91 WeakPolarHBondContact NE2-CA 3.29Å; H39-E92 VanDerWaalsContact CE1-CG 3.44Å; H39-E92 WeakPolarHBondContact CE1-CG 3.4Å; H39-E92 PolarHBondContact CE1-N 2.92Å; H39-E92 VanDerWaalsContact CE1-N 3.3Å; H39-E92 PolarHBondContact NE2-N 2.74Å
40	R	83	Confident	89	Confident	197 Å²	197	71.8 Å²	71.8	74%	0.743	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	8.7	-176.1	-51.1	-178.4	-178.9	173.6	0.4	116.1	L38 S89 F90	L38-R40 PolarHBondContact O-N 2.81Å; R40-S89 WeakPolarHBondContact CA-OG 3.49Å; R40-F90 PolarHBondContact N-O 2.82Å
41	H	84.3	Confident	88.7	Confident	107 Å²	107	70.6 Å²	70.6	50%	0.495	32%	0.318	S	S	.	.	S	Bend	trans	-87.9	160.8	173.8	-69.3	59	0	0	0	111.2	L38 H39 F90	L38-H41 HydrophobicContact CB-CB 4.36Å; L38-H41 WeakPolarHBondContact CB-ND1 3.43Å; L38-H41 WeakPolarHBondContact O-CB 3.31Å; L38-H41 PolarHBondContact O-N 2.84Å; L38-H41 VanDerWaalsContact O-N 3.14Å; H39-H41 PolarHBondContact O-N 2.8Å; H39-H41 VanDerWaalsContact O-N 3.11Å; H39-H41 PolarHBondContact O-ND1 2.78Å; H41-F90 WeakPolarHBondContact O-CB 3.32Å; H41-F90 PolarHBondContact O-N 3.06Å
42	Q	88.5	Confident	88.3	Confident	122 Å²	122	68.8 Å²	68.8	57%	0.57	31%	0.313	S	S	*	.			trans	-76.8	125.5	174.7	-171.4	-177.8	5.7	0	0	110.3	I86 F87	Q42-I86 HydrophobicContact CG-CG2 4.07Å; Q42-I86 VanDerWaalsContact NE2-CG2 3.29Å; Q42-F87 VanDerWaalsContact CA-O 3.29Å; Q42-F87 WeakPolarHBondContact CA-O 3.43Å; Q42-F87 VanDerWaalsContact CG-O 3.27Å; Q42-F87 WeakPolarHBondContact CG-O 3.38Å
43	L	88.9	Confident	87.8	Confident	18 Å²	18	70.9 Å²	70.9	9%	0.094	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	149.1	170.1	173.6	63.8	0	0	0	110.3	A35 P37 L45 I86 F87 F90 V116	A35-L43 HydrophobicContact CB-CD1 3.73Å; A35-L43 HydrophobicContact CB-CD2 4.13Å; P37-L43 HydrophobicContact CB-CB 4.08Å; P37-L43 HydrophobicContact CB-CD1 4.46Å; P37-L43 HydrophobicContact CG-CB 4.25Å; P37-L43 HydrophobicContact CG-CD2 3.96Å; P37-L43 HydrophobicContact CG-CG 4.49Å; L43-L45 HydrophobicContact CD1-CD2 4.38Å; L43-L45 HydrophobicContact CD2-CD2 4.16Å; L43-L45 HydrophobicContact CD2-CG 4.4Å; L43-L45 HydrophobicContact CG-CD2 4.42Å; L43-I86 WeakPolarHBondContact O-CA 3.29Å; L43-F87 HydrophobicContact CB-CB 4.09Å; L43-F87 HydrophobicContact CB-CD2 3.68Å; L43-F87 HydrophobicContact CB-CG 4.17Å; L43-F87 HydrophobicContact CD2-CD2 3.66Å; L43-F87 HydrophobicContact CD2-CE2 3.64Å; L43-F87 HydrophobicContact CD2-CG 4.45Å; L43-F87 HydrophobicContact CD2-CZ 4.38Å; L43-F87 HydrophobicContact CG-CD2 3.71Å; L43-F87 HydrophobicContact CG-CE2 4.06Å; L43-F87 PolarHBondContact N-O 2.86Å; L43-F87 VanDerWaalsContact N-O 3.11Å; L43-F87 PolarHBondContact O-N 2.84Å; L43-F90 HydrophobicContact CD2-CD2 4.17Å; L43-F90 HydrophobicContact CD2-CE2 4.38Å; L43-V116 HydrophobicContact CD2-CG1 3.37Å
44	R	91.6	Very high	87.4	Confident	108 Å²	108	70.4 Å²	70.4	41%	0.408	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	129.4	165.2	-174.3	-179	-54.9	-159.1	13.9	110.5	F46 E84 L85 I86	R44-F46 HydrophobicContact CG-CE1 4.35Å; R44-F46 HydrophobicContact CG-CE2 4.37Å; R44-F46 HydrophobicContact CG-CZ 4.18Å; R44-E84 WeakPolarHBondContact CD-OE2 3.32Å; R44-E84 HydrophobicContact CG-CB 4.22Å; R44-E84 IonicContact CZ-OE2 3.26Å; R44-E84 IonicContact NE-OE2 3.84Å; R44-E84 IonicContact NH1-OE2 3.75Å; R44-E84 PolarHBondContact NH1-OE2 2.91Å; R44-L85 CarbonylContact C-O 2.87Å; R44-L85 VanDerWaalsContact CA-O 3.31Å; R44-L85 WeakPolarHBondContact CA-O 3.42Å; R44-I86 HydrophobicContact CB-CG1 4.24Å; R44-I86 HydrophobicContact CG-CG1 3.87Å
45	L	92.5	Very high	87.3	Confident	4 Å²	4	66.8 Å²	66.8	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.5	167.3	-55.9	176	0	0	0	109.2	P32 A35 L43 W59 E84 L85 F87 Y98 V116	P32-L45 HydrophobicContact CB-CB 4.43Å; A35-L45 HydrophobicContact CB-CD2 3.76Å; L43-L45 HydrophobicContact CD1-CD2 4.38Å; L43-L45 HydrophobicContact CD2-CD2 4.16Å; L43-L45 HydrophobicContact CD2-CG 4.4Å; L43-L45 HydrophobicContact CG-CD2 4.42Å; L45-W59 HydrophobicContact CB-CH2 3.42Å; L45-W59 VanDerWaalsContact CB-CH2 3.42Å; L45-W59 HydrophobicContact CB-CZ2 4.16Å; L45-W59 HydrophobicContact CB-CZ3 3.82Å; L45-W59 HydrophobicContact CD1-CH2 4.33Å; L45-W59 HydrophobicContact CD1-CZ3 3.84Å; L45-E84 CarbonylContact O-C 3.54Å; L45-E84 WeakPolarHBondContact O-CA 3.4Å; L45-L85 HydrophobicContact CB-CB 4.47Å; L45-L85 HydrophobicContact CD1-CD2 4.33Å; L45-L85 PolarHBondContact N-O 2.02Å; L45-L85 PolarHBondContact O-N 2.87Å; L45-F87 HydrophobicContact CD1-CE2 3.93Å; L45-F87 HydrophobicContact CD1-CZ 4.29Å; L45-F87 HydrophobicContact CG-CE2 4.05Å; L45-Y98 HydrophobicContact CD1-CD1 4.06Å; L45-Y98 HydrophobicContact CD1-CD2 4.39Å; L45-Y98 HydrophobicContact CD1-CG 3.77Å; L45-V116 HydrophobicContact CD1-CG2 3.88Å; L45-V116 HydrophobicContact CD2-CG2 3.99Å
46	F	92.9	Very high	87.4	Confident	79 Å²	79	69.4 Å²	69.4	35%	0.346	33%	0.334	S	S	.	.			trans	-93.9	139.2	179.7	-62.1	-88.1	0	0	0	110.6	E30 Y31 P32 R44 E84	E30-F46 HydrophobicContact CG-CB 3.88Å; Y31-F46 CarbonylContact C-O 3.58Å; P32-F46 WeakPolarHBondContact CA-O 3.36Å; P32-F46 WeakPolarHBondContact CD-O 3.34Å; R44-F46 HydrophobicContact CG-CE1 4.35Å; R44-F46 HydrophobicContact CG-CE2 4.37Å; R44-F46 HydrophobicContact CG-CZ 4.18Å; F46-E84 HydrophobicContact CD1-CG 3.96Å
47	C	92.3	Very high	87.6	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.331	C	S	.	.			trans	-150	122.8	168.8	178.9	0	0	0	0	108.9	E30 I57 W59 C100	E30-C47 WeakPolarHBondContact O-CA 3.41Å; C47-I57 HydrophobicContact CB-CG2 4.13Å; C47-W59 HydrophobicContact CB-CH2 3.77Å; C47-W59 HydrophobicContact CB-CZ2 3.3Å; C47-C100 HydrophobicContact CB-CB 3.73Å; C47-C100 WeakPolarHBondContact CB-SG 3.38Å; C47-C100 WeakPolarHBondContact SG-CB 3.35Å; C47-C100 CovalentContact SG-SG 2.02Å; C47-C100 PolarHBondContact SG-SG 2.88Å
48	R	91.2	Very high	87.9	Confident	99 Å²	99	70 Å²	70	37%	0.374	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	131.8	-178	-61.3	178.4	178.8	163.9	-1	109.4	F28 I29 E30 E84	F28-R48 WeakPolarHBondContact CA-O 3.42Å; I29-R48 HydrophobicContact CD1-CB 4.26Å; I29-R48 PolarHBondContact N-O 2.84Å; E30-R48 HydrophobicContact CB-CB 4.24Å; E30-R48 PolarHBondContact N-O 3.11Å; E30-R48 VanDerWaalsContact N-O 3.12Å; E30-R48 PolarHBondContact O-N 2.92Å; E30-R48 VanDerWaalsContact O-O 3.09Å; E30-R48 IonicContact OE2-CZ 3.81Å; E30-R48 IonicContact OE2-NH1 2.69Å; R48-E84 IonicContact CZ-OE1 2.67Å; R48-E84 IonicContact NE-OE1 3.16Å; R48-E84 IonicContact NH2-OE1 2.92Å; R48-E84 PolarHBondContact NH2-OE1 3.35Å
49	A	89.4	Confident	88.4	Confident	20 Å²	20	66.9 Å²	66.9	17%	0.165	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	141.8	179.6	0	0	0	0	0	111.3	L27 F28 V55 I57 A102	L27-A49 CarbonylContact O-C 3.51Å; L27-A49 WeakPolarHBondContact O-CA 3.48Å; L27-A49 WeakPolarHBondContact O-CB 3.43Å; F28-A49 HydrophobicContact CD1-CB 3.97Å; F28-A49 HydrophobicContact CE1-CB 4.34Å; F28-A49 HydrophobicContact CG-CB 4.46Å; A49-V55 HydrophobicContact CB-CG1 4.15Å; A49-I57 HydrophobicContact CB-CD1 4.18Å; A49-A102 HydrophobicContact CB-CB 3.62Å
50	E	88.9	Confident	89	Confident	118 Å²	118	65.9 Å²	65.9	55%	0.551	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	150.2	172.5	-70.5	170.3	-171.4	0	0	110	P26 L27 I29	P26-E50 CarbonylContact C-O 3.55Å; P26-E50 VanDerWaalsContact CA-O 3.3Å; P26-E50 WeakPolarHBondContact CA-O 3.5Å; L27-E50 PolarHBondContact N-O 2.89Å; L27-E50 PolarHBondContact O-N 2.82Å; I29-E50 HydrophobicContact CD1-CG 3.72Å; I29-E50 WeakPolarHBondContact CD1-OE1 3.32Å; I29-E50 HydrophobicContact CG1-CG 3.77Å
51	G	84.2	Confident	89.4	Confident	21 Å²	21	58.7 Å²	58.7	22%	0.216	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.6	143.7	-179.1	0	0	0	0	0	109.3	R24 P53	R24-G51 WeakPolarHBondContact O-CA 3.47Å; G51-P53 CarbonylContact C-O 3.54Å; G51-P53 CarbonylContact O-C 3.53Å; G51-P53 VanDerWaalsContact O-O 3.14Å
52	E	82.6	Confident	89.8	Confident	71 Å²	71	57.6 Å²	57.6	33%	0.332	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	123.2	-174.9	176.6	48.6	-140.2	0	0	109	E21 P23 R24 N104 H106	E21-E52 HydrophobicContact CB-CG 4.09Å; P23-E52 WeakPolarHBondContact CA-O 3.42Å; R24-E52 PolarHBondContact N-O 2.97Å; R24-E52 PolarHBondContact O-N 2.88Å; R24-E52 VanDerWaalsContact O-N 3.12Å; E52-N104 PolarHBondContact N-ND2 3.24Å; E52-N104 PolarHBondContact O-ND2 3.31Å; E52-H106 PolarHBondContact O-CD2 3.1Å; E52-H106 VanDerWaalsContact O-CD2 3.22Å
53	P	81.8	Confident	89.8	Confident	47 Å²	47	54.1 Å²	54.1	31%	0.305	29%	0.286	S	S	.	.	S	Bend	cis	-68.9	165	-2.9	31.2	-35.7	0	0	0	114	G51 V55 N104 V105	G51-P53 CarbonylContact C-O 3.54Å; G51-P53 CarbonylContact O-C 3.53Å; G51-P53 VanDerWaalsContact O-O 3.14Å; P53-V55 PolarHBondContact O-N 3.45Å; P53-N104 VanDerWaalsContact O-CB 3.23Å; P53-N104 WeakPolarHBondContact O-CB 3.48Å; P53-N104 PolarHBondContact O-ND2 2.72Å; P53-V105 HydrophobicContact CG-CG2 3.66Å
54	I	83.3	Confident	90	Very high	154 Å²	154	61.1 Å²	61.1	79%	0.79	32%	0.315	S	S	*	.			trans	-34.6	127.6	-175.7	-59.3	171.9	0	0	0	113.4
55	V	89.2	Confident	90	Very high	22 Å²	22	59.5 Å²	59.5	13%	0.133	32%	0.318	C	S	.	.			trans	-76.9	132.2	-176.6	-174.9	0	0	0	0	112.6	P26 A49 P53 I57 A102	P26-V55 HydrophobicContact CB-CG1 3.87Å; P26-V55 HydrophobicContact CB-CG2 4.03Å; P26-V55 HydrophobicContact CG-CG1 3.99Å; P26-V55 HydrophobicContact CG-CG2 4.11Å; A49-V55 HydrophobicContact CB-CG1 4.15Å; P53-V55 PolarHBondContact O-N 3.45Å; V55-I57 HydrophobicContact CG1-CD1 3.95Å; V55-A102 HydrophobicContact CG1-CB 3.77Å
56	S	91.3	Very high	89.8	Confident	69 Å²	69	59.8 Å²	59.8	48%	0.483	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	131.9	167.8	-176.3	0	0	0	0	111.1	S103	S56-S103 PolarHBondContact N-O 3.16Å; S56-S103 PolarHBondContact O-N 3.47Å; S56-S103 PolarHBondContact O-OG 2.89Å; S56-S103 VanDerWaalsContact O-OG 3.13Å
57	I	91.8	Very high	89.6	Confident	29 Å²	29	60.3 Å²	60.3	15%	0.149	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	119.1	-179.2	-55.4	-60.2	0	0	0	110.3	C47 A49 V55 C100 A102	C47-I57 HydrophobicContact CB-CG2 4.13Å; A49-I57 HydrophobicContact CB-CD1 4.18Å; V55-I57 HydrophobicContact CG1-CD1 3.95Å; I57-C100 HydrophobicContact CG2-CB 3.97Å; I57-A102 HydrophobicContact CD1-CB 3.8Å
58	T	92	Very high	89.2	Confident	45 Å²	45	61.1 Å²	61.1	28%	0.276	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.4	175	-58.5	0	0	0	0	110.2	Y60 V65 C100 N101	T58-Y60 HydrophobicContact CG2-CD2 4.38Å; T58-Y60 HydrophobicContact CG2-CE2 3.72Å; T58-V65 HydrophobicContact CG2-CG1 4.15Å; T58-C100 CarbonylContact O-C 3.44Å; T58-C100 WeakPolarHBondContact O-CA 3.06Å; T58-N101 PolarHBondContact N-O 2.86Å; T58-N101 PolarHBondContact O-N 2.9Å
59	W	94.4	Very high	88.6	Confident	1 Å²	1	60.8 Å²	60.8	0%	0.004	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	144	178.4	-75.1	85.9	0	0	0	113	P32 L45 C47 V65 V66 I79 G83 L85 C100	P32-W59 HydrophobicContact CB-CH2 3.82Å; P32-W59 HydrophobicContact CB-CZ3 3.78Å; P32-W59 HydrophobicContact CG-CH2 3.97Å; P32-W59 HydrophobicContact CG-CZ3 3.78Å; L45-W59 HydrophobicContact CB-CH2 3.42Å; L45-W59 VanDerWaalsContact CB-CH2 3.42Å; L45-W59 HydrophobicContact CB-CZ2 4.16Å; L45-W59 HydrophobicContact CB-CZ3 3.82Å; L45-W59 HydrophobicContact CD1-CH2 4.33Å; L45-W59 HydrophobicContact CD1-CZ3 3.84Å; C47-W59 HydrophobicContact CB-CH2 3.77Å; C47-W59 HydrophobicContact CB-CZ2 3.3Å; W59-V65 WeakPolarHBondContact O-CA 3.41Å; W59-V66 HydrophobicContact CB-CB 3.95Å; W59-V66 HydrophobicContact CB-CG2 3.83Å; W59-V66 PolarHBondContact O-N 3.41Å; W59-I79 HydrophobicContact CB-CD1 4.34Å; W59-I79 HydrophobicContact CG-CD1 4.43Å; W59-G83 PolarHBondContact NE1-O 2.84Å; W59-L85 HydrophobicContact CB-CD2 4.37Å; W59-L85 HydrophobicContact CD2-CB 3.64Å; W59-L85 HydrophobicContact CD2-CD2 4.05Å; W59-L85 HydrophobicContact CD2-CG 4.48Å; W59-L85 HydrophobicContact CE3-CB 4.14Å; W59-L85 HydrophobicContact CE3-CD2 4.02Å; W59-L85 HydrophobicContact CG-CB 3.98Å; W59-L85 HydrophobicContact CG-CD2 4.22Å; W59-L85 HydrophobicContact CH2-CB 4.39Å; W59-L85 HydrophobicContact CZ2-CB 3.91Å; W59-L85 HydrophobicContact CZ3-CB 4.49Å; W59-C100 HydrophobicContact CD2-CB 4.09Å; W59-C100 HydrophobicContact CE3-CB 4.2Å; W59-C100 HydrophobicContact CZ2-CB 4.41Å; W59-C100 HydrophobicContact CZ3-CB 4.41Å
60	Y	94.6	Very high	88.2	Confident	53 Å²	53	71.3 Å²	71.3	21%	0.208	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.5	174.7	-67.7	-104.5	0	0	0	110.5	T58 K64 V65 Y98 Y99 N101	T58-Y60 HydrophobicContact CG2-CD2 4.38Å; T58-Y60 HydrophobicContact CG2-CE2 3.72Å; Y60-K64 CarbonylContact C-O 3.6Å; Y60-K64 WeakPolarHBondContact CA-O 3.06Å; Y60-V65 HydrophobicContact CD1-CG2 4.07Å; Y60-V65 HydrophobicContact CE1-CG2 3.58Å; Y60-Y98 WeakPolarHBondContact O-CA 3.39Å; Y60-Y99 VanDerWaalsContact CB-CE2 3.43Å; Y60-Y99 HydrophobicContact CD1-CE2 4.16Å; Y60-Y99 HydrophobicContact CD2-CD2 4.14Å; Y60-Y99 AromaticContact CD2-CE2 3.65Å; Y60-Y99 HydrophobicContact CD2-CE2 3.65Å; Y60-Y99 HydrophobicContact CE2-CE2 4.45Å; Y60-Y99 HydrophobicContact CG-CD2 4.21Å; Y60-Y99 AromaticContact CG-CE2 3.49Å; Y60-Y99 HydrophobicContact CG-CE2 3.49Å; Y60-Y99 VanDerWaalsContact CG-CE2 3.49Å; Y60-Y99 AromaticContact CG-CZ 3.67Å; Y60-Y99 PolarHBondContact N-O 2.91Å; Y60-Y99 PolarHBondContact O-N 3.2Å; Y60-N101 HydrophobicContact CD2-CB 4.26Å; Y60-N101 HydrophobicContact CE2-CB 3.7Å
61	K	93	Very high	87.8	Confident	45 Å²	45	71.5 Å²	71.5	20%	0.196	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	120.9	170.2	-175.3	-160.6	-168.2	-164.5	0	108.4	G63 K64 V66 E93 E95 H97 Y98	K61-G63 PolarHBondContact O-N 3.15Å; K61-K64 PolarHBondContact N-O 2.87Å; K61-K64 PolarHBondContact O-N 2.85Å; K61-V66 HydrophobicContact CB-CG2 3.95Å; K61-E93 PolarHBondContact NZ-O 2.91Å; K61-E95 VanDerWaalsContact CE-C 3.41Å; K61-E95 WeakPolarHBondContact CE-O 3.35Å; K61-E95 PolarHBondContact NZ-O 3.43Å; K61-H97 WeakPolarHBondContact CA-O 3.21Å; K61-Y98 HydrophobicContact CB-CD1 4.13Å; K61-Y98 HydrophobicContact CB-CE1 3.71Å; K61-Y98 HydrophobicContact CB-CE2 4.41Å; K61-Y98 HydrophobicContact CD-CE1 4.36Å; K61-Y98 HydrophobicContact CD-CE2 4.12Å; K61-Y98 VanDerWaalsContact CD-OH 3.23Å; K61-Y98 WeakPolarHBondContact CD-OH 3.45Å; K61-Y98 WeakPolarHBondContact CE-OH 3.31Å; K61-Y98 HydrophobicContact CG-CD1 4.44Å; K61-Y98 HydrophobicContact CG-CD2 4.29Å; K61-Y98 HydrophobicContact CG-CE1 3.89Å; K61-Y98 HydrophobicContact CG-CE2 3.71Å; K61-Y98 VanDerWaalsContact CG-CZ 3.48Å
62	D	91.3	Very high	87.6	Confident	85 Å²	85	75.5 Å²	75.5	46%	0.455	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	41.3	176.6	-54.4	-58.7	0	0	0	113.2	K64 G96 H97	D62-K64 PolarHBondContact O-N 3.29Å; D62-G96 VanDerWaalsContact OD2-CA 3.29Å; D62-G96 WeakPolarHBondContact OD2-CA 3.1Å; D62-H97 PolarHBondContact N-O 2.74Å; D62-H97 WeakPolarHBondContact OD1-CB 3.39Å; D62-H97 IonicContact OD1-CG 2.66Å; D62-H97 PolarHBondContact OD1-N 3.49Å; D62-H97 IonicContact OD1-ND1 2.62Å; D62-H97 PolarHBondContact OD1-ND1 3.07Å; D62-H97 VanDerWaalsContact OD1-ND1 3.14Å
63	G	89.6	Confident	87.4	Confident	48 Å²	48	77.8 Å²	77.8	50%	0.495	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	-9.6	-179.4	0	0	0	0	0	116.3	K61	K61-G63 PolarHBondContact O-N 3.15Å
64	K	91.8	Very high	87.1	Confident	165 Å²	165	79.5 Å²	79.5	72%	0.717	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	146.5	178.6	-61.6	177.4	-175.6	173.2	0	111	Y60 K61 D62	Y60-K64 CarbonylContact C-O 3.6Å; Y60-K64 WeakPolarHBondContact CA-O 3.06Å; K61-K64 PolarHBondContact N-O 2.87Å; K61-K64 PolarHBondContact O-N 2.85Å; D62-K64 PolarHBondContact O-N 3.29Å
65	V	91.5	Very high	87	Confident	75 Å²	75	73.3 Å²	73.3	46%	0.455	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	138	175.3	178.2	0	0	0	0	110	T58 W59 Y60 E67	T58-V65 HydrophobicContact CG2-CG1 4.15Å; W59-V65 WeakPolarHBondContact O-CA 3.41Å; Y60-V65 HydrophobicContact CD1-CG2 4.07Å; Y60-V65 HydrophobicContact CE1-CG2 3.58Å; V65-E67 PolarHBondContact O-N 3.4Å
66	V	89.7	Confident	86.6	Confident	9 Å²	9	72.8 Å²	72.8	6%	0.055	39%	0.392	C	S	.	.			trans	-74.2	111.7	177.9	179.3	0	0	0	0	110.3	W59 K61 N77 L85 Y98	W59-V66 HydrophobicContact CB-CB 3.95Å; W59-V66 HydrophobicContact CB-CG2 3.83Å; W59-V66 PolarHBondContact O-N 3.41Å; K61-V66 HydrophobicContact CB-CG2 3.95Å; V66-N77 HydrophobicContact CG1-CB 4.11Å; V66-L85 HydrophobicContact CG1-CD1 3.96Å; V66-L85 HydrophobicContact CG1-CD2 4.04Å; V66-L85 HydrophobicContact CG2-CD2 4.23Å; V66-Y98 HydrophobicContact CG2-CD1 4.06Å; V66-Y98 HydrophobicContact CG2-CE1 3.78Å
67	E	87.7	Confident	86.4	Confident	90 Å²	90	69.9 Å²	69.9	42%	0.421	37%	0.371	S	S	.	.			trans	-72	126.7	173.4	-58.2	173.7	122.1	0	0	110	V65 Q71 K72 N77	V65-E67 PolarHBondContact O-N 3.4Å; E67-Q71 HydrophobicContact CB-CB 4.48Å; E67-K72 HydrophobicContact CB-CB 4.05Å; E67-K72 HydrophobicContact CB-CD 4.44Å; E67-K72 WeakPolarHBondContact OE2-CD 3.42Å; E67-K72 IonicContact OE2-NZ 2.89Å; E67-K72 PolarHBondContact OE2-NZ 2.96Å; E67-N77 WeakPolarHBondContact O-CB 3.49Å
68	T	84.6	Confident	86.2	Confident	18 Å²	18	75.7 Å²	75.7	11%	0.11	39%	0.391	C	S	.	.			trans	-88.6	167.6	173.3	66.3	0	0	0	0	111.9	R70 Q71 K72 T75 N77 I79	T68-R70 PolarHBondContact O-N 3.18Å; T68-Q71 PolarHBondContact O-N 2.8Å; T68-Q71 PolarHBondContact OG1-OE1 3.48Å; T68-K72 PolarHBondContact O-N 2.94Å; T68-T75 VanDerWaalsContact C-CG2 3.48Å; T68-N77 CarbonylContact C-O 3.35Å; T68-N77 WeakPolarHBondContact CA-O 3.35Å; T68-I79 HydrophobicContact CG2-CB 4.33Å; T68-I79 HydrophobicContact CG2-CD1 3.84Å; T68-I79 HydrophobicContact CG2-CG1 3.88Å
69	Q	78.4	Confident	86	Confident	92 Å²	92	76.1 Å²	76.1	43%	0.43	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-22.8	174.1	-80.7	-170.5	-21.8	0	0	115.2	T75 N77	Q69-T75 HydrophobicContact CB-CG2 4.49Å; Q69-T75 HydrophobicContact CG-CG2 3.95Å; Q69-T75 WeakPolarHBondContact CG-O 3.43Å; Q69-T75 PolarHBondContact NE2-O 3.2Å; Q69-N77 PolarHBondContact N-O 3.02Å
70	R	79.7	Confident	85.6	Confident	241 Å²	241	77.6 Å²	77.6	91%	0.909	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-20.9	175.5	-67.8	-177.1	174.9	-177.5	-2.4	113.7	T68	T68-R70 PolarHBondContact O-N 3.18Å
71	Q	81.4	Confident	85	Confident	121 Å²	121	83.8 Å²	83.8	57%	0.565	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-37.5	-179.3	-67.6	155.1	-71	0	0	111.1	E67 T68	E67-Q71 HydrophobicContact CB-CB 4.48Å; T68-Q71 PolarHBondContact O-N 2.8Å; T68-Q71 PolarHBondContact OG1-OE1 3.48Å
72	K	80.7	Confident	84.3	Confident	106 Å²	106	84.2 Å²	84.2	46%	0.461	45%	0.449	S	S	.	.	S	Bend	trans	-136.9	102.3	-179.9	-178.4	168.8	170.3	179.4	0	111.2	E67 T68 G74 T75	E67-K72 HydrophobicContact CB-CB 4.05Å; E67-K72 HydrophobicContact CB-CD 4.44Å; E67-K72 WeakPolarHBondContact OE2-CD 3.42Å; E67-K72 IonicContact OE2-NZ 2.89Å; E67-K72 PolarHBondContact OE2-NZ 2.96Å; T68-K72 PolarHBondContact O-N 2.94Å; K72-G74 PolarHBondContact O-N 3.29Å; K72-T75 WeakPolarHBondContact O-CG2 3.37Å; K72-T75 PolarHBondContact O-N 3.3Å
73	P	77.4	Confident	83.9	Confident	119 Å²	119	80.4 Å²	80.4	77%	0.773	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	135.1	170.2	-25.4	35.4	0	0	0	111
74	G	75.5	Confident	84	Confident	83 Å²	83	78.7 Å²	78.7	86%	0.856	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.4	-23.7	-179.5	0	0	0	0	0	115.3	K72	K72-G74 PolarHBondContact O-N 3.29Å
75	T	81.5	Confident	84	Confident	23 Å²	23	70.9 Å²	70.9	14%	0.141	38%	0.375	C	S	.	.			trans	-70.3	155.9	173.6	-169.5	0	0	0	0	112.3	T68 Q69 K72 N77	T68-T75 VanDerWaalsContact C-CG2 3.48Å; Q69-T75 HydrophobicContact CB-CG2 4.49Å; Q69-T75 HydrophobicContact CG-CG2 3.95Å; Q69-T75 WeakPolarHBondContact CG-O 3.43Å; Q69-T75 PolarHBondContact NE2-O 3.2Å; K72-T75 WeakPolarHBondContact O-CG2 3.37Å; K72-T75 PolarHBondContact O-N 3.3Å; T75-N77 VanDerWaalsContact C-N 3.33Å; T75-N77 HydrophobicContact CG2-CB 4.08Å; T75-N77 PolarHBondContact OG1-N 2.86Å; T75-N77 PolarHBondContact OG1-ND2 2.84Å
76	S	80.7	Confident	84	Confident	11 Å²	11	67.9 Å²	67.9	8%	0.077	36%	0.357	C	S	.	.			trans	-84.2	-9.2	170.5	84.3	0	0	0	0	112.9	L88 S89 D94	S76-L88 WeakPolarHBondContact O-CB 3.02Å; S76-L88 WeakPolarHBondContact O-CG 3.4Å; S76-L88 PolarHBondContact O-N 2.7Å; S76-S89 VanDerWaalsContact CB-O 3.3Å; S76-S89 WeakPolarHBondContact CB-O 3.36Å; S76-S89 PolarHBondContact OG-O 2.85Å; S76-D94 PolarHBondContact OG-OD2 3.14Å
77	N	86.7	Confident	84	Confident	9 Å²	9	67.4 Å²	67.4	5%	0.048	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	133.7	-165.6	-70.5	-46.8	0	0	0	115.5	V66 E67 T68 Q69 T75 L85 I86 F87	V66-N77 HydrophobicContact CG1-CB 4.11Å; E67-N77 WeakPolarHBondContact O-CB 3.49Å; T68-N77 CarbonylContact C-O 3.35Å; T68-N77 WeakPolarHBondContact CA-O 3.35Å; Q69-N77 PolarHBondContact N-O 3.02Å; T75-N77 VanDerWaalsContact C-N 3.33Å; T75-N77 HydrophobicContact CG2-CB 4.08Å; T75-N77 PolarHBondContact OG1-N 2.86Å; T75-N77 PolarHBondContact OG1-ND2 2.84Å; N77-L85 HydrophobicContact CB-CD1 4.24Å; N77-I86 CarbonylContact C-O 3.51Å; N77-I86 WeakPolarHBondContact CA-O 3.48Å; N77-F87 WeakPolarHBondContact OD1-CD1 3.19Å; N77-F87 WeakPolarHBondContact OD1-CE1 2.99Å
78	R	88.1	Confident	83.9	Confident	151 Å²	151	66.8 Å²	66.8	57%	0.57	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.2	122.8	175.8	176.3	179	176.7	177.4	-1.1	110.6	I86	R78-I86 PolarHBondContact N-O 2.8Å; R78-I86 WeakPolarHBondContact O-CB 3.44Å; R78-I86 PolarHBondContact O-N 2.79Å
79	I	87.7	Confident	84	Confident	54 Å²	54	67.7 Å²	67.7	28%	0.277	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	141.6	171.5	-61.1	165	0	0	0	109.4	W59 T68 E84 L85	W59-I79 HydrophobicContact CB-CD1 4.34Å; W59-I79 HydrophobicContact CG-CD1 4.43Å; T68-I79 HydrophobicContact CG2-CB 4.33Å; T68-I79 HydrophobicContact CG2-CD1 3.84Å; T68-I79 HydrophobicContact CG2-CG1 3.88Å; I79-E84 CarbonylContact C-O 3.58Å; I79-E84 WeakPolarHBondContact CA-O 3.29Å; I79-L85 HydrophobicContact CG1-CD1 3.94Å
80	T	85.9	Confident	84.4	Confident	32 Å²	32	63.3 Å²	63.3	20%	0.196	34%	0.34	C	S	.	.			trans	-92.2	161.3	175.4	76.1	0	0	0	0	112	A82 G83 E84 I86	T80-A82 PolarHBondContact O-N 2.96Å; T80-A82 PolarHBondContact OG1-N 2.91Å; T80-G83 PolarHBondContact O-N 2.8Å; T80-E84 HydrophobicContact CG2-CB 4.12Å; T80-E84 PolarHBondContact N-O 2.84Å; T80-E84 WeakPolarHBondContact OG1-CB 3.4Å; T80-E84 PolarHBondContact OG1-N 2.79Å; T80-I86 HydrophobicContact CG2-CD1 3.46Å; T80-I86 VanDerWaalsContact CG2-CD1 3.46Å; T80-I86 HydrophobicContact CG2-CG1 4.09Å
81	N	81.4	Confident	84.7	Confident	182 Å²	182	54.8 Å²	54.8	97%	0.973	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-15.2	173.5	-60.5	23.4	0	0	0	113.5
82	A	79.5	Confident	84.8	Confident	54 Å²	54	56.3 Å²	56.3	45%	0.446	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	10.3	177.3	0	0	0	0	0	113.4	T80 E84	T80-A82 PolarHBondContact O-N 2.96Å; T80-A82 PolarHBondContact OG1-N 2.91Å; A82-E84 HydrophobicContact CB-CG 4.37Å
83	G	83.2	Confident	85.1	Confident	6 Å²	6	59.7 Å²	59.7	6%	0.062	34%	0.337	C	S	.	.	S	Bend	trans	81.9	7.4	179.3	0	0	0	0	0	115.1	W59 T80	W59-G83 PolarHBondContact NE1-O 2.84Å; T80-G83 PolarHBondContact O-N 2.8Å
84	E	91	Very high	85.6	Confident	12 Å²	12	54.4 Å²	54.4	6%	0.056	30%	0.302	C	S	.	.			trans	-86.8	134.9	-177	-51.2	166.8	169.5	0	0	110.7	R44 L45 F46 R48 I79 T80 A82	R44-E84 WeakPolarHBondContact CD-OE2 3.32Å; R44-E84 HydrophobicContact CG-CB 4.22Å; R44-E84 IonicContact CZ-OE2 3.26Å; R44-E84 IonicContact NE-OE2 3.84Å; R44-E84 IonicContact NH1-OE2 3.75Å; R44-E84 PolarHBondContact NH1-OE2 2.91Å; L45-E84 CarbonylContact O-C 3.54Å; L45-E84 WeakPolarHBondContact O-CA 3.4Å; F46-E84 HydrophobicContact CD1-CG 3.96Å; R48-E84 IonicContact CZ-OE1 2.67Å; R48-E84 IonicContact NE-OE1 3.16Å; R48-E84 IonicContact NH2-OE1 2.92Å; R48-E84 PolarHBondContact NH2-OE1 3.35Å; I79-E84 CarbonylContact C-O 3.58Å; I79-E84 WeakPolarHBondContact CA-O 3.29Å; T80-E84 HydrophobicContact CG2-CB 4.12Å; T80-E84 PolarHBondContact N-O 2.84Å; T80-E84 WeakPolarHBondContact OG1-CB 3.4Å; T80-E84 PolarHBondContact OG1-N 2.79Å; A82-E84 HydrophobicContact CB-CG 4.37Å
85	L	91.7	Very high	86.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.4	172.9	174.2	61.4	0	0	0	110	R44 L45 W59 V66 N77 I79 F87 Y98	R44-L85 CarbonylContact C-O 2.87Å; R44-L85 VanDerWaalsContact CA-O 3.31Å; R44-L85 WeakPolarHBondContact CA-O 3.42Å; L45-L85 HydrophobicContact CB-CB 4.47Å; L45-L85 HydrophobicContact CD1-CD2 4.33Å; L45-L85 PolarHBondContact N-O 2.02Å; L45-L85 PolarHBondContact O-N 2.87Å; W59-L85 HydrophobicContact CB-CD2 4.37Å; W59-L85 HydrophobicContact CD2-CB 3.64Å; W59-L85 HydrophobicContact CD2-CD2 4.05Å; W59-L85 HydrophobicContact CD2-CG 4.48Å; W59-L85 HydrophobicContact CE3-CB 4.14Å; W59-L85 HydrophobicContact CE3-CD2 4.02Å; W59-L85 HydrophobicContact CG-CB 3.98Å; W59-L85 HydrophobicContact CG-CD2 4.22Å; W59-L85 HydrophobicContact CH2-CB 4.39Å; W59-L85 HydrophobicContact CZ2-CB 3.91Å; W59-L85 HydrophobicContact CZ3-CB 4.49Å; V66-L85 HydrophobicContact CG1-CD1 3.96Å; V66-L85 HydrophobicContact CG1-CD2 4.04Å; V66-L85 HydrophobicContact CG2-CD2 4.23Å; N77-L85 HydrophobicContact CB-CD1 4.24Å; I79-L85 HydrophobicContact CG1-CD1 3.94Å; L85-F87 HydrophobicContact CD2-CE2 3.96Å; L85-F87 HydrophobicContact CD2-CZ 3.81Å; L85-F87 HydrophobicContact CG-CE2 3.95Å; L85-F87 HydrophobicContact CG-CZ 4.24Å; L85-Y98 HydrophobicContact CD2-CD1 3.65Å; L85-Y98 HydrophobicContact CD2-CE1 3.66Å
86	I	90.9	Very high	86.8	Confident	12 Å²	12	52.8 Å²	52.8	6%	0.062	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.2	177.8	-64.2	175.9	0	0	0	109.7	Q42 L43 R44 N77 R78 T80 L88	Q42-I86 HydrophobicContact CG-CG2 4.07Å; Q42-I86 VanDerWaalsContact NE2-CG2 3.29Å; L43-I86 WeakPolarHBondContact O-CA 3.29Å; R44-I86 HydrophobicContact CB-CG1 4.24Å; R44-I86 HydrophobicContact CG-CG1 3.87Å; N77-I86 CarbonylContact C-O 3.51Å; N77-I86 WeakPolarHBondContact CA-O 3.48Å; R78-I86 PolarHBondContact N-O 2.8Å; R78-I86 WeakPolarHBondContact O-CB 3.44Å; R78-I86 PolarHBondContact O-N 2.79Å; T80-I86 HydrophobicContact CG2-CD1 3.46Å; T80-I86 VanDerWaalsContact CG2-CD1 3.46Å; T80-I86 HydrophobicContact CG2-CG1 4.09Å; I86-L88 HydrophobicContact CG2-CD2 4.36Å
87	F	89.9	Confident	87.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	118.2	168.5	-54.9	-104.3	0	0	0	107.1	Q42 L43 L45 N77 L85 S89 F90 D94 Y98	Q42-F87 VanDerWaalsContact CA-O 3.29Å; Q42-F87 WeakPolarHBondContact CA-O 3.43Å; Q42-F87 VanDerWaalsContact CG-O 3.27Å; Q42-F87 WeakPolarHBondContact CG-O 3.38Å; L43-F87 HydrophobicContact CB-CB 4.09Å; L43-F87 HydrophobicContact CB-CD2 3.68Å; L43-F87 HydrophobicContact CB-CG 4.17Å; L43-F87 HydrophobicContact CD2-CD2 3.66Å; L43-F87 HydrophobicContact CD2-CE2 3.64Å; L43-F87 HydrophobicContact CD2-CG 4.45Å; L43-F87 HydrophobicContact CD2-CZ 4.38Å; L43-F87 HydrophobicContact CG-CD2 3.71Å; L43-F87 HydrophobicContact CG-CE2 4.06Å; L43-F87 PolarHBondContact N-O 2.86Å; L43-F87 VanDerWaalsContact N-O 3.11Å; L43-F87 PolarHBondContact O-N 2.84Å; L45-F87 HydrophobicContact CD1-CE2 3.93Å; L45-F87 HydrophobicContact CD1-CZ 4.29Å; L45-F87 HydrophobicContact CG-CE2 4.05Å; N77-F87 WeakPolarHBondContact OD1-CD1 3.19Å; N77-F87 WeakPolarHBondContact OD1-CE1 2.99Å; L85-F87 HydrophobicContact CD2-CE2 3.96Å; L85-F87 HydrophobicContact CD2-CZ 3.81Å; L85-F87 HydrophobicContact CG-CE2 3.95Å; L85-F87 HydrophobicContact CG-CZ 4.24Å; F87-S89 VanDerWaalsContact C-N 3.31Å; F87-S89 PolarHBondContact O-N 2.77Å; F87-F90 AromaticContact CD1-CD2 3.99Å; F87-F90 HydrophobicContact CD1-CD2 3.99Å; F87-F90 HydrophobicContact CD1-CE2 4.5Å; F87-F90 HydrophobicContact CE1-CD2 4.36Å; F87-F90 HydrophobicContact CE1-CE2 4.43Å; F87-F90 HydrophobicContact CG-CD2 4.19Å; F87-D94 HydrophobicContact CD1-CB 3.75Å; F87-D94 HydrophobicContact CE1-CB 3.76Å; F87-Y98 HydrophobicContact CE1-CE1 4.1Å; F87-Y98 HydrophobicContact CE1-CE2 4.46Å; F87-Y98 AromaticContact CE1-CZ 3.73Å; F87-Y98 WeakPolarHBondContact CE1-OH 3.38Å; F87-Y98 HydrophobicContact CZ-CD1 4.23Å; F87-Y98 AromaticContact CZ-CE1 3.6Å; F87-Y98 HydrophobicContact CZ-CE1 3.6Å; F87-Y98 HydrophobicContact CZ-CE2 4.06Å; F87-Y98 AromaticContact CZ-CZ 3.51Å
88	L	86	Confident	87.9	Confident	76 Å²	76	56.3 Å²	56.3	40%	0.398	29%	0.288	S	S	.	.	S	Bend	trans	-72.6	-25	-178	-68.5	170.8	0	0	0	113.2	S76 I86	S76-L88 WeakPolarHBondContact O-CB 3.02Å; S76-L88 WeakPolarHBondContact O-CG 3.4Å; S76-L88 PolarHBondContact O-N 2.7Å; I86-L88 HydrophobicContact CG2-CD2 4.36Å
89	S	86.9	Confident	88.2	Confident	38 Å²	38	51 Å²	51	27%	0.266	27%	0.268	S	S	.	.	S	Bend	trans	-157.9	102.2	174.7	166.7	0	0	0	0	106.6	R40 S76 F87 N91	R40-S89 WeakPolarHBondContact CA-OG 3.49Å; S76-S89 VanDerWaalsContact CB-O 3.3Å; S76-S89 WeakPolarHBondContact CB-O 3.36Å; S76-S89 PolarHBondContact OG-O 2.85Å; F87-S89 VanDerWaalsContact C-N 3.31Å; F87-S89 PolarHBondContact O-N 2.77Å; S89-N91 PolarHBondContact O-N 2.98Å; S89-N91 PolarHBondContact O-OD1 3.15Å; S89-N91 PolarHBondContact OG-OD1 3.36Å
90	F	86.7	Confident	88.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.255	C	S	.	.			trans	-69.6	125.3	-178.3	-175	-90.4	0	0	0	111.7	P37 R40 H41 L43 F87 D94 E95 V116 A118	P37-F90 HydrophobicContact CB-CB 4.28Å; P37-F90 HydrophobicContact CB-CD1 4.4Å; P37-F90 HydrophobicContact CB-CG 4.23Å; P37-F90 HydrophobicContact CG-CB 3.99Å; P37-F90 HydrophobicContact CG-CD1 3.47Å; P37-F90 VanDerWaalsContact CG-CD1 3.47Å; P37-F90 HydrophobicContact CG-CD2 3.74Å; P37-F90 HydrophobicContact CG-CE1 3.82Å; P37-F90 HydrophobicContact CG-CE2 4.07Å; P37-F90 HydrophobicContact CG-CG 3.42Å; P37-F90 VanDerWaalsContact CG-CG 3.42Å; P37-F90 HydrophobicContact CG-CZ 4.11Å; R40-F90 PolarHBondContact N-O 2.82Å; H41-F90 WeakPolarHBondContact O-CB 3.32Å; H41-F90 PolarHBondContact O-N 3.06Å; L43-F90 HydrophobicContact CD2-CD2 4.17Å; L43-F90 HydrophobicContact CD2-CE2 4.38Å; F87-F90 AromaticContact CD1-CD2 3.99Å; F87-F90 HydrophobicContact CD1-CD2 3.99Å; F87-F90 HydrophobicContact CD1-CE2 4.5Å; F87-F90 HydrophobicContact CE1-CD2 4.36Å; F87-F90 HydrophobicContact CE1-CE2 4.43Å; F87-F90 HydrophobicContact CG-CD2 4.19Å; F90-D94 HydrophobicContact CD2-CB 3.53Å; F90-D94 HydrophobicContact CE2-CB 3.36Å; F90-D94 WeakPolarHBondContact CE2-O 3.3Å; F90-D94 HydrophobicContact CG-CB 4.29Å; F90-D94 HydrophobicContact CZ-CB 4.03Å; F90-E95 HydrophobicContact CE1-CG 4.19Å; F90-E95 HydrophobicContact CZ-CG 3.98Å; F90-V116 HydrophobicContact CD2-CG1 4.29Å; F90-V116 HydrophobicContact CE2-CG1 3.39Å; F90-V116 HydrophobicContact CZ-CG1 3.79Å; F90-A118 HydrophobicContact CE1-CB 4.06Å
91	N	85.9	Confident	88.9	Confident	62 Å²	62	48 Å²	48	33%	0.332	25%	0.251	S	S	.	.			trans	-123.4	173.9	-178.8	-57.8	-33.3	0	0	0	111.6	H39 S89 E93 D94	H39-N91 WeakPolarHBondContact NE2-CA 3.29Å; S89-N91 PolarHBondContact O-N 2.98Å; S89-N91 PolarHBondContact O-OD1 3.15Å; S89-N91 PolarHBondContact OG-OD1 3.36Å; N91-E93 PolarHBondContact O-N 3.18Å; N91-D94 PolarHBondContact N-OD2 3.29Å; N91-D94 WeakPolarHBondContact O-CB 3.37Å; N91-D94 PolarHBondContact O-N 3.37Å
92	E	83.7	Confident	89.5	Confident	152 Å²	152	39.4 Å²	39.4	71%	0.71	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-55.5	-36.5	176.2	-60.1	-174.5	167.1	0	0	112.8	H39 D94 E95	H39-E92 VanDerWaalsContact CE1-CG 3.44Å; H39-E92 WeakPolarHBondContact CE1-CG 3.4Å; H39-E92 PolarHBondContact CE1-N 2.92Å; H39-E92 VanDerWaalsContact CE1-N 3.3Å; H39-E92 PolarHBondContact NE2-N 2.74Å; E92-D94 PolarHBondContact O-N 2.83Å; E92-D94 VanDerWaalsContact O-N 3.16Å; E92-E95 PolarHBondContact O-N 3.41Å; E92-E95 VanDerWaalsContact O-N 3.11Å
93	E	86.2	Confident	90	Very high	177 Å²	177	38.5 Å²	38.5	83%	0.827	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-63	-17.8	175.6	-67.3	-175.4	-142.4	0	0	114	K61 N91	K61-E93 PolarHBondContact NZ-O 2.91Å; N91-E93 PolarHBondContact O-N 3.18Å
94	D	89.2	Confident	90.4	Very high	9 Å²	9	39.4 Å²	39.4	5%	0.048	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-91.2	-4.5	177.8	-67.5	-44.3	0	0	0	112.4	S76 F87 F90 N91 E92 Y98	S76-D94 PolarHBondContact OG-OD2 3.14Å; F87-D94 HydrophobicContact CD1-CB 3.75Å; F87-D94 HydrophobicContact CE1-CB 3.76Å; F90-D94 HydrophobicContact CD2-CB 3.53Å; F90-D94 HydrophobicContact CE2-CB 3.36Å; F90-D94 WeakPolarHBondContact CE2-O 3.3Å; F90-D94 HydrophobicContact CG-CB 4.29Å; F90-D94 HydrophobicContact CZ-CB 4.03Å; N91-D94 PolarHBondContact N-OD2 3.29Å; N91-D94 WeakPolarHBondContact O-CB 3.37Å; N91-D94 PolarHBondContact O-N 3.37Å; E92-D94 PolarHBondContact O-N 2.83Å; E92-D94 VanDerWaalsContact O-N 3.16Å; D94-Y98 VanDerWaalsContact O-CE2 3.31Å; D94-Y98 WeakPolarHBondContact O-CE2 3.21Å; D94-Y98 PolarHBondContact O-OH 3.29Å; D94-Y98 VanDerWaalsContact O-OH 3.05Å
95	E	90.9	Very high	90.3	Very high	63 Å²	63	44.4 Å²	44.4	29%	0.294	23%	0.23	S	C	.	.			trans	-70.5	131.6	175.7	-64.1	-158.3	165.9	0	0	113	K61 F90 E92 V116 K117 A118	K61-E95 VanDerWaalsContact CE-C 3.41Å; K61-E95 WeakPolarHBondContact CE-O 3.35Å; K61-E95 PolarHBondContact NZ-O 3.43Å; F90-E95 HydrophobicContact CE1-CG 4.19Å; F90-E95 HydrophobicContact CZ-CG 3.98Å; E92-E95 PolarHBondContact O-N 3.41Å; E92-E95 VanDerWaalsContact O-N 3.11Å; E95-V116 CarbonylContact C-O 3.44Å; E95-V116 WeakPolarHBondContact CA-O 3.22Å; E95-K117 WeakPolarHBondContact OE1-CG 3.49Å; E95-K117 WeakPolarHBondContact OE2-CE 3.3Å; E95-A118 WeakPolarHBondContact OE1-CB 3.17Å; E95-A118 PolarHBondContact OE1-N 3.18Å
96	G	91.5	Very high	90.1	Very high	9 Å²	9	48.9 Å²	48.9	9%	0.093	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.4	-173.4	176.7	0	0	0	0	0	114.6	D62 Y98 V116	D62-G96 VanDerWaalsContact OD2-CA 3.29Å; D62-G96 WeakPolarHBondContact OD2-CA 3.1Å; G96-Y98 WeakPolarHBondContact O-CD2 3.35Å; G96-V116 PolarHBondContact N-O 2.92Å; G96-V116 PolarHBondContact O-N 3.41Å
97	H	94.4	Very high	89.9	Confident	91 Å²	91	49.6 Å²	49.6	42%	0.421	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	114.1	177.9	-60.1	83.9	0	0	0	111.1	K61 D62 A114	K61-H97 WeakPolarHBondContact CA-O 3.21Å; D62-H97 PolarHBondContact N-O 2.74Å; D62-H97 WeakPolarHBondContact OD1-CB 3.39Å; D62-H97 IonicContact OD1-CG 2.66Å; D62-H97 PolarHBondContact OD1-N 3.49Å; D62-H97 IonicContact OD1-ND1 2.62Å; D62-H97 PolarHBondContact OD1-ND1 3.07Å; D62-H97 VanDerWaalsContact OD1-ND1 3.14Å; H97-A114 CarbonylContact C-O 3.53Å; H97-A114 WeakPolarHBondContact CA-O 3.43Å
98	Y	95.3	Very high	90	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.008	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.3	-177.5	-74.8	-96.8	0	0	0	112	L45 Y60 K61 V66 L85 F87 D94 G96 S113 A114 V116	L45-Y98 HydrophobicContact CD1-CD1 4.06Å; L45-Y98 HydrophobicContact CD1-CD2 4.39Å; L45-Y98 HydrophobicContact CD1-CG 3.77Å; Y60-Y98 WeakPolarHBondContact O-CA 3.39Å; K61-Y98 HydrophobicContact CB-CD1 4.13Å; K61-Y98 HydrophobicContact CB-CE1 3.71Å; K61-Y98 HydrophobicContact CB-CE2 4.41Å; K61-Y98 HydrophobicContact CD-CE1 4.36Å; K61-Y98 HydrophobicContact CD-CE2 4.12Å; K61-Y98 VanDerWaalsContact CD-OH 3.23Å; K61-Y98 WeakPolarHBondContact CD-OH 3.45Å; K61-Y98 WeakPolarHBondContact CE-OH 3.31Å; K61-Y98 HydrophobicContact CG-CD1 4.44Å; K61-Y98 HydrophobicContact CG-CD2 4.29Å; K61-Y98 HydrophobicContact CG-CE1 3.89Å; K61-Y98 HydrophobicContact CG-CE2 3.71Å; K61-Y98 VanDerWaalsContact CG-CZ 3.48Å; V66-Y98 HydrophobicContact CG2-CD1 4.06Å; V66-Y98 HydrophobicContact CG2-CE1 3.78Å; L85-Y98 HydrophobicContact CD2-CD1 3.65Å; L85-Y98 HydrophobicContact CD2-CE1 3.66Å; F87-Y98 HydrophobicContact CE1-CE1 4.1Å; F87-Y98 HydrophobicContact CE1-CE2 4.46Å; F87-Y98 AromaticContact CE1-CZ 3.73Å; F87-Y98 WeakPolarHBondContact CE1-OH 3.38Å; F87-Y98 HydrophobicContact CZ-CD1 4.23Å; F87-Y98 AromaticContact CZ-CE1 3.6Å; F87-Y98 HydrophobicContact CZ-CE1 3.6Å; F87-Y98 HydrophobicContact CZ-CE2 4.06Å; F87-Y98 AromaticContact CZ-CZ 3.51Å; D94-Y98 VanDerWaalsContact O-CE2 3.31Å; D94-Y98 WeakPolarHBondContact O-CE2 3.21Å; D94-Y98 PolarHBondContact O-OH 3.29Å; D94-Y98 VanDerWaalsContact O-OH 3.05Å; G96-Y98 WeakPolarHBondContact O-CD2 3.35Å; Y98-S113 WeakPolarHBondContact O-CA 3.2Å; Y98-A114 PolarHBondContact N-O 2.9Å; Y98-A114 PolarHBondContact O-N 3.23Å; Y98-V116 HydrophobicContact CD2-CB 3.72Å; Y98-V116 HydrophobicContact CD2-CG2 3.45Å; Y98-V116 VanDerWaalsContact CD2-CG2 3.45Å; Y98-V116 HydrophobicContact CE2-CB 3.95Å; Y98-V116 HydrophobicContact CE2-CG2 4.12Å; Y98-V116 HydrophobicContact CG-CG2 4.11Å
99	Y	95.1	Very high	90.3	Very high	41 Å²	41	56.8 Å²	56.8	16%	0.161	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	159.1	169.1	62.4	-91.1	0	0	0	110.3	Y60 I110 S111	Y60-Y99 VanDerWaalsContact CB-CE2 3.43Å; Y60-Y99 HydrophobicContact CD1-CE2 4.16Å; Y60-Y99 HydrophobicContact CD2-CD2 4.14Å; Y60-Y99 AromaticContact CD2-CE2 3.65Å; Y60-Y99 HydrophobicContact CD2-CE2 3.65Å; Y60-Y99 HydrophobicContact CE2-CE2 4.45Å; Y60-Y99 HydrophobicContact CG-CD2 4.21Å; Y60-Y99 AromaticContact CG-CE2 3.49Å; Y60-Y99 HydrophobicContact CG-CE2 3.49Å; Y60-Y99 VanDerWaalsContact CG-CE2 3.49Å; Y60-Y99 AromaticContact CG-CZ 3.67Å; Y60-Y99 PolarHBondContact N-O 2.91Å; Y60-Y99 PolarHBondContact O-N 3.2Å; Y99-I110 HydrophobicContact CD2-CG2 3.64Å; Y99-I110 HydrophobicContact CE2-CD1 4.13Å; Y99-I110 HydrophobicContact CE2-CG2 4.15Å; Y99-I110 HydrophobicContact CG-CG2 4.28Å; Y99-S111 WeakPolarHBondContact CA-OG 3.32Å; Y99-S111 WeakPolarHBondContact CB-OG 3.44Å
100	C	93.9	Very high	90.6	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	141.8	173.1	57.6	0	0	0	0	110.9	F28 C47 I57 T58 W59 S111	F28-C100 VanDerWaalsContact CE1-SG 3.56Å; C47-C100 HydrophobicContact CB-CB 3.73Å; C47-C100 WeakPolarHBondContact CB-SG 3.38Å; C47-C100 WeakPolarHBondContact SG-CB 3.35Å; C47-C100 CovalentContact SG-SG 2.02Å; C47-C100 PolarHBondContact SG-SG 2.88Å; I57-C100 HydrophobicContact CG2-CB 3.97Å; T58-C100 CarbonylContact O-C 3.44Å; T58-C100 WeakPolarHBondContact O-CA 3.06Å; W59-C100 HydrophobicContact CD2-CB 4.09Å; W59-C100 HydrophobicContact CE3-CB 4.2Å; W59-C100 HydrophobicContact CZ2-CB 4.41Å; W59-C100 HydrophobicContact CZ3-CB 4.41Å; C100-S111 PolarHBondContact N-OG 3.36Å; C100-S111 PolarHBondContact O-N 3.06Å
101	N	94.1	Very high	90.9	Very high	23 Å²	23	58.5 Å²	58.5	12%	0.123	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	117.5	170.4	-172.6	1.9	0	0	0	108.3	T58 Y60 N109 I110	T58-N101 PolarHBondContact N-O 2.86Å; T58-N101 PolarHBondContact O-N 2.9Å; Y60-N101 HydrophobicContact CD2-CB 4.26Å; Y60-N101 HydrophobicContact CE2-CB 3.7Å; N101-N109 PolarHBondContact OD1-O 2.74Å; N101-I110 HydrophobicContact CB-CG1 3.97Å
102	A	92.7	Very high	91.2	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	122.5	175.2	0	0	0	0	0	108.8	P26 F28 A49 V55 I57 W108 N109	P26-A102 HydrophobicContact CB-CB 3.76Å; P26-A102 WeakPolarHBondContact CG-O 3.49Å; F28-A102 HydrophobicContact CD1-CB 4.34Å; F28-A102 HydrophobicContact CE1-CB 3.52Å; F28-A102 HydrophobicContact CE2-CB 4.33Å; F28-A102 HydrophobicContact CZ-CB 3.52Å; A49-A102 HydrophobicContact CB-CB 3.62Å; V55-A102 HydrophobicContact CG1-CB 3.77Å; I57-A102 HydrophobicContact CD1-CB 3.8Å; A102-W108 CarbonylContact O-C 3.59Å; A102-W108 WeakPolarHBondContact O-CA 3.26Å; A102-N109 PolarHBondContact N-O 2.75Å; A102-N109 PolarHBondContact O-N 2.87Å
103	S	91.9	Very high	91.7	Very high	35 Å²	35	55 Å²	55	25%	0.245	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	138.2	-169.7	58.5	0	0	0	0	113	S56	S56-S103 PolarHBondContact N-O 3.16Å; S56-S103 PolarHBondContact O-N 3.47Å; S56-S103 PolarHBondContact O-OG 2.89Å; S56-S103 VanDerWaalsContact O-OG 3.13Å
104	N	89.8	Confident	92	Very high	25 Å²	25	46.6 Å²	46.6	13%	0.134	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	-175.6	164.7	75.9	3.7	0	0	0	110.4	R24 P26 E52 P53 H106 G107	R24-N104 PolarHBondContact O-ND2 2.99Å; P26-N104 HydrophobicContact CG-CB 4.32Å; E52-N104 PolarHBondContact N-ND2 3.24Å; E52-N104 PolarHBondContact O-ND2 3.31Å; P53-N104 VanDerWaalsContact O-CB 3.23Å; P53-N104 WeakPolarHBondContact O-CB 3.48Å; P53-N104 PolarHBondContact O-ND2 2.72Å; N104-H106 PolarHBondContact O-N 2.94Å; N104-H106 VanDerWaalsContact O-N 3.11Å; N104-H106 PolarHBondContact OD1-N 2.93Å; N104-G107 PolarHBondContact N-O 3.44Å; N104-G107 PolarHBondContact O-N 2.93Å; N104-G107 VanDerWaalsContact O-N 3.16Å; N104-G107 PolarHBondContact OD1-N 2.89Å
105	V	90.3	Very high	92.1	Very high	117 Å²	117	48.9 Å²	48.9	71%	0.709	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-8.9	-175.2	-53.3	0	0	0	0	114.4	P53	P53-V105 HydrophobicContact CG-CG2 3.66Å
106	H	86	Confident	92.1	Very high	94 Å²	94	45.9 Å²	45.9	44%	0.435	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	1	176.5	-58.9	-63.8	0	0	0	113.7	P23 E52 N104	P23-H106 VanDerWaalsContact CB-CE1 3.44Å; P23-H106 WeakPolarHBondContact CB-CE1 3.46Å; P23-H106 WeakPolarHBondContact CB-NE2 3.36Å; E52-H106 PolarHBondContact O-CD2 3.1Å; E52-H106 VanDerWaalsContact O-CD2 3.22Å; N104-H106 PolarHBondContact O-N 2.94Å; N104-H106 VanDerWaalsContact O-N 3.11Å; N104-H106 PolarHBondContact OD1-N 2.93Å
107	G	87.9	Confident	92	Very high	27 Å²	27	49.2 Å²	49.2	28%	0.278	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	147.1	-171.1	171.8	0	0	0	0	0	113.5	P26 N104	P26-G107 VanDerWaalsContact CD-O 3.25Å; P26-G107 WeakPolarHBondContact CD-O 3.28Å; N104-G107 PolarHBondContact N-O 3.44Å; N104-G107 PolarHBondContact O-N 2.93Å; N104-G107 VanDerWaalsContact O-N 3.16Å; N104-G107 PolarHBondContact OD1-N 2.89Å
108	W	91.9	Very high	91.6	Very high	170 Å²	170	45.5 Å²	45.5	64%	0.644	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	163.9	178.3	62	-92.5	0	0	0	111.2	A102 I110	A102-W108 CarbonylContact O-C 3.59Å; A102-W108 WeakPolarHBondContact O-CA 3.26Å; W108-I110 HydrophobicContact CE3-CD1 4.17Å; W108-I110 HydrophobicContact CE3-CG1 3.97Å; W108-I110 HydrophobicContact CH2-CD1 4.41Å; W108-I110 HydrophobicContact CZ3-CB 4.42Å; W108-I110 HydrophobicContact CZ3-CD1 3.58Å; W108-I110 HydrophobicContact CZ3-CG1 3.75Å
109	N	91.6	Very high	91.2	Very high	57 Å²	57	45.9 Å²	45.9	31%	0.305	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	141.4	-177.6	-162.3	-2.6	0	0	0	108.9	P26 F28 N101 A102	P26-N109 HydrophobicContact CB-CB 4.46Å; P26-N109 WeakPolarHBondContact O-CB 3.47Å; P26-N109 PolarHBondContact O-ND2 3.03Å; F28-N109 HydrophobicContact CE2-CB 3.93Å; F28-N109 VanDerWaalsContact CZ-O 3.29Å; F28-N109 WeakPolarHBondContact CZ-O 3.43Å; N101-N109 PolarHBondContact OD1-O 2.74Å; A102-N109 PolarHBondContact N-O 2.75Å; A102-N109 PolarHBondContact O-N 2.87Å
110	I	93.5	Very high	90.9	Very high	69 Å²	69	48.3 Å²	48.3	35%	0.354	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	136.6	-178.3	-79	174.6	0	0	0	109.9	Y99 N101 W108	Y99-I110 HydrophobicContact CD2-CG2 3.64Å; Y99-I110 HydrophobicContact CE2-CD1 4.13Å; Y99-I110 HydrophobicContact CE2-CG2 4.15Å; Y99-I110 HydrophobicContact CG-CG2 4.28Å; N101-I110 HydrophobicContact CB-CG1 3.97Å; W108-I110 HydrophobicContact CE3-CD1 4.17Å; W108-I110 HydrophobicContact CE3-CG1 3.97Å; W108-I110 HydrophobicContact CH2-CD1 4.41Å; W108-I110 HydrophobicContact CZ3-CB 4.42Å; W108-I110 HydrophobicContact CZ3-CD1 3.58Å; W108-I110 HydrophobicContact CZ3-CG1 3.75Å
111	S	93.5	Very high	90.6	Very high	6 Å²	6	50.4 Å²	50.4	4%	0.042	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-70.7	161.7	177.1	76.2	0	0	0	0	111.8	F28 P32 Y99 C100	F28-S111 VanDerWaalsContact CZ-N 3.31Å; P32-S111 WeakPolarHBondContact CG-OG 3.49Å; Y99-S111 WeakPolarHBondContact CA-OG 3.32Å; Y99-S111 WeakPolarHBondContact CB-OG 3.44Å; C100-S111 PolarHBondContact N-OG 3.36Å; C100-S111 PolarHBondContact O-N 3.06Å
112	P	92.7	Very high	90.4	Very high	73 Å²	73	52.8 Å²	52.8	47%	0.474	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-50.3	147.3	156.7	-23.9	35	0	0	0	111	Y31	Y31-P112 HydrophobicContact CD2-CB 4.38Å; Y31-P112 HydrophobicContact CD2-CG 3.92Å; Y31-P112 HydrophobicContact CE2-CG 4.04Å; Y31-P112 HydrophobicContact CG-CG 4.44Å
113	S	93.4	Very high	90.2	Very high	67 Å²	67	54.7 Å²	54.7	47%	0.469	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-78.8	130.9	170.7	-63.4	0	0	0	0	110.3	Y98	Y98-S113 WeakPolarHBondContact O-CA 3.2Å
114	A	92.3	Very high	90	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.008	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	132.2	168.2	0	0	0	0	0	110.7	P32 R33 D34 H97 Y98 V116	P32-A114 HydrophobicContact CB-CB 3.77Å; P32-A114 HydrophobicContact CG-CB 4.48Å; R33-A114 WeakPolarHBondContact O-CB 3.42Å; D34-A114 WeakPolarHBondContact OD1-CA 3.33Å; H97-A114 CarbonylContact C-O 3.53Å; H97-A114 WeakPolarHBondContact CA-O 3.43Å; Y98-A114 PolarHBondContact N-O 2.9Å; Y98-A114 PolarHBondContact O-N 3.23Å; A114-V116 PolarHBondContact O-N 2.88Å
115	L	92.1	Very high	89.8	Confident	57 Å²	57	60 Å²	60	30%	0.298	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	121.3	166.2	176.1	60.8	0	0	0	109.5	D34 A35 K117	D34-L115 CarbonylContact C-O 3.55Å; D34-L115 VanDerWaalsContact CA-O 3.23Å; D34-L115 WeakPolarHBondContact CA-O 3.38Å; D34-L115 PolarHBondContact OD1-N 3.46Å; A35-L115 PolarHBondContact N-O 2.81Å; L115-K117 HydrophobicContact CG-CB 4.43Å
116	V	90.9	Very high	89.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122	171	-173.5	0	0	0	0	108.9	A35 L43 L45 F90 E95 G96 Y98 A114	A35-V116 HydrophobicContact CB-CG2 4.33Å; A35-V116 WeakPolarHBondContact O-CA 3.04Å; L43-V116 HydrophobicContact CD2-CG1 3.37Å; L45-V116 HydrophobicContact CD1-CG2 3.88Å; L45-V116 HydrophobicContact CD2-CG2 3.99Å; F90-V116 HydrophobicContact CD2-CG1 4.29Å; F90-V116 HydrophobicContact CE2-CG1 3.39Å; F90-V116 HydrophobicContact CZ-CG1 3.79Å; E95-V116 CarbonylContact C-O 3.44Å; E95-V116 WeakPolarHBondContact CA-O 3.22Å; G96-V116 PolarHBondContact N-O 2.92Å; G96-V116 PolarHBondContact O-N 3.41Å; Y98-V116 HydrophobicContact CD2-CB 3.72Å; Y98-V116 HydrophobicContact CD2-CG2 3.45Å; Y98-V116 VanDerWaalsContact CD2-CG2 3.45Å; Y98-V116 HydrophobicContact CE2-CB 3.95Å; Y98-V116 HydrophobicContact CE2-CG2 4.12Å; Y98-V116 HydrophobicContact CG-CG2 4.11Å; A114-V116 PolarHBondContact O-N 2.88Å
117	K	88.8	Confident	89.9	Confident	78 Å²	78	53.5 Å²	53.5	34%	0.339	31%	0.308	S	S	.	.			trans	-147	144.6	-172.2	-172	160.4	-166.6	169.3	0	111.5	A35 F36 P37 E95 L115 A119	A35-K117 PolarHBondContact O-N 2.85Å; A35-K117 VanDerWaalsContact O-N 3.16Å; F36-K117 WeakPolarHBondContact CA-O 3.45Å; F36-K117 HydrophobicContact CD1-CB 4.1Å; F36-K117 HydrophobicContact CE1-CB 4.1Å; P37-K117 WeakPolarHBondContact CD-O 3.38Å; E95-K117 WeakPolarHBondContact OE1-CG 3.49Å; E95-K117 WeakPolarHBondContact OE2-CE 3.3Å; L115-K117 HydrophobicContact CG-CB 4.43Å; K117-A119 PolarHBondContact O-N 3.47Å
118	A	87.1	Confident	90	Very high	13 Å²	13	53.4 Å²	53.4	11%	0.107	31%	0.308	C	S	.	.			trans	-59.5	130.5	178.3	0	0	0	0	0	110.8	F90 E95 F120	F90-A118 HydrophobicContact CE1-CB 4.06Å; E95-A118 WeakPolarHBondContact OE1-CB 3.17Å; E95-A118 PolarHBondContact OE1-N 3.18Å; A118-F120 PolarHBondContact O-N 3.36Å
119	A	86.7	Confident	90.1	Very high	11 Å²	11	45.9 Å²	45.9	9%	0.091	28%	0.28	C	S	.	.			trans	-74	125.6	178.7	0	0	0	0	0	109.8	F36 P37 L38 K117 S150 A199	F36-A119 HydrophobicContact CB-CB 4.09Å; F36-A119 WeakPolarHBondContact O-CB 3.47Å; P37-A119 WeakPolarHBondContact O-CB 3.38Å; P37-A119 PolarHBondContact O-N 3.27Å; L38-A119 HydrophobicContact CD2-CB 4.42Å; K117-A119 PolarHBondContact O-N 3.47Å; A119-S150 WeakPolarHBondContact CA-O 3.33Å; A119-A199 HydrophobicContact CB-CB 3.83Å
120	F	88.5	Confident	90.1	Very high	91 Å²	91	50.2 Å²	50.2	40%	0.399	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	156.4	177.4	79.7	-93.4	0	0	0	111.1	A118 V148 G149 S150 A199	A118-F120 PolarHBondContact O-N 3.36Å; F120-V148 HydrophobicContact CE2-CG1 4.15Å; F120-V148 HydrophobicContact CZ-CG1 4.31Å; F120-G149 CarbonylContact O-C 3.33Å; F120-G149 WeakPolarHBondContact O-CA 3.19Å; F120-S150 PolarHBondContact N-O 2.65Å; F120-S150 PolarHBondContact O-N 3.19Å; F120-A199 VanDerWaalsContact C-CB 3.47Å
121	F	88.1	Confident	90.1	Very high	45 Å²	45	50.7 Å²	50.7	20%	0.197	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	102.8	-178.8	-173.3	-100.2	0	0	0	108.7	P147 P153 S197 A199 H201 W202	F121-P147 HydrophobicContact CD1-CB 4.49Å; F121-P147 HydrophobicContact CD2-CB 4.25Å; F121-P147 HydrophobicContact CE1-CB 4.12Å; F121-P147 HydrophobicContact CE1-CG 4.03Å; F121-P147 HydrophobicContact CE2-CB 3.86Å; F121-P147 HydrophobicContact CE2-CG 4.14Å; F121-P147 HydrophobicContact CZ-CB 3.8Å; F121-P147 HydrophobicContact CZ-CG 3.65Å; F121-P153 HydrophobicContact CD2-CG 3.79Å; F121-P153 HydrophobicContact CE2-CB 3.99Å; F121-P153 HydrophobicContact CE2-CG 3.67Å; F121-S197 WeakPolarHBondContact CD2-OG 3.5Å; F121-A199 HydrophobicContact CB-CB 3.82Å; F121-H201 WeakPolarHBondContact CE1-O 3.45Å; F121-W202 HydrophobicContact CE1-CB 3.82Å; F121-W202 HydrophobicContact CZ-CB 3.63Å
122	D	89.5	Confident	89.8	Confident	73 Å²	73	53.3 Å²	53.3	39%	0.39	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	112.3	-179.6	-178.7	22.3	0	0	0	111.3	S124 P147 V148	D122-S124 WeakPolarHBondContact OD1-CB 3.45Å; D122-S124 PolarHBondContact OD1-N 2.71Å; D122-S124 PolarHBondContact OD1-OG 2.71Å; D122-S124 WeakPolarHBondContact OD2-CB 3.37Å; D122-S124 PolarHBondContact OD2-OG 2.85Å; D122-P147 CarbonylContact O-C 3.55Å; D122-P147 VanDerWaalsContact O-CA 3.27Å; D122-P147 WeakPolarHBondContact O-CA 3.47Å; D122-P147 WeakPolarHBondContact O-CB 3.46Å; D122-V148 PolarHBondContact N-O 3.06Å; D122-V148 PolarHBondContact O-N 2.91Å
123	A	88	Confident	89.4	Confident	40 Å²	40	52 Å²	52	33%	0.331	31%	0.311	S	S	.	.			trans	-90	4.5	176	0	0	0	0	0	113.7	S125 A126 P147	A123-S125 PolarHBondContact O-N 3.27Å; A123-S125 VanDerWaalsContact O-N 3.16Å; A123-A126 HydrophobicContact CB-CB 4.26Å; A123-A126 WeakPolarHBondContact O-CB 3.46Å; A123-A126 PolarHBondContact O-N 3.46Å; A123-A126 VanDerWaalsContact O-N 3.07Å; A123-P147 HydrophobicContact CB-CB 4.27Å; A123-P147 HydrophobicContact CB-CG 3.99Å
124	S	87.4	Confident	88.9	Confident	88 Å²	88	49 Å²	49	62%	0.615	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-38.4	-179.1	69	0	0	0	0	113.7	D122	D122-S124 WeakPolarHBondContact OD1-CB 3.45Å; D122-S124 PolarHBondContact OD1-N 2.71Å; D122-S124 PolarHBondContact OD1-OG 2.71Å; D122-S124 WeakPolarHBondContact OD2-CB 3.37Å; D122-S124 PolarHBondContact OD2-OG 2.85Å
125	S	85.7	Confident	88.2	Confident	82 Å²	82	52.9 Å²	52.9	57%	0.573	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	7.1	-175.8	-57.7	0	0	0	0	113	A123	A123-S125 PolarHBondContact O-N 3.27Å; A123-S125 VanDerWaalsContact O-N 3.16Å
126	A	88.5	Confident	87.6	Confident	24 Å²	24	54.9 Å²	54.9	20%	0.198	32%	0.315	C	S	.	.			trans	-80.2	128.8	-174.3	0	0	0	0	0	111.9	A123 T145 P147 W202	A123-A126 HydrophobicContact CB-CB 4.26Å; A123-A126 WeakPolarHBondContact O-CB 3.46Å; A123-A126 PolarHBondContact O-N 3.46Å; A123-A126 VanDerWaalsContact O-N 3.07Å; A126-T145 CarbonylContact C-O 3.56Å; A126-T145 VanDerWaalsContact CA-O 3.24Å; A126-T145 WeakPolarHBondContact CA-O 3.45Å; A126-P147 HydrophobicContact CB-CB 4.42Å; A126-P147 HydrophobicContact CB-CG 3.76Å; A126-W202 HydrophobicContact CB-CD2 4.28Å; A126-W202 HydrophobicContact CB-CH2 4.18Å; A126-W202 HydrophobicContact CB-CZ2 3.58Å
127	S	90.9	Very high	87	Confident	51 Å²	51	57.4 Å²	57.4	36%	0.357	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-125.4	137.1	-179.7	72.8	0	0	0	0	111.8	C144 T145	S127-C144 WeakPolarHBondContact O-CA 3.45Å; S127-T145 PolarHBondContact N-O 3.44Å; S127-T145 PolarHBondContact O-N 2.9Å; S127-T145 VanDerWaalsContact OG-CB 3.28Å; S127-T145 WeakPolarHBondContact OG-CB 3.43Å; S127-T145 PolarHBondContact OG-N 2.94Å; S127-T145 PolarHBondContact OG-OG1 3.3Å
128	G	89.1	Confident	86.8	Confident	26 Å²	26	57 Å²	57	27%	0.268	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-84.9	169.8	177.4	0	0	0	0	0	113.3
129	P	93.1	Very high	87	Confident	11 Å²	11	59.6 Å²	59.6	7%	0.071	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-62.3	149.2	167.9	28.4	-35.3	0	0	0	112.1	L142 E143 W157 S204 A207	P129-L142 HydrophobicContact CB-CB 4.24Å; P129-E143 WeakPolarHBondContact CA-O 3.48Å; P129-E143 WeakPolarHBondContact CB-O 3.42Å; P129-W157 HydrophobicContact CB-CH2 3.88Å; P129-W157 HydrophobicContact CB-CZ3 3.96Å; P129-W157 HydrophobicContact CG-CH2 3.99Å; P129-W157 HydrophobicContact CG-CZ3 3.79Å; P129-S204 WeakPolarHBondContact CD-OG 3.22Å; P129-A207 HydrophobicContact CB-CB 3.63Å; P129-A207 HydrophobicContact CG-CB 3.68Å
130	E	92.5	Very high	87.2	Confident	149 Å²	149	59.6 Å²	59.6	70%	0.696	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-94.1	156.7	165.7	-62.3	-165.2	150.1	0	0	111.7	K132 A207	E130-K132 PolarHBondContact O-N 2.99Å; E130-A207 WeakPolarHBondContact O-CB 3.43Å
131	S	92.5	Very high	87.5	Confident	78 Å²	78	58.1 Å²	58.1	55%	0.545	35%	0.35	S	S	.	.			trans	-73.1	89.8	-180	-65.5	0	0	0	0	111.9	T208	S131-T208 PolarHBondContact OG-N 3Å
132	K	88	Confident	87.8	Confident	62 Å²	62	56 Å²	56	27%	0.27	34%	0.341	S	S	.	.			trans	-84.7	157.6	178.9	-62.5	-169.4	-176.4	-176	0	112.5	E130 L141 L142 E143 T208 L209 T210	E130-K132 PolarHBondContact O-N 2.99Å; K132-L141 WeakPolarHBondContact CD-O 3.34Å; K132-L141 WeakPolarHBondContact CE-O 3.44Å; K132-L141 PolarHBondContact NZ-O 3.45Å; K132-L142 HydrophobicContact CB-CD2 4.12Å; K132-L142 HydrophobicContact CD-CD2 4.35Å; K132-L142 HydrophobicContact CG-CD2 4.26Å; K132-E143 VanDerWaalsContact NZ-CD 3.28Å; K132-E143 IonicContact NZ-OE1 3.7Å; K132-E143 PolarHBondContact NZ-OE1 3.17Å; K132-E143 IonicContact NZ-OE2 2.83Å; K132-E143 PolarHBondContact NZ-OE2 3.47Å; K132-T208 VanDerWaalsContact O-O 3.13Å; K132-L209 WeakPolarHBondContact O-CA 3.49Å; K132-T210 PolarHBondContact O-N 2.98Å
133	S	83.9	Confident	87.9	Confident	45 Å²	45	57.2 Å²	57.2	32%	0.315	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	137.4	176.2	-168.8	0	0	0	0	110.3	T210 R212	S133-T210 VanDerWaalsContact CA-O 3.23Å; S133-T210 WeakPolarHBondContact CA-O 3.29Å; S133-T210 WeakPolarHBondContact CB-O 3.31Å; S133-T210 PolarHBondContact OG-O 3.16Å; S133-R212 WeakPolarHBondContact OG-CD 2.88Å; S133-R212 WeakPolarHBondContact OG-CG 3.42Å; S133-R212 PolarHBondContact OG-NE 2.91Å
134	A	83.6	Confident	88.1	Confident	4 Å²	4	55.5 Å²	55.5	3%	0.033	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	160	-167.3	0	0	0	0	0	112.2	Q138 V140 L209 T210 I211 R212	A134-Q138 HydrophobicContact CB-CB 4.48Å; A134-V140 HydrophobicContact CB-CG2 3.31Å; A134-L209 HydrophobicContact CB-CD1 4.25Å; A134-T210 PolarHBondContact N-O 3.22Å; A134-T210 VanDerWaalsContact N-O 3.12Å; A134-I211 CarbonylContact O-C 3.49Å; A134-I211 WeakPolarHBondContact O-CA 3.42Å; A134-R212 PolarHBondContact O-N 3.34Å
135	H	78.1	Confident	88.4	Confident	83 Å²	83	54.7 Å²	54.7	38%	0.384	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	161.8	172.8	66.6	82.1	0	0	0	112.6	G137 Q138 V287	H135-G137 PolarHBondContact O-N 2.83Å; H135-Q138 PolarHBondContact CD2-OE1 3.38Å; H135-Q138 WeakPolarHBondContact O-CB 3.4Å; H135-Q138 PolarHBondContact O-N 2.89Å; H135-Q138 VanDerWaalsContact O-N 3.1Å; H135-V287 HydrophobicContact CB-CG1 3.56Å; H135-V287 HydrophobicContact CB-CG2 4.39Å
136	F	77.8	Confident	88.6	Confident	98 Å²	98	52 Å²	52	43%	0.43	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	134.5	170.8	-76.1	-97.2	0	0	0	111.1	Q138 V183 R185 I211 R213	F136-Q138 PolarHBondContact O-N 2.89Å; F136-V183 WeakPolarHBondContact CA-O 3.41Å; F136-R185 HydrophobicContact CE1-CB 3.84Å; F136-R185 HydrophobicContact CZ-CB 3.93Å; F136-R185 HydrophobicContact CZ-CG 4.47Å; F136-I211 HydrophobicContact CD2-CG2 3.78Å; F136-I211 HydrophobicContact CE2-CG2 3.52Å; F136-I211 HydrophobicContact CG-CG2 4.44Å; F136-I211 HydrophobicContact CZ-CG2 4.02Å; F136-R213 HydrophobicContact CD2-CB 4.3Å; F136-R213 HydrophobicContact CE2-CB 4.16Å
137	G	79.6	Confident	88.7	Confident	54 Å²	54	51 Å²	51	56%	0.557	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	-9.3	-178.1	0	0	0	0	0	115.4	H135 V183	H135-G137 PolarHBondContact O-N 2.83Å; G137-V183 PolarHBondContact N-O 3.06Å
138	Q	84.9	Confident	88.7	Confident	69 Å²	69	52.6 Å²	52.6	32%	0.322	30%	0.3	S	S	.	.			trans	-64.8	150.2	174.6	-159.4	175.1	-8	0	0	110.7	A134 H135 F136 G182 V183	A134-Q138 HydrophobicContact CB-CB 4.48Å; H135-Q138 PolarHBondContact CD2-OE1 3.38Å; H135-Q138 WeakPolarHBondContact O-CB 3.4Å; H135-Q138 PolarHBondContact O-N 2.89Å; H135-Q138 VanDerWaalsContact O-N 3.1Å; F136-Q138 PolarHBondContact O-N 2.89Å; Q138-G182 PolarHBondContact O-N 3.38Å; Q138-V183 WeakPolarHBondContact O-CG2 3.33Å; Q138-V183 PolarHBondContact O-N 2.79Å
139	T	90.8	Very high	88.5	Confident	68 Å²	68	51.9 Å²	51.9	42%	0.417	29%	0.293	S	S	.	.			trans	-93	129.6	163.4	-65.8	0	0	0	0	109.2	R179 I180 E181	T139-R179 HydrophobicContact CG2-CG 4.11Å; T139-I180 CarbonylContact C-O 3.45Å; T139-I180 VanDerWaalsContact CA-O 3.27Å; T139-I180 WeakPolarHBondContact CA-O 3.25Å; T139-E181 HydrophobicContact CG2-CG 4.07Å
140	V	91.7	Very high	88.2	Confident	10 Å²	10	52.2 Å²	52.2	6%	0.061	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.9	-176.7	174	0	0	0	0	109.8	A134 L142 R179 I180 V183 L209	A134-V140 HydrophobicContact CB-CG2 3.31Å; V140-L142 HydrophobicContact CG1-CD2 4.24Å; V140-L142 HydrophobicContact CG1-CG 4.29Å; V140-R179 CarbonylContact O-C 3.59Å; V140-R179 WeakPolarHBondContact O-CA 3.25Å; V140-I180 PolarHBondContact N-O 2.58Å; V140-I180 PolarHBondContact O-N 3.08Å; V140-V183 HydrophobicContact CB-CG2 4.3Å; V140-V183 HydrophobicContact CG2-CG2 3.76Å; V140-L209 HydrophobicContact CG1-CD1 4.18Å
141	L	93.6	Very high	87.8	Confident	61 Å²	61	47 Å²	47	32%	0.319	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	116.9	164	178.5	58	0	0	0	108.8	K132 E143 M173 L178 R179	K132-L141 WeakPolarHBondContact CD-O 3.34Å; K132-L141 WeakPolarHBondContact CE-O 3.44Å; K132-L141 PolarHBondContact NZ-O 3.45Å; L141-E143 HydrophobicContact CD2-CG 4.48Å; L141-E143 HydrophobicContact CG-CG 4.48Å; L141-M173 HydrophobicContact CD1-SD 3.69Å; L141-M173 HydrophobicContact CD2-SD 4.27Å; L141-L178 WeakPolarHBondContact CA-O 3.43Å; L141-R179 HydrophobicContact CD1-CB 4.47Å
142	L	94	Very high	87.6	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	106.4	162.6	-62.7	178.1	0	0	0	106.8	P129 K132 V140 W157 G177 L178 Y191	P129-L142 HydrophobicContact CB-CB 4.24Å; K132-L142 HydrophobicContact CB-CD2 4.12Å; K132-L142 HydrophobicContact CD-CD2 4.35Å; K132-L142 HydrophobicContact CG-CD2 4.26Å; V140-L142 HydrophobicContact CG1-CD2 4.24Å; V140-L142 HydrophobicContact CG1-CG 4.29Å; L142-W157 HydrophobicContact CB-CH2 3.63Å; L142-W157 HydrophobicContact CB-CZ3 3.81Å; L142-W157 HydrophobicContact CD1-CZ3 4.01Å; L142-W157 WeakPolarHBondContact O-CH2 3.26Å; L142-G177 CarbonylContact O-C 3.55Å; L142-G177 VanDerWaalsContact O-CA 3.25Å; L142-G177 WeakPolarHBondContact O-CA 3.46Å; L142-L178 HydrophobicContact CB-CB 4.45Å; L142-L178 PolarHBondContact N-O 3.12Å; L142-L178 PolarHBondContact O-N 2.93Å; L142-Y191 HydrophobicContact CD1-CD1 3.88Å; L142-Y191 HydrophobicContact CD1-CD2 3.85Å; L142-Y191 HydrophobicContact CD1-CE1 4.44Å; L142-Y191 HydrophobicContact CD1-CE2 4.41Å; L142-Y191 HydrophobicContact CD1-CG 3.55Å
143	E	92.7	Very high	87.6	Confident	99 Å²	99	46.2 Å²	46.2	46%	0.463	28%	0.277	S	S	.	.			trans	-63	152.7	174	-76.7	104.7	-105.7	0	0	111.3	P129 K132 L141	P129-E143 WeakPolarHBondContact CA-O 3.48Å; P129-E143 WeakPolarHBondContact CB-O 3.42Å; K132-E143 VanDerWaalsContact NZ-CD 3.28Å; K132-E143 IonicContact NZ-OE1 3.7Å; K132-E143 PolarHBondContact NZ-OE1 3.17Å; K132-E143 IonicContact NZ-OE2 2.83Å; K132-E143 PolarHBondContact NZ-OE2 3.47Å; L141-E143 HydrophobicContact CD2-CG 4.48Å; L141-E143 HydrophobicContact CG-CG 4.48Å
144	C	92.8	Very high	88	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.02	28%	0.284	C	S	.	.			trans	-155.4	132	164.9	172	0	0	0	0	105.7	S127 W157 C193	S127-C144 WeakPolarHBondContact O-CA 3.45Å; C144-W157 HydrophobicContact CB-CH2 3.98Å; C144-W157 HydrophobicContact CB-CZ2 3.53Å; C144-C193 HydrophobicContact CB-CB 3.58Å; C144-C193 WeakPolarHBondContact CB-SG 3.24Å; C144-C193 WeakPolarHBondContact SG-CB 3.18Å; C144-C193 CovalentContact SG-SG 2.03Å; C144-C193 PolarHBondContact SG-SG 2.99Å
145	T	92.2	Very high	88.4	Confident	71 Å²	71	48.8 Å²	48.8	44%	0.436	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-105.3	107.8	167.7	-56.8	0	0	0	0	106.6	A126 S127	A126-T145 CarbonylContact C-O 3.56Å; A126-T145 VanDerWaalsContact CA-O 3.24Å; A126-T145 WeakPolarHBondContact CA-O 3.45Å; S127-T145 PolarHBondContact N-O 3.44Å; S127-T145 PolarHBondContact O-N 2.9Å; S127-T145 VanDerWaalsContact OG-CB 3.28Å; S127-T145 WeakPolarHBondContact OG-CB 3.43Å; S127-T145 PolarHBondContact OG-N 2.94Å; S127-T145 PolarHBondContact OG-OG1 3.3Å
146	P	90.4	Very high	89	Confident	27 Å²	27	48.7 Å²	48.7	18%	0.175	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-69.3	161.5	179.6	30.4	-36.1	0	0	0	111.5	V155 S175 A195	P146-V155 HydrophobicContact CB-CG2 3.72Å; P146-V155 HydrophobicContact CG-CG2 3.83Å; P146-S175 WeakPolarHBondContact CD-O 3.42Å; P146-A195 HydrophobicContact CB-CB 3.97Å
147	P	91.3	Very high	89.8	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.019	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-48.1	146.1	164.1	-28.1	36.4	0	0	0	112.9	F121 D122 A123 A126 P153 A195 W202	F121-P147 HydrophobicContact CD1-CB 4.49Å; F121-P147 HydrophobicContact CD2-CB 4.25Å; F121-P147 HydrophobicContact CE1-CB 4.12Å; F121-P147 HydrophobicContact CE1-CG 4.03Å; F121-P147 HydrophobicContact CE2-CB 3.86Å; F121-P147 HydrophobicContact CE2-CG 4.14Å; F121-P147 HydrophobicContact CZ-CB 3.8Å; F121-P147 HydrophobicContact CZ-CG 3.65Å; D122-P147 CarbonylContact O-C 3.55Å; D122-P147 VanDerWaalsContact O-CA 3.27Å; D122-P147 WeakPolarHBondContact O-CA 3.47Å; D122-P147 WeakPolarHBondContact O-CB 3.46Å; A123-P147 HydrophobicContact CB-CB 4.27Å; A123-P147 HydrophobicContact CB-CG 3.99Å; A126-P147 HydrophobicContact CB-CB 4.42Å; A126-P147 HydrophobicContact CB-CG 3.76Å; P147-P153 WeakPolarHBondContact O-CG 3.45Å; P147-A195 HydrophobicContact CG-CB 4.24Å; P147-W202 HydrophobicContact CG-CB 3.61Å; P147-W202 HydrophobicContact CG-CD2 3.87Å; P147-W202 HydrophobicContact CG-CE3 4.24Å; P147-W202 HydrophobicContact CG-CG 3.63Å
148	V	89.6	Confident	90.5	Very high	83 Å²	83	43.9 Å²	43.9	50%	0.503	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	135.3	171.6	-175	0	0	0	0	108.1	F120 D122	F120-V148 HydrophobicContact CE2-CG1 4.15Å; F120-V148 HydrophobicContact CZ-CG1 4.31Å; D122-V148 PolarHBondContact N-O 3.06Å; D122-V148 PolarHBondContact O-N 2.91Å
149	G	86.4	Confident	90.8	Very high	11 Å²	11	42.3 Å²	42.3	11%	0.113	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	166.6	-179.3	0	0	0	0	0	114.2	F120 P151 S152	F120-G149 CarbonylContact O-C 3.33Å; F120-G149 WeakPolarHBondContact O-CA 3.19Å; G149-P151 CarbonylContact C-O 3.5Å; G149-P151 CarbonylContact O-C 3.58Å; G149-S152 PolarHBondContact O-N 3.09Å
150	S	85.2	Confident	90.8	Very high	18 Å²	18	42.8 Å²	42.8	13%	0.126	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	114.3	171.1	-153.2	0	0	0	0	107.4	F36 A119 F120	F36-S150 WeakPolarHBondContact CD1-OG 3.35Å; F36-S150 WeakPolarHBondContact CE1-OG 3.49Å; A119-S150 WeakPolarHBondContact CA-O 3.33Å; F120-S150 PolarHBondContact N-O 2.65Å; F120-S150 PolarHBondContact O-N 3.19Å
151	P	85.6	Confident	90.6	Very high	39 Å²	39	48 Å²	48	25%	0.253	27%	0.27	S	S	.	.	S	Bend	cis	-67.6	159.9	-2.6	34	-33.1	0	0	0	110.9	F36 G149 P153 S198	F36-P151 HydrophobicContact CB-CG 4.43Å; F36-P151 HydrophobicContact CD2-CB 3.77Å; F36-P151 HydrophobicContact CD2-CG 4.17Å; F36-P151 HydrophobicContact CE2-CB 4Å; F36-P151 HydrophobicContact CG-CB 4.14Å; F36-P151 HydrophobicContact CG-CG 4.35Å; G149-P151 CarbonylContact C-O 3.5Å; G149-P151 CarbonylContact O-C 3.58Å; P151-P153 WeakPolarHBondContact O-CD 3.39Å; P151-S198 WeakPolarHBondContact CD-OG 3.15Å
152	S	87.1	Confident	90.4	Very high	104 Å²	104	52.4 Å²	52.4	73%	0.727	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-54.1	123.6	178.4	-54.3	0	0	0	0	110.8	G149	G149-S152 PolarHBondContact O-N 3.09Å
153	P	89.4	Confident	90.1	Very high	21 Å²	21	58.5 Å²	58.5	14%	0.136	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-61.1	138.4	-175.1	-28.3	37.7	0	0	0	113.6	F121 P147 P151 A195 E196	F121-P153 HydrophobicContact CD2-CG 3.79Å; F121-P153 HydrophobicContact CE2-CB 3.99Å; F121-P153 HydrophobicContact CE2-CG 3.67Å; P147-P153 WeakPolarHBondContact O-CG 3.45Å; P151-P153 WeakPolarHBondContact O-CD 3.39Å; P153-A195 HydrophobicContact CB-CB 4.02Å; P153-E196 WeakPolarHBondContact CA-O 3.46Å
154	T	90.8	Very high	89.8	Confident	76 Å²	76	55.4 Å²	55.4	47%	0.466	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	125.6	175.7	-57.5	0	0	0	0	109.4	Y156 E196	T154-Y156 HydrophobicContact CG2-CE1 3.94Å; T154-Y156 HydrophobicContact CG2-CE2 3.97Å; T154-E196 PolarHBondContact N-O 2.79Å; T154-E196 PolarHBondContact O-N 2.98Å
155	V	91.5	Very high	89.5	Confident	27 Å²	27	61 Å²	61	16%	0.164	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	128.8	-176.3	-176.9	0	0	0	0	111.8	P146 V172 C193 L194	P146-V155 HydrophobicContact CB-CG2 3.72Å; P146-V155 HydrophobicContact CG-CG2 3.83Å; V155-V172 HydrophobicContact CB-CG1 4.45Å; V155-V172 HydrophobicContact CG1-CG1 4.31Å; V155-C193 VanDerWaalsContact CG1-SG 3.59Å; V155-L194 CarbonylContact C-O 3.56Å; V155-L194 VanDerWaalsContact CA-O 3.3Å; V155-L194 WeakPolarHBondContact CA-O 3.22Å
156	Y	91.9	Very high	89.1	Confident	80 Å²	80	62.1 Å²	62.1	31%	0.314	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	162.9	172.1	-52.5	-74.4	0	0	0	110.7	T154 K163 L194 E196	T154-Y156 HydrophobicContact CG2-CE1 3.94Å; T154-Y156 HydrophobicContact CG2-CE2 3.97Å; Y156-K163 VanDerWaalsContact CD1-NZ 3.33Å; Y156-K163 VanDerWaalsContact CG-CE 3.45Å; Y156-L194 PolarHBondContact N-O 2.98Å; Y156-L194 PolarHBondContact O-N 3.19Å; Y156-E196 HydrophobicContact CE2-CB 4.21Å; Y156-E196 VanDerWaalsContact CE2-OE2 3.24Å; Y156-E196 WeakPolarHBondContact CE2-OE2 3.21Å
157	W	94.3	Very high	88.8	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.015	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	136.1	175.6	-73.9	73.2	0	0	0	110.9	P129 L142 C144 M164 G176 L178 Y191 Q192 C193	P129-W157 HydrophobicContact CB-CH2 3.88Å; P129-W157 HydrophobicContact CB-CZ3 3.96Å; P129-W157 HydrophobicContact CG-CH2 3.99Å; P129-W157 HydrophobicContact CG-CZ3 3.79Å; L142-W157 HydrophobicContact CB-CH2 3.63Å; L142-W157 HydrophobicContact CB-CZ3 3.81Å; L142-W157 HydrophobicContact CD1-CZ3 4.01Å; L142-W157 WeakPolarHBondContact O-CH2 3.26Å; C144-W157 HydrophobicContact CB-CH2 3.98Å; C144-W157 HydrophobicContact CB-CZ2 3.53Å; W157-M164 HydrophobicContact CB-CE 4.09Å; W157-M164 WeakPolarHBondContact O-CB 3.41Å; W157-M164 PolarHBondContact O-N 3.22Å; W157-G176 WeakPolarHBondContact CZ2-O 3.45Å; W157-G176 PolarHBondContact NE1-O 2.9Å; W157-L178 HydrophobicContact CB-CD2 4.3Å; W157-L178 HydrophobicContact CD2-CB 3.63Å; W157-L178 HydrophobicContact CD2-CD2 3.87Å; W157-L178 HydrophobicContact CD2-CG 4.38Å; W157-L178 VanDerWaalsContact CE2-CB 3.44Å; W157-L178 HydrophobicContact CE3-CB 3.99Å; W157-L178 HydrophobicContact CE3-CD2 3.83Å; W157-L178 HydrophobicContact CG-CB 4.14Å; W157-L178 HydrophobicContact CG-CD2 4.06Å; W157-L178 HydrophobicContact CH2-CB 4.01Å; W157-L178 HydrophobicContact CZ2-CB 3.66Å; W157-L178 HydrophobicContact CZ3-CB 4.16Å; W157-L178 HydrophobicContact CZ3-CD2 4.45Å; W157-Y191 HydrophobicContact CE3-CD1 4.2Å; W157-Q192 CarbonylContact C-O 3.43Å; W157-Q192 VanDerWaalsContact CA-O 3.28Å; W157-Q192 WeakPolarHBondContact CA-O 3.06Å; W157-C193 HydrophobicContact CD2-CB 4.32Å; W157-C193 HydrophobicContact CE3-CB 4.45Å; W157-C193 HydrophobicContact CH2-CB 4.11Å; W157-C193 HydrophobicContact CZ2-CB 3.92Å; W157-C193 HydrophobicContact CZ3-CB 4.37Å
158	K	93.5	Very high	88.5	Confident	48 Å²	48	68.1 Å²	68.1	21%	0.209	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	139.1	162.3	-76.5	169.3	-176.9	165.7	0	108.6	Q162 Y191 Q192 L194 E203	K158-Q162 CarbonylContact C-O 3.59Å; K158-Q162 VanDerWaalsContact CA-O 3.22Å; K158-Q162 WeakPolarHBondContact CA-O 3.25Å; K158-Y191 VanDerWaalsContact O-CA 3.32Å; K158-Y191 WeakPolarHBondContact O-CA 3.42Å; K158-Q192 HydrophobicContact CB-CB 4.3Å; K158-Q192 PolarHBondContact N-O 3.5Å; K158-Q192 PolarHBondContact O-N 3.11Å; K158-L194 HydrophobicContact CB-CD1 4.01Å; K158-L194 HydrophobicContact CD-CD1 3.99Å; K158-L194 HydrophobicContact CD-CD2 3.94Å; K158-L194 VanDerWaalsContact CE-CD2 3.46Å; K158-L194 HydrophobicContact CG-CD1 3.68Å; K158-L194 HydrophobicContact CG-CD2 4.24Å; K158-E203 IonicContact NZ-OE1 2.7Å; K158-E203 PolarHBondContact NZ-OE1 2.87Å; K158-E203 IonicContact NZ-OE2 3.73Å; K158-E203 PolarHBondContact NZ-OE2 3.42Å
159	H	93.1	Very high	88.6	Confident	35 Å²	35	66.4 Å²	66.4	16%	0.162	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.2	166.7	174.6	-133.5	0	0	0	108.2	N161 Q162 M164 Q186 A188 T190 Y191	H159-N161 PolarHBondContact O-N 2.63Å; H159-Q162 PolarHBondContact N-O 3.37Å; H159-Q162 PolarHBondContact O-N 3.44Å; H159-M164 HydrophobicContact CB-CB 4.21Å; H159-M164 HydrophobicContact CB-CG 4.37Å; H159-Q186 PolarHBondContact CE1-O 2.81Å; H159-A188 PolarHBondContact NE2-O 2.89Å; H159-T190 CarbonylContact C-O 3.34Å; H159-T190 WeakPolarHBondContact CA-O 3.21Å; H159-T190 PolarHBondContact CD2-O 3.26Å; H159-Y191 HydrophobicContact CB-CD1 4.16Å; H159-Y191 HydrophobicContact CB-CE1 3.8Å; H159-Y191 AromaticContact CD2-CD2 3.91Å; H159-Y191 AromaticContact CD2-CE1 3.71Å; H159-Y191 AromaticContact CD2-CE2 3.34Å; H159-Y191 WeakPolarHBondContact CD2-CE2 3.36Å; H159-Y191 AromaticContact CD2-CZ 3.23Å; H159-Y191 PolarHBondContact CD2-OH 3.09Å; H159-Y191 AromaticContact CG-CE1 3.85Å; H159-Y191 AromaticContact CG-CZ 3.74Å; H159-Y191 AromaticContact NE2-CE2 3.74Å; H159-Y191 AromaticContact NE2-CZ 3.7Å
160	N	89.3	Confident	88.8	Confident	79 Å²	79	66.4 Å²	66.4	42%	0.422	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.9	48.2	-173.3	-63.4	-40.8	0	0	0	112.5	Q162 A188 G189 T190	N160-Q162 PolarHBondContact O-N 2.96Å; N160-Q162 VanDerWaalsContact O-N 3.12Å; N160-A188 PolarHBondContact ND2-O 2.86Å; N160-G189 WeakPolarHBondContact OD1-CA 3.19Å; N160-T190 PolarHBondContact N-O 3.47Å; N160-T190 PolarHBondContact OD1-N 3.33Å
161	N	87.1	Confident	89	Confident	119 Å²	119	72 Å²	72	64%	0.636	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	-0	-176.1	-57.6	-2.7	0	0	0	116.7	H159	H159-N161 PolarHBondContact O-N 2.63Å
162	Q	89.8	Confident	89.3	Confident	153 Å²	153	72.6 Å²	72.6	72%	0.715	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	142	176.9	-61	-175.6	-1.3	0	0	111.2	K158 H159 N160 M164	K158-Q162 CarbonylContact C-O 3.59Å; K158-Q162 VanDerWaalsContact CA-O 3.22Å; K158-Q162 WeakPolarHBondContact CA-O 3.25Å; H159-Q162 PolarHBondContact N-O 3.37Å; H159-Q162 PolarHBondContact O-N 3.44Å; N160-Q162 PolarHBondContact O-N 2.96Å; N160-Q162 VanDerWaalsContact O-N 3.12Å; Q162-M164 PolarHBondContact O-N 3.44Å; Q162-M164 VanDerWaalsContact O-N 3.16Å
163	K	87.3	Confident	89.4	Confident	129 Å²	129	71.4 Å²	71.4	56%	0.561	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	115.6	177	-171.3	164.8	-177.4	163.4	0	109.2	Y156	Y156-K163 VanDerWaalsContact CD1-NZ 3.33Å; Y156-K163 VanDerWaalsContact CG-CE 3.45Å
164	M	88	Confident	89.3	Confident	33 Å²	33	80.5 Å²	80.5	16%	0.163	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-73.4	133.2	-170.5	-176.9	-164.8	73.1	0	0	111.3	W157 H159 Q162 L178 Y191	W157-M164 HydrophobicContact CB-CE 4.09Å; W157-M164 WeakPolarHBondContact O-CB 3.41Å; W157-M164 PolarHBondContact O-N 3.22Å; H159-M164 HydrophobicContact CB-CB 4.21Å; H159-M164 HydrophobicContact CB-CG 4.37Å; Q162-M164 PolarHBondContact O-N 3.44Å; Q162-M164 VanDerWaalsContact O-N 3.16Å; M164-L178 HydrophobicContact CE-CD1 3.56Å; M164-L178 HydrophobicContact CE-CD2 3.75Å; M164-L178 HydrophobicContact CE-CG 4.31Å; M164-L178 HydrophobicContact SD-CD1 4.32Å; M164-L178 HydrophobicContact SD-CD2 3.68Å; M164-Y191 HydrophobicContact SD-CE1 4.11Å
165	V	85.7	Confident	89.1	Confident	122 Å²	122	80.1 Å²	80.1	74%	0.739	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-80.5	123.9	172.9	-176.7	0	0	0	0	109.9
166	V	83.9	Confident	88.9	Confident	93 Å²	93	78.9 Å²	78.9	56%	0.564	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-65.3	134.9	173.2	-179.5	0	0	0	0	109	T170	V166-T170 WeakPolarHBondContact CG1-O 3.41Å
167	S	84	Confident	88.9	Confident	50 Å²	50	75.1 Å²	75.1	35%	0.35	39%	0.391	S	S	.	.	B	Isolated β-bridge	trans	-136.6	173.1	-173.6	77.2	0	0	0	0	111.3	R169 T170	S167-R169 PolarHBondContact O-N 3.29Å; S167-R169 PolarHBondContact OG-N 2.82Å; S167-T170 WeakPolarHBondContact CB-OG1 3.22Å; S167-T170 PolarHBondContact N-O 3.09Å; S167-T170 VanDerWaalsContact N-O 3.14Å; S167-T170 PolarHBondContact N-OG1 2.83Å; S167-T170 CarbonylContact O-C 3.59Å; S167-T170 PolarHBondContact O-N 2.89Å; S167-T170 PolarHBondContact OG-N 2.9Å; S167-T170 PolarHBondContact OG-OG1 3.04Å
168	S	85.6	Confident	88.9	Confident	107 Å²	107	74.9 Å²	74.9	75%	0.748	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-26.2	175.4	53.6	0	0	0	0	113.9
169	R	90.2	Very high	89	Confident	47 Å²	47	77.6 Å²	77.6	18%	0.177	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-23.4	174.4	-61.4	-168.9	-52	123.5	7.3	114.8	S167 E181 G182 D187	S167-R169 PolarHBondContact O-N 3.29Å; S167-R169 PolarHBondContact OG-N 2.82Å; R169-E181 WeakPolarHBondContact CD-O 3.46Å; R169-E181 PolarHBondContact O-N 2.9Å; R169-G182 PolarHBondContact NH1-O 2.87Å; R169-D187 IonicContact CZ-OD1 3.75Å; R169-D187 IonicContact CZ-OD2 3.09Å; R169-D187 IonicContact NH1-OD1 3.85Å; R169-D187 IonicContact NH1-OD2 2.96Å; R169-D187 PolarHBondContact NH1-OD2 3Å; R169-D187 IonicContact NH2-OD1 2.75Å; R169-D187 PolarHBondContact NH2-OD1 3.25Å; R169-D187 IonicContact NH2-OD2 2.71Å; R169-D187 PolarHBondContact NH2-OD2 2.63Å
170	T	90.7	Very high	89	Confident	10 Å²	10	75.9 Å²	75.9	6%	0.061	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	111.2	-168.8	47.9	0	0	0	0	110	V166 S167 R179 I180	V166-T170 WeakPolarHBondContact CG1-O 3.41Å; S167-T170 WeakPolarHBondContact CB-OG1 3.22Å; S167-T170 PolarHBondContact N-O 3.09Å; S167-T170 VanDerWaalsContact N-O 3.14Å; S167-T170 PolarHBondContact N-OG1 2.83Å; S167-T170 CarbonylContact O-C 3.59Å; S167-T170 PolarHBondContact O-N 2.89Å; S167-T170 PolarHBondContact OG-N 2.9Å; S167-T170 PolarHBondContact OG-OG1 3.04Å; T170-R179 WeakPolarHBondContact CA-O 3.28Å; T170-I180 HydrophobicContact CG2-CB 4.41Å; T170-I180 HydrophobicContact CG2-CG1 4.17Å; T170-I180 HydrophobicContact CG2-CG2 4.03Å
171	R	90.3	Very high	89.1	Confident	136 Å²	136	74.4 Å²	74.4	51%	0.513	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.9	-174.7	-52.6	-174	-160.1	-175	11.2	110.3	R179 E181	R171-R179 PolarHBondContact N-O 2.77Å; R171-R179 PolarHBondContact O-N 2.91Å; R171-E181 IonicContact CZ-OE2 3.6Å; R171-E181 IonicContact NE-OE2 2.71Å; R171-E181 IonicContact NH2-OE2 3.96Å; R171-E181 PolarHBondContact NH2-OE2 2.79Å
172	V	91.9	Very high	89	Confident	51 Å²	51	70.1 Å²	70.1	31%	0.309	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	132.6	165.8	-174.2	0	0	0	0	107.4	V155 G177	V155-V172 HydrophobicContact CB-CG1 4.45Å; V155-V172 HydrophobicContact CG1-CG1 4.31Å; V172-G177 WeakPolarHBondContact CA-O 3.37Å
173	M	89.6	Confident	88.9	Confident	80 Å²	80	62.9 Å²	62.9	39%	0.394	33%	0.332	S	S	.	.			trans	-89.6	161.5	178.1	-64.9	-178.7	58	0	0	110.6	L141 S175 G176 G177 R179	L141-M173 HydrophobicContact CD1-SD 3.69Å; L141-M173 HydrophobicContact CD2-SD 4.27Å; M173-S175 PolarHBondContact O-N 2.85Å; M173-S175 VanDerWaalsContact O-N 3.13Å; M173-G176 WeakPolarHBondContact O-CA 3.47Å; M173-G176 PolarHBondContact O-N 2.85Å; M173-G177 PolarHBondContact N-O 3.31Å; M173-R179 HydrophobicContact CG-CB 4.42Å; M173-R179 HydrophobicContact SD-CB 4.25Å
174	E	86.2	Confident	88.9	Confident	211 Å²	211	61.7 Å²	61.7	99%	0.986	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.3	178.4	-65.3	172.8	176.1	0	0	113.3	G176	E174-G176 PolarHBondContact O-N 3.07Å
175	S	86.2	Confident	88.6	Confident	69 Å²	69	70.1 Å²	70.1	48%	0.483	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-11.6	172.6	56.7	0	0	0	0	114.6	P146 M173	P146-S175 WeakPolarHBondContact CD-O 3.42Å; M173-S175 PolarHBondContact O-N 2.85Å; M173-S175 VanDerWaalsContact O-N 3.13Å
176	G	88.5	Confident	88.7	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.01	35%	0.353	C	S	.	.	S	Bend	trans	96.6	-17.4	-170.6	0	0	0	0	0	114.4	W157 M173 E174	W157-G176 WeakPolarHBondContact CZ2-O 3.45Å; W157-G176 PolarHBondContact NE1-O 2.9Å; M173-G176 WeakPolarHBondContact O-CA 3.47Å; M173-G176 PolarHBondContact O-N 2.85Å; E174-G176 PolarHBondContact O-N 3.07Å
177	G	92.1	Very high	89	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.328	C	S	.	.			trans	-65.2	144.9	-178.8	0	0	0	0	0	114.5	L142 V172 M173	L142-G177 CarbonylContact O-C 3.55Å; L142-G177 VanDerWaalsContact O-CA 3.25Å; L142-G177 WeakPolarHBondContact O-CA 3.46Å; V172-G177 WeakPolarHBondContact CA-O 3.37Å; M173-G177 PolarHBondContact N-O 3.31Å
178	L	94.1	Very high	89.2	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	115.4	177.4	170.1	59	0	0	0	111.7	L141 L142 W157 M164 I180 Y191	L141-L178 WeakPolarHBondContact CA-O 3.43Å; L142-L178 HydrophobicContact CB-CB 4.45Å; L142-L178 PolarHBondContact N-O 3.12Å; L142-L178 PolarHBondContact O-N 2.93Å; W157-L178 HydrophobicContact CB-CD2 4.3Å; W157-L178 HydrophobicContact CD2-CB 3.63Å; W157-L178 HydrophobicContact CD2-CD2 3.87Å; W157-L178 HydrophobicContact CD2-CG 4.38Å; W157-L178 VanDerWaalsContact CE2-CB 3.44Å; W157-L178 HydrophobicContact CE3-CB 3.99Å; W157-L178 HydrophobicContact CE3-CD2 3.83Å; W157-L178 HydrophobicContact CG-CB 4.14Å; W157-L178 HydrophobicContact CG-CD2 4.06Å; W157-L178 HydrophobicContact CH2-CB 4.01Å; W157-L178 HydrophobicContact CZ2-CB 3.66Å; W157-L178 HydrophobicContact CZ3-CB 4.16Å; W157-L178 HydrophobicContact CZ3-CD2 4.45Å; M164-L178 HydrophobicContact CE-CD1 3.56Å; M164-L178 HydrophobicContact CE-CD2 3.75Å; M164-L178 HydrophobicContact CE-CG 4.31Å; M164-L178 HydrophobicContact SD-CD1 4.32Å; M164-L178 HydrophobicContact SD-CD2 3.68Å; L178-I180 HydrophobicContact CD1-CG1 4.28Å; L178-I180 HydrophobicContact CD2-CD1 4.21Å; L178-I180 HydrophobicContact CD2-CG1 4.28Å; L178-I180 HydrophobicContact CG-CD1 4.39Å; L178-I180 HydrophobicContact CG-CG1 3.94Å; L178-Y191 HydrophobicContact CD2-CD1 3.79Å; L178-Y191 HydrophobicContact CD2-CE1 3.68Å
179	R	94.2	Very high	89.5	Confident	104 Å²	104	62 Å²	62	39%	0.392	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.2	171.2	-178.8	174.2	170.1	129.7	-6.4	110.6	T139 V140 L141 T170 R171 M173 E181	T139-R179 HydrophobicContact CG2-CG 4.11Å; V140-R179 CarbonylContact O-C 3.59Å; V140-R179 WeakPolarHBondContact O-CA 3.25Å; L141-R179 HydrophobicContact CD1-CB 4.47Å; T170-R179 WeakPolarHBondContact CA-O 3.28Å; R171-R179 PolarHBondContact N-O 2.77Å; R171-R179 PolarHBondContact O-N 2.91Å; M173-R179 HydrophobicContact CG-CB 4.42Å; M173-R179 HydrophobicContact SD-CB 4.25Å; R179-E181 HydrophobicContact CG-CG 4.16Å; R179-E181 IonicContact CZ-OE1 3.28Å; R179-E181 IonicContact NE-OE1 3.66Å; R179-E181 PolarHBondContact NE-OE1 2.64Å; R179-E181 IonicContact NH2-OE1 3.88Å; R179-E181 PolarHBondContact NH2-OE1 3.03Å
180	I	93.9	Very high	89.7	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	112	176	-51.1	-177	0	0	0	108.4	T139 V140 T170 L178 V183 Y191 L209	T139-I180 CarbonylContact C-O 3.45Å; T139-I180 VanDerWaalsContact CA-O 3.27Å; T139-I180 WeakPolarHBondContact CA-O 3.25Å; V140-I180 PolarHBondContact N-O 2.58Å; V140-I180 PolarHBondContact O-N 3.08Å; T170-I180 HydrophobicContact CG2-CB 4.41Å; T170-I180 HydrophobicContact CG2-CG1 4.17Å; T170-I180 HydrophobicContact CG2-CG2 4.03Å; L178-I180 HydrophobicContact CD1-CG1 4.28Å; L178-I180 HydrophobicContact CD2-CD1 4.21Å; L178-I180 HydrophobicContact CD2-CG1 4.28Å; L178-I180 HydrophobicContact CG-CD1 4.39Å; L178-I180 HydrophobicContact CG-CG1 3.94Å; I180-V183 HydrophobicContact CB-CG2 4.31Å; I180-V183 HydrophobicContact CG2-CG2 3.83Å; I180-Y191 HydrophobicContact CD1-CE1 4.13Å; I180-L209 HydrophobicContact CD1-CD2 3.84Å
181	E	90.7	Very high	89.9	Confident	47 Å²	47	61.6 Å²	61.6	22%	0.22	30%	0.301	C	S	.	.	S	Bend	trans	-93.8	130.6	-179.2	-54.2	-168.1	132.5	0	0	111	T139 R169 R171 R179	T139-E181 HydrophobicContact CG2-CG 4.07Å; R169-E181 WeakPolarHBondContact CD-O 3.46Å; R169-E181 PolarHBondContact O-N 2.9Å; R171-E181 IonicContact CZ-OE2 3.6Å; R171-E181 IonicContact NE-OE2 2.71Å; R171-E181 IonicContact NH2-OE2 3.96Å; R171-E181 PolarHBondContact NH2-OE2 2.79Å; R179-E181 HydrophobicContact CG-CG 4.16Å; R179-E181 IonicContact CZ-OE1 3.28Å; R179-E181 IonicContact NE-OE1 3.66Å; R179-E181 PolarHBondContact NE-OE1 2.64Å; R179-E181 IonicContact NH2-OE1 3.88Å; R179-E181 PolarHBondContact NH2-OE1 3.03Å
182	G	86.9	Confident	90.1	Very high	29 Å²	29	56.3 Å²	56.3	30%	0.299	28%	0.282	S	S	.	.	S	Bend	trans	61.4	64.4	179.3	0	0	0	0	0	113	Q138 R169 K184	Q138-G182 PolarHBondContact O-N 3.38Å; R169-G182 PolarHBondContact NH1-O 2.87Å; G182-K184 PolarHBondContact O-N 2.96Å
183	V	87.6	Confident	90.2	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.012	27%	0.267	C	S	.	.			trans	-54.2	131.3	-177.3	164.7	0	0	0	0	112.9	F136 G137 Q138 V140 I180 D187 I211	F136-V183 WeakPolarHBondContact CA-O 3.41Å; G137-V183 PolarHBondContact N-O 3.06Å; Q138-V183 WeakPolarHBondContact O-CG2 3.33Å; Q138-V183 PolarHBondContact O-N 2.79Å; V140-V183 HydrophobicContact CB-CG2 4.3Å; V140-V183 HydrophobicContact CG2-CG2 3.76Å; I180-V183 HydrophobicContact CB-CG2 4.31Å; I180-V183 HydrophobicContact CG2-CG2 3.83Å; V183-D187 WeakPolarHBondContact CA-OD2 3.17Å; V183-I211 HydrophobicContact CG1-CD1 3.48Å; V183-I211 VanDerWaalsContact CG1-CD1 3.48Å; V183-I211 HydrophobicContact CG1-CG1 3.83Å; V183-I211 HydrophobicContact CG1-CG2 4.48Å
184	K	86.6	Confident	90.3	Very high	103 Å²	103	50.8 Å²	50.8	45%	0.448	25%	0.252	S	S	.	.			trans	-118.8	159	-179.5	-64.4	-179	-178.7	-173.8	0	110.6	G182 Q186 D187 I211	G182-K184 PolarHBondContact O-N 2.96Å; K184-Q186 HydrophobicContact CB-CG 4.18Å; K184-Q186 PolarHBondContact O-N 2.8Å; K184-D187 PolarHBondContact N-OD2 2.93Å; K184-D187 WeakPolarHBondContact O-CB 3.07Å; K184-D187 PolarHBondContact O-N 2.85Å; K184-I211 WeakPolarHBondContact O-CD1 3.47Å
185	R	82.5	Confident	90.6	Very high	210 Å²	210	40.8 Å²	40.8	79%	0.792	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-49.3	-35.9	-178.5	-173.2	178.2	178.5	-171.7	-2	114.2	F136 D187 A188	F136-R185 HydrophobicContact CE1-CB 3.84Å; F136-R185 HydrophobicContact CZ-CB 3.93Å; F136-R185 HydrophobicContact CZ-CG 4.47Å; R185-D187 VanDerWaalsContact C-N 3.28Å; R185-D187 PolarHBondContact O-N 2.74Å; R185-A188 PolarHBondContact O-N 3.37Å
186	Q	87.2	Confident	90.8	Very high	139 Å²	139	42 Å²	42	65%	0.65	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-69.8	-19.5	179.5	70.6	-166.7	62.5	0	0	114.2	H159 K184 A188	H159-Q186 PolarHBondContact CE1-O 2.81Å; K184-Q186 HydrophobicContact CB-CG 4.18Å; K184-Q186 PolarHBondContact O-N 2.8Å; Q186-A188 PolarHBondContact O-N 3.06Å
187	D	90	Very high	90.8	Very high	10 Å²	10	43.1 Å²	43.1	5%	0.053	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-82.9	1.5	-179.9	-46.7	-33.4	0	0	0	111.5	R169 V183 K184 R185 Y191 I211	R169-D187 IonicContact CZ-OD1 3.75Å; R169-D187 IonicContact CZ-OD2 3.09Å; R169-D187 IonicContact NH1-OD1 3.85Å; R169-D187 IonicContact NH1-OD2 2.96Å; R169-D187 PolarHBondContact NH1-OD2 3Å; R169-D187 IonicContact NH2-OD1 2.75Å; R169-D187 PolarHBondContact NH2-OD1 3.25Å; R169-D187 IonicContact NH2-OD2 2.71Å; R169-D187 PolarHBondContact NH2-OD2 2.63Å; V183-D187 WeakPolarHBondContact CA-OD2 3.17Å; K184-D187 PolarHBondContact N-OD2 2.93Å; K184-D187 WeakPolarHBondContact O-CB 3.07Å; K184-D187 PolarHBondContact O-N 2.85Å; R185-D187 VanDerWaalsContact C-N 3.28Å; R185-D187 PolarHBondContact O-N 2.74Å; D187-Y191 WeakPolarHBondContact O-CE2 3.35Å; D187-Y191 PolarHBondContact O-OH 2.89Å; D187-Y191 VanDerWaalsContact O-OH 3.09Å; D187-I211 HydrophobicContact CB-CD1 4.42Å
188	A	88.8	Confident	90.3	Very high	37 Å²	37	46.6 Å²	46.6	31%	0.306	24%	0.235	S	C	.	.			trans	-72.3	146.6	170.7	0	0	0	0	0	110.5	H159 N160 R185 Q186 I211	H159-A188 PolarHBondContact NE2-O 2.89Å; N160-A188 PolarHBondContact ND2-O 2.86Å; R185-A188 PolarHBondContact O-N 3.37Å; Q186-A188 PolarHBondContact O-N 3.06Å; A188-I211 HydrophobicContact CB-CB 4.5Å; A188-I211 HydrophobicContact CB-CD1 3.82Å; A188-I211 HydrophobicContact CB-CG1 3.95Å
189	G	91.2	Very high	89.9	Confident	15 Å²	15	47.7 Å²	47.7	16%	0.155	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.6	-171.2	175.8	0	0	0	0	0	114.5	N160 T208 L209	N160-G189 WeakPolarHBondContact OD1-CA 3.19Å; G189-T208 WeakPolarHBondContact O-CA 3.26Å; G189-L209 PolarHBondContact N-O 2.84Å; G189-L209 PolarHBondContact O-N 2.87Å
190	T	94.1	Very high	89.5	Confident	45 Å²	45	43.9 Å²	43.9	28%	0.276	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	140.2	170.5	53.2	0	0	0	0	110.8	H159 N160 A207	H159-T190 CarbonylContact C-O 3.34Å; H159-T190 WeakPolarHBondContact CA-O 3.21Å; H159-T190 PolarHBondContact CD2-O 3.26Å; N160-T190 PolarHBondContact N-O 3.47Å; N160-T190 PolarHBondContact OD1-N 3.33Å; T190-A207 CarbonylContact C-O 3.57Å; T190-A207 VanDerWaalsContact CA-O 3.28Å; T190-A207 WeakPolarHBondContact CA-O 3.49Å
191	Y	94.7	Very high	89.4	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.016	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	134.4	177.1	-77.9	-91	0	0	0	109.6	L142 W157 K158 H159 M164 L178 I180 D187 S206 A207 L209	L142-Y191 HydrophobicContact CD1-CD1 3.88Å; L142-Y191 HydrophobicContact CD1-CD2 3.85Å; L142-Y191 HydrophobicContact CD1-CE1 4.44Å; L142-Y191 HydrophobicContact CD1-CE2 4.41Å; L142-Y191 HydrophobicContact CD1-CG 3.55Å; W157-Y191 HydrophobicContact CE3-CD1 4.2Å; K158-Y191 VanDerWaalsContact O-CA 3.32Å; K158-Y191 WeakPolarHBondContact O-CA 3.42Å; H159-Y191 HydrophobicContact CB-CD1 4.16Å; H159-Y191 HydrophobicContact CB-CE1 3.8Å; H159-Y191 AromaticContact CD2-CD2 3.91Å; H159-Y191 AromaticContact CD2-CE1 3.71Å; H159-Y191 AromaticContact CD2-CE2 3.34Å; H159-Y191 WeakPolarHBondContact CD2-CE2 3.36Å; H159-Y191 AromaticContact CD2-CZ 3.23Å; H159-Y191 PolarHBondContact CD2-OH 3.09Å; H159-Y191 AromaticContact CG-CE1 3.85Å; H159-Y191 AromaticContact CG-CZ 3.74Å; H159-Y191 AromaticContact NE2-CE2 3.74Å; H159-Y191 AromaticContact NE2-CZ 3.7Å; M164-Y191 HydrophobicContact SD-CE1 4.11Å; L178-Y191 HydrophobicContact CD2-CD1 3.79Å; L178-Y191 HydrophobicContact CD2-CE1 3.68Å; I180-Y191 HydrophobicContact CD1-CE1 4.13Å; D187-Y191 WeakPolarHBondContact O-CE2 3.35Å; D187-Y191 PolarHBondContact O-OH 2.89Å; D187-Y191 VanDerWaalsContact O-OH 3.09Å; Y191-S206 WeakPolarHBondContact O-CA 3.46Å; Y191-A207 PolarHBondContact N-O 2.75Å; Y191-A207 PolarHBondContact O-N 2.66Å; Y191-L209 HydrophobicContact CD2-CB 3.76Å; Y191-L209 HydrophobicContact CE2-CB 3.65Å; Y191-L209 HydrophobicContact CE2-CD2 3.84Å; Y191-L209 HydrophobicContact CE2-CG 4.36Å
192	Q	94.4	Very high	89.5	Confident	26 Å²	26	48.7 Å²	48.7	12%	0.121	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143.7	169	-62.2	173.6	-84.3	0	0	109.2	W157 K158 L194 S204 S206	W157-Q192 CarbonylContact C-O 3.43Å; W157-Q192 VanDerWaalsContact CA-O 3.28Å; W157-Q192 WeakPolarHBondContact CA-O 3.06Å; K158-Q192 HydrophobicContact CB-CB 4.3Å; K158-Q192 PolarHBondContact N-O 3.5Å; K158-Q192 PolarHBondContact O-N 3.11Å; Q192-L194 HydrophobicContact CB-CD1 4.26Å; Q192-L194 WeakPolarHBondContact O-CD1 3.36Å; Q192-S204 WeakPolarHBondContact CA-OG 3.43Å; Q192-S204 PolarHBondContact NE2-O 2.93Å; Q192-S204 VanDerWaalsContact NE2-O 3.16Å; Q192-S206 VanDerWaalsContact CG-OG 3.28Å; Q192-S206 WeakPolarHBondContact CG-OG 3.41Å
193	C	93.7	Very high	89.7	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	142	168.6	-176.7	0	0	0	0	109	C144 V155 W157 W202 S204	C144-C193 HydrophobicContact CB-CB 3.58Å; C144-C193 WeakPolarHBondContact CB-SG 3.24Å; C144-C193 WeakPolarHBondContact SG-CB 3.18Å; C144-C193 CovalentContact SG-SG 2.03Å; C144-C193 PolarHBondContact SG-SG 2.99Å; V155-C193 VanDerWaalsContact CG1-SG 3.59Å; W157-C193 HydrophobicContact CD2-CB 4.32Å; W157-C193 HydrophobicContact CE3-CB 4.45Å; W157-C193 HydrophobicContact CH2-CB 4.11Å; W157-C193 HydrophobicContact CZ2-CB 3.92Å; W157-C193 HydrophobicContact CZ3-CB 4.37Å; C193-W202 HydrophobicContact CB-CZ3 4.39Å; C193-S204 PolarHBondContact N-OG 3.01Å; C193-S204 WeakPolarHBondContact O-CB 2.99Å; C193-S204 PolarHBondContact O-N 2.99Å; C193-S204 PolarHBondContact O-OG 2.97Å
194	L	93.4	Very high	90	Very high	15 Å²	15	51.1 Å²	51.1	8%	0.079	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	137.9	-177.1	-60.7	90.4	0	0	0	108.8	V155 Y156 K158 Q192 W202 E203	V155-L194 CarbonylContact C-O 3.56Å; V155-L194 VanDerWaalsContact CA-O 3.3Å; V155-L194 WeakPolarHBondContact CA-O 3.22Å; Y156-L194 PolarHBondContact N-O 2.98Å; Y156-L194 PolarHBondContact O-N 3.19Å; K158-L194 HydrophobicContact CB-CD1 4.01Å; K158-L194 HydrophobicContact CD-CD1 3.99Å; K158-L194 HydrophobicContact CD-CD2 3.94Å; K158-L194 VanDerWaalsContact CE-CD2 3.46Å; K158-L194 HydrophobicContact CG-CD1 3.68Å; K158-L194 HydrophobicContact CG-CD2 4.24Å; Q192-L194 HydrophobicContact CB-CD1 4.26Å; Q192-L194 WeakPolarHBondContact O-CD1 3.36Å; L194-W202 VanDerWaalsContact CA-O 3.31Å; L194-W202 WeakPolarHBondContact CA-O 3.38Å; L194-E203 HydrophobicContact CD2-CG 3.72Å; L194-E203 VanDerWaalsContact CD2-OE1 3.32Å; L194-E203 WeakPolarHBondContact CD2-OE1 3.45Å; L194-E203 HydrophobicContact CG-CB 4.47Å; L194-E203 HydrophobicContact CG-CG 4.01Å
195	A	91.9	Very high	90.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.8	-178.8	0	0	0	0	0	110.3	P146 P147 P153 H201 W202	P146-A195 HydrophobicContact CB-CB 3.97Å; P147-A195 HydrophobicContact CG-CB 4.24Å; P153-A195 HydrophobicContact CB-CB 4.02Å; A195-H201 CarbonylContact O-C 3.53Å; A195-H201 WeakPolarHBondContact O-CA 3.37Å; A195-H201 PolarHBondContact O-ND1 3.41Å; A195-W202 HydrophobicContact CB-CE3 4.2Å; A195-W202 PolarHBondContact N-O 2.81Å; A195-W202 PolarHBondContact O-N 3.03Å
196	E	90.4	Very high	90.6	Very high	96 Å²	96	48.3 Å²	48.3	45%	0.449	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	131.7	-170.9	-174.6	176.3	-158.6	0	0	110.4	P153 T154 Y156	P153-E196 WeakPolarHBondContact CA-O 3.46Å; T154-E196 PolarHBondContact N-O 2.79Å; T154-E196 PolarHBondContact O-N 2.98Å; Y156-E196 HydrophobicContact CE2-CB 4.21Å; Y156-E196 VanDerWaalsContact CE2-OE2 3.24Å; Y156-E196 WeakPolarHBondContact CE2-OE2 3.21Å
197	S	87.7	Confident	90.9	Very high	23 Å²	23	41.8 Å²	41.8	16%	0.161	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	171.9	173.6	80.2	0	0	0	0	110.9	F121 A199 G200	F121-S197 WeakPolarHBondContact CD2-OG 3.5Å; S197-A199 PolarHBondContact O-N 2.98Å; S197-A199 VanDerWaalsContact O-N 3.12Å; S197-A199 PolarHBondContact OG-N 2.68Å; S197-A199 VanDerWaalsContact OG-N 3.11Å; S197-G200 PolarHBondContact N-O 3.1Å; S197-G200 PolarHBondContact O-N 3.41Å; S197-G200 PolarHBondContact OG-N 3.23Å
198	S	83.2	Confident	91	Very high	73 Å²	73	44.1 Å²	44.1	51%	0.51	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.2	172.3	55.7	0	0	0	0	114	P151	P151-S198 WeakPolarHBondContact CD-OG 3.15Å
199	A	84.7	Confident	91.2	Very high	24 Å²	24	42.4 Å²	42.4	20%	0.198	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-14.9	179.3	0	0	0	0	0	114.2	L38 A119 F120 F121 S197	L38-A199 HydrophobicContact CD2-CB 4.29Å; A119-A199 HydrophobicContact CB-CB 3.83Å; F120-A199 VanDerWaalsContact C-CB 3.47Å; F121-A199 HydrophobicContact CB-CB 3.82Å; S197-A199 PolarHBondContact O-N 2.98Å; S197-A199 VanDerWaalsContact O-N 3.12Å; S197-A199 PolarHBondContact OG-N 2.68Å; S197-A199 VanDerWaalsContact OG-N 3.11Å
200	G	86.4	Confident	91	Very high	24 Å²	24	45 Å²	45	25%	0.247	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.4	173.1	-178	0	0	0	0	0	115.7	S197	S197-G200 PolarHBondContact N-O 3.1Å; S197-G200 PolarHBondContact O-N 3.41Å; S197-G200 PolarHBondContact OG-N 3.23Å
201	H	90.9	Very high	90.3	Very high	102 Å²	102	44.5 Å²	44.5	47%	0.472	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	145.6	178.5	175.5	53.7	0	0	0	110.3	F121 A195 E203	F121-H201 WeakPolarHBondContact CE1-O 3.45Å; A195-H201 CarbonylContact O-C 3.53Å; A195-H201 WeakPolarHBondContact O-CA 3.37Å; A195-H201 PolarHBondContact O-ND1 3.41Å; H201-E203 IonicContact CE1-OE1 2.7Å; H201-E203 VanDerWaalsContact NE2-CG 3.31Å; H201-E203 WeakPolarHBondContact NE2-CG 3.4Å; H201-E203 IonicContact NE2-OE1 3.62Å; H201-E203 PolarHBondContact NE2-OE1 3.43Å
202	W	92.9	Very high	89.3	Confident	45 Å²	45	49.3 Å²	49.3	17%	0.17	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	139.9	177.6	176.1	90.9	0	0	0	110.6	F121 A126 P147 C193 L194 A195	F121-W202 HydrophobicContact CE1-CB 3.82Å; F121-W202 HydrophobicContact CZ-CB 3.63Å; A126-W202 HydrophobicContact CB-CD2 4.28Å; A126-W202 HydrophobicContact CB-CH2 4.18Å; A126-W202 HydrophobicContact CB-CZ2 3.58Å; P147-W202 HydrophobicContact CG-CB 3.61Å; P147-W202 HydrophobicContact CG-CD2 3.87Å; P147-W202 HydrophobicContact CG-CE3 4.24Å; P147-W202 HydrophobicContact CG-CG 3.63Å; C193-W202 HydrophobicContact CB-CZ3 4.39Å; L194-W202 VanDerWaalsContact CA-O 3.31Å; L194-W202 WeakPolarHBondContact CA-O 3.38Å; A195-W202 HydrophobicContact CB-CE3 4.2Å; A195-W202 PolarHBondContact N-O 2.81Å; A195-W202 PolarHBondContact O-N 3.03Å
203	E	92.3	Very high	88.2	Confident	77 Å²	77	53.5 Å²	53.5	36%	0.36	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.4	169.6	-56.5	-155.5	-176.6	0	0	110.7	K158 L194 H201	K158-E203 IonicContact NZ-OE1 2.7Å; K158-E203 PolarHBondContact NZ-OE1 2.87Å; K158-E203 IonicContact NZ-OE2 3.73Å; K158-E203 PolarHBondContact NZ-OE2 3.42Å; L194-E203 HydrophobicContact CD2-CG 3.72Å; L194-E203 VanDerWaalsContact CD2-OE1 3.32Å; L194-E203 WeakPolarHBondContact CD2-OE1 3.45Å; L194-E203 HydrophobicContact CG-CB 4.47Å; L194-E203 HydrophobicContact CG-CG 4.01Å; H201-E203 IonicContact CE1-OE1 2.7Å; H201-E203 VanDerWaalsContact NE2-CG 3.31Å; H201-E203 WeakPolarHBondContact NE2-CG 3.4Å; H201-E203 IonicContact NE2-OE1 3.62Å; H201-E203 PolarHBondContact NE2-OE1 3.43Å
204	S	93.1	Very high	87.1	Confident	6 Å²	6	58.6 Å²	58.6	4%	0.042	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-74.4	160.5	176	82.1	0	0	0	0	112.4	P129 Q192 C193	P129-S204 WeakPolarHBondContact CD-OG 3.22Å; Q192-S204 WeakPolarHBondContact CA-OG 3.43Å; Q192-S204 PolarHBondContact NE2-O 2.93Å; Q192-S204 VanDerWaalsContact NE2-O 3.16Å; C193-S204 PolarHBondContact N-OG 3.01Å; C193-S204 WeakPolarHBondContact O-CB 2.99Å; C193-S204 PolarHBondContact O-N 2.99Å; C193-S204 PolarHBondContact O-OG 2.97Å
205	K	90.8	Very high	86.2	Confident	190 Å²	190	58 Å²	58	83%	0.826	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-55.3	149.7	156.4	-67.2	176.5	179.8	173.2	0	109.9
206	S	91.6	Very high	85.5	Confident	64 Å²	64	66 Å²	66	45%	0.448	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-80.9	125.5	-179.2	-51.4	0	0	0	0	112	Y191 Q192	Y191-S206 WeakPolarHBondContact O-CA 3.46Å; Q192-S206 VanDerWaalsContact CG-OG 3.28Å; Q192-S206 WeakPolarHBondContact CG-OG 3.41Å
207	A	93	Very high	84.9	Confident	1 Å²	1	64 Å²	64	1%	0.008	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	147.6	166.1	0	0	0	0	0	110.9	P129 E130 T190 Y191	P129-A207 HydrophobicContact CB-CB 3.63Å; P129-A207 HydrophobicContact CG-CB 3.68Å; E130-A207 WeakPolarHBondContact O-CB 3.43Å; T190-A207 CarbonylContact C-O 3.57Å; T190-A207 VanDerWaalsContact CA-O 3.28Å; T190-A207 WeakPolarHBondContact CA-O 3.49Å; Y191-A207 PolarHBondContact N-O 2.75Å; Y191-A207 PolarHBondContact O-N 2.66Å
208	T	92.7	Very high	84.3	Confident	59 Å²	59	68 Å²	68	36%	0.362	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	116.3	171.4	-57.9	0	0	0	0	110.5	S131 K132 G189 T210	S131-T208 PolarHBondContact OG-N 3Å; K132-T208 VanDerWaalsContact O-O 3.13Å; G189-T208 WeakPolarHBondContact O-CA 3.26Å; T208-T210 PolarHBondContact O-N 3.33Å
209	L	91.9	Very high	84	Confident	1 Å²	1	70 Å²	70	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	102.7	171.7	-179.2	52.3	0	0	0	109.8	K132 A134 V140 I180 G189 Y191	K132-L209 WeakPolarHBondContact O-CA 3.49Å; A134-L209 HydrophobicContact CB-CD1 4.25Å; V140-L209 HydrophobicContact CG1-CD1 4.18Å; I180-L209 HydrophobicContact CD1-CD2 3.84Å; G189-L209 PolarHBondContact N-O 2.84Å; G189-L209 PolarHBondContact O-N 2.87Å; Y191-L209 HydrophobicContact CD2-CB 3.76Å; Y191-L209 HydrophobicContact CE2-CB 3.65Å; Y191-L209 HydrophobicContact CE2-CD2 3.84Å; Y191-L209 HydrophobicContact CE2-CG 4.36Å
210	T	86.4	Confident	83.5	Confident	70 Å²	70	72.4 Å²	72.4	43%	0.429	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	107.9	-175.9	-58.2	0	0	0	0	111.1	K132 S133 A134 T208 R212	K132-T210 PolarHBondContact O-N 2.98Å; S133-T210 VanDerWaalsContact CA-O 3.23Å; S133-T210 WeakPolarHBondContact CA-O 3.29Å; S133-T210 WeakPolarHBondContact CB-O 3.31Å; S133-T210 PolarHBondContact OG-O 3.16Å; A134-T210 PolarHBondContact N-O 3.22Å; A134-T210 VanDerWaalsContact N-O 3.12Å; T208-T210 PolarHBondContact O-N 3.33Å; T210-R212 PolarHBondContact O-N 2.92Å
211	I	80.6	Confident	83.2	Confident	34 Å²	34	71.7 Å²	71.7	17%	0.174	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	114.7	178.9	-57.4	-179.2	0	0	0	110.8	A134 F136 V183 K184 D187 A188	A134-I211 CarbonylContact O-C 3.49Å; A134-I211 WeakPolarHBondContact O-CA 3.42Å; F136-I211 HydrophobicContact CD2-CG2 3.78Å; F136-I211 HydrophobicContact CE2-CG2 3.52Å; F136-I211 HydrophobicContact CG-CG2 4.44Å; F136-I211 HydrophobicContact CZ-CG2 4.02Å; V183-I211 HydrophobicContact CG1-CD1 3.48Å; V183-I211 VanDerWaalsContact CG1-CD1 3.48Å; V183-I211 HydrophobicContact CG1-CG1 3.83Å; V183-I211 HydrophobicContact CG1-CG2 4.48Å; K184-I211 WeakPolarHBondContact O-CD1 3.47Å; D187-I211 HydrophobicContact CB-CD1 4.42Å; A188-I211 HydrophobicContact CB-CB 4.5Å; A188-I211 HydrophobicContact CB-CD1 3.82Å; A188-I211 HydrophobicContact CB-CG1 3.95Å
212	R	72.6	Confident	82.6	Confident	106 Å²	106	71.8 Å²	71.8	40%	0.4	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	162.6	170.9	-63.3	173.4	-176.3	-179.7	2.1	110.5	S133 A134 T210 P242 V287	S133-R212 WeakPolarHBondContact OG-CD 2.88Å; S133-R212 WeakPolarHBondContact OG-CG 3.42Å; S133-R212 PolarHBondContact OG-NE 2.91Å; A134-R212 PolarHBondContact O-N 3.34Å; T210-R212 PolarHBondContact O-N 2.92Å; R212-P242 HydrophobicContact CG-CG 4.46Å; R212-V287 HydrophobicContact CB-CG2 3.36Å; R212-V287 HydrophobicContact CG-CG2 4.45Å
213	R	71.3	Confident	82	Confident	113 Å²	113	70.1 Å²	70.1	43%	0.426	33%	0.329	S	S	.	.			trans	-134.1	153.7	179	56.4	180	176.3	-166.7	-2	110.3	F136 N285	F136-R213 HydrophobicContact CD2-CB 4.3Å; F136-R213 HydrophobicContact CE2-CB 4.16Å; R213-N285 PolarHBondContact O-ND2 3.36Å; R213-N285 PolarHBondContact O-OD1 3.42Å
214	K	70.5	Confident	81.2	Confident	107 Å²	107	70.1 Å²	70.1	47%	0.465	33%	0.328	S	S	.	.			trans	-50.5	145.8	158.3	-81.7	-164.6	166.6	-147.4	0	109.1	V287 N289	K214-V287 HydrophobicContact CG-CG1 4.17Å; K214-N289 PolarHBondContact NZ-O 3.16Å
215	P	75.8	Confident	80.4	Confident	2 Å²	2	71.9 Å²	71.9	1%	0.013	34%	0.335	C	S	.	.			trans	-65.2	161.6	-179	24.5	-26.7	0	0	0	110.8	V283 N285 G288 V290	P215-V283 HydrophobicContact CB-CG1 3.69Å; P215-V283 HydrophobicContact CG-CB 4.46Å; P215-V283 HydrophobicContact CG-CG1 3.97Å; P215-V283 WeakPolarHBondContact CG-O 3.42Å; P215-N285 HydrophobicContact CG-CB 4.39Å; P215-G288 WeakPolarHBondContact CD-O 3.34Å; P215-V290 HydrophobicContact CG-CG2 4.22Å; P215-V290 WeakPolarHBondContact O-CG1 3.25Å
216	R	77.5	Confident	79.7	Confident	170 Å²	170	63 Å²	63	64%	0.642	30%	0.297	S	S	*	.			trans	-125.7	144.6	172.4	-65.7	-175.6	175.1	-164.1	-5.2	109.2	G238 S239	R216-G238 CarbonylContact O-C 3.6Å; R216-S239 PolarHBondContact N-OG 2.91Å; R216-S239 VanDerWaalsContact N-OG 3.1Å; R216-S239 WeakPolarHBondContact O-CB 3.05Å; R216-S239 PolarHBondContact O-N 3.26Å
217	F	76.1	Confident	79.1	Confident	53 Å²	53	62.2 Å²	62.2	23%	0.232	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	133.5	168.1	-64.2	-80.6	0	0	0	110.1	T220 V283 V290 E291 A292	F217-T220 HydrophobicContact CB-CG2 3.71Å; F217-T220 HydrophobicContact CD1-CG2 3.99Å; F217-T220 HydrophobicContact CD2-CG2 3.84Å; F217-T220 HydrophobicContact CE2-CG2 4.5Å; F217-T220 HydrophobicContact CG-CG2 3.57Å; F217-V283 HydrophobicContact CD1-CG2 3.84Å; F217-V283 HydrophobicContact CE1-CB 4.3Å; F217-V283 HydrophobicContact CE1-CG2 3.36Å; F217-V283 HydrophobicContact CZ-CG2 4.02Å; F217-V290 HydrophobicContact CD2-CG2 3.93Å; F217-V290 HydrophobicContact CE2-CB 3.95Å; F217-V290 HydrophobicContact CE2-CG2 3.43Å; F217-V290 VanDerWaalsContact CE2-CG2 3.43Å; F217-V290 HydrophobicContact CZ-CG2 3.84Å; F217-E291 VanDerWaalsContact CZ-C 3.42Å; F217-A292 HydrophobicContact CD1-CB 4.42Å; F217-A292 HydrophobicContact CD2-CB 4.37Å; F217-A292 HydrophobicContact CE1-CB 3.77Å; F217-A292 HydrophobicContact CE2-CB 3.72Å; F217-A292 HydrophobicContact CZ-CB 3.41Å; F217-A292 VanDerWaalsContact CZ-CB 3.41Å
218	K	75.9	Confident	78.5	Confident	108 Å²	108	64.5 Å²	64.5	47%	0.47	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-38.3	154.5	-67.6	-167.5	-173.5	176	0	110.1	L237 E240	K218-L237 HydrophobicContact CB-CD2 4.01Å; K218-L237 HydrophobicContact CD-CD2 3.73Å; K218-L237 HydrophobicContact CG-CD2 4.23Å; K218-L237 PolarHBondContact N-O 2.73Å; K218-E240 WeakPolarHBondContact CE-OE2 3.45Å; K218-E240 IonicContact NZ-OE1 3.46Å; K218-E240 PolarHBondContact NZ-OE1 2.84Å; K218-E240 IonicContact NZ-OE2 3.34Å; K218-E240 PolarHBondContact NZ-OE2 2.85Å
219	F	76.1	Confident	77.9	Confident	113 Å²	113	63.7 Å²	63.7	50%	0.496	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	123.8	173.4	-62.5	-69.3	0	0	0	109.1	L237	F219-L237 HydrophobicContact CB-CB 4.1Å; F219-L237 HydrophobicContact CD2-CB 3.83Å; F219-L237 HydrophobicContact CD2-CD1 4.48Å; F219-L237 HydrophobicContact CG-CB 4.47Å; F219-L237 PolarHBondContact N-O 3.05Å; F219-L237 PolarHBondContact O-N 3.36Å
220	T	75.2	Confident	77.3	Confident	75 Å²	75	66.9 Å²	66.9	46%	0.46	32%	0.324	S	S	.	.			trans	-88.3	148.4	164.6	46.3	0	0	0	0	109.2	F217 A292	F217-T220 HydrophobicContact CB-CG2 3.71Å; F217-T220 HydrophobicContact CD1-CG2 3.99Å; F217-T220 HydrophobicContact CD2-CG2 3.84Å; F217-T220 HydrophobicContact CE2-CG2 4.5Å; F217-T220 HydrophobicContact CG-CG2 3.57Å; T220-A292 HydrophobicContact CG2-CB 3.81Å
221	P	80.4	Confident	77	Confident	9 Å²	9	66.7 Å²	66.7	6%	0.058	33%	0.326	C	S	.	.			trans	-67.4	147.9	172.4	32	-36	0	0	0	110.9	F234 Q235 W248 C281 A292 A294	P221-F234 HydrophobicContact CB-CB 4.31Å; P221-Q235 VanDerWaalsContact CA-O 3.29Å; P221-Q235 WeakPolarHBondContact CA-O 3.5Å; P221-W248 HydrophobicContact CB-CH2 3.79Å; P221-W248 HydrophobicContact CB-CZ3 4.25Å; P221-W248 HydrophobicContact CG-CH2 4.12Å; P221-W248 HydrophobicContact CG-CZ3 4.27Å; P221-C281 HydrophobicContact CG-CB 4.28Å; P221-A292 HydrophobicContact CG-CB 4.48Å; P221-A294 HydrophobicContact CB-CB 3.71Å; P221-A294 HydrophobicContact CG-CB 3.94Å
222	M	77.4	Confident	77.1	Confident	104 Å²	104	65.5 Å²	65.5	51%	0.512	32%	0.32	S	S	.	.			trans	-108.3	135	176	-68.8	169.7	166.3	0	0	109.2	F234	M222-F234 VanDerWaalsContact O-CD1 3.31Å; M222-F234 WeakPolarHBondContact O-CD1 3.48Å; M222-F234 VanDerWaalsContact O-CE1 3.29Å; M222-F234 WeakPolarHBondContact O-CE1 3.47Å
223	S	80	Confident	77.7	Confident	10 Å²	10	63.4 Å²	63.4	7%	0.07	32%	0.315	C	S	.	.			trans	-59.3	151.5	173.2	-51	0	0	0	0	112.3	H295 C738 T739	S223-H295 CarbonylContact C-O 3.53Å; S223-H295 WeakPolarHBondContact CA-O 3.36Å; S223-H295 VanDerWaalsContact CB-O 3.24Å; S223-H295 WeakPolarHBondContact CB-O 3.43Å; S223-H295 PolarHBondContact OG-N 3.15Å; S223-C738 VanDerWaalsContact O-CB 3.26Å; S223-C738 WeakPolarHBondContact O-CB 3.38Å; S223-C738 PolarHBondContact O-SG 2.9Å; S223-C738 VanDerWaalsContact O-SG 3.36Å; S223-T739 WeakPolarHBondContact OG-CG2 3.47Å
224	K	76.5	Confident	78.3	Confident	78 Å²	78	58.1 Å²	58.1	34%	0.339	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	153.9	-173.6	-71	-177	172	-174.2	0	112.5	V232 E233 F234 H295 L296 S297	K224-V232 HydrophobicContact CD-CG1 3.88Å; K224-E233 PolarHBondContact NZ-O 3.45Å; K224-F234 HydrophobicContact CB-CE1 4.2Å; K224-F234 HydrophobicContact CB-CZ 4.47Å; K224-F234 HydrophobicContact CD-CE1 4.23Å; K224-F234 HydrophobicContact CG-CE1 4.13Å; K224-H295 PolarHBondContact N-O 2.87Å; K224-L296 HydrophobicContact CB-CD1 4.5Å; K224-S297 PolarHBondContact O-N 2.74Å
225	Q	76.3	Confident	78.8	Confident	43 Å²	43	57.6 Å²	57.6	20%	0.201	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	142.9	162.9	-176.9	149.4	81.8	0	0	108.6	S297 V299	Q225-S297 CarbonylContact C-O 3.55Å; Q225-S297 VanDerWaalsContact CA-O 3.32Å; Q225-S297 WeakPolarHBondContact CA-O 3.03Å; Q225-S297 PolarHBondContact NE2-OG 3.3Å; Q225-V299 HydrophobicContact CG-CG2 4.48Å
226	A	76.8	Confident	79.1	Confident	4 Å²	4	57.5 Å²	57.5	3%	0.033	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	150.9	-178.7	0	0	0	0	0	111.4	D230 V232 V271 L296 S297 V298 V299	A226-D230 HydrophobicContact CB-CB 4.39Å; A226-V232 HydrophobicContact CB-CG2 3.5Å; A226-V271 HydrophobicContact CB-CG1 4.31Å; A226-L296 HydrophobicContact CB-CD1 4.04Å; A226-S297 PolarHBondContact N-O 2.84Å; A226-V298 WeakPolarHBondContact O-CA 3.43Å; A226-V299 WeakPolarHBondContact O-CG2 3.28Å; A226-V299 PolarHBondContact O-N 2.87Å
227	V	77.7	Confident	79.4	Confident	47 Å²	47	51.2 Å²	51.2	29%	0.285	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	147.6	174.2	-168.7	0	0	0	0	109.6	G229 D230 V299 P301	V227-G229 PolarHBondContact O-N 3.38Å; V227-D230 WeakPolarHBondContact CA-OD2 3.34Å; V227-D230 WeakPolarHBondContact CB-OD2 3.46Å; V227-D230 PolarHBondContact N-OD2 3.03Å; V227-D230 VanDerWaalsContact O-CB 3.24Å; V227-D230 WeakPolarHBondContact O-CB 3.34Å; V227-D230 PolarHBondContact O-N 2.83Å; V227-V299 CarbonylContact C-O 3.6Å; V227-V299 VanDerWaalsContact CA-O 3.31Å; V227-V299 WeakPolarHBondContact CA-O 3.3Å; V227-V299 HydrophobicContact CG2-CG2 4.28Å; V227-P301 HydrophobicContact CG1-CG 4.29Å
228	V	80.1	Confident	79.3	Confident	48 Å²	48	48.9 Å²	48.9	29%	0.291	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	124.7	173.1	172.5	0	0	0	0	110.7	V271 L273 V298 V299	V228-V271 CarbonylContact C-O 3.47Å; V228-V271 VanDerWaalsContact CA-O 3.24Å; V228-V271 WeakPolarHBondContact CA-O 3.36Å; V228-L273 HydrophobicContact CG2-CD2 3.69Å; V228-L273 HydrophobicContact CG2-CG 3.79Å; V228-V298 HydrophobicContact CG2-CG1 3.84Å; V228-V299 PolarHBondContact N-O 2.91Å
229	G	80.1	Confident	79	Confident	43 Å²	43	44.2 Å²	44.2	44%	0.443	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	103	-16.1	-173.2	0	0	0	0	0	114.7	V227 V271	V227-G229 PolarHBondContact O-N 3.38Å; G229-V271 PolarHBondContact N-O 3.27Å
230	D	80.3	Confident	78.3	Confident	67 Å²	67	44.4 Å²	44.4	36%	0.358	25%	0.246	S	C	.	.			trans	-65.2	170.1	179.6	-77.6	-19.5	0	0	0	113.2	A226 V227 H270 V271	A226-D230 HydrophobicContact CB-CB 4.39Å; V227-D230 WeakPolarHBondContact CA-OD2 3.34Å; V227-D230 WeakPolarHBondContact CB-OD2 3.46Å; V227-D230 PolarHBondContact N-OD2 3.03Å; V227-D230 VanDerWaalsContact O-CB 3.24Å; V227-D230 WeakPolarHBondContact O-CB 3.34Å; V227-D230 PolarHBondContact O-N 2.83Å; D230-H270 PolarHBondContact O-N 2.97Å; D230-H270 VanDerWaalsContact O-N 3.09Å; D230-V271 WeakPolarHBondContact O-CG2 3.3Å; D230-V271 PolarHBondContact O-N 2.85Å
231	S	80.6	Confident	77.4	Confident	67 Å²	67	46.8 Å²	46.8	47%	0.469	26%	0.256	S	S	.	.			trans	-119.3	127.5	167.4	-60.7	0	0	0	0	110.5	I268	S231-I268 CarbonylContact C-O 3.58Å; S231-I268 VanDerWaalsContact CA-O 3.28Å; S231-I268 WeakPolarHBondContact CA-O 3.45Å
232	V	81.3	Confident	76.3	Confident	9 Å²	9	47.6 Å²	47.6	6%	0.055	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.7	-170.5	175.7	0	0	0	0	110.5	K224 A226 F234 R267 I268 V271 L296	K224-V232 HydrophobicContact CD-CG1 3.88Å; A226-V232 HydrophobicContact CB-CG2 3.5Å; V232-F234 HydrophobicContact CG1-CD2 4.23Å; V232-F234 HydrophobicContact CG1-CE2 3.79Å; V232-F234 HydrophobicContact CG1-CZ 3.95Å; V232-R267 WeakPolarHBondContact O-CA 3.45Å; V232-I268 PolarHBondContact N-O 3.31Å; V232-I268 PolarHBondContact O-N 3.25Å; V232-V271 HydrophobicContact CB-CG2 4.27Å; V232-V271 HydrophobicContact CG2-CG2 3.85Å; V232-L296 HydrophobicContact CG1-CD1 4.25Å; V232-L296 HydrophobicContact CG2-CD1 4.37Å
233	E	85.9	Confident	75.8	Confident	62 Å²	62	49.7 Å²	49.7	29%	0.29	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.9	175.9	-63	-170.6	172.8	0	0	111.8	K224 T265 L266 R267	K224-E233 PolarHBondContact NZ-O 3.45Å; E233-T265 HydrophobicContact CB-CG2 3.92Å; E233-T265 HydrophobicContact CG-CG2 4.4Å; E233-L266 CarbonylContact C-O 3.56Å; E233-L266 WeakPolarHBondContact CA-O 3.46Å; E233-R267 HydrophobicContact CG-CB 3.98Å; E233-R267 HydrophobicContact CG-CG 3.94Å; E233-R267 WeakPolarHBondContact OE1-CD 3.12Å; E233-R267 IonicContact OE1-CZ 2.71Å; E233-R267 IonicContact OE1-NE 2.59Å; E233-R267 IonicContact OE1-NH1 3.59Å; E233-R267 PolarHBondContact OE1-NH1 3.23Å
234	F	83.4	Confident	75.4	Confident	1 Å²	1	50.5 Å²	50.5	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.2	169.4	-63.7	-76	0	0	0	109.9	P221 M222 K224 V232 W248 T265 L266 I268 Y279 A294 L296	P221-F234 HydrophobicContact CB-CB 4.31Å; M222-F234 VanDerWaalsContact O-CD1 3.31Å; M222-F234 WeakPolarHBondContact O-CD1 3.48Å; M222-F234 VanDerWaalsContact O-CE1 3.29Å; M222-F234 WeakPolarHBondContact O-CE1 3.47Å; K224-F234 HydrophobicContact CB-CE1 4.2Å; K224-F234 HydrophobicContact CB-CZ 4.47Å; K224-F234 HydrophobicContact CD-CE1 4.23Å; K224-F234 HydrophobicContact CG-CE1 4.13Å; V232-F234 HydrophobicContact CG1-CD2 4.23Å; V232-F234 HydrophobicContact CG1-CE2 3.79Å; V232-F234 HydrophobicContact CG1-CZ 3.95Å; F234-W248 HydrophobicContact CB-CH2 3.52Å; F234-W248 HydrophobicContact CB-CZ2 4.31Å; F234-W248 HydrophobicContact CB-CZ3 4.04Å; F234-W248 WeakPolarHBondContact O-CZ2 3.42Å; F234-T265 CarbonylContact O-C 3.56Å; F234-T265 WeakPolarHBondContact O-CA 3.29Å; F234-L266 HydrophobicContact CB-CB 4.45Å; F234-L266 PolarHBondContact N-O 2.99Å; F234-L266 PolarHBondContact O-N 2.81Å; F234-I268 HydrophobicContact CD2-CD1 4.43Å; F234-I268 HydrophobicContact CE2-CD1 4.01Å; F234-Y279 HydrophobicContact CE2-CD2 4.06Å; F234-Y279 HydrophobicContact CE2-CE2 4.43Å; F234-Y279 HydrophobicContact CE2-CG 4.23Å; F234-Y279 HydrophobicContact CZ-CD2 4.47Å; F234-A294 HydrophobicContact CD1-CB 3.93Å; F234-A294 HydrophobicContact CE1-CB 3.93Å; F234-L296 HydrophobicContact CE2-CB 4.42Å; F234-L296 HydrophobicContact CE2-CD2 4.44Å; F234-L296 HydrophobicContact CZ-CB 3.99Å; F234-L296 HydrophobicContact CZ-CD1 4.17Å; F234-L296 HydrophobicContact CZ-CG 4.48Å
235	Q	81.8	Confident	75.6	Confident	96 Å²	96	51.2 Å²	51.2	45%	0.449	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	132.9	178.3	-63.5	-176.1	-1.9	0	0	110.5	P221 T265	P221-Q235 VanDerWaalsContact CA-O 3.29Å; P221-Q235 WeakPolarHBondContact CA-O 3.5Å; Q235-T265 HydrophobicContact CG-CG2 4.13Å
236	C	82.6	Confident	75.9	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.007	29%	0.289	C	S	.	.			trans	-136.1	140.6	171.3	-175.2	0	0	0	0	110	W248 K264 C281	C236-W248 HydrophobicContact CB-CH2 3.85Å; C236-W248 HydrophobicContact CB-CZ2 3.34Å; C236-K264 PolarHBondContact N-O 3.09Å; C236-C281 HydrophobicContact CB-CB 3.7Å; C236-C281 WeakPolarHBondContact CB-SG 3.46Å; C236-C281 WeakPolarHBondContact SG-CB 3.46Å; C236-C281 CovalentContact SG-SG 2.03Å; C236-C281 PolarHBondContact SG-SG 3.02Å
237	L	81.9	Confident	76.2	Confident	38 Å²	38	55.1 Å²	55.1	20%	0.199	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	123.5	-178.1	-149	133.3	0	0	0	112.7	K218 F219 K264	K218-L237 HydrophobicContact CB-CD2 4.01Å; K218-L237 HydrophobicContact CD-CD2 3.73Å; K218-L237 HydrophobicContact CG-CD2 4.23Å; K218-L237 PolarHBondContact N-O 2.73Å; F219-L237 HydrophobicContact CB-CB 4.1Å; F219-L237 HydrophobicContact CD2-CB 3.83Å; F219-L237 HydrophobicContact CD2-CD1 4.48Å; F219-L237 HydrophobicContact CG-CB 4.47Å; F219-L237 PolarHBondContact N-O 3.05Å; F219-L237 PolarHBondContact O-N 3.36Å; L237-K264 HydrophobicContact CD1-CD 3.98Å; L237-K264 HydrophobicContact CD1-CG 4.44Å
238	G	75.1	Confident	76.6	Confident	3 Å²	3	54.4 Å²	54.4	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	172.3	178.2	0	0	0	0	0	114.8	R216 E240	R216-G238 CarbonylContact O-C 3.6Å; G238-E240 PolarHBondContact O-N 2.96Å
239	S	69.9	Low	76.7	Confident	11 Å²	11	56.6 Å²	56.6	8%	0.077	31%	0.308	C	S	.	.			trans	-76.6	114.5	172.1	59.6	0	0	0	0	111	R216 N241 S244	R216-S239 PolarHBondContact N-OG 2.91Å; R216-S239 VanDerWaalsContact N-OG 3.1Å; R216-S239 WeakPolarHBondContact O-CB 3.05Å; R216-S239 PolarHBondContact O-N 3.26Å; S239-N241 PolarHBondContact O-N 3.08Å; S239-S244 PolarHBondContact O-OG 3.29Å
240	E	61	Low	76.7	Confident	116 Å²	116	55.6 Å²	55.6	54%	0.542	29%	0.29	S	S	.	.			trans	-56.1	-24.3	-170.2	-68.9	103.4	-157.7	0	0	116	K218 G238 P242 N243	K218-E240 WeakPolarHBondContact CE-OE2 3.45Å; K218-E240 IonicContact NZ-OE1 3.46Å; K218-E240 PolarHBondContact NZ-OE1 2.84Å; K218-E240 IonicContact NZ-OE2 3.34Å; K218-E240 PolarHBondContact NZ-OE2 2.85Å; G238-E240 PolarHBondContact O-N 2.96Å; E240-P242 CarbonylContact O-C 3.55Å; E240-P242 VanDerWaalsContact O-C 3.3Å; E240-N243 WeakPolarHBondContact O-CA 3.47Å; E240-N243 PolarHBondContact O-N 3.1Å
241	N	56.8	Low	76.3	Confident	125 Å²	125	58.4 Å²	58.4	67%	0.668	30%	0.301	S	S	*	.	S	Bend	trans	-121.2	120.5	-173.6	-165.5	-18.2	0	0	0	112.7	S239	S239-N241 PolarHBondContact O-N 3.08Å
242	P	57.4	Low	75.5	Confident	26 Å²	26	58 Å²	58	17%	0.169	31%	0.309	C	S	.	.	S	Bend	cis	-73.9	148.2	-6.6	31.5	-35	0	0	0	112	R212 E240 S244 N285	R212-P242 HydrophobicContact CG-CG 4.46Å; E240-P242 CarbonylContact O-C 3.55Å; E240-P242 VanDerWaalsContact O-C 3.3Å; P242-S244 PolarHBondContact O-N 2.89Å; P242-N285 HydrophobicContact CG-CB 4.36Å
243	N	65.9	Low	74.2	Confident	149 Å²	149	65 Å²	65	80%	0.797	35%	0.345	S	S	*	.			trans	-32.5	104.2	-173.5	-66.2	6.7	0	0	0	113.4	E240	E240-N243 WeakPolarHBondContact O-CA 3.47Å; E240-N243 PolarHBondContact O-N 3.1Å
244	S	72.3	Confident	72.7	Confident	27 Å²	27	65.7 Å²	65.7	19%	0.189	35%	0.347	C	S	.	.			trans	-89	123.2	180	61.4	0	0	0	0	111.5	S239 P242 K284	S239-S244 PolarHBondContact O-OG 3.29Å; P242-S244 PolarHBondContact O-N 2.89Å; S244-K284 CarbonylContact C-O 3.59Å; S244-K284 WeakPolarHBondContact CA-O 3.39Å
245	T	81.1	Confident	71.3	Confident	93 Å²	93	72.5 Å²	72.5	57%	0.571	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	142	166.2	53.7	0	0	0	0	109.9	K284	T245-K284 PolarHBondContact N-O 2.04Å; T245-K284 PolarHBondContact O-N 2.93Å; T245-K284 PolarHBondContact OG1-O 3Å
246	I	81.6	Confident	70.1	Confident	30 Å²	30	69.4 Å²	69.4	15%	0.154	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133	174.4	-60.8	176.1	0	0	0	107.6	K264 E282 V283	I246-K264 HydrophobicContact CD1-CB 4.36Å; I246-K264 HydrophobicContact CD1-CG 3.87Å; I246-E282 WeakPolarHBondContact CA-O 2.72Å; I246-V283 HydrophobicContact CG1-CG2 4.38Å
247	L	84.4	Confident	69	Low	98 Å²	98	72.4 Å²	72.4	51%	0.513	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	145	172.5	179.3	64.5	0	0	0	108.5	E282	L247-E282 HydrophobicContact CB-CB 4.37Å; L247-E282 PolarHBondContact N-O 2.99Å; L247-E282 PolarHBondContact O-N 2.92Å
248	W	84.5	Confident	68.1	Low	32 Å²	32	72.4 Å²	72.4	12%	0.121	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.5	174.6	-73.2	91	0	0	0	109.8	P221 F234 C236 L260 K264 L266 I280 C281	P221-W248 HydrophobicContact CB-CH2 3.79Å; P221-W248 HydrophobicContact CB-CZ3 4.25Å; P221-W248 HydrophobicContact CG-CH2 4.12Å; P221-W248 HydrophobicContact CG-CZ3 4.27Å; F234-W248 HydrophobicContact CB-CH2 3.52Å; F234-W248 HydrophobicContact CB-CZ2 4.31Å; F234-W248 HydrophobicContact CB-CZ3 4.04Å; F234-W248 WeakPolarHBondContact O-CZ2 3.42Å; C236-W248 HydrophobicContact CB-CH2 3.85Å; C236-W248 HydrophobicContact CB-CZ2 3.34Å; W248-L260 HydrophobicContact CG-CD1 4.4Å; W248-K264 PolarHBondContact NE1-O 3.11Å; W248-L266 HydrophobicContact CB-CD1 3.98Å; W248-L266 HydrophobicContact CB-CD2 4.42Å; W248-L266 HydrophobicContact CD2-CB 3.8Å; W248-L266 HydrophobicContact CD2-CD1 4.38Å; W248-L266 HydrophobicContact CD2-CD2 4.07Å; W248-L266 HydrophobicContact CD2-CG 4.32Å; W248-L266 HydrophobicContact CE3-CB 4.15Å; W248-L266 HydrophobicContact CE3-CD2 3.85Å; W248-L266 HydrophobicContact CG-CB 4.19Å; W248-L266 HydrophobicContact CG-CD1 3.97Å; W248-L266 HydrophobicContact CG-CD2 4.36Å; W248-L266 HydrophobicContact CG-CG 4.42Å; W248-L266 HydrophobicContact CH2-CB 4.21Å; W248-L266 HydrophobicContact CZ2-CB 3.91Å; W248-L266 HydrophobicContact CZ3-CB 4.35Å; W248-L266 HydrophobicContact CZ3-CD2 4.34Å; W248-I280 WeakPolarHBondContact CA-O 3.39Å; W248-C281 HydrophobicContact CD2-CB 4.2Å; W248-C281 HydrophobicContact CE3-CB 4Å; W248-C281 HydrophobicContact CH2-CB 4.08Å; W248-C281 HydrophobicContact CZ2-CB 4.25Å; W248-C281 HydrophobicContact CZ3-CB 3.93Å
249	R	82.3	Confident	67.7	Low	95 Å²	95	74.7 Å²	74.7	36%	0.358	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	134.6	173.3	64.9	-171.3	-174.4	84.5	-5.8	109.6	I280 E291	R249-I280 HydrophobicContact CG-CB 3.78Å; R249-I280 HydrophobicContact CG-CG2 4.25Å; R249-I280 PolarHBondContact N-O 2.84Å; R249-I280 VanDerWaalsContact NH1-CD1 3.29Å; R249-I280 PolarHBondContact O-N 3.32Å; R249-E291 IonicContact CZ-OE1 2.87Å; R249-E291 VanDerWaalsContact CZ-OE1 3.28Å; R249-E291 IonicContact CZ-OE2 3.93Å; R249-E291 IonicContact NE-OE1 3.64Å; R249-E291 PolarHBondContact NE-OE1 2.97Å; R249-E291 IonicContact NH2-OE1 3.81Å; R249-E291 PolarHBondContact NH2-OE1 2.98Å; R249-E291 IonicContact NH2-OE2 2.81Å; R249-E291 PolarHBondContact NH2-OE2 2.75Å
250	R	80.5	Confident	67.7	Low	21 Å²	21	78.1 Å²	78.1	8%	0.079	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	140.6	163.6	179.3	166.5	69.1	154.4	-9.5	108.2	G252 N253 K254 I255 I256 S274 D278 Y279	R250-G252 PolarHBondContact O-N 2.86Å; R250-N253 PolarHBondContact O-N 2.94Å; R250-K254 PolarHBondContact NH2-O 3.35Å; R250-I255 PolarHBondContact NH2-O 2.81Å; R250-I256 HydrophobicContact CB-CD1 3.94Å; R250-I256 HydrophobicContact CG-CD1 4.37Å; R250-I256 VanDerWaalsContact NE-CD1 3.32Å; R250-S274 PolarHBondContact NH1-O 2.84Å; R250-D278 WeakPolarHBondContact CA-O 3.46Å; R250-Y279 HydrophobicContact CB-CD1 4.41Å; R250-Y279 HydrophobicContact CB-CE1 4.38Å
251	E	71.3	Confident	67.9	Low	126 Å²	126	75.6 Å²	75.6	59%	0.589	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	136.4	174.2	-167.8	149.1	-102.1	0	0	111.1	D278	E251-D278 PolarHBondContact N-O 2.97Å
252	G	64.3	Low	68.3	Low	60 Å²	60	75.8 Å²	75.8	62%	0.619	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	11.2	-177	0	0	0	0	0	117	R250 K254	R250-G252 PolarHBondContact O-N 2.86Å; G252-K254 PolarHBondContact O-N 2.9Å
253	N	54.7	Low	68.8	Low	155 Å²	155	84.2 Å²	84.2	83%	0.829	44%	0.44	S	S	*	.			trans	59.3	5.9	165.8	-81.7	-5.8	0	0	0	118.9	R250	R250-N253 PolarHBondContact O-N 2.94Å
254	K	53.9	Low	69.3	Low	76 Å²	76	81.5 Å²	81.5	33%	0.33	42%	0.421	S	S	.	.			trans	-69.4	133.7	177.7	-64	162.3	179.6	163.2	0	112.1	R250 G252 I256 S982 L983	R250-K254 PolarHBondContact NH2-O 3.35Å; G252-K254 PolarHBondContact O-N 2.9Å; K254-I256 WeakPolarHBondContact O-CG1 3.46Å; K254-S982 WeakPolarHBondContact CD-O 3.4Å; K254-S982 WeakPolarHBondContact CE-O 3.3Å; K254-S982 PolarHBondContact NZ-O 3.34Å; K254-L983 PolarHBondContact NZ-O 2.99Å
255	I	53.3	Low	69.7	Low	145 Å²	145	81.1 Å²	81.1	74%	0.744	42%	0.417	S	S	*	.			trans	-58.7	155.3	176.1	-55.6	172.5	0	0	0	110.8	R250	R250-I255 PolarHBondContact NH2-O 2.81Å
256	I	57.7	Low	69.9	Low	31 Å²	31	77.3 Å²	77.3	16%	0.159	39%	0.393	C	S	.	.			trans	-151.8	150.8	-177.8	-34.5	174.9	0	0	0	108.9	R250 K254 A258 I268 Y279	R250-I256 HydrophobicContact CB-CD1 3.94Å; R250-I256 HydrophobicContact CG-CD1 4.37Å; R250-I256 VanDerWaalsContact NE-CD1 3.32Å; K254-I256 WeakPolarHBondContact O-CG1 3.46Å; I256-A258 HydrophobicContact CB-CB 4.37Å; I256-A258 PolarHBondContact O-N 3.35Å; I256-I268 HydrophobicContact CG2-CG2 4.46Å; I256-Y279 HydrophobicContact CD1-CE1 3.51Å
257	Q	59	Low	70.2	Confident	64 Å²	64	79.4 Å²	79.4	30%	0.299	40%	0.399	S	S	.	.			trans	-68.6	84.8	151.7	-84.8	64.7	54.3	0	0	109.5	L978 Y979	Q257-L978 VanDerWaalsContact CD-O 3.23Å; Q257-L978 WeakPolarHBondContact CG-O 3.21Å; Q257-Y979 VanDerWaalsContact CD-N 3.29Å; Q257-Y979 PolarHBondContact NE2-O 3.35Å; Q257-Y979 PolarHBondContact OE1-O 3.31Å; Q257-Y979 VanDerWaalsContact OE1-O 3.09Å
258	A	63.7	Low	70.3	Confident	38 Å²	38	74.8 Å²	74.8	31%	0.314	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	110.6	165.5	0	0	0	0	0	109.3	I256 L266 R267 I268	I256-A258 HydrophobicContact CB-CB 4.37Å; I256-A258 PolarHBondContact O-N 3.35Å; A258-L266 HydrophobicContact CB-CD1 3.65Å; A258-L266 HydrophobicContact CB-CG 4.03Å; A258-R267 CarbonylContact C-O 3.58Å; A258-R267 WeakPolarHBondContact CA-O 3.33Å; A258-I268 HydrophobicContact CB-CG1 4.46Å
259	S	66.5	Low	70.1	Confident	51 Å²	51	76.9 Å²	76.9	36%	0.357	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	142.7	170.2	63.3	0	0	0	0	109.7	R267	S259-R267 PolarHBondContact N-O 2.82Å; S259-R267 PolarHBondContact O-N 3.06Å; S259-R267 WeakPolarHBondContact OG-CB 3.47Å; S259-R267 PolarHBondContact OG-O 3.41Å
260	L	69	Low	70.2	Confident	82 Å²	82	78.6 Å²	78.6	43%	0.429	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	89.6	-176.3	-171.7	71.8	0	0	0	110.7	W248 R263 T265 L266	W248-L260 HydrophobicContact CG-CD1 4.4Å; L260-R263 HydrophobicContact CD2-CB 4.42Å; L260-T265 CarbonylContact C-O 3.6Å; L260-T265 WeakPolarHBondContact CA-O 3.44Å; L260-L266 HydrophobicContact CD1-CD1 4.29Å
261	I	65.4	Low	70.3	Confident	63 Å²	63	77.6 Å²	77.6	32%	0.323	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	132.4	178.7	-62.3	-179.9	0	0	0	109.6	R263 K264 T265 R267	I261-R263 PolarHBondContact O-N 3.19Å; I261-K264 PolarHBondContact O-N 3.44Å; I261-T265 PolarHBondContact N-O 2.75Å; I261-T265 PolarHBondContact O-N 3.24Å; I261-R267 HydrophobicContact CD1-CB 4.24Å; I261-R267 VanDerWaalsContact CD1-CD 3.46Å
262	D	65.8	Low	71	Confident	129 Å²	129	75.5 Å²	75.5	69%	0.69	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	22.5	178.6	-61.8	-20.8	0	0	0	116.2	K264	D262-K264 HydrophobicContact CB-CD 4.22Å; D262-K264 WeakPolarHBondContact O-CD 3.39Å; D262-K264 WeakPolarHBondContact O-CG 3.42Å; D262-K264 PolarHBondContact O-N 2.56Å
263	R	68	Low	71.9	Confident	204 Å²	204	76.5 Å²	76.5	77%	0.77	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	24.9	-170.9	-57.6	-176.3	178.8	-176.7	-0.7	113.8	L260 I261	L260-R263 HydrophobicContact CD2-CB 4.42Å; I261-R263 PolarHBondContact O-N 3.19Å
264	K	76.6	Confident	73.2	Confident	91 Å²	91	70.1 Å²	70.1	40%	0.396	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.7	-45.1	-173	-71.7	157.3	-177.5	170.9	0	112.6	C236 L237 I246 W248 I261 D262	C236-K264 PolarHBondContact N-O 3.09Å; L237-K264 HydrophobicContact CD1-CD 3.98Å; L237-K264 HydrophobicContact CD1-CG 4.44Å; I246-K264 HydrophobicContact CD1-CB 4.36Å; I246-K264 HydrophobicContact CD1-CG 3.87Å; W248-K264 PolarHBondContact NE1-O 3.11Å; I261-K264 PolarHBondContact O-N 3.44Å; D262-K264 HydrophobicContact CB-CD 4.22Å; D262-K264 WeakPolarHBondContact O-CD 3.39Å; D262-K264 WeakPolarHBondContact O-CG 3.42Å; D262-K264 PolarHBondContact O-N 2.56Å
265	T	80.4	Confident	74.8	Confident	20 Å²	20	66.8 Å²	66.8	12%	0.123	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.6	-173.6	-58.6	0	0	0	0	109.8	E233 F234 Q235 L260 I261	E233-T265 HydrophobicContact CB-CG2 3.92Å; E233-T265 HydrophobicContact CG-CG2 4.4Å; F234-T265 CarbonylContact O-C 3.56Å; F234-T265 WeakPolarHBondContact O-CA 3.29Å; Q235-T265 HydrophobicContact CG-CG2 4.13Å; L260-T265 CarbonylContact C-O 3.6Å; L260-T265 WeakPolarHBondContact CA-O 3.44Å; I261-T265 PolarHBondContact N-O 2.75Å; I261-T265 PolarHBondContact O-N 3.24Å
266	L	86	Confident	76.2	Confident	13 Å²	13	61 Å²	61	7%	0.068	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	121.8	171.8	-166.8	74.8	0	0	0	108.9	E233 F234 W248 A258 L260 Y279	E233-L266 CarbonylContact C-O 3.56Å; E233-L266 WeakPolarHBondContact CA-O 3.46Å; F234-L266 HydrophobicContact CB-CB 4.45Å; F234-L266 PolarHBondContact N-O 2.99Å; F234-L266 PolarHBondContact O-N 2.81Å; W248-L266 HydrophobicContact CB-CD1 3.98Å; W248-L266 HydrophobicContact CB-CD2 4.42Å; W248-L266 HydrophobicContact CD2-CB 3.8Å; W248-L266 HydrophobicContact CD2-CD1 4.38Å; W248-L266 HydrophobicContact CD2-CD2 4.07Å; W248-L266 HydrophobicContact CD2-CG 4.32Å; W248-L266 HydrophobicContact CE3-CB 4.15Å; W248-L266 HydrophobicContact CE3-CD2 3.85Å; W248-L266 HydrophobicContact CG-CB 4.19Å; W248-L266 HydrophobicContact CG-CD1 3.97Å; W248-L266 HydrophobicContact CG-CD2 4.36Å; W248-L266 HydrophobicContact CG-CG 4.42Å; W248-L266 HydrophobicContact CH2-CB 4.21Å; W248-L266 HydrophobicContact CZ2-CB 3.91Å; W248-L266 HydrophobicContact CZ3-CB 4.35Å; W248-L266 HydrophobicContact CZ3-CD2 4.34Å; A258-L266 HydrophobicContact CB-CD1 3.65Å; A258-L266 HydrophobicContact CB-CG 4.03Å; L260-L266 HydrophobicContact CD1-CD1 4.29Å; L266-Y279 HydrophobicContact CD2-CD1 3.39Å; L266-Y279 HydrophobicContact CD2-CE1 3.84Å; L266-Y279 HydrophobicContact CD2-CG 4.35Å
267	R	86.9	Confident	77.5	Confident	73 Å²	73	60.4 Å²	60.4	28%	0.275	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	117.6	-179.6	172.1	-178.6	173.6	124.4	-11.3	110.4	V232 E233 A258 S259 I261 E269	V232-R267 WeakPolarHBondContact O-CA 3.45Å; E233-R267 HydrophobicContact CG-CB 3.98Å; E233-R267 HydrophobicContact CG-CG 3.94Å; E233-R267 WeakPolarHBondContact OE1-CD 3.12Å; E233-R267 IonicContact OE1-CZ 2.71Å; E233-R267 IonicContact OE1-NE 2.59Å; E233-R267 IonicContact OE1-NH1 3.59Å; E233-R267 PolarHBondContact OE1-NH1 3.23Å; A258-R267 CarbonylContact C-O 3.58Å; A258-R267 WeakPolarHBondContact CA-O 3.33Å; S259-R267 PolarHBondContact N-O 2.82Å; S259-R267 PolarHBondContact O-N 3.06Å; S259-R267 WeakPolarHBondContact OG-CB 3.47Å; S259-R267 PolarHBondContact OG-O 3.41Å; I261-R267 HydrophobicContact CD1-CB 4.24Å; I261-R267 VanDerWaalsContact CD1-CD 3.46Å; R267-E269 HydrophobicContact CG-CG 4.13Å; R267-E269 IonicContact CZ-OE1 3.31Å; R267-E269 IonicContact NE-OE1 2.77Å; R267-E269 PolarHBondContact NE-OE1 3.24Å; R267-E269 IonicContact NH2-OE1 2.66Å; R267-E269 PolarHBondContact NH2-OE1 2.96Å
268	I	85.9	Confident	78.8	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	132.2	173.8	-51.6	156.4	0	0	0	107	S231 V232 F234 I256 A258 V271 Y279 L296	S231-I268 CarbonylContact C-O 3.58Å; S231-I268 VanDerWaalsContact CA-O 3.28Å; S231-I268 WeakPolarHBondContact CA-O 3.45Å; V232-I268 PolarHBondContact N-O 3.31Å; V232-I268 PolarHBondContact O-N 3.25Å; F234-I268 HydrophobicContact CD2-CD1 4.43Å; F234-I268 HydrophobicContact CE2-CD1 4.01Å; I256-I268 HydrophobicContact CG2-CG2 4.46Å; A258-I268 HydrophobicContact CB-CG1 4.46Å; I268-V271 HydrophobicContact CB-CG2 4.14Å; I268-V271 HydrophobicContact CG2-CG2 3.71Å; I268-Y279 HydrophobicContact CD1-CE1 3.78Å; I268-Y279 HydrophobicContact CD1-CE2 4.16Å; I268-Y279 WeakPolarHBondContact CD1-OH 3.06Å; I268-Y279 HydrophobicContact CG1-CE1 4.5Å; I268-L296 HydrophobicContact CD1-CD2 3.72Å
269	E	82.1	Confident	79.9	Confident	77 Å²	77	58.2 Å²	58.2	36%	0.36	29%	0.289	S	S	.	.			trans	-117.8	146.7	179	-59	-169.3	144.1	0	0	110.1	R267 V271	R267-E269 HydrophobicContact CG-CG 4.13Å; R267-E269 IonicContact CZ-OE1 3.31Å; R267-E269 IonicContact NE-OE1 2.77Å; R267-E269 PolarHBondContact NE-OE1 3.24Å; R267-E269 IonicContact NH2-OE1 2.66Å; R267-E269 PolarHBondContact NH2-OE1 2.96Å; E269-V271 VanDerWaalsContact C-N 3.32Å; E269-V271 PolarHBondContact O-N 2.91Å
270	H	83	Confident	80.9	Confident	131 Å²	131	56 Å²	56	61%	0.606	27%	0.273	S	S	*	.	S	Bend	trans	54.7	45.9	-177.6	-50.6	94.7	0	0	0	112.6	D230 Q272	D230-H270 PolarHBondContact O-N 2.97Å; D230-H270 VanDerWaalsContact O-N 3.09Å; H270-Q272 PolarHBondContact O-N 3.44Å; H270-Q272 PolarHBondContact O-NE2 2.9Å
271	V	83.6	Confident	81.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.253	C	S	.	.			trans	-45.5	132.9	-175	169.1	0	0	0	0	111.7	A226 V228 G229 D230 V232 I268 E269 D275 V298	A226-V271 HydrophobicContact CB-CG1 4.31Å; V228-V271 CarbonylContact C-O 3.47Å; V228-V271 VanDerWaalsContact CA-O 3.24Å; V228-V271 WeakPolarHBondContact CA-O 3.36Å; G229-V271 PolarHBondContact N-O 3.27Å; D230-V271 WeakPolarHBondContact O-CG2 3.3Å; D230-V271 PolarHBondContact O-N 2.85Å; V232-V271 HydrophobicContact CB-CG2 4.27Å; V232-V271 HydrophobicContact CG2-CG2 3.85Å; I268-V271 HydrophobicContact CB-CG2 4.14Å; I268-V271 HydrophobicContact CG2-CG2 3.71Å; E269-V271 VanDerWaalsContact C-N 3.32Å; E269-V271 PolarHBondContact O-N 2.91Å; V271-D275 HydrophobicContact CG1-CB 4.5Å; V271-V298 HydrophobicContact CG1-CB 4.33Å; V271-V298 HydrophobicContact CG1-CG1 3.66Å; V271-V298 HydrophobicContact CG1-CG2 3.62Å
272	Q	85.6	Confident	82.8	Confident	81 Å²	81	50.1 Å²	50.1	38%	0.379	24%	0.242	S	C	.	.			trans	-111	157.9	177.1	-59.1	-61.5	-58	0	0	109.9	H270 S274 D275	H270-Q272 PolarHBondContact O-N 3.44Å; H270-Q272 PolarHBondContact O-NE2 2.9Å; Q272-S274 PolarHBondContact O-N 3.07Å; Q272-D275 PolarHBondContact N-OD2 2.89Å; Q272-D275 PolarHBondContact O-N 3.27Å
273	L	81.8	Confident	83.7	Confident	81 Å²	81	44 Å²	44	42%	0.424	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-47.8	-35.7	170.8	-63.7	177.7	0	0	0	111.9	V228 D275 A276 V298	V228-L273 HydrophobicContact CG2-CD2 3.69Å; V228-L273 HydrophobicContact CG2-CG 3.79Å; L273-D275 PolarHBondContact O-N 3.24Å; L273-A276 WeakPolarHBondContact O-CB 3.45Å; L273-A276 PolarHBondContact O-N 3.07Å; L273-V298 HydrophobicContact CD2-CG1 4.24Å
274	S	83.8	Confident	84.4	Confident	21 Å²	21	39.2 Å²	39.2	15%	0.147	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-43.4	-30.5	168.8	130.1	0	0	0	0	117.1	R250 Q272 G981 S982 L983	R250-S274 PolarHBondContact NH1-O 2.84Å; Q272-S274 PolarHBondContact O-N 3.07Å; S274-G981 WeakPolarHBondContact OG-CA 3.38Å; S274-G981 PolarHBondContact OG-N 2.93Å; S274-S982 VanDerWaalsContact CB-N 3.34Å; S274-S982 CarbonylContact O-C 3.49Å; S274-S982 WeakPolarHBondContact O-CA 3.35Å; S274-S982 PolarHBondContact O-N 2.96Å; S274-S982 PolarHBondContact OG-N 2.81Å; S274-L983 PolarHBondContact O-N 2.81Å
275	D	85.8	Confident	84.5	Confident	6 Å²	6	35.6 Å²	35.6	3%	0.032	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-94.8	-4.7	-168.7	-53.8	-31	0	0	0	112	V271 Q272 L273 Y279 L296	V271-D275 HydrophobicContact CG1-CB 4.5Å; Q272-D275 PolarHBondContact N-OD2 2.89Å; Q272-D275 PolarHBondContact O-N 3.27Å; L273-D275 PolarHBondContact O-N 3.24Å; D275-Y279 WeakPolarHBondContact O-CE2 3.37Å; D275-Y279 PolarHBondContact O-OH 2.67Å; D275-L296 HydrophobicContact CB-CD2 4.27Å
276	A	84	Confident	84.3	Confident	24 Å²	24	38.3 Å²	38.3	20%	0.198	20%	0.204	C	C	.	.			trans	-57.5	151.4	175.6	0	0	0	0	0	113.1	L273 L296 V298	L273-A276 WeakPolarHBondContact O-CB 3.45Å; L273-A276 PolarHBondContact O-N 3.07Å; A276-L296 CarbonylContact C-O 3.59Å; A276-L296 WeakPolarHBondContact CA-O 3.39Å; A276-L296 WeakPolarHBondContact CB-O 3.33Å; A276-V298 HydrophobicContact CB-CB 4.36Å; A276-V298 HydrophobicContact CB-CG2 4.04Å
277	G	83.7	Confident	83.7	Confident	19 Å²	19	39.6 Å²	39.6	20%	0.196	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	120.4	-167.4	-179.7	0	0	0	0	0	114.2	Y279 L296	G277-Y279 WeakPolarHBondContact O-CD2 3.41Å; G277-L296 PolarHBondContact N-O 3.4Å; G277-L296 PolarHBondContact O-N 3.02Å
278	D	87	Confident	83.2	Confident	53 Å²	53	37.1 Å²	37.1	28%	0.283	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.4	-166.6	-81.6	20.2	0	0	0	113.4	R250 E251 V293 H295	R250-D278 WeakPolarHBondContact CA-O 3.46Å; E251-D278 PolarHBondContact N-O 2.97Å; D278-V293 HydrophobicContact CB-CG1 3.78Å; D278-V293 VanDerWaalsContact OD2-CG1 3.27Å; D278-V293 WeakPolarHBondContact OD2-CG1 3.41Å; D278-H295 IonicContact OD1-CE1 2.68Å; D278-H295 IonicContact OD1-CG 3.41Å; D278-H295 IonicContact OD1-ND1 3.78Å; D278-H295 PolarHBondContact OD1-ND1 3.43Å
279	Y	87.2	Confident	83.1	Confident	2 Å²	2	40 Å²	40	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	121.2	176.1	-71.1	-95.6	0	0	0	110.1	F234 R250 I256 L266 I268 D275 G277 A294 L296	F234-Y279 HydrophobicContact CE2-CD2 4.06Å; F234-Y279 HydrophobicContact CE2-CE2 4.43Å; F234-Y279 HydrophobicContact CE2-CG 4.23Å; F234-Y279 HydrophobicContact CZ-CD2 4.47Å; R250-Y279 HydrophobicContact CB-CD1 4.41Å; R250-Y279 HydrophobicContact CB-CE1 4.38Å; I256-Y279 HydrophobicContact CD1-CE1 3.51Å; L266-Y279 HydrophobicContact CD2-CD1 3.39Å; L266-Y279 HydrophobicContact CD2-CE1 3.84Å; L266-Y279 HydrophobicContact CD2-CG 4.35Å; I268-Y279 HydrophobicContact CD1-CE1 3.78Å; I268-Y279 HydrophobicContact CD1-CE2 4.16Å; I268-Y279 WeakPolarHBondContact CD1-OH 3.06Å; I268-Y279 HydrophobicContact CG1-CE1 4.5Å; D275-Y279 WeakPolarHBondContact O-CE2 3.37Å; D275-Y279 PolarHBondContact O-OH 2.67Å; G277-Y279 WeakPolarHBondContact O-CD2 3.41Å; Y279-A294 PolarHBondContact N-O 3.07Å; Y279-A294 PolarHBondContact O-N 2.85Å; Y279-L296 HydrophobicContact CD2-CB 4.01Å; Y279-L296 HydrophobicContact CE2-CB 3.71Å; Y279-L296 HydrophobicContact CE2-CD2 3.88Å; Y279-L296 HydrophobicContact CE2-CG 4.45Å
280	I	87.3	Confident	83.2	Confident	6 Å²	6	38.2 Å²	38.2	3%	0.031	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.2	-169.3	-53.5	169.6	0	0	0	108.7	W248 R249 E291 A292 V293	W248-I280 WeakPolarHBondContact CA-O 3.39Å; R249-I280 HydrophobicContact CG-CB 3.78Å; R249-I280 HydrophobicContact CG-CG2 4.25Å; R249-I280 PolarHBondContact N-O 2.84Å; R249-I280 VanDerWaalsContact NH1-CD1 3.29Å; R249-I280 PolarHBondContact O-N 3.32Å; I280-E291 HydrophobicContact CG2-CB 4.09Å; I280-A292 WeakPolarHBondContact CA-O 3.23Å; I280-V293 HydrophobicContact CG1-CB 4.4Å; I280-V293 HydrophobicContact CG1-CG1 3.97Å; I280-V293 HydrophobicContact CG1-CG2 4.03Å; I280-V293 HydrophobicContact CG2-CG2 4.43Å
281	C	87.3	Confident	83.4	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	112.9	171.8	179	0	0	0	0	109.8	P221 C236 W248 E291 A292	P221-C281 HydrophobicContact CG-CB 4.28Å; C236-C281 HydrophobicContact CB-CB 3.7Å; C236-C281 WeakPolarHBondContact CB-SG 3.46Å; C236-C281 WeakPolarHBondContact SG-CB 3.46Å; C236-C281 CovalentContact SG-SG 2.03Å; C236-C281 PolarHBondContact SG-SG 3.02Å; W248-C281 HydrophobicContact CD2-CB 4.2Å; W248-C281 HydrophobicContact CE3-CB 4Å; W248-C281 HydrophobicContact CH2-CB 4.08Å; W248-C281 HydrophobicContact CZ2-CB 4.25Å; W248-C281 HydrophobicContact CZ3-CB 3.93Å; C281-E291 WeakPolarHBondContact O-CA 3.48Å; C281-A292 PolarHBondContact N-O 2.78Å; C281-A292 PolarHBondContact O-N 2.71Å; C281-A292 VanDerWaalsContact O-N 3.08Å
282	E	87.2	Confident	83.3	Confident	20 Å²	20	36.7 Å²	36.7	9%	0.093	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	120.4	166.2	-173.6	-166.6	-170.6	0	0	109.2	I246 L247 N289 E291	I246-E282 WeakPolarHBondContact CA-O 2.72Å; L247-E282 HydrophobicContact CB-CB 4.37Å; L247-E282 PolarHBondContact N-O 2.99Å; L247-E282 PolarHBondContact O-N 2.92Å; E282-N289 HydrophobicContact CG-CB 3.85Å; E282-N289 WeakPolarHBondContact OE1-CB 3.4Å; E282-N289 PolarHBondContact OE1-ND2 3.46Å; E282-E291 HydrophobicContact CB-CG 4.22Å; E282-E291 HydrophobicContact CG-CG 4.17Å
283	V	85	Confident	83.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	118.6	167.9	-178.1	0	0	0	0	108	P215 F217 I246 N289 V290	P215-V283 HydrophobicContact CB-CG1 3.69Å; P215-V283 HydrophobicContact CG-CB 4.46Å; P215-V283 HydrophobicContact CG-CG1 3.97Å; P215-V283 WeakPolarHBondContact CG-O 3.42Å; F217-V283 HydrophobicContact CD1-CG2 3.84Å; F217-V283 HydrophobicContact CE1-CB 4.3Å; F217-V283 HydrophobicContact CE1-CG2 3.36Å; F217-V283 HydrophobicContact CZ-CG2 4.02Å; I246-V283 HydrophobicContact CG1-CG2 4.38Å; V283-N289 CarbonylContact O-C 3.44Å; V283-N289 VanDerWaalsContact O-CA 3.25Å; V283-N289 WeakPolarHBondContact O-CA 3.4Å; V283-V290 HydrophobicContact CB-CG2 4.1Å; V283-V290 PolarHBondContact N-O 3.09Å; V283-V290 PolarHBondContact O-N 3.37Å
284	K	82.7	Confident	83.2	Confident	104 Å²	104	32.6 Å²	32.6	45%	0.452	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140	-171.8	-173.2	172.8	-171.5	162	0	111.5	S244 T245 N289	S244-K284 CarbonylContact C-O 3.59Å; S244-K284 WeakPolarHBondContact CA-O 3.39Å; T245-K284 PolarHBondContact N-O 2.04Å; T245-K284 PolarHBondContact O-N 2.93Å; T245-K284 PolarHBondContact OG1-O 3Å; K284-N289 HydrophobicContact CB-CB 4.29Å; K284-N289 HydrophobicContact CG-CB 4.35Å
285	N	78.8	Confident	83.2	Confident	15 Å²	15	35.3 Å²	35.3	8%	0.08	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	-176.4	169.2	79.1	13.3	0	0	0	110.7	R213 P215 P242 V287 G288	R213-N285 PolarHBondContact O-ND2 3.36Å; R213-N285 PolarHBondContact O-OD1 3.42Å; P215-N285 HydrophobicContact CG-CB 4.39Å; P242-N285 HydrophobicContact CG-CB 4.36Å; N285-V287 PolarHBondContact O-N 3.25Å; N285-V287 WeakPolarHBondContact OD1-CB 3.18Å; N285-V287 PolarHBondContact OD1-N 2.94Å; N285-G288 PolarHBondContact N-O 2.84Å; N285-G288 PolarHBondContact O-N 2.98Å; N285-G288 PolarHBondContact OD1-O 3.15Å
286	A	74.8	Confident	83.1	Confident	78 Å²	78	35 Å²	35	65%	0.645	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	1.4	-177.5	0	0	0	0	0	116.3
287	V	73.6	Confident	82.9	Confident	39 Å²	39	35.6 Å²	35.6	24%	0.236	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-10.9	172.7	179.9	0	0	0	0	111.9	H135 R212 K214 N285	H135-V287 HydrophobicContact CB-CG1 3.56Å; H135-V287 HydrophobicContact CB-CG2 4.39Å; R212-V287 HydrophobicContact CB-CG2 3.36Å; R212-V287 HydrophobicContact CG-CG2 4.45Å; K214-V287 HydrophobicContact CG-CG1 4.17Å; N285-V287 PolarHBondContact O-N 3.25Å; N285-V287 WeakPolarHBondContact OD1-CB 3.18Å; N285-V287 PolarHBondContact OD1-N 2.94Å
288	G	76.9	Confident	82.8	Confident	22 Å²	22	35.2 Å²	35.2	23%	0.227	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.4	-162.9	-179	0	0	0	0	0	112.4	P215 N285	P215-G288 WeakPolarHBondContact CD-O 3.34Å; N285-G288 PolarHBondContact N-O 2.84Å; N285-G288 PolarHBondContact O-N 2.98Å; N285-G288 PolarHBondContact OD1-O 3.15Å
289	N	84.5	Confident	82.5	Confident	61 Å²	61	33.2 Å²	33.2	33%	0.326	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	163	-171.5	58.5	-6.8	0	0	0	113.5	K214 E282 V283 K284	K214-N289 PolarHBondContact NZ-O 3.16Å; E282-N289 HydrophobicContact CG-CB 3.85Å; E282-N289 WeakPolarHBondContact OE1-CB 3.4Å; E282-N289 PolarHBondContact OE1-ND2 3.46Å; V283-N289 CarbonylContact O-C 3.44Å; V283-N289 VanDerWaalsContact O-CA 3.25Å; V283-N289 WeakPolarHBondContact O-CA 3.4Å; K284-N289 HydrophobicContact CB-CB 4.29Å; K284-N289 HydrophobicContact CG-CB 4.35Å
290	V	83.4	Confident	82.2	Confident	39 Å²	39	34.1 Å²	34.1	24%	0.236	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	149.8	160.1	-62.2	0	0	0	0	108.6	P215 F217 V283	P215-V290 HydrophobicContact CG-CG2 4.22Å; P215-V290 WeakPolarHBondContact O-CG1 3.25Å; F217-V290 HydrophobicContact CD2-CG2 3.93Å; F217-V290 HydrophobicContact CE2-CB 3.95Å; F217-V290 HydrophobicContact CE2-CG2 3.43Å; F217-V290 VanDerWaalsContact CE2-CG2 3.43Å; F217-V290 HydrophobicContact CZ-CG2 3.84Å; V283-V290 HydrophobicContact CB-CG2 4.1Å; V283-V290 PolarHBondContact N-O 3.09Å; V283-V290 PolarHBondContact O-N 3.37Å
291	E	88.2	Confident	82	Confident	85 Å²	85	36.2 Å²	36.2	40%	0.397	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	151.8	-178.6	-60.7	-166	121.6	0	0	111.3	F217 R249 I280 C281 E282	F217-E291 VanDerWaalsContact CZ-C 3.42Å; R249-E291 IonicContact CZ-OE1 2.87Å; R249-E291 VanDerWaalsContact CZ-OE1 3.28Å; R249-E291 IonicContact CZ-OE2 3.93Å; R249-E291 IonicContact NE-OE1 3.64Å; R249-E291 PolarHBondContact NE-OE1 2.97Å; R249-E291 IonicContact NH2-OE1 3.81Å; R249-E291 PolarHBondContact NH2-OE1 2.98Å; R249-E291 IonicContact NH2-OE2 2.81Å; R249-E291 PolarHBondContact NH2-OE2 2.75Å; I280-E291 HydrophobicContact CG2-CB 4.09Å; C281-E291 WeakPolarHBondContact O-CA 3.48Å; E282-E291 HydrophobicContact CB-CG 4.22Å; E282-E291 HydrophobicContact CG-CG 4.17Å
292	A	81.4	Confident	81.9	Confident	15 Å²	15	36.5 Å²	36.5	12%	0.124	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	141.2	172.7	0	0	0	0	0	109.8	F217 T220 P221 I280 C281	F217-A292 HydrophobicContact CD1-CB 4.42Å; F217-A292 HydrophobicContact CD2-CB 4.37Å; F217-A292 HydrophobicContact CE1-CB 3.77Å; F217-A292 HydrophobicContact CE2-CB 3.72Å; F217-A292 HydrophobicContact CZ-CB 3.41Å; F217-A292 VanDerWaalsContact CZ-CB 3.41Å; T220-A292 HydrophobicContact CG2-CB 3.81Å; P221-A292 HydrophobicContact CG-CB 4.48Å; I280-A292 WeakPolarHBondContact CA-O 3.23Å; C281-A292 PolarHBondContact N-O 2.78Å; C281-A292 PolarHBondContact O-N 2.71Å; C281-A292 VanDerWaalsContact O-N 3.08Å
293	V	83.8	Confident	82	Confident	75 Å²	75	40 Å²	40	46%	0.455	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	140.3	-171.3	-168.6	0	0	0	0	110.3	D278 I280	D278-V293 HydrophobicContact CB-CG1 3.78Å; D278-V293 VanDerWaalsContact OD2-CG1 3.27Å; D278-V293 WeakPolarHBondContact OD2-CG1 3.41Å; I280-V293 HydrophobicContact CG1-CB 4.4Å; I280-V293 HydrophobicContact CG1-CG1 3.97Å; I280-V293 HydrophobicContact CG1-CG2 4.03Å; I280-V293 HydrophobicContact CG2-CG2 4.43Å
294	A	80.3	Confident	82.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	130	168.3	0	0	0	0	0	109.9	P221 F234 Y279	P221-A294 HydrophobicContact CB-CB 3.71Å; P221-A294 HydrophobicContact CG-CB 3.94Å; F234-A294 HydrophobicContact CD1-CB 3.93Å; F234-A294 HydrophobicContact CE1-CB 3.93Å; Y279-A294 PolarHBondContact N-O 3.07Å; Y279-A294 PolarHBondContact O-N 2.85Å
295	H	84.7	Confident	82.6	Confident	78 Å²	78	41.6 Å²	41.6	36%	0.361	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	137.8	178.7	-172.4	79.8	0	0	0	110.8	S223 K224 D278	S223-H295 CarbonylContact C-O 3.53Å; S223-H295 WeakPolarHBondContact CA-O 3.36Å; S223-H295 VanDerWaalsContact CB-O 3.24Å; S223-H295 WeakPolarHBondContact CB-O 3.43Å; S223-H295 PolarHBondContact OG-N 3.15Å; K224-H295 PolarHBondContact N-O 2.87Å; D278-H295 IonicContact OD1-CE1 2.68Å; D278-H295 IonicContact OD1-CG 3.41Å; D278-H295 IonicContact OD1-ND1 3.78Å; D278-H295 PolarHBondContact OD1-ND1 3.43Å
296	L	83.4	Confident	83.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.8	167.2	-175.9	53.4	0	0	0	109.7	K224 A226 V232 F234 I268 D275 A276 G277 Y279 V298	K224-L296 HydrophobicContact CB-CD1 4.5Å; A226-L296 HydrophobicContact CB-CD1 4.04Å; V232-L296 HydrophobicContact CG1-CD1 4.25Å; V232-L296 HydrophobicContact CG2-CD1 4.37Å; F234-L296 HydrophobicContact CE2-CB 4.42Å; F234-L296 HydrophobicContact CE2-CD2 4.44Å; F234-L296 HydrophobicContact CZ-CB 3.99Å; F234-L296 HydrophobicContact CZ-CD1 4.17Å; F234-L296 HydrophobicContact CZ-CG 4.48Å; I268-L296 HydrophobicContact CD1-CD2 3.72Å; D275-L296 HydrophobicContact CB-CD2 4.27Å; A276-L296 CarbonylContact C-O 3.59Å; A276-L296 WeakPolarHBondContact CA-O 3.39Å; A276-L296 WeakPolarHBondContact CB-O 3.33Å; G277-L296 PolarHBondContact N-O 3.4Å; G277-L296 PolarHBondContact O-N 3.02Å; Y279-L296 HydrophobicContact CD2-CB 4.01Å; Y279-L296 HydrophobicContact CE2-CB 3.71Å; Y279-L296 HydrophobicContact CE2-CD2 3.88Å; Y279-L296 HydrophobicContact CE2-CG 4.45Å; L296-V298 HydrophobicContact CD1-CG2 4.37Å; L296-V298 HydrophobicContact CD2-CG2 4.13Å; L296-V298 HydrophobicContact CG-CG2 3.8Å
297	S	80	Confident	84	Confident	37 Å²	37	44.3 Å²	44.3	26%	0.259	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	127.5	166.7	175.3	0	0	0	0	108.8	K224 Q225 A226	K224-S297 PolarHBondContact O-N 2.74Å; Q225-S297 CarbonylContact C-O 3.55Å; Q225-S297 VanDerWaalsContact CA-O 3.32Å; Q225-S297 WeakPolarHBondContact CA-O 3.03Å; Q225-S297 PolarHBondContact NE2-OG 3.3Å; A226-S297 PolarHBondContact N-O 2.84Å
298	V	81.4	Confident	85	Confident	11 Å²	11	43 Å²	43	7%	0.067	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	125.5	177.9	-170	0	0	0	0	110.8	A226 V228 V271 L273 A276 L296	A226-V298 WeakPolarHBondContact O-CA 3.43Å; V228-V298 HydrophobicContact CG2-CG1 3.84Å; V271-V298 HydrophobicContact CG1-CB 4.33Å; V271-V298 HydrophobicContact CG1-CG1 3.66Å; V271-V298 HydrophobicContact CG1-CG2 3.62Å; L273-V298 HydrophobicContact CD2-CG1 4.24Å; A276-V298 HydrophobicContact CB-CB 4.36Å; A276-V298 HydrophobicContact CB-CG2 4.04Å; L296-V298 HydrophobicContact CD1-CG2 4.37Å; L296-V298 HydrophobicContact CD2-CG2 4.13Å; L296-V298 HydrophobicContact CG-CG2 3.8Å
299	V	79.8	Confident	85.7	Confident	11 Å²	11	48.7 Å²	48.7	7%	0.067	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	146.8	176	-67.3	0	0	0	0	110.3	Q225 A226 V227 V228 S328 A386	Q225-V299 HydrophobicContact CG-CG2 4.48Å; A226-V299 WeakPolarHBondContact O-CG2 3.28Å; A226-V299 PolarHBondContact O-N 2.87Å; V227-V299 CarbonylContact C-O 3.6Å; V227-V299 VanDerWaalsContact CA-O 3.31Å; V227-V299 WeakPolarHBondContact CA-O 3.3Å; V227-V299 HydrophobicContact CG2-CG2 4.28Å; V228-V299 PolarHBondContact N-O 2.91Å; V299-S328 VanDerWaalsContact CA-O 3.32Å; V299-S328 WeakPolarHBondContact CA-O 3.34Å; V299-S328 VanDerWaalsContact CB-O 3.25Å; V299-S328 WeakPolarHBondContact CB-O 3.14Å; V299-A386 HydrophobicContact CB-CB 4.26Å; V299-A386 HydrophobicContact CG2-CB 3.97Å
300	S	82.7	Confident	85.9	Confident	20 Å²	20	50.5 Å²	50.5	14%	0.14	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134.4	168.6	53.7	0	0	0	0	109.3	S328 Q384	S300-S328 PolarHBondContact N-O 3.18Å; S300-S328 VanDerWaalsContact N-O 3.1Å; S300-S328 PolarHBondContact O-N 2.69Å; S300-S328 VanDerWaalsContact O-N 3.08Å; S300-S328 VanDerWaalsContact OG-CB 3.28Å; S300-S328 WeakPolarHBondContact OG-CB 3.26Å; S300-S328 PolarHBondContact OG-N 2.83Å; S300-Q384 PolarHBondContact O-NE2 2.8Å; S300-Q384 PolarHBondContact O-OE1 2.85Å
301	P	81.8	Confident	86	Confident	51 Å²	51	51.3 Å²	51.3	33%	0.331	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	161.8	-179.8	32.1	-35.2	0	0	0	110.5	V227 I303	V227-P301 HydrophobicContact CG1-CG 4.29Å; P301-I303 PolarHBondContact O-N 2.83Å
302	P	85.4	Confident	85.6	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.032	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132.3	-176.6	29.3	-31.2	0	0	0	109.9	S326 P331 A382 Q384 V389	P302-S326 CarbonylContact C-O 3.57Å; P302-S326 WeakPolarHBondContact CA-O 3.46Å; P302-P331 HydrophobicContact CB-CB 3.94Å; P302-P331 HydrophobicContact CB-CG 4.12Å; P302-A382 HydrophobicContact CB-CB 4.4Å; P302-Q384 VanDerWaalsContact CA-OE1 3.28Å; P302-Q384 HydrophobicContact CB-CG 4.11Å; P302-Q384 VanDerWaalsContact CB-OE1 3.32Å; P302-Q384 HydrophobicContact CG-CG 3.88Å; P302-Q384 VanDerWaalsContact N-OE1 3.13Å; P302-V389 HydrophobicContact CB-CG2 3.91Å; P302-V389 HydrophobicContact CG-CG1 4.29Å; P302-V389 HydrophobicContact CG-CG2 4.06Å; P302-V389 WeakPolarHBondContact O-CG1 3.46Å; P302-V389 WeakPolarHBondContact O-CG2 3.27Å
303	I	89.3	Confident	85.5	Confident	95 Å²	95	51.6 Å²	51.6	49%	0.487	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.2	177.8	59.1	169.9	0	0	0	110.5	P301 T325 S326	P301-I303 PolarHBondContact O-N 2.83Å; I303-T325 CarbonylContact O-C 3.54Å; I303-T325 WeakPolarHBondContact O-CA 3.31Å; I303-T325 VanDerWaalsContact O-CB 3.29Å; I303-T325 WeakPolarHBondContact O-CB 3.36Å; I303-S326 WeakPolarHBondContact CG1-O 3.5Å; I303-S326 PolarHBondContact N-O 2.96Å; I303-S326 PolarHBondContact O-N 3.37Å
304	F	90.3	Very high	84.9	Confident	49 Å²	49	51 Å²	51	22%	0.215	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	130.2	168.1	-65.5	-79.5	0	0	0	110	T307 T325 C380 V389 K390 S391	F304-T307 HydrophobicContact CB-CG2 3.56Å; F304-T307 HydrophobicContact CD1-CG2 4.18Å; F304-T307 HydrophobicContact CD2-CG2 4.16Å; F304-T307 HydrophobicContact CG-CG2 3.71Å; F304-T325 HydrophobicContact CD1-CG2 3.46Å; F304-T325 VanDerWaalsContact CD1-CG2 3.46Å; F304-T325 HydrophobicContact CE1-CG2 3.64Å; F304-T325 HydrophobicContact CG-CG2 4.26Å; F304-C380 HydrophobicContact CE1-CB 4.5Å; F304-V389 HydrophobicContact CD2-CB 4.4Å; F304-V389 HydrophobicContact CD2-CG2 4.05Å; F304-V389 HydrophobicContact CE2-CB 3.7Å; F304-V389 HydrophobicContact CE2-CG2 3.51Å; F304-V389 HydrophobicContact CZ-CB 4.31Å; F304-V389 HydrophobicContact CZ-CG2 3.84Å; F304-K390 WeakPolarHBondContact CE2-O 3.46Å; F304-S391 VanDerWaalsContact CZ-CB 3.47Å; F304-S391 VanDerWaalsContact CZ-N 3.32Å
305	V	91	Very high	84.3	Confident	87 Å²	87	53.1 Å²	53.1	53%	0.527	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-37.1	167.3	-175.6	0	0	0	0	109.3	L324	V305-L324 HydrophobicContact CB-CB 4.32Å; V305-L324 HydrophobicContact CB-CD2 4.12Å; V305-L324 HydrophobicContact CB-CG 4.06Å; V305-L324 HydrophobicContact CG1-CD2 3.98Å; V305-L324 HydrophobicContact CG1-CG 4.48Å; V305-L324 PolarHBondContact N-O 3.38Å
306	I	92	Very high	83.6	Confident	83 Å²	83	51.3 Å²	51.3	43%	0.426	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	122.8	168.2	-56.1	175.4	0	0	0	107.1	D322 C323 L324	I306-D322 HydrophobicContact CG2-CB 4.23Å; I306-C323 WeakPolarHBondContact O-CA 3.43Å; I306-L324 HydrophobicContact CB-CB 3.88Å; I306-L324 HydrophobicContact CD1-CB 4.06Å; I306-L324 HydrophobicContact CD1-CD2 4.12Å; I306-L324 HydrophobicContact CG1-CB 3.95Å; I306-L324 HydrophobicContact CG1-CD2 4.35Å; I306-L324 PolarHBondContact N-O 3.04Å; I306-L324 PolarHBondContact O-N 3.39Å
307	T	91.3	Very high	83.4	Confident	68 Å²	68	52.2 Å²	52.2	42%	0.417	30%	0.303	S	S	.	.			trans	-92.7	146.2	166.7	47.5	0	0	0	0	109.8	F304 D322 S391	F304-T307 HydrophobicContact CB-CG2 3.56Å; F304-T307 HydrophobicContact CD1-CG2 4.18Å; F304-T307 HydrophobicContact CD2-CG2 4.16Å; F304-T307 HydrophobicContact CG-CG2 3.71Å; T307-D322 CarbonylContact C-O 3.44Å; T307-S391 WeakPolarHBondContact CB-OG 3.4Å; T307-S391 WeakPolarHBondContact CG2-OG 3.48Å
308	P	94.5	Very high	83.7	Confident	11 Å²	11	56.5 Å²	56.5	7%	0.071	32%	0.319	C	S	.	.			trans	-67.2	152.9	170.1	29.2	-35.3	0	0	0	111.9	F321 D322 W335 A393	P308-F321 HydrophobicContact CB-CB 4.24Å; P308-F321 HydrophobicContact CB-CD1 4.13Å; P308-D322 WeakPolarHBondContact CA-O 3.44Å; P308-W335 HydrophobicContact CB-CH2 3.83Å; P308-W335 HydrophobicContact CB-CZ3 4.36Å; P308-W335 HydrophobicContact CG-CH2 3.83Å; P308-W335 HydrophobicContact CG-CZ3 4.11Å; P308-A393 HydrophobicContact CB-CB 3.73Å; P308-A393 HydrophobicContact CG-CB 4.04Å
309	E	90.7	Very high	84.2	Confident	141 Å²	141	56.2 Å²	56.2	66%	0.659	32%	0.317	S	S	*	.			trans	-116	151.2	179.5	-59.7	177.3	153.8	0	0	109.9	F321 A393	E309-F321 WeakPolarHBondContact O-CE1 3.47Å; E309-A393 WeakPolarHBondContact O-CB 3.39Å
310	D	88.3	Confident	84.9	Confident	100 Å²	100	57.5 Å²	57.5	54%	0.535	33%	0.327	S	S	.	.			trans	-60.6	139.9	176	-68.8	-4.8	0	0	0	111.4	A393 Q394 F396	D310-A393 WeakPolarHBondContact OD1-CA 3.27Å; D310-Q394 WeakPolarHBondContact CA-O 3.47Å; D310-Q394 PolarHBondContact OD1-N 2.7Å; D310-F396 HydrophobicContact CB-CE2 4.42Å
311	K	86.8	Confident	85.5	Confident	55 Å²	55	56.6 Å²	56.6	24%	0.239	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	141.8	-176.8	-68.7	-176.2	-175.7	-177.3	0	112.4	V319 S320 F321 Q394 F396	K311-V319 HydrophobicContact CB-CG2 4.09Å; K311-V319 HydrophobicContact CD-CG2 3.81Å; K311-S320 WeakPolarHBondContact CD-O 3.25Å; K311-S320 WeakPolarHBondContact CE-O 3.4Å; K311-S320 PolarHBondContact NZ-O 3.15Å; K311-F321 HydrophobicContact CB-CE1 4.22Å; K311-F321 HydrophobicContact CB-CZ 4.39Å; K311-F321 HydrophobicContact CD-CD1 4.47Å; K311-F321 HydrophobicContact CD-CE1 4.27Å; K311-F321 HydrophobicContact CG-CE1 4.21Å; K311-Q394 PolarHBondContact N-O 3.18Å; K311-F396 PolarHBondContact O-N 2.67Å
312	T	78.4	Confident	86.1	Confident	88 Å²	88	56.8 Å²	56.8	54%	0.54	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.6	173	-55.9	0	0	0	0	108.8	F396 E398	T312-F396 WeakPolarHBondContact CA-O 3.4Å; T312-F396 HydrophobicContact CG2-CB 4.16Å; T312-E398 HydrophobicContact CG2-CB 3.96Å; T312-E398 HydrophobicContact CG2-CG 4.25Å
313	V	80.3	Confident	86.5	Confident	19 Å²	19	56.7 Å²	56.7	12%	0.115	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	135	-175.2	177.5	0	0	0	0	110.4	H318 V319 T370 F396 I397 E398	V313-H318 WeakPolarHBondContact CG1-O 3.47Å; V313-V319 HydrophobicContact CG2-CB 3.96Å; V313-V319 HydrophobicContact CG2-CG2 3.89Å; V313-T370 HydrophobicContact CG1-CG2 4.14Å; V313-F396 PolarHBondContact N-O 2.84Å; V313-I397 CarbonylContact O-C 3.58Å; V313-I397 VanDerWaalsContact O-CA 3.28Å; V313-I397 WeakPolarHBondContact O-CA 3.48Å; V313-E398 PolarHBondContact O-N 2.81Å
314	P	69.7	Low	86.6	Confident	63 Å²	63	55.8 Å²	55.8	41%	0.409	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	153.5	178.2	25.3	-35.6	0	0	0	113.1	G316 G317 T370 E398	P314-G316 PolarHBondContact O-N 3.08Å; P314-G317 PolarHBondContact O-N 3.13Å; P314-T370 PolarHBondContact O-OG1 2.83Å; P314-E398 HydrophobicContact CB-CB 4.36Å
315	L	67.9	Low	86.6	Confident	44 Å²	44	54.6 Å²	54.6	23%	0.23	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	128.5	177.3	-177.6	60.1	0	0	0	111.2	G317 L372 I397 F591	L315-G317 VanDerWaalsContact C-N 3.27Å; L315-L372 HydrophobicContact CD1-CG 4.03Å; L315-L372 HydrophobicContact CD2-CD1 4.22Å; L315-L372 HydrophobicContact CD2-CG 4.48Å; L315-I397 HydrophobicContact CB-CG2 3.97Å; L315-I397 HydrophobicContact CD1-CG2 4.26Å; L315-F591 HydrophobicContact CD2-CD1 4.3Å; L315-F591 HydrophobicContact CD2-CE1 4.12Å
316	G	70.3	Confident	86.5	Confident	39 Å²	39	53.3 Å²	53.3	40%	0.402	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-1.4	-175	0	0	0	0	0	114.8	P314 S369 T370	P314-G316 PolarHBondContact O-N 3.08Å; G316-S369 PolarHBondContact O-OG 3.04Å; G316-T370 WeakPolarHBondContact CA-O 3.38Å; G316-T370 PolarHBondContact N-O 2.85Å; G316-T370 PolarHBondContact N-OG1 2.9Å; G316-T370 VanDerWaalsContact N-OG1 3.15Å
317	G	78.8	Confident	86.1	Confident	19 Å²	19	50 Å²	50	20%	0.196	29%	0.292	C	S	.	.			trans	-72.2	-163.6	173.3	0	0	0	0	0	113.6	P314 L315 S369 T370	P314-G317 PolarHBondContact O-N 3.13Å; L315-G317 VanDerWaalsContact C-N 3.27Å; G317-S369 CarbonylContact O-C 3.54Å; G317-S369 WeakPolarHBondContact O-CA 3.41Å; G317-S369 PolarHBondContact O-N 3.45Å; G317-S369 VanDerWaalsContact O-N 3.08Å; G317-T370 PolarHBondContact N-OG1 2.97Å; G317-T370 VanDerWaalsContact N-OG1 3.13Å; G317-T370 PolarHBondContact O-N 2.91Å
318	H	87.9	Confident	85.5	Confident	127 Å²	127	48.7 Å²	48.7	59%	0.588	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133	149.3	178.2	56.4	-92.8	0	0	0	110.7	V313 F366 I367	V313-H318 WeakPolarHBondContact CG1-O 3.47Å; H318-F366 HydrophobicContact CB-CE2 4.09Å; H318-F366 HydrophobicContact CB-CZ 3.92Å; H318-I367 WeakPolarHBondContact CA-O 3.31Å
319	V	91.3	Very high	84.8	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	145	-179.7	69.2	0	0	0	0	111.6	K311 V313 F321 F366 I367 T370 L395	K311-V319 HydrophobicContact CB-CG2 4.09Å; K311-V319 HydrophobicContact CD-CG2 3.81Å; V313-V319 HydrophobicContact CG2-CB 3.96Å; V313-V319 HydrophobicContact CG2-CG2 3.89Å; V319-F321 HydrophobicContact CG1-CE2 4.29Å; V319-F321 HydrophobicContact CG2-CE2 4.2Å; V319-F321 HydrophobicContact CG2-CZ 4.32Å; V319-F366 WeakPolarHBondContact O-CA 3.39Å; V319-F366 WeakPolarHBondContact O-CD2 3.38Å; V319-I367 HydrophobicContact CG1-CB 3.89Å; V319-I367 HydrophobicContact CG1-CD1 3.8Å; V319-I367 HydrophobicContact CG1-CG1 3.89Å; V319-I367 PolarHBondContact N-O 2.85Å; V319-I367 VanDerWaalsContact N-O 3.15Å; V319-I367 PolarHBondContact O-N 3.14Å; V319-T370 HydrophobicContact CG1-CG2 4.11Å; V319-L395 HydrophobicContact CB-CD1 4.49Å; V319-L395 HydrophobicContact CG1-CD1 4.24Å; V319-L395 HydrophobicContact CG1-CD2 4.1Å; V319-L395 HydrophobicContact CG2-CD1 4.15Å
320	S	94.3	Very high	84.4	Confident	39 Å²	39	49.9 Å²	49.9	27%	0.273	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145.1	165.6	68.5	0	0	0	0	110.9	K311 L365	K311-S320 WeakPolarHBondContact CD-O 3.25Å; K311-S320 WeakPolarHBondContact CE-O 3.4Å; K311-S320 PolarHBondContact NZ-O 3.15Å; S320-L365 CarbonylContact C-O 3.52Å; S320-L365 VanDerWaalsContact CA-O 3.26Å; S320-L365 WeakPolarHBondContact CA-O 3.29Å
321	F	95.9	Very high	84.3	Confident	1 Å²	1	46 Å²	46	0%	0.004	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	126.3	162.7	-68.5	-75.4	0	0	0	108.6	P308 E309 K311 V319 W335 T364 L365 F378 A393 L395	P308-F321 HydrophobicContact CB-CB 4.24Å; P308-F321 HydrophobicContact CB-CD1 4.13Å; E309-F321 WeakPolarHBondContact O-CE1 3.47Å; K311-F321 HydrophobicContact CB-CE1 4.22Å; K311-F321 HydrophobicContact CB-CZ 4.39Å; K311-F321 HydrophobicContact CD-CD1 4.47Å; K311-F321 HydrophobicContact CD-CE1 4.27Å; K311-F321 HydrophobicContact CG-CE1 4.21Å; V319-F321 HydrophobicContact CG1-CE2 4.29Å; V319-F321 HydrophobicContact CG2-CE2 4.2Å; V319-F321 HydrophobicContact CG2-CZ 4.32Å; F321-W335 HydrophobicContact CB-CH2 3.48Å; F321-W335 VanDerWaalsContact CB-CH2 3.48Å; F321-W335 HydrophobicContact CB-CZ2 4Å; F321-W335 HydrophobicContact CB-CZ3 3.99Å; F321-W335 VanDerWaalsContact O-CZ2 3.31Å; F321-W335 WeakPolarHBondContact O-CZ2 3.42Å; F321-T364 CarbonylContact O-C 3.59Å; F321-T364 WeakPolarHBondContact O-CA 3.36Å; F321-L365 PolarHBondContact N-O 2.91Å; F321-L365 PolarHBondContact O-N 2.85Å; F321-F378 HydrophobicContact CD2-CD1 4.42Å; F321-F378 HydrophobicContact CD2-CD2 4.48Å; F321-F378 HydrophobicContact CD2-CG 4.28Å; F321-F378 HydrophobicContact CE2-CD1 4.47Å; F321-F378 AromaticContact CE2-CD2 3.83Å; F321-F378 HydrophobicContact CE2-CD2 3.83Å; F321-F378 HydrophobicContact CE2-CE2 4.05Å; F321-F378 HydrophobicContact CE2-CG 4.08Å; F321-F378 HydrophobicContact CE2-CZ 4.47Å; F321-F378 HydrophobicContact CZ-CD2 4.22Å; F321-A393 HydrophobicContact CD1-CB 3.98Å; F321-A393 HydrophobicContact CE1-CB 3.84Å; F321-L395 HydrophobicContact CE2-CB 4.24Å; F321-L395 HydrophobicContact CE2-CD1 4.43Å; F321-L395 HydrophobicContact CE2-CD2 4.41Å; F321-L395 HydrophobicContact CZ-CB 3.9Å; F321-L395 HydrophobicContact CZ-CD1 4.1Å; F321-L395 HydrophobicContact CZ-CG 4.45Å
322	D	94.2	Very high	84.3	Confident	55 Å²	55	45 Å²	45	29%	0.294	29%	0.285	S	S	.	.			trans	-102.5	133.7	-176	-61.8	-70.6	0	0	0	109.8	I306 T307 P308 T364	I306-D322 HydrophobicContact CG2-CB 4.23Å; T307-D322 CarbonylContact C-O 3.44Å; P308-D322 WeakPolarHBondContact CA-O 3.44Å; D322-T364 WeakPolarHBondContact OD1-CB 3.3Å; D322-T364 VanDerWaalsContact OD1-CG2 3.23Å; D322-T364 WeakPolarHBondContact OD1-CG2 3.39Å; D322-T364 PolarHBondContact OD1-OG1 2.97Å
323	C	92.8	Very high	84.8	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.02	27%	0.265	C	S	.	.			trans	-144	97.1	179.3	-179.6	0	0	0	0	110	I306 W335 G363 C380	I306-C323 WeakPolarHBondContact O-CA 3.43Å; C323-W335 HydrophobicContact CB-CH2 3.74Å; C323-W335 HydrophobicContact CB-CZ2 3.3Å; C323-G363 WeakPolarHBondContact O-CA 3.4Å; C323-C380 HydrophobicContact CB-CB 3.69Å; C323-C380 WeakPolarHBondContact CB-SG 3.4Å; C323-C380 WeakPolarHBondContact SG-CB 3.33Å; C323-C380 CovalentContact SG-SG 2.03Å; C323-C380 PolarHBondContact SG-SG 3.03Å
324	L	92	Very high	85.2	Confident	75 Å²	75	41.6 Å²	41.6	39%	0.393	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.3	177.8	-174.9	64.2	0	0	0	109	V305 I306	V305-L324 HydrophobicContact CB-CB 4.32Å; V305-L324 HydrophobicContact CB-CD2 4.12Å; V305-L324 HydrophobicContact CB-CG 4.06Å; V305-L324 HydrophobicContact CG1-CD2 3.98Å; V305-L324 HydrophobicContact CG1-CG 4.48Å; V305-L324 PolarHBondContact N-O 3.38Å; I306-L324 HydrophobicContact CB-CB 3.88Å; I306-L324 HydrophobicContact CD1-CB 4.06Å; I306-L324 HydrophobicContact CD1-CD2 4.12Å; I306-L324 HydrophobicContact CG1-CB 3.95Å; I306-L324 HydrophobicContact CG1-CD2 4.35Å; I306-L324 PolarHBondContact N-O 3.04Å; I306-L324 PolarHBondContact O-N 3.39Å
325	T	90.1	Very high	86.2	Confident	24 Å²	24	38.6 Å²	38.6	15%	0.147	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	151.7	179.7	61.3	0	0	0	0	112.1	I303 F304 P331 V333 A382	I303-T325 CarbonylContact O-C 3.54Å; I303-T325 WeakPolarHBondContact O-CA 3.31Å; I303-T325 VanDerWaalsContact O-CB 3.29Å; I303-T325 WeakPolarHBondContact O-CB 3.36Å; F304-T325 HydrophobicContact CD1-CG2 3.46Å; F304-T325 VanDerWaalsContact CD1-CG2 3.46Å; F304-T325 HydrophobicContact CE1-CG2 3.64Å; F304-T325 HydrophobicContact CG-CG2 4.26Å; T325-P331 WeakPolarHBondContact OG1-CG 3.39Å; T325-V333 WeakPolarHBondContact OG1-CG2 3.27Å; T325-A382 HydrophobicContact CG2-CB 3.79Å
326	S	88.6	Confident	87	Confident	60 Å²	60	38.9 Å²	38.9	42%	0.42	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	155.4	176.8	-174.7	0	0	0	0	110.5	P302 I303	P302-S326 CarbonylContact C-O 3.57Å; P302-S326 WeakPolarHBondContact CA-O 3.46Å; I303-S326 WeakPolarHBondContact CG1-O 3.5Å; I303-S326 PolarHBondContact N-O 2.96Å; I303-S326 PolarHBondContact O-N 3.37Å
327	G	84.1	Confident	87.5	Confident	14 Å²	14	37.6 Å²	37.6	14%	0.144	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.9	163	-177	0	0	0	0	0	110.8	P329	G327-P329 CarbonylContact C-O 3.52Å; G327-P329 CarbonylContact O-C 3.54Å
328	S	79.3	Confident	87.1	Confident	40 Å²	40	40.7 Å²	40.7	28%	0.28	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	113.6	177.1	-175.5	0	0	0	0	109.6	V299 S300 Q384	V299-S328 VanDerWaalsContact CA-O 3.32Å; V299-S328 WeakPolarHBondContact CA-O 3.34Å; V299-S328 VanDerWaalsContact CB-O 3.25Å; V299-S328 WeakPolarHBondContact CB-O 3.14Å; S300-S328 PolarHBondContact N-O 3.18Å; S300-S328 VanDerWaalsContact N-O 3.1Å; S300-S328 PolarHBondContact O-N 2.69Å; S300-S328 VanDerWaalsContact O-N 3.08Å; S300-S328 VanDerWaalsContact OG-CB 3.28Å; S300-S328 WeakPolarHBondContact OG-CB 3.26Å; S300-S328 PolarHBondContact OG-N 2.83Å; S328-Q384 PolarHBondContact O-NE2 2.91Å
329	P	78.7	Confident	85.8	Confident	67 Å²	67	41.3 Å²	41.3	44%	0.435	26%	0.261	S	S	.	.	S	Bend	cis	-63	161.6	-7.2	29.8	-37	0	0	0	112.4	G327 Q384	G327-P329 CarbonylContact C-O 3.52Å; G327-P329 CarbonylContact O-C 3.54Å; P329-Q384 PolarHBondContact O-NE2 3.06Å
330	P	82.8	Confident	84.7	Confident	111 Å²	111	43.9 Å²	43.9	72%	0.721	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-54.1	132.9	179.6	-27.3	35.7	0	0	0	112.5
331	P	86.7	Confident	83.8	Confident	17 Å²	17	42.6 Å²	42.6	11%	0.11	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-76.3	148.6	-175.2	30.1	-35.3	0	0	0	113	P302 T325 V333 A382 S383 Q384	P302-P331 HydrophobicContact CB-CB 3.94Å; P302-P331 HydrophobicContact CB-CG 4.12Å; T325-P331 WeakPolarHBondContact OG1-CG 3.39Å; P331-V333 PolarHBondContact O-N 2.88Å; P331-A382 HydrophobicContact CB-CB 4.1Å; P331-A382 HydrophobicContact CG-CB 4.25Å; P331-S383 WeakPolarHBondContact CA-O 3.45Å; P331-Q384 HydrophobicContact CB-CB 4.21Å; P331-Q384 HydrophobicContact CB-CG 4.32Å
332	S	86	Confident	83.1	Confident	34 Å²	34	43.2 Å²	43.2	24%	0.238	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	117.9	169.1	-60.8	0	0	0	0	109.5	A382 S383	S332-A382 WeakPolarHBondContact O-CA 3.39Å; S332-S383 PolarHBondContact N-O 3.17Å; S332-S383 PolarHBondContact O-N 3.27Å
333	V	89.6	Confident	82.6	Confident	18 Å²	18	41.9 Å²	41.9	11%	0.109	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	141.1	-174.8	-169	0	0	0	0	111.1	T325 P331 V344 C380 K381 A382	T325-V333 WeakPolarHBondContact OG1-CG2 3.27Å; P331-V333 PolarHBondContact O-N 2.88Å; V333-V344 HydrophobicContact CB-CB 4.01Å; V333-V344 HydrophobicContact CB-CG2 3.76Å; V333-V344 HydrophobicContact CG1-CG2 3.72Å; V333-V344 PolarHBondContact O-N 2.83Å; V333-C380 VanDerWaalsContact CG1-SG 3.55Å; V333-K381 CarbonylContact C-O 3.6Å; V333-K381 WeakPolarHBondContact CA-O 3.42Å; V333-A382 HydrophobicContact CG2-CB 4.12Å
334	R	88.6	Confident	82.2	Confident	18 Å²	18	43 Å²	43	7%	0.068	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	147.5	174.4	65.6	-165	-177.8	92.4	-8.5	113	S341 F342 W343 K381 E679	R334-S341 PolarHBondContact NH1-OG 3.13Å; R334-F342 CarbonylContact C-O 3.41Å; R334-F342 VanDerWaalsContact CA-O 3.26Å; R334-F342 WeakPolarHBondContact CA-O 3.21Å; R334-F342 WeakPolarHBondContact CB-O 3.16Å; R334-W343 HydrophobicContact CB-CD2 4.01Å; R334-W343 HydrophobicContact CB-CE3 3.83Å; R334-W343 HydrophobicContact CB-CG 4.46Å; R334-W343 HydrophobicContact CB-CZ3 4.25Å; R334-W343 VanDerWaalsContact CD-CH2 3.49Å; R334-W343 HydrophobicContact CG-CE3 4.46Å; R334-W343 HydrophobicContact CG-CZ3 4.39Å; R334-K381 HydrophobicContact CG-CB 4.31Å; R334-K381 PolarHBondContact N-O 3.5Å; R334-K381 PolarHBondContact O-N 2.82Å; R334-E679 IonicContact NH2-OE1 2.65Å; R334-E679 PolarHBondContact NH2-OE1 2.94Å; R334-E679 VanDerWaalsContact NH2-OE1 3.16Å
335	W	89.3	Confident	81.7	Confident	1 Å²	1	40 Å²	40	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	144.7	169.3	-72.6	99.4	0	0	0	111.2	P308 F321 C323 S341 F342 G363 L365 F378 E379 C380	P308-W335 HydrophobicContact CB-CH2 3.83Å; P308-W335 HydrophobicContact CB-CZ3 4.36Å; P308-W335 HydrophobicContact CG-CH2 3.83Å; P308-W335 HydrophobicContact CG-CZ3 4.11Å; F321-W335 HydrophobicContact CB-CH2 3.48Å; F321-W335 VanDerWaalsContact CB-CH2 3.48Å; F321-W335 HydrophobicContact CB-CZ2 4Å; F321-W335 HydrophobicContact CB-CZ3 3.99Å; F321-W335 VanDerWaalsContact O-CZ2 3.31Å; F321-W335 WeakPolarHBondContact O-CZ2 3.42Å; C323-W335 HydrophobicContact CB-CH2 3.74Å; C323-W335 HydrophobicContact CB-CZ2 3.3Å; W335-S341 CarbonylContact O-C 3.56Å; W335-S341 VanDerWaalsContact O-CA 3.27Å; W335-S341 WeakPolarHBondContact O-CA 3.12Å; W335-F342 HydrophobicContact CB-CB 4.41Å; W335-F342 PolarHBondContact N-O 3.43Å; W335-F342 PolarHBondContact O-N 3.42Å; W335-G363 PolarHBondContact NE1-O 3.42Å; W335-L365 HydrophobicContact CB-CD2 4.24Å; W335-L365 HydrophobicContact CD2-CB 3.85Å; W335-L365 HydrophobicContact CD2-CD2 3.91Å; W335-L365 HydrophobicContact CE3-CD2 4.07Å; W335-L365 HydrophobicContact CG-CB 3.95Å; W335-L365 HydrophobicContact CG-CD2 4Å; W335-L365 HydrophobicContact CG-CG 4.48Å; W335-L365 HydrophobicContact CZ2-CB 4.11Å; W335-F378 HydrophobicContact CE3-CB 4.32Å; W335-F378 HydrophobicContact CZ3-CB 4.2Å; W335-E379 CarbonylContact C-O 3.54Å; W335-E379 WeakPolarHBondContact CA-O 3.45Å; W335-C380 HydrophobicContact CD2-CB 4.32Å; W335-C380 HydrophobicContact CE3-CB 3.97Å; W335-C380 HydrophobicContact CH2-CB 3.89Å; W335-C380 HydrophobicContact CZ2-CB 4.26Å; W335-C380 HydrophobicContact CZ3-CB 3.75Å
336	L	84.9	Confident	81.2	Confident	49 Å²	49	42.7 Å²	42.7	26%	0.257	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.3	175.6	-84.1	168.4	0	0	0	109.3	F340 F378 E379	L336-F340 WeakPolarHBondContact CA-O 3.26Å; L336-F378 CarbonylContact O-C 3.56Å; L336-F378 WeakPolarHBondContact O-CA 3.34Å; L336-E379 HydrophobicContact CB-CB 4.09Å; L336-E379 WeakPolarHBondContact CD1-OE1 3.21Å; L336-E379 PolarHBondContact N-O 2.88Å; L336-E379 PolarHBondContact O-N 2.83Å
337	H	82.1	Confident	80.8	Confident	13 Å²	13	45.2 Å²	45.2	6%	0.06	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	110.7	172.5	173.5	69.6	0	0	0	109.9	K339 F340 D374 L377 F378	H337-K339 PolarHBondContact O-N 3.24Å; H337-F340 PolarHBondContact N-O 3.49Å; H337-F340 WeakPolarHBondContact O-CD2 3.38Å; H337-F340 PolarHBondContact O-N 3.44Å; H337-D374 PolarHBondContact CE1-O 3.48Å; H337-D374 PolarHBondContact NE2-O 2.98Å; H337-L377 PolarHBondContact ND1-O 3.38Å; H337-F378 HydrophobicContact CB-CD1 3.62Å; H337-F378 HydrophobicContact CB-CE1 3.55Å; H337-F378 HydrophobicContact CB-CG 4.22Å; H337-F378 HydrophobicContact CB-CZ 4.08Å; H337-F378 AromaticContact CD2-CZ 3.84Å; H337-F378 AromaticContact CE1-CE2 3.57Å; H337-F378 AromaticContact CE1-CZ 3.68Å; H337-F378 AromaticContact CG-CD1 3.94Å; H337-F378 AromaticContact CG-CE1 3.52Å; H337-F378 AromaticContact CG-CE2 3.94Å; H337-F378 AromaticContact CG-CZ 3.51Å; H337-F378 AromaticContact ND1-CD2 3.66Å; H337-F378 AromaticContact ND1-CE1 3.81Å; H337-F378 AromaticContact ND1-CE2 3.34Å; H337-F378 VanDerWaalsContact ND1-CE2 3.34Å; H337-F378 WeakPolarHBondContact ND1-CE2 2.83Å; H337-F378 AromaticContact ND1-CG 4Å; H337-F378 AromaticContact ND1-CZ 3.42Å; H337-F378 WeakPolarHBondContact ND1-CZ 3.42Å; H337-F378 AromaticContact NE2-CZ 3.96Å
338	G	70.2	Confident	80.4	Confident	83 Å²	83	52.5 Å²	52.5	86%	0.856	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	-89.7	-177.3	0	0	0	0	0	113.6
339	K	61.1	Low	80.1	Confident	140 Å²	140	53.3 Å²	53.3	61%	0.609	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-14.2	178.9	-73.7	171	163.4	-173.5	0	114	H337 I787	H337-K339 PolarHBondContact O-N 3.24Å; K339-I787 HydrophobicContact CB-CB 4.26Å; K339-I787 HydrophobicContact CB-CD1 4.36Å; K339-I787 HydrophobicContact CB-CG2 4.32Å; K339-I787 HydrophobicContact CD-CD1 3.54Å; K339-I787 HydrophobicContact CG-CD1 4Å
340	F	68.4	Low	79.9	Confident	60 Å²	60	59 Å²	59	26%	0.263	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	143.9	-178.1	-54.6	-84.5	0	0	0	110.5	L336 H337 F342	L336-F340 WeakPolarHBondContact CA-O 3.26Å; H337-F340 PolarHBondContact N-O 3.49Å; H337-F340 WeakPolarHBondContact O-CD2 3.38Å; H337-F340 PolarHBondContact O-N 3.44Å; F340-F342 HydrophobicContact CB-CE2 3.75Å; F340-F342 HydrophobicContact CB-CZ 3.83Å; F340-F342 HydrophobicContact CD1-CZ 4.23Å; F340-F342 HydrophobicContact CG-CZ 4.27Å
341	S	74.3	Confident	79.8	Confident	12 Å²	12	56.2 Å²	56.2	8%	0.084	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	121.2	173.1	-178.9	0	0	0	0	109.1	R334 W335 Y786	R334-S341 PolarHBondContact NH1-OG 3.13Å; W335-S341 CarbonylContact O-C 3.56Å; W335-S341 VanDerWaalsContact O-CA 3.27Å; W335-S341 WeakPolarHBondContact O-CA 3.12Å; S341-Y786 PolarHBondContact O-OH 2.63Å
342	F	80.3	Confident	79	Confident	13 Å²	13	58 Å²	58	6%	0.057	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.7	-179.4	-51.4	-75.4	0	0	0	109.8	R334 W335 F340 A354 Y357 V359 L365	R334-F342 CarbonylContact C-O 3.41Å; R334-F342 VanDerWaalsContact CA-O 3.26Å; R334-F342 WeakPolarHBondContact CA-O 3.21Å; R334-F342 WeakPolarHBondContact CB-O 3.16Å; W335-F342 HydrophobicContact CB-CB 4.41Å; W335-F342 PolarHBondContact N-O 3.43Å; W335-F342 PolarHBondContact O-N 3.42Å; F340-F342 HydrophobicContact CB-CE2 3.75Å; F340-F342 HydrophobicContact CB-CZ 3.83Å; F340-F342 HydrophobicContact CD1-CZ 4.23Å; F340-F342 HydrophobicContact CG-CZ 4.27Å; F342-A354 HydrophobicContact CD1-CB 4.42Å; F342-A354 HydrophobicContact CE1-CB 3.92Å; F342-Y357 HydrophobicContact CE1-CD2 4.43Å; F342-Y357 HydrophobicContact CE1-CG 4.38Å; F342-Y357 AromaticContact CE2-CD1 3.94Å; F342-Y357 HydrophobicContact CE2-CD1 3.94Å; F342-Y357 HydrophobicContact CE2-CD2 4.33Å; F342-Y357 HydrophobicContact CE2-CE1 4.41Å; F342-Y357 AromaticContact CE2-CG 3.9Å; F342-Y357 HydrophobicContact CE2-CG 3.9Å; F342-Y357 HydrophobicContact CZ-CD1 4.08Å; F342-Y357 AromaticContact CZ-CD2 3.65Å; F342-Y357 HydrophobicContact CZ-CD2 3.65Å; F342-Y357 HydrophobicContact CZ-CE2 4.21Å; F342-Y357 AromaticContact CZ-CG 3.58Å; F342-Y357 HydrophobicContact CZ-CG 3.58Å; F342-V359 HydrophobicContact CB-CG2 3.65Å; F342-V359 HydrophobicContact CG-CG2 4.26Å; F342-L365 HydrophobicContact CD2-CD1 4.37Å
343	W	83.8	Confident	78.2	Confident	28 Å²	28	63 Å²	63	11%	0.106	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	142.8	175	-67.5	90.1	0	0	0	110.6	R334 I675 L681 K797 A799	R334-W343 HydrophobicContact CB-CD2 4.01Å; R334-W343 HydrophobicContact CB-CE3 3.83Å; R334-W343 HydrophobicContact CB-CG 4.46Å; R334-W343 HydrophobicContact CB-CZ3 4.25Å; R334-W343 VanDerWaalsContact CD-CH2 3.49Å; R334-W343 HydrophobicContact CG-CE3 4.46Å; R334-W343 HydrophobicContact CG-CZ3 4.39Å; W343-I675 HydrophobicContact CH2-CD1 3.99Å; W343-L681 HydrophobicContact CH2-CD1 3.87Å; W343-L681 HydrophobicContact CZ2-CD1 3.49Å; W343-L681 VanDerWaalsContact CZ2-CD1 3.49Å; W343-K797 HydrophobicContact CG-CB 4.3Å; W343-K797 HydrophobicContact CG-CD 4.48Å; W343-K797 PolarHBondContact NE1-O 3.27Å; W343-A799 HydrophobicContact CH2-CB 4.02Å; W343-A799 HydrophobicContact CZ2-CB 3.85Å
344	V	86	Confident	76.9	Confident	26 Å²	26	63.1 Å²	63.1	16%	0.158	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-73.7	126.4	168.2	178.8	0	0	0	0	107.8	V333 V359	V333-V344 HydrophobicContact CB-CB 4.01Å; V333-V344 HydrophobicContact CB-CG2 3.76Å; V333-V344 HydrophobicContact CG1-CG2 3.72Å; V333-V344 PolarHBondContact O-N 2.83Å; V344-V359 HydrophobicContact CB-CG1 4.41Å; V344-V359 HydrophobicContact CG2-CG1 4.01Å
345	P	81.2	Confident	75.9	Confident	12 Å²	12	66.2 Å²	66.2	8%	0.078	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-64.2	155.7	176.8	-17.7	29.5	0	0	0	112.2	E349 L352 P361	P345-E349 WeakPolarHBondContact CA-OE2 3.45Å; P345-E349 HydrophobicContact CB-CB 3.56Å; P345-E349 VanDerWaalsContact CB-OE2 3.32Å; P345-E349 WeakPolarHBondContact CB-OE2 3.5Å; P345-L352 HydrophobicContact CG-CB 4.23Å; P345-P361 HydrophobicContact CB-CG 4.22Å
346	K	79.9	Confident	75.5	Confident	80 Å²	80	68.7 Å²	68.7	35%	0.348	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-56.4	155	168	-59.4	172.5	-160.2	170.9	0	109.6	N348 E349 P361 E753	K346-N348 PolarHBondContact O-N 2.9Å; K346-E349 HydrophobicContact CB-CB 4.42Å; K346-E349 HydrophobicContact CB-CG 3.9Å; K346-E349 HydrophobicContact CD-CG 4.33Å; K346-E349 WeakPolarHBondContact CD-OE1 3.35Å; K346-E349 WeakPolarHBondContact CE-OE1 3.25Å; K346-E349 HydrophobicContact CG-CG 4.29Å; K346-E349 WeakPolarHBondContact CG-OE1 3.26Å; K346-E349 PolarHBondContact N-OE2 2.9Å; K346-E349 IonicContact NZ-OE1 2.69Å; K346-E349 WeakPolarHBondContact O-CB 3.32Å; K346-E349 PolarHBondContact O-N 2.81Å; K346-P361 WeakPolarHBondContact O-CB 3.16Å; K346-E753 IonicContact NZ-OE1 3.94Å; K346-E753 PolarHBondContact NZ-OE1 2.72Å; K346-E753 IonicContact NZ-OE2 3.16Å; K346-E753 PolarHBondContact NZ-OE2 2.77Å
347	P	79.3	Confident	75.4	Confident	114 Å²	114	67 Å²	67	74%	0.74	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-26.6	178.8	-30.8	37.2	0	0	0	116.4
348	N	76.5	Confident	75.5	Confident	166 Å²	166	67.1 Å²	67.1	89%	0.888	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-6.7	179.8	-60.5	-10.9	0	0	0	113.7	K346	K346-N348 PolarHBondContact O-N 2.9Å
349	E	73.2	Confident	76.3	Confident	57 Å²	57	63.2 Å²	63.2	27%	0.266	34%	0.337	S	S	.	.	S	Bend	trans	-83	156.1	179.9	-74.5	170.2	-173.9	0	0	111.5	P345 K346 P361	P345-E349 WeakPolarHBondContact CA-OE2 3.45Å; P345-E349 HydrophobicContact CB-CB 3.56Å; P345-E349 VanDerWaalsContact CB-OE2 3.32Å; P345-E349 WeakPolarHBondContact CB-OE2 3.5Å; K346-E349 HydrophobicContact CB-CB 4.42Å; K346-E349 HydrophobicContact CB-CG 3.9Å; K346-E349 HydrophobicContact CD-CG 4.33Å; K346-E349 WeakPolarHBondContact CD-OE1 3.35Å; K346-E349 WeakPolarHBondContact CE-OE1 3.25Å; K346-E349 HydrophobicContact CG-CG 4.29Å; K346-E349 WeakPolarHBondContact CG-OE1 3.26Å; K346-E349 PolarHBondContact N-OE2 2.9Å; K346-E349 IonicContact NZ-OE1 2.69Å; K346-E349 WeakPolarHBondContact O-CB 3.32Å; K346-E349 PolarHBondContact O-N 2.81Å; E349-P361 VanDerWaalsContact O-CG 3.25Å; E349-P361 WeakPolarHBondContact O-CG 3.44Å
350	K	74.2	Confident	77.7	Confident	188 Å²	188	60.1 Å²	60.1	82%	0.817	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-73.2	150.1	175	-67.8	177.1	-177.6	171.3	0	110.7	L352	K350-L352 PolarHBondContact O-N 3.36Å
351	P	79.2	Confident	78.5	Confident	52 Å²	52	59 Å²	59	34%	0.338	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-54.5	132.6	173.9	-25.6	34.6	0	0	0	112.3	Q353 V359 F360	P351-Q353 PolarHBondContact O-N 3.37Å; P351-V359 CarbonylContact C-O 3.44Å; P351-V359 VanDerWaalsContact CA-O 3.25Å; P351-V359 WeakPolarHBondContact CA-O 3.47Å; P351-F360 HydrophobicContact CB-CD1 3.84Å; P351-F360 HydrophobicContact CB-CE1 4.07Å; P351-F360 HydrophobicContact CB-CG 4.33Å; P351-F360 HydrophobicContact CG-CD1 3.58Å; P351-F360 HydrophobicContact CG-CE1 3.88Å; P351-F360 HydrophobicContact CG-CG 4.45Å
352	L	70.6	Confident	79.2	Confident	54 Å²	54	62.9 Å²	62.9	28%	0.283	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	107.3	179.3	178.8	67.5	0	0	0	109.4	P345 K350 S358 V359	P345-L352 HydrophobicContact CG-CB 4.23Å; K350-L352 PolarHBondContact O-N 3.36Å; L352-S358 CarbonylContact O-C 3.56Å; L352-S358 VanDerWaalsContact O-CA 3.31Å; L352-S358 WeakPolarHBondContact O-CA 3.38Å; L352-V359 HydrophobicContact CB-CB 4.47Å; L352-V359 PolarHBondContact N-O 3.13Å; L352-V359 PolarHBondContact O-N 3.38Å
353	Q	69.3	Low	79.7	Confident	139 Å²	139	62.3 Å²	62.3	65%	0.65	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	122.5	176.3	-62.9	-167.5	-25.7	0	0	111	P351	P351-Q353 PolarHBondContact O-N 3.37Å
354	A	62.2	Low	80.1	Confident	20 Å²	20	61.8 Å²	61.8	17%	0.165	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	79.2	-177.7	0	0	0	0	0	109.9	F342 R356 Y357	F342-A354 HydrophobicContact CD1-CB 4.42Å; F342-A354 HydrophobicContact CE1-CB 3.92Å; A354-R356 PolarHBondContact O-N 2.78Å; A354-R356 VanDerWaalsContact O-N 3.16Å; A354-Y357 PolarHBondContact N-O 3.01Å; A354-Y357 PolarHBondContact O-N 2.57Å; A354-Y357 VanDerWaalsContact O-N 3.15Å
355	G	68.1	Low	80.5	Confident	84 Å²	84	60.6 Å²	60.6	87%	0.866	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	-112	-175.7	0	0	0	0	0	111.7
356	R	79.8	Confident	81.1	Confident	52 Å²	52	63 Å²	63	20%	0.196	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-18.8	177.3	-67.8	-169	-58.1	100.5	4.2	113.9	A354 N368 S369 M371 D374	A354-R356 PolarHBondContact O-N 2.78Å; A354-R356 VanDerWaalsContact O-N 3.16Å; R356-N368 WeakPolarHBondContact CB-O 3.13Å; R356-N368 WeakPolarHBondContact CD-O 3.23Å; R356-N368 WeakPolarHBondContact CG-O 3.42Å; R356-N368 PolarHBondContact O-N 3.3Å; R356-S369 WeakPolarHBondContact CD-O 3.43Å; R356-S369 PolarHBondContact NH1-O 3.49Å; R356-M371 VanDerWaalsContact CZ-SD 3.57Å; R356-M371 PolarHBondContact NE-SD 2.77Å; R356-M371 VanDerWaalsContact NE-SD 3.37Å; R356-M371 PolarHBondContact NH2-SD 2.89Å; R356-D374 IonicContact CZ-OD1 3.79Å; R356-D374 IonicContact CZ-OD2 2.89Å; R356-D374 IonicContact NH1-OD1 3.22Å; R356-D374 IonicContact NH1-OD2 3.81Å; R356-D374 PolarHBondContact NH1-OD2 2.79Å; R356-D374 VanDerWaalsContact NH2-CG 3.33Å; R356-D374 IonicContact NH2-OD1 3.44Å; R356-D374 PolarHBondContact NH2-OD1 3.26Å; R356-D374 IonicContact NH2-OD2 2.63Å; R356-D374 PolarHBondContact NH2-OD2 2.91Å; R356-D374 VanDerWaalsContact NH2-OD2 3.09Å
357	Y	82.8	Confident	81.6	Confident	15 Å²	15	59.2 Å²	59.2	6%	0.059	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	143.1	-179.5	-55.6	-85.6	0	0	0	110.7	F342 A354 L365 F366 I367 D374	F342-Y357 HydrophobicContact CE1-CD2 4.43Å; F342-Y357 HydrophobicContact CE1-CG 4.38Å; F342-Y357 AromaticContact CE2-CD1 3.94Å; F342-Y357 HydrophobicContact CE2-CD1 3.94Å; F342-Y357 HydrophobicContact CE2-CD2 4.33Å; F342-Y357 HydrophobicContact CE2-CE1 4.41Å; F342-Y357 AromaticContact CE2-CG 3.9Å; F342-Y357 HydrophobicContact CE2-CG 3.9Å; F342-Y357 HydrophobicContact CZ-CD1 4.08Å; F342-Y357 AromaticContact CZ-CD2 3.65Å; F342-Y357 HydrophobicContact CZ-CD2 3.65Å; F342-Y357 HydrophobicContact CZ-CE2 4.21Å; F342-Y357 AromaticContact CZ-CG 3.58Å; F342-Y357 HydrophobicContact CZ-CG 3.58Å; A354-Y357 PolarHBondContact N-O 3.01Å; A354-Y357 PolarHBondContact O-N 2.57Å; A354-Y357 VanDerWaalsContact O-N 3.15Å; Y357-L365 HydrophobicContact CD1-CD1 4.32Å; Y357-F366 CarbonylContact C-O 3.51Å; Y357-F366 WeakPolarHBondContact CA-O 3.23Å; Y357-I367 HydrophobicContact CD1-CD1 4.23Å; Y357-I367 HydrophobicContact CD1-CG1 3.9Å; Y357-I367 HydrophobicContact CD1-CG2 4.21Å; Y357-I367 HydrophobicContact CE1-CD1 3.88Å; Y357-I367 HydrophobicContact CE1-CG1 4.04Å; Y357-I367 HydrophobicContact CE1-CG2 4.08Å; Y357-D374 PolarHBondContact OH-OD1 2.88Å
358	S	85.7	Confident	81.9	Confident	14 Å²	14	58.4 Å²	58.4	10%	0.098	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	128.9	170.9	-67.7	0	0	0	0	109.8	L352 F366	L352-S358 CarbonylContact O-C 3.56Å; L352-S358 VanDerWaalsContact O-CA 3.31Å; L352-S358 WeakPolarHBondContact O-CA 3.38Å; S358-F366 PolarHBondContact N-O 3.38Å; S358-F366 PolarHBondContact O-N 2.86Å
359	V	87.3	Confident	82	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.2	175.5	-175.7	0	0	0	0	110.3	F342 V344 P351 L352 T364 L365	F342-V359 HydrophobicContact CB-CG2 3.65Å; F342-V359 HydrophobicContact CG-CG2 4.26Å; V344-V359 HydrophobicContact CB-CG1 4.41Å; V344-V359 HydrophobicContact CG2-CG1 4.01Å; P351-V359 CarbonylContact C-O 3.44Å; P351-V359 VanDerWaalsContact CA-O 3.25Å; P351-V359 WeakPolarHBondContact CA-O 3.47Å; L352-V359 HydrophobicContact CB-CB 4.47Å; L352-V359 PolarHBondContact N-O 3.13Å; L352-V359 PolarHBondContact O-N 3.38Å; V359-T364 WeakPolarHBondContact CA-O 3.34Å; V359-L365 HydrophobicContact CG2-CD1 3.68Å
360	F	88.9	Confident	82.2	Confident	76 Å²	76	50.5 Å²	50.5	33%	0.333	28%	0.279	S	S	.	.			trans	-97.2	152.2	-176.7	-67.4	-93	0	0	0	111.5	P351 N362 G363 T364 F366	P351-F360 HydrophobicContact CB-CD1 3.84Å; P351-F360 HydrophobicContact CB-CE1 4.07Å; P351-F360 HydrophobicContact CB-CG 4.33Å; P351-F360 HydrophobicContact CG-CD1 3.58Å; P351-F360 HydrophobicContact CG-CE1 3.88Å; P351-F360 HydrophobicContact CG-CG 4.45Å; F360-N362 WeakPolarHBondContact CB-OD1 3.5Å; F360-N362 PolarHBondContact O-N 2.88Å; F360-N362 VanDerWaalsContact O-N 3.08Å; F360-G363 PolarHBondContact O-N 3.15Å; F360-T364 PolarHBondContact N-O 2.83Å; F360-F366 HydrophobicContact CE2-CB 3.95Å
361	P	87	Confident	82	Confident	37 Å²	37	45 Å²	45	24%	0.24	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-17	-178.5	-24.5	33.3	0	0	0	116	P345 K346 E349 G363	P345-P361 HydrophobicContact CB-CG 4.22Å; K346-P361 WeakPolarHBondContact O-CB 3.16Å; E349-P361 VanDerWaalsContact O-CG 3.25Å; E349-P361 WeakPolarHBondContact O-CG 3.44Å; P361-G363 PolarHBondContact O-N 2.88Å
362	N	88.9	Confident	81.3	Confident	92 Å²	92	44 Å²	44	49%	0.492	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-3.4	173.6	72	-29.4	0	0	0	113.5	F360 T364	F360-N362 WeakPolarHBondContact CB-OD1 3.5Å; F360-N362 PolarHBondContact O-N 2.88Å; F360-N362 VanDerWaalsContact O-N 3.08Å; N362-T364 PolarHBondContact ND2-OG1 3.01Å; N362-T364 WeakPolarHBondContact OD1-CB 3.5Å; N362-T364 PolarHBondContact OD1-N 2.89Å; N362-T364 VanDerWaalsContact OD1-N 3.08Å; N362-T364 PolarHBondContact OD1-OG1 3.27Å
363	G	89.4	Confident	81.2	Confident	2 Å²	2	45.2 Å²	45.2	2%	0.021	26%	0.262	C	S	.	.	S	Bend	trans	96.5	-6.4	-177.6	0	0	0	0	0	115.5	C323 W335 F360 P361 L365	C323-G363 WeakPolarHBondContact O-CA 3.4Å; W335-G363 PolarHBondContact NE1-O 3.42Å; F360-G363 PolarHBondContact O-N 3.15Å; P361-G363 PolarHBondContact O-N 2.88Å; G363-L365 PolarHBondContact O-N 3.25Å
364	T	93.7	Very high	81.5	Confident	17 Å²	17	38.6 Å²	38.6	10%	0.104	23%	0.231	C	C	.	.			trans	-67.7	125.3	178.5	-55.4	0	0	0	0	111.3	F321 D322 V359 F360 N362	F321-T364 CarbonylContact O-C 3.59Å; F321-T364 WeakPolarHBondContact O-CA 3.36Å; D322-T364 WeakPolarHBondContact OD1-CB 3.3Å; D322-T364 VanDerWaalsContact OD1-CG2 3.23Å; D322-T364 WeakPolarHBondContact OD1-CG2 3.39Å; D322-T364 PolarHBondContact OD1-OG1 2.97Å; V359-T364 WeakPolarHBondContact CA-O 3.34Å; F360-T364 PolarHBondContact N-O 2.83Å; N362-T364 PolarHBondContact ND2-OG1 3.01Å; N362-T364 WeakPolarHBondContact OD1-CB 3.5Å; N362-T364 PolarHBondContact OD1-N 2.89Å; N362-T364 VanDerWaalsContact OD1-N 3.08Å; N362-T364 PolarHBondContact OD1-OG1 3.27Å
365	L	93.9	Very high	82	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	127.1	162.2	170.5	66	0	0	0	108.9	S320 F321 W335 F342 Y357 V359 G363 F378	S320-L365 CarbonylContact C-O 3.52Å; S320-L365 VanDerWaalsContact CA-O 3.26Å; S320-L365 WeakPolarHBondContact CA-O 3.29Å; F321-L365 PolarHBondContact N-O 2.91Å; F321-L365 PolarHBondContact O-N 2.85Å; W335-L365 HydrophobicContact CB-CD2 4.24Å; W335-L365 HydrophobicContact CD2-CB 3.85Å; W335-L365 HydrophobicContact CD2-CD2 3.91Å; W335-L365 HydrophobicContact CE3-CD2 4.07Å; W335-L365 HydrophobicContact CG-CB 3.95Å; W335-L365 HydrophobicContact CG-CD2 4Å; W335-L365 HydrophobicContact CG-CG 4.48Å; W335-L365 HydrophobicContact CZ2-CB 4.11Å; F342-L365 HydrophobicContact CD2-CD1 4.37Å; Y357-L365 HydrophobicContact CD1-CD1 4.32Å; V359-L365 HydrophobicContact CG2-CD1 3.68Å; G363-L365 PolarHBondContact O-N 3.25Å; L365-F378 HydrophobicContact CD2-CD1 3.55Å; L365-F378 HydrophobicContact CD2-CE1 3.75Å
366	F	93	Very high	82.4	Confident	62 Å²	62	36.1 Å²	36.1	27%	0.272	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	139.2	174.6	-177.9	-105.4	0	0	0	110.4	H318 V319 Y357 S358 F360 N368	H318-F366 HydrophobicContact CB-CE2 4.09Å; H318-F366 HydrophobicContact CB-CZ 3.92Å; V319-F366 WeakPolarHBondContact O-CA 3.39Å; V319-F366 WeakPolarHBondContact O-CD2 3.38Å; Y357-F366 CarbonylContact C-O 3.51Å; Y357-F366 WeakPolarHBondContact CA-O 3.23Å; S358-F366 PolarHBondContact N-O 3.38Å; S358-F366 PolarHBondContact O-N 2.86Å; F360-F366 HydrophobicContact CE2-CB 3.95Å; F366-N368 HydrophobicContact CD1-CB 4.49Å; F366-N368 HydrophobicContact CE1-CB 3.87Å
367	I	90.3	Very high	82.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	117.8	174.6	-41.6	179.1	0	0	0	108.4	H318 V319 Y357 F378 L395	H318-I367 WeakPolarHBondContact CA-O 3.31Å; V319-I367 HydrophobicContact CG1-CB 3.89Å; V319-I367 HydrophobicContact CG1-CD1 3.8Å; V319-I367 HydrophobicContact CG1-CG1 3.89Å; V319-I367 PolarHBondContact N-O 2.85Å; V319-I367 VanDerWaalsContact N-O 3.15Å; V319-I367 PolarHBondContact O-N 3.14Å; Y357-I367 HydrophobicContact CD1-CD1 4.23Å; Y357-I367 HydrophobicContact CD1-CG1 3.9Å; Y357-I367 HydrophobicContact CD1-CG2 4.21Å; Y357-I367 HydrophobicContact CE1-CD1 3.88Å; Y357-I367 HydrophobicContact CE1-CG1 4.04Å; Y357-I367 HydrophobicContact CE1-CG2 4.08Å; I367-F378 HydrophobicContact CD1-CE1 3.88Å; I367-F378 HydrophobicContact CD1-CZ 3.63Å; I367-L395 HydrophobicContact CD1-CD2 4.19Å
368	N	85.1	Confident	83	Confident	98 Å²	98	37.2 Å²	37.2	52%	0.524	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	129.5	175.7	-167.7	11.9	0	0	0	110.6	R356 F366	R356-N368 WeakPolarHBondContact CB-O 3.13Å; R356-N368 WeakPolarHBondContact CD-O 3.23Å; R356-N368 WeakPolarHBondContact CG-O 3.42Å; R356-N368 PolarHBondContact O-N 3.3Å; F366-N368 HydrophobicContact CD1-CB 4.49Å; F366-N368 HydrophobicContact CE1-CB 3.87Å
369	S	79.8	Confident	83.3	Confident	55 Å²	55	38.1 Å²	38.1	39%	0.385	22%	0.217	S	C	.	.	S	Bend	trans	53.9	82.6	-174.4	-154	0	0	0	0	113	G316 G317 R356	G316-S369 PolarHBondContact O-OG 3.04Å; G317-S369 CarbonylContact O-C 3.54Å; G317-S369 WeakPolarHBondContact O-CA 3.41Å; G317-S369 PolarHBondContact O-N 3.45Å; G317-S369 VanDerWaalsContact O-N 3.08Å; R356-S369 WeakPolarHBondContact CD-O 3.43Å; R356-S369 PolarHBondContact NH1-O 3.49Å
370	T	77.1	Confident	83.6	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.012	22%	0.217	C	C	.	.			trans	-57	143.4	179.4	51.7	0	0	0	0	112.2	V313 P314 G316 G317 V319 I397	V313-T370 HydrophobicContact CG1-CG2 4.14Å; P314-T370 PolarHBondContact O-OG1 2.83Å; G316-T370 WeakPolarHBondContact CA-O 3.38Å; G316-T370 PolarHBondContact N-O 2.85Å; G316-T370 PolarHBondContact N-OG1 2.9Å; G316-T370 VanDerWaalsContact N-OG1 3.15Å; G317-T370 PolarHBondContact N-OG1 2.97Å; G317-T370 VanDerWaalsContact N-OG1 3.13Å; G317-T370 PolarHBondContact O-N 2.91Å; V319-T370 HydrophobicContact CG1-CG2 4.11Å; T370-I397 HydrophobicContact CG2-CD1 4.16Å
371	M	70.8	Confident	83.7	Confident	72 Å²	72	35.2 Å²	35.2	36%	0.355	20%	0.204	S	C	.	.			trans	-121.1	157.7	174.5	-68.4	-179.4	172.3	0	0	110.3	R356 S373 D374	R356-M371 VanDerWaalsContact CZ-SD 3.57Å; R356-M371 PolarHBondContact NE-SD 2.77Å; R356-M371 VanDerWaalsContact NE-SD 3.37Å; R356-M371 PolarHBondContact NH2-SD 2.89Å; M371-S373 WeakPolarHBondContact CB-OG 3.48Å; M371-S373 PolarHBondContact O-N 2.96Å; M371-S373 VanDerWaalsContact O-N 3.13Å; M371-D374 PolarHBondContact N-OD2 3.17Å; M371-D374 VanDerWaalsContact O-CB 3.3Å; M371-D374 WeakPolarHBondContact O-CB 3.28Å; M371-D374 PolarHBondContact O-N 2.9Å
372	L	64.5	Low	83.9	Confident	31 Å²	31	33.4 Å²	33.4	16%	0.162	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-61.5	-20.7	175	-77.1	162.3	0	0	0	113.3	L315 D374 I397 L435 F643	L315-L372 HydrophobicContact CD1-CG 4.03Å; L315-L372 HydrophobicContact CD2-CD1 4.22Å; L315-L372 HydrophobicContact CD2-CG 4.48Å; L372-D374 PolarHBondContact O-N 3.09Å; L372-I397 HydrophobicContact CD2-CB 4.11Å; L372-I397 HydrophobicContact CD2-CG2 3.93Å; L372-L435 HydrophobicContact CD1-CD1 3.88Å; L372-L435 HydrophobicContact CD1-CD2 4.17Å; L372-L435 HydrophobicContact CD2-CD1 3.95Å; L372-F643 HydrophobicContact CB-CZ 4.27Å; L372-F643 HydrophobicContact CD1-CE1 4.4Å; L372-F643 HydrophobicContact CD1-CZ 3.64Å
373	S	67.2	Low	83.7	Confident	79 Å²	79	29.1 Å²	29.1	55%	0.552	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-66.6	-16.7	170.2	54.7	0	0	0	0	114.7	M371	M371-S373 WeakPolarHBondContact CB-OG 3.48Å; M371-S373 PolarHBondContact O-N 2.96Å; M371-S373 VanDerWaalsContact O-N 3.13Å
374	D	77.1	Confident	83.4	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-94	-11.7	-174.3	-47.1	-16	0	0	0	111.5	H337 R356 Y357 M371 L372 G376 F378 L395	H337-D374 PolarHBondContact CE1-O 3.48Å; H337-D374 PolarHBondContact NE2-O 2.98Å; R356-D374 IonicContact CZ-OD1 3.79Å; R356-D374 IonicContact CZ-OD2 2.89Å; R356-D374 IonicContact NH1-OD1 3.22Å; R356-D374 IonicContact NH1-OD2 3.81Å; R356-D374 PolarHBondContact NH1-OD2 2.79Å; R356-D374 VanDerWaalsContact NH2-CG 3.33Å; R356-D374 IonicContact NH2-OD1 3.44Å; R356-D374 PolarHBondContact NH2-OD1 3.26Å; R356-D374 IonicContact NH2-OD2 2.63Å; R356-D374 PolarHBondContact NH2-OD2 2.91Å; R356-D374 VanDerWaalsContact NH2-OD2 3.09Å; Y357-D374 PolarHBondContact OH-OD1 2.88Å; M371-D374 PolarHBondContact N-OD2 3.17Å; M371-D374 VanDerWaalsContact O-CB 3.3Å; M371-D374 WeakPolarHBondContact O-CB 3.28Å; M371-D374 PolarHBondContact O-N 2.9Å; L372-D374 PolarHBondContact O-N 3.09Å; D374-G376 PolarHBondContact O-N 2.82Å; D374-F378 WeakPolarHBondContact O-CE2 3.31Å; D374-L395 HydrophobicContact CB-CD2 4.12Å
375	A	71.9	Confident	82.3	Confident	36 Å²	36	30.2 Å²	30.2	30%	0.298	17%	0.172	S	C	.	.			trans	-64	130.7	176.5	0	0	0	0	0	110.3	I397	A375-I397 HydrophobicContact CB-CG1 4Å
376	G	76	Confident	81.1	Confident	16 Å²	16	31.7 Å²	31.7	17%	0.165	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	143.7	-173.9	-175.4	0	0	0	0	0	113.6	D374 Q394 L395	D374-G376 PolarHBondContact O-N 2.82Å; G376-Q394 VanDerWaalsContact C-OE1 3.27Å; G376-Q394 VanDerWaalsContact CA-NE2 3.3Å; G376-L395 PolarHBondContact N-O 2.86Å; G376-L395 VanDerWaalsContact N-O 3.1Å; G376-L395 PolarHBondContact O-N 2.86Å
377	L	83.8	Confident	80.1	Confident	90 Å²	90	29.7 Å²	29.7	47%	0.471	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	136.3	-178.9	-157.4	71.6	0	0	0	111	H337 T392 Q394	H337-L377 PolarHBondContact ND1-O 3.38Å; L377-T392 HydrophobicContact CD2-CG2 3.98Å; L377-T392 HydrophobicContact CG-CG2 4.34Å; L377-Q394 HydrophobicContact CD1-CB 4.38Å
378	F	91.4	Very high	79.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	116.8	169	-72.8	-101.6	0	0	0	108.1	F321 W335 L336 H337 L365 I367 D374 T392 A393 L395	F321-F378 HydrophobicContact CD2-CD1 4.42Å; F321-F378 HydrophobicContact CD2-CD2 4.48Å; F321-F378 HydrophobicContact CD2-CG 4.28Å; F321-F378 HydrophobicContact CE2-CD1 4.47Å; F321-F378 AromaticContact CE2-CD2 3.83Å; F321-F378 HydrophobicContact CE2-CD2 3.83Å; F321-F378 HydrophobicContact CE2-CE2 4.05Å; F321-F378 HydrophobicContact CE2-CG 4.08Å; F321-F378 HydrophobicContact CE2-CZ 4.47Å; F321-F378 HydrophobicContact CZ-CD2 4.22Å; W335-F378 HydrophobicContact CE3-CB 4.32Å; W335-F378 HydrophobicContact CZ3-CB 4.2Å; L336-F378 CarbonylContact O-C 3.56Å; L336-F378 WeakPolarHBondContact O-CA 3.34Å; H337-F378 HydrophobicContact CB-CD1 3.62Å; H337-F378 HydrophobicContact CB-CE1 3.55Å; H337-F378 HydrophobicContact CB-CG 4.22Å; H337-F378 HydrophobicContact CB-CZ 4.08Å; H337-F378 AromaticContact CD2-CZ 3.84Å; H337-F378 AromaticContact CE1-CE2 3.57Å; H337-F378 AromaticContact CE1-CZ 3.68Å; H337-F378 AromaticContact CG-CD1 3.94Å; H337-F378 AromaticContact CG-CE1 3.52Å; H337-F378 AromaticContact CG-CE2 3.94Å; H337-F378 AromaticContact CG-CZ 3.51Å; H337-F378 AromaticContact ND1-CD2 3.66Å; H337-F378 AromaticContact ND1-CE1 3.81Å; H337-F378 AromaticContact ND1-CE2 3.34Å; H337-F378 VanDerWaalsContact ND1-CE2 3.34Å; H337-F378 WeakPolarHBondContact ND1-CE2 2.83Å; H337-F378 AromaticContact ND1-CG 4Å; H337-F378 AromaticContact ND1-CZ 3.42Å; H337-F378 WeakPolarHBondContact ND1-CZ 3.42Å; H337-F378 AromaticContact NE2-CZ 3.96Å; L365-F378 HydrophobicContact CD2-CD1 3.55Å; L365-F378 HydrophobicContact CD2-CE1 3.75Å; I367-F378 HydrophobicContact CD1-CE1 3.88Å; I367-F378 HydrophobicContact CD1-CZ 3.63Å; D374-F378 WeakPolarHBondContact O-CE2 3.31Å; F378-T392 VanDerWaalsContact O-CA 3.28Å; F378-T392 WeakPolarHBondContact O-CA 3.42Å; F378-A393 PolarHBondContact N-O 3.36Å; F378-A393 PolarHBondContact O-N 3.25Å; F378-L395 HydrophobicContact CD2-CB 4.05Å; F378-L395 HydrophobicContact CE2-CB 3.63Å; F378-L395 HydrophobicContact CE2-CD2 3.9Å; F378-L395 HydrophobicContact CE2-CG 4.43Å; F378-L395 HydrophobicContact CZ-CD2 4.24Å
379	E	92.7	Very high	79.9	Confident	34 Å²	34	29.6 Å²	29.6	16%	0.159	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123	172.1	178.5	-175.5	110.6	0	0	109.6	W335 L336 K390 S391 T392	W335-E379 CarbonylContact C-O 3.54Å; W335-E379 WeakPolarHBondContact CA-O 3.45Å; L336-E379 HydrophobicContact CB-CB 4.09Å; L336-E379 WeakPolarHBondContact CD1-OE1 3.21Å; L336-E379 PolarHBondContact N-O 2.88Å; L336-E379 PolarHBondContact O-N 2.83Å; E379-K390 HydrophobicContact CG-CB 4.33Å; E379-K390 HydrophobicContact CG-CG 4.37Å; E379-K390 IonicContact OE1-NZ 2.99Å; E379-K390 PolarHBondContact OE1-NZ 2.99Å; E379-K390 IonicContact OE2-NZ 2.63Å; E379-K390 PolarHBondContact OE2-NZ 3.25Å; E379-S391 CarbonylContact C-O 3.54Å; E379-S391 WeakPolarHBondContact CA-O 3.36Å; E379-T392 HydrophobicContact CB-CG2 3.95Å; E379-T392 HydrophobicContact CG-CG2 4.09Å
380	C	93.4	Very high	80.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.8	159.8	-172.9	0	0	0	0	109.5	F304 C323 V333 W335 K390 S391	F304-C380 HydrophobicContact CE1-CB 4.5Å; C323-C380 HydrophobicContact CB-CB 3.69Å; C323-C380 WeakPolarHBondContact CB-SG 3.4Å; C323-C380 WeakPolarHBondContact SG-CB 3.33Å; C323-C380 CovalentContact SG-SG 2.03Å; C323-C380 PolarHBondContact SG-SG 3.03Å; V333-C380 VanDerWaalsContact CG1-SG 3.55Å; W335-C380 HydrophobicContact CD2-CB 4.32Å; W335-C380 HydrophobicContact CE3-CB 3.97Å; W335-C380 HydrophobicContact CH2-CB 3.89Å; W335-C380 HydrophobicContact CZ2-CB 4.26Å; W335-C380 HydrophobicContact CZ3-CB 3.75Å; C380-K390 WeakPolarHBondContact O-CA 3.45Å; C380-S391 PolarHBondContact N-O 2.96Å; C380-S391 PolarHBondContact O-N 3.45Å
381	K	91.6	Very high	81.2	Confident	15 Å²	15	33.2 Å²	33.2	7%	0.065	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.9	-178.7	-173.5	-179.7	-176.7	-175.2	0	110.9	V333 R334 I388 V389 K390 E679	V333-K381 CarbonylContact C-O 3.6Å; V333-K381 WeakPolarHBondContact CA-O 3.42Å; R334-K381 HydrophobicContact CG-CB 4.31Å; R334-K381 PolarHBondContact N-O 3.5Å; R334-K381 PolarHBondContact O-N 2.82Å; K381-I388 HydrophobicContact CD-CG2 4.37Å; K381-I388 HydrophobicContact CG-CG2 4.17Å; K381-V389 WeakPolarHBondContact CA-O 3.46Å; K381-K390 HydrophobicContact CB-CG 4.47Å; K381-K390 HydrophobicContact CD-CG 4.44Å; K381-K390 HydrophobicContact CG-CG 4.06Å; K381-E679 VanDerWaalsContact CE-OE2 3.27Å; K381-E679 WeakPolarHBondContact CE-OE2 3.28Å; K381-E679 IonicContact NZ-OE1 2.65Å; K381-E679 PolarHBondContact NZ-OE1 2.82Å; K381-E679 IonicContact NZ-OE2 2.76Å; K381-E679 PolarHBondContact NZ-OE2 2.79Å
382	A	90.8	Very high	82.2	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.6	177.5	0	0	0	0	0	110.7	P302 T325 P331 S332 V333 I388 V389	P302-A382 HydrophobicContact CB-CB 4.4Å; T325-A382 HydrophobicContact CG2-CB 3.79Å; P331-A382 HydrophobicContact CB-CB 4.1Å; P331-A382 HydrophobicContact CG-CB 4.25Å; S332-A382 WeakPolarHBondContact O-CA 3.39Å; V333-A382 HydrophobicContact CG2-CB 4.12Å; A382-I388 WeakPolarHBondContact O-CA 3.49Å; A382-V389 HydrophobicContact CB-CG2 4.13Å; A382-V389 PolarHBondContact N-O 2.88Å; A382-V389 PolarHBondContact O-N 3.47Å
383	S	85.3	Confident	83.4	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.014	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	138.1	-170.8	-52.3	0	0	0	0	112.6	P331 S332 E679	P331-S383 WeakPolarHBondContact CA-O 3.45Å; S332-S383 PolarHBondContact N-O 3.17Å; S332-S383 PolarHBondContact O-N 3.27Å; S383-E679 PolarHBondContact OG-OE2 2.96Å
384	Q	81.4	Confident	84.3	Confident	6 Å²	6	29.7 Å²	29.7	3%	0.028	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	173.7	178.4	55.9	174.6	100.5	0	0	111.1	S300 P302 S328 P329 P331 A386 G387 I675 S676	S300-Q384 PolarHBondContact O-NE2 2.8Å; S300-Q384 PolarHBondContact O-OE1 2.85Å; P302-Q384 VanDerWaalsContact CA-OE1 3.28Å; P302-Q384 HydrophobicContact CB-CG 4.11Å; P302-Q384 VanDerWaalsContact CB-OE1 3.32Å; P302-Q384 HydrophobicContact CG-CG 3.88Å; P302-Q384 VanDerWaalsContact N-OE1 3.13Å; S328-Q384 PolarHBondContact O-NE2 2.91Å; P329-Q384 PolarHBondContact O-NE2 3.06Å; P331-Q384 HydrophobicContact CB-CB 4.21Å; P331-Q384 HydrophobicContact CB-CG 4.32Å; Q384-A386 PolarHBondContact O-N 3.1Å; Q384-A386 VanDerWaalsContact O-N 3.12Å; Q384-G387 PolarHBondContact N-O 3.02Å; Q384-G387 PolarHBondContact O-N 3.46Å; Q384-I675 CarbonylContact C-O 3.42Å; Q384-I675 WeakPolarHBondContact CA-O 3.25Å; Q384-I675 PolarHBondContact N-O 2.86Å; Q384-S676 WeakPolarHBondContact O-CA 3.49Å; Q384-S676 VanDerWaalsContact O-CB 3.27Å; Q384-S676 WeakPolarHBondContact O-CB 3.14Å
385	K	71.7	Confident	84.8	Confident	35 Å²	35	29.7 Å²	29.7	15%	0.152	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-39	178.3	-173.9	-179.7	-176.2	-159	0	113.3	I675 P677 Y838 D839 H924	K385-I675 PolarHBondContact N-O 3.31Å; K385-P677 WeakPolarHBondContact O-CD 3.49Å; K385-P677 WeakPolarHBondContact O-CG 3.42Å; K385-Y838 HydrophobicContact CB-CD2 3.95Å; K385-Y838 HydrophobicContact CB-CE2 4.08Å; K385-Y838 HydrophobicContact CB-CG 4.32Å; K385-Y838 HydrophobicContact CD-CD1 3.97Å; K385-Y838 HydrophobicContact CD-CE1 4.31Å; K385-Y838 HydrophobicContact CD-CG 4.15Å; K385-Y838 HydrophobicContact CG-CD1 4.07Å; K385-Y838 HydrophobicContact CG-CD2 3.89Å; K385-Y838 HydrophobicContact CG-CE2 4.37Å; K385-Y838 HydrophobicContact CG-CG 3.73Å; K385-D839 WeakPolarHBondContact CE-OD1 3.19Å; K385-D839 IonicContact NZ-OD1 2.76Å; K385-D839 PolarHBondContact NZ-OD1 2.59Å; K385-H924 WeakPolarHBondContact CE-CE1 3.47Å; K385-H924 PolarHBondContact NZ-CE1 2.87Å; K385-H924 VanDerWaalsContact NZ-CE1 3.27Å
386	A	68.1	Low	84.9	Confident	32 Å²	32	31.2 Å²	31.2	26%	0.264	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-6.3	-177.5	0	0	0	0	0	115	V299 Q384	V299-A386 HydrophobicContact CB-CB 4.26Å; V299-A386 HydrophobicContact CG2-CB 3.97Å; Q384-A386 PolarHBondContact O-N 3.1Å; Q384-A386 VanDerWaalsContact O-N 3.12Å
387	G	71.4	Confident	84.7	Confident	21 Å²	21	31.4 Å²	31.4	22%	0.216	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.4	-172.7	179.1	0	0	0	0	0	115.9	Q384	Q384-G387 PolarHBondContact N-O 3.02Å; Q384-G387 PolarHBondContact O-N 3.46Å
388	I	82.9	Confident	83.7	Confident	53 Å²	53	32.3 Å²	32.3	27%	0.272	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	136.5	179.8	-60.5	178.1	0	0	0	108.1	K381 A382 S678 E679	K381-I388 HydrophobicContact CD-CG2 4.37Å; K381-I388 HydrophobicContact CG-CG2 4.17Å; A382-I388 WeakPolarHBondContact O-CA 3.49Å; I388-S678 WeakPolarHBondContact CD1-OG 3.37Å; I388-E679 HydrophobicContact CD1-CG 4Å
389	V	88.5	Confident	82	Confident	42 Å²	42	34.4 Å²	34.4	26%	0.255	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	155.8	166.5	-66.3	0	0	0	0	111.7	P302 F304 K381 A382	P302-V389 HydrophobicContact CB-CG2 3.91Å; P302-V389 HydrophobicContact CG-CG1 4.29Å; P302-V389 HydrophobicContact CG-CG2 4.06Å; P302-V389 WeakPolarHBondContact O-CG1 3.46Å; P302-V389 WeakPolarHBondContact O-CG2 3.27Å; F304-V389 HydrophobicContact CD2-CB 4.4Å; F304-V389 HydrophobicContact CD2-CG2 4.05Å; F304-V389 HydrophobicContact CE2-CB 3.7Å; F304-V389 HydrophobicContact CE2-CG2 3.51Å; F304-V389 HydrophobicContact CZ-CB 4.31Å; F304-V389 HydrophobicContact CZ-CG2 3.84Å; K381-V389 WeakPolarHBondContact CA-O 3.46Å; A382-V389 HydrophobicContact CB-CG2 4.13Å; A382-V389 PolarHBondContact N-O 2.88Å; A382-V389 PolarHBondContact O-N 3.47Å
390	K	92	Very high	80.2	Confident	114 Å²	114	35 Å²	35	50%	0.496	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	143.4	-178.8	-69.2	163.5	164.5	-82.6	0	109.3	F304 E379 C380 K381	F304-K390 WeakPolarHBondContact CE2-O 3.46Å; E379-K390 HydrophobicContact CG-CB 4.33Å; E379-K390 HydrophobicContact CG-CG 4.37Å; E379-K390 IonicContact OE1-NZ 2.99Å; E379-K390 PolarHBondContact OE1-NZ 2.99Å; E379-K390 IonicContact OE2-NZ 2.63Å; E379-K390 PolarHBondContact OE2-NZ 3.25Å; C380-K390 WeakPolarHBondContact O-CA 3.45Å; K381-K390 HydrophobicContact CB-CG 4.47Å; K381-K390 HydrophobicContact CD-CG 4.44Å; K381-K390 HydrophobicContact CG-CG 4.06Å
391	S	92.4	Very high	78.5	Confident	20 Å²	20	37.6 Å²	37.6	14%	0.14	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	149.9	168.5	-177.6	0	0	0	0	108.4	F304 T307 E379 C380	F304-S391 VanDerWaalsContact CZ-CB 3.47Å; F304-S391 VanDerWaalsContact CZ-N 3.32Å; T307-S391 WeakPolarHBondContact CB-OG 3.4Å; T307-S391 WeakPolarHBondContact CG2-OG 3.48Å; E379-S391 CarbonylContact C-O 3.54Å; E379-S391 WeakPolarHBondContact CA-O 3.36Å; C380-S391 PolarHBondContact N-O 2.96Å; C380-S391 PolarHBondContact O-N 3.45Å
392	T	91.7	Very high	77.2	Confident	68 Å²	68	36.9 Å²	36.9	42%	0.417	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	136.2	-169.3	55	0	0	0	0	111.3	L377 F378 E379	L377-T392 HydrophobicContact CD2-CG2 3.98Å; L377-T392 HydrophobicContact CG-CG2 4.34Å; F378-T392 VanDerWaalsContact O-CA 3.28Å; F378-T392 WeakPolarHBondContact O-CA 3.42Å; E379-T392 HydrophobicContact CB-CG2 3.95Å; E379-T392 HydrophobicContact CG-CG2 4.09Å
393	A	90.7	Very high	76.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.3	172.2	0	0	0	0	0	111.1	P308 E309 D310 F321 F378	P308-A393 HydrophobicContact CB-CB 3.73Å; P308-A393 HydrophobicContact CG-CB 4.04Å; E309-A393 WeakPolarHBondContact O-CB 3.39Å; D310-A393 WeakPolarHBondContact OD1-CA 3.27Å; F321-A393 HydrophobicContact CD1-CB 3.98Å; F321-A393 HydrophobicContact CE1-CB 3.84Å; F378-A393 PolarHBondContact N-O 3.36Å; F378-A393 PolarHBondContact O-N 3.25Å
394	Q	85.5	Confident	75.9	Confident	39 Å²	39	37.1 Å²	37.1	18%	0.182	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	126.5	-179.5	179.3	62.6	37.4	0	0	110.5	D310 K311 G376 L377 F396	D310-Q394 WeakPolarHBondContact CA-O 3.47Å; D310-Q394 PolarHBondContact OD1-N 2.7Å; K311-Q394 PolarHBondContact N-O 3.18Å; G376-Q394 VanDerWaalsContact C-OE1 3.27Å; G376-Q394 VanDerWaalsContact CA-NE2 3.3Å; L377-Q394 HydrophobicContact CD1-CB 4.38Å; Q394-F396 HydrophobicContact CB-CE2 4.02Å; Q394-F396 HydrophobicContact CB-CZ 4.19Å; Q394-F396 HydrophobicContact CG-CD1 4.25Å; Q394-F396 HydrophobicContact CG-CD2 4.08Å; Q394-F396 HydrophobicContact CG-CE1 3.74Å; Q394-F396 HydrophobicContact CG-CE2 3.54Å; Q394-F396 HydrophobicContact CG-CG 4.41Å; Q394-F396 HydrophobicContact CG-CZ 3.36Å
395	L	87.2	Confident	76.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	120.8	166.7	-174	54.6	0	0	0	109.7	V319 F321 I367 D374 G376 F378 I397	V319-L395 HydrophobicContact CB-CD1 4.49Å; V319-L395 HydrophobicContact CG1-CD1 4.24Å; V319-L395 HydrophobicContact CG1-CD2 4.1Å; V319-L395 HydrophobicContact CG2-CD1 4.15Å; F321-L395 HydrophobicContact CE2-CB 4.24Å; F321-L395 HydrophobicContact CE2-CD1 4.43Å; F321-L395 HydrophobicContact CE2-CD2 4.41Å; F321-L395 HydrophobicContact CZ-CB 3.9Å; F321-L395 HydrophobicContact CZ-CD1 4.1Å; F321-L395 HydrophobicContact CZ-CG 4.45Å; I367-L395 HydrophobicContact CD1-CD2 4.19Å; D374-L395 HydrophobicContact CB-CD2 4.12Å; G376-L395 PolarHBondContact N-O 2.86Å; G376-L395 VanDerWaalsContact N-O 3.1Å; G376-L395 PolarHBondContact O-N 2.86Å; F378-L395 HydrophobicContact CD2-CB 4.05Å; F378-L395 HydrophobicContact CE2-CB 3.63Å; F378-L395 HydrophobicContact CE2-CD2 3.9Å; F378-L395 HydrophobicContact CE2-CG 4.43Å; F378-L395 HydrophobicContact CZ-CD2 4.24Å; L395-I397 HydrophobicContact CD1-CD1 4.41Å; L395-I397 HydrophobicContact CD2-CD1 4.15Å; L395-I397 HydrophobicContact CG-CD1 4.08Å
396	F	74.9	Confident	77	Confident	69 Å²	69	35.4 Å²	35.4	30%	0.303	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	135.8	165.8	-56.9	-82.4	0	0	0	109	D310 K311 T312 V313 Q394 V437	D310-F396 HydrophobicContact CB-CE2 4.42Å; K311-F396 PolarHBondContact O-N 2.67Å; T312-F396 WeakPolarHBondContact CA-O 3.4Å; T312-F396 HydrophobicContact CG2-CB 4.16Å; V313-F396 PolarHBondContact N-O 2.84Å; Q394-F396 HydrophobicContact CB-CE2 4.02Å; Q394-F396 HydrophobicContact CB-CZ 4.19Å; Q394-F396 HydrophobicContact CG-CD1 4.25Å; Q394-F396 HydrophobicContact CG-CD2 4.08Å; Q394-F396 HydrophobicContact CG-CE1 3.74Å; Q394-F396 HydrophobicContact CG-CE2 3.54Å; Q394-F396 HydrophobicContact CG-CG 4.41Å; Q394-F396 HydrophobicContact CG-CZ 3.36Å; F396-V437 HydrophobicContact CD1-CG1 4.48Å; F396-V437 HydrophobicContact CD1-CG2 3.92Å; F396-V437 HydrophobicContact CE1-CG2 4.37Å
397	I	71.1	Confident	78	Confident	20 Å²	20	34 Å²	34	10%	0.103	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.4	170.9	-60.1	-58.4	0	0	0	108.1	V313 L315 T370 L372 A375 L395 S399	V313-I397 CarbonylContact O-C 3.58Å; V313-I397 VanDerWaalsContact O-CA 3.28Å; V313-I397 WeakPolarHBondContact O-CA 3.48Å; L315-I397 HydrophobicContact CB-CG2 3.97Å; L315-I397 HydrophobicContact CD1-CG2 4.26Å; T370-I397 HydrophobicContact CG2-CD1 4.16Å; L372-I397 HydrophobicContact CD2-CB 4.11Å; L372-I397 HydrophobicContact CD2-CG2 3.93Å; A375-I397 HydrophobicContact CB-CG1 4Å; L395-I397 HydrophobicContact CD1-CD1 4.41Å; L395-I397 HydrophobicContact CD2-CD1 4.15Å; L395-I397 HydrophobicContact CG-CD1 4.08Å; I397-S399 PolarHBondContact O-N 2.8Å
398	E	64.3	Low	78.8	Confident	108 Å²	108	36.4 Å²	36.4	51%	0.505	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	131.6	-175.6	-161.7	177.2	-172.7	0	0	110.8	T312 V313 P314 V400	T312-E398 HydrophobicContact CG2-CB 3.96Å; T312-E398 HydrophobicContact CG2-CG 4.25Å; V313-E398 PolarHBondContact O-N 2.81Å; P314-E398 HydrophobicContact CB-CB 4.36Å; E398-V400 PolarHBondContact O-N 2.85Å
399	S	54.4	Low	79	Confident	45 Å²	45	34 Å²	34	32%	0.315	18%	0.179	S	C	.	.			trans	-82.9	110.7	-174.8	62	0	0	0	0	111.7	I397 V401 L435	I397-S399 PolarHBondContact O-N 2.8Å; S399-V401 PolarHBondContact O-N 3.02Å; S399-L435 WeakPolarHBondContact CB-O 3.2Å
400	V	55	Low	79	Confident	46 Å²	46	32 Å²	32	28%	0.279	17%	0.167	S	C	.	.			trans	-60.9	130	161.2	-175.6	0	0	0	0	108.3	E398 I402	E398-V400 PolarHBondContact O-N 2.85Å; V400-I402 HydrophobicContact CB-CG1 4.07Å; V400-I402 HydrophobicContact CG1-CG1 3.86Å; V400-I402 PolarHBondContact O-N 3.38Å; V400-I402 VanDerWaalsContact O-N 3.07Å
401	V	57.8	Low	78.9	Confident	55 Å²	55	26.6 Å²	26.6	33%	0.333	14%	0.143	S	C	.	.			trans	-78.2	89.3	172.7	-176.9	0	0	0	0	108.1	S399 S403 Y433 T434	S399-V401 PolarHBondContact O-N 3.02Å; V401-S403 PolarHBondContact O-N 2.88Å; V401-Y433 WeakPolarHBondContact CA-O 3.37Å; V401-T434 HydrophobicContact CG2-CG2 4.03Å
402	I	64.1	Low	78.8	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	119.3	-175.2	-61.2	-164.7	0	0	0	109.5	V400 L404 Q432 Y433 F591	V400-I402 HydrophobicContact CB-CG1 4.07Å; V400-I402 HydrophobicContact CG1-CG1 3.86Å; V400-I402 PolarHBondContact O-N 3.38Å; V400-I402 VanDerWaalsContact O-N 3.07Å; I402-L404 HydrophobicContact CG2-CD1 4.2Å; I402-L404 HydrophobicContact CG2-CG 4.07Å; I402-Q432 WeakPolarHBondContact O-CA 3.42Å; I402-Y433 PolarHBondContact N-O 2.86Å; I402-Y433 VanDerWaalsContact N-O 3.15Å; I402-Y433 PolarHBondContact O-N 2.79Å; I402-F591 HydrophobicContact CD1-CD1 4.02Å; I402-F591 HydrophobicContact CD1-CD2 4.13Å; I402-F591 HydrophobicContact CD1-CE1 3.57Å; I402-F591 HydrophobicContact CD1-CE2 3.71Å; I402-F591 HydrophobicContact CD1-CG 4.25Å; I402-F591 HydrophobicContact CD1-CZ 3.37Å; I402-F591 WeakPolarHBondContact CD1-O 3.19Å; I402-F591 HydrophobicContact CG1-CE2 4.39Å; I402-F591 HydrophobicContact CG1-CZ 4.06Å
403	S	72.3	Confident	78.5	Confident	7 Å²	7	28.5 Å²	28.5	5%	0.049	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	117.2	173.1	-62.4	0	0	0	0	109.8	V401	V401-S403 PolarHBondContact O-N 2.88Å
404	L	77.7	Confident	78	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.4	178.6	-83.8	161.3	0	0	0	110.4	I402 L431 Y433 T589 W597	I402-L404 HydrophobicContact CG2-CD1 4.2Å; I402-L404 HydrophobicContact CG2-CG 4.07Å; L404-L431 HydrophobicContact CB-CB 4.39Å; L404-L431 PolarHBondContact N-O 2.85Å; L404-L431 PolarHBondContact O-N 2.96Å; L404-Y433 HydrophobicContact CD1-CD2 4.19Å; L404-Y433 HydrophobicContact CD1-CE2 3.94Å; L404-T589 HydrophobicContact CD1-CG2 3.68Å; L404-T589 HydrophobicContact CD2-CG2 4.02Å; L404-W597 HydrophobicContact CD1-CZ2 4.45Å
405	P	87.3	Confident	77.9	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	144.7	171	30.7	-34.9	0	0	0	110.1	V496 V498 R507 T509 W597	P405-V496 HydrophobicContact CB-CG1 4.04Å; P405-V498 HydrophobicContact CB-CB 4.34Å; P405-V498 HydrophobicContact CB-CG2 3.85Å; P405-R507 HydrophobicContact CG-CB 4.32Å; P405-T509 HydrophobicContact CB-CG2 4.03Å; P405-T509 HydrophobicContact CG-CG2 4.17Å; P405-W597 PolarHBondContact O-NE1 2.8Å
406	L	87.6	Confident	77.8	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.016	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	130.6	172.6	171.4	65.4	0	0	0	109.4	E408 S428 T429 L431 L623 P635 I637	L406-E408 HydrophobicContact CD2-CG 4.29Å; L406-E408 HydrophobicContact CG-CG 4.48Å; L406-S428 CarbonylContact O-C 3.51Å; L406-S428 WeakPolarHBondContact O-CA 3.24Å; L406-S428 WeakPolarHBondContact O-CB 3.43Å; L406-T429 HydrophobicContact CB-CG2 3.89Å; L406-T429 HydrophobicContact CD2-CG2 3.9Å; L406-T429 HydrophobicContact CG-CG2 4.18Å; L406-T429 PolarHBondContact N-O 2.94Å; L406-T429 PolarHBondContact O-N 2.86Å; L406-L431 HydrophobicContact CB-CD1 4.3Å; L406-L431 HydrophobicContact CB-CG 4.15Å; L406-L431 HydrophobicContact CD2-CD1 4.03Å; L406-L431 HydrophobicContact CD2-CD2 4.11Å; L406-L431 HydrophobicContact CD2-CG 4.2Å; L406-L623 HydrophobicContact CD1-CD2 3.53Å; L406-P635 HydrophobicContact CD1-CG 4.39Å; L406-P635 HydrophobicContact CD2-CG 3.9Å; L406-I637 HydrophobicContact CD2-CD1 3.89Å
407	I	89.9	Confident	78.1	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	110.1	163.7	-67.1	165.6	0	0	0	107.1	G410 H427 V496 T509 W511 R625	I407-G410 VanDerWaalsContact CG2-CA 3.43Å; I407-G410 VanDerWaalsContact CG2-N 3.31Å; I407-H427 CarbonylContact C-O 3.5Å; I407-V496 HydrophobicContact CD1-CB 4.37Å; I407-V496 HydrophobicContact CD1-CG2 3.86Å; I407-V496 HydrophobicContact CG1-CB 4.17Å; I407-V496 HydrophobicContact CG1-CG2 3.64Å; I407-T509 HydrophobicContact CD1-CG2 4.08Å; I407-T509 HydrophobicContact CG1-CG2 3.96Å; I407-W511 HydrophobicContact CB-CE3 4.18Å; I407-W511 HydrophobicContact CD1-CB 3.75Å; I407-W511 HydrophobicContact CG2-CB 4.4Å; I407-W511 HydrophobicContact CG2-CD2 4.3Å; I407-W511 HydrophobicContact CG2-CE3 3.75Å; I407-W511 HydrophobicContact CG2-CZ3 4.37Å; I407-R625 PolarHBondContact O-NH2 3.41Å
408	E	87.5	Confident	78.8	Confident	70 Å²	70	37 Å²	37	33%	0.327	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	-46.7	178.2	-65.7	-168.5	178.5	0	0	111.2	L406 H427 T429 R625	L406-E408 HydrophobicContact CD2-CG 4.29Å; L406-E408 HydrophobicContact CG-CG 4.48Å; E408-H427 PolarHBondContact N-O 3.27Å; E408-T429 HydrophobicContact CG-CG2 3.89Å; E408-T429 WeakPolarHBondContact OE1-CG2 3.4Å; E408-R625 PolarHBondContact O-NH1 2.76Å
409	I	87.5	Confident	79.7	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.015	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	109	173.5	-59.2	179.8	0	0	0	107.9	P425 C426 H427 D536 L539 R634	I409-P425 HydrophobicContact CG2-CB 4.04Å; I409-P425 HydrophobicContact CG2-CG 3.95Å; I409-C426 CarbonylContact O-C 3.15Å; I409-C426 VanDerWaalsContact O-CA 3.32Å; I409-C426 WeakPolarHBondContact O-CA 3.38Å; I409-H427 HydrophobicContact CB-CB 4.4Å; I409-H427 PolarHBondContact N-O 2.63Å; I409-H427 PolarHBondContact O-N 3.08Å; I409-D536 WeakPolarHBondContact CD1-OD2 3.05Å; I409-L539 HydrophobicContact CG2-CD1 4.04Å; I409-R634 HydrophobicContact CD1-CG 4.04Å; I409-R634 HydrophobicContact CG1-CG 3.86Å
410	G	88.5	Confident	81.2	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.188	C	C	.	.			trans	-94.1	179.7	172.5	0	0	0	0	0	112.8	I407 Q412 P425	I407-G410 VanDerWaalsContact CG2-CA 3.43Å; I407-G410 VanDerWaalsContact CG2-N 3.31Å; G410-Q412 PolarHBondContact O-NE2 2.75Å; G410-P425 CarbonylContact C-O 3.49Å
411	P	90.8	Very high	82.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.			trans	-63.3	144.2	179.6	27.3	-36.1	0	0	0	111.2	L424 P425 W456 W511 S513	P411-L424 HydrophobicContact CB-CB 4.2Å; P411-P425 VanDerWaalsContact CD-O 3.29Å; P411-P425 WeakPolarHBondContact CD-O 3.37Å; P411-W456 HydrophobicContact CB-CH2 4.01Å; P411-W456 HydrophobicContact CB-CZ3 4.18Å; P411-W456 HydrophobicContact CG-CH2 3.95Å; P411-W456 HydrophobicContact CG-CZ3 3.96Å; P411-W511 VanDerWaalsContact CD-CD1 3.47Å; P411-W511 HydrophobicContact CG-CG 4.49Å; P411-W511 WeakPolarHBondContact CG-O 3.28Å; P411-W511 VanDerWaalsContact O-CD1 3.29Å; P411-W511 PolarHBondContact O-NE1 2.95Å; P411-S513 WeakPolarHBondContact O-CB 3.02Å
412	Q	88.4	Confident	84.1	Confident	9 Å²	9	33.5 Å²	33.5	4%	0.042	18%	0.18	C	C	.	.			trans	-108.5	155.9	-179.9	-54	-59	-42.6	0	0	109.9	G410 R414 S513 L539	G410-Q412 PolarHBondContact O-NE2 2.75Å; Q412-R414 PolarHBondContact O-N 2.79Å; Q412-S513 WeakPolarHBondContact O-CB 3.16Å; Q412-S513 PolarHBondContact O-OG 2.93Å; Q412-L539 HydrophobicContact CG-CD2 4.33Å
413	N	86.7	Confident	85.3	Confident	119 Å²	119	36.3 Å²	36.3	64%	0.636	20%	0.198	S	C	*	.			trans	-66.7	119.8	174.7	-70	-20.3	0	0	0	108.8	S513 F514	N413-S513 WeakPolarHBondContact OD1-CA 3.5Å; N413-S513 WeakPolarHBondContact OD1-CB 3.02Å; N413-F514 WeakPolarHBondContact CA-O 3.5Å; N413-F514 PolarHBondContact OD1-N 3.16Å
414	R	80.4	Confident	86.1	Confident	63 Å²	63	36.1 Å²	36.1	24%	0.238	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	143.9	-174.2	-73	-166.6	-179.7	-172.5	6.9	113	Q412 F416 F514 Q516	Q412-R414 PolarHBondContact O-N 2.79Å; R414-F416 HydrophobicContact CB-CD2 4.04Å; R414-F416 HydrophobicContact CB-CE2 3.57Å; R414-F416 HydrophobicContact CB-CZ 4.5Å; R414-F416 HydrophobicContact CG-CE2 4.39Å; R414-F514 PolarHBondContact N-O 3.47Å; R414-F514 VanDerWaalsContact N-O 3.11Å; R414-Q516 PolarHBondContact O-N 3.42Å
415	T	83.4	Confident	86.7	Confident	57 Å²	57	36.7 Å²	36.7	35%	0.35	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.2	170.5	-58.5	0	0	0	0	109.5	Q516 I518 Y528	T415-Q516 CarbonylContact C-O 3.6Å; T415-Q516 WeakPolarHBondContact CA-O 3.37Å; T415-Q516 HydrophobicContact CG2-CB 4.39Å; T415-Q516 HydrophobicContact CG2-CG 4.43Å; T415-I518 HydrophobicContact CG2-CD1 3.4Å; T415-I518 VanDerWaalsContact CG2-CD1 3.4Å; T415-I518 HydrophobicContact CG2-CG1 3.77Å; T415-Y528 HydrophobicContact CG2-CE1 3.94Å
416	F	83.6	Confident	86.9	Confident	29 Å²	29	36.7 Å²	36.7	13%	0.127	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	161.3	175.4	-71.3	-101	0	0	0	110.4	R414 M420 A422 L484 L515 Q516 V517 I518	R414-F416 HydrophobicContact CB-CD2 4.04Å; R414-F416 HydrophobicContact CB-CE2 3.57Å; R414-F416 HydrophobicContact CB-CZ 4.5Å; R414-F416 HydrophobicContact CG-CE2 4.39Å; F416-M420 HydrophobicContact CD1-CB 4.32Å; F416-M420 HydrophobicContact CD1-SD 4.28Å; F416-A422 HydrophobicContact CD1-CB 4.36Å; F416-A422 HydrophobicContact CD2-CB 4.3Å; F416-A422 HydrophobicContact CE1-CB 3.97Å; F416-A422 HydrophobicContact CE2-CB 3.87Å; F416-A422 HydrophobicContact CZ-CB 3.69Å; F416-L484 HydrophobicContact CB-CD1 3.46Å; F416-L484 VanDerWaalsContact CB-CD1 3.46Å; F416-L484 HydrophobicContact CD1-CD1 4Å; F416-L484 HydrophobicContact CD2-CD1 4.43Å; F416-L484 HydrophobicContact CG-CD1 3.76Å; F416-L515 HydrophobicContact CD2-CD1 3.39Å; F416-L515 HydrophobicContact CE2-CD1 3.65Å; F416-L515 HydrophobicContact CG-CD1 4.46Å; F416-Q516 PolarHBondContact N-O 2.68Å; F416-V517 WeakPolarHBondContact O-CA 3.44Å; F416-I518 PolarHBondContact O-N 3.23Å
417	F	82.8	Confident	87	Confident	63 Å²	63	39.4 Å²	39.4	28%	0.276	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	147.8	169.9	-66	-78.7	0	0	0	111.6	G419 M420 I518 Y528	F417-G419 PolarHBondContact O-N 2.8Å; F417-M420 HydrophobicContact CB-CE 4.13Å; F417-M420 HydrophobicContact CB-CG 4.27Å; F417-M420 HydrophobicContact CB-SD 3.97Å; F417-M420 HydrophobicContact CD2-CE 3.73Å; F417-M420 HydrophobicContact CD2-SD 4.12Å; F417-M420 HydrophobicContact CG-CE 4.4Å; F417-M420 WeakPolarHBondContact O-CB 3.5Å; F417-M420 WeakPolarHBondContact O-CG 3.37Å; F417-M420 PolarHBondContact O-N 3.47Å; F417-M420 VanDerWaalsContact O-N 3.15Å; F417-I518 CarbonylContact C-O 3.58Å; F417-I518 WeakPolarHBondContact CA-O 3.42Å; F417-Y528 HydrophobicContact CE2-CD1 4.03Å; F417-Y528 HydrophobicContact CE2-CE1 4.38Å; F417-Y528 HydrophobicContact CE2-CG 4.22Å; F417-Y528 HydrophobicContact CZ-CD1 4.13Å; F417-Y528 HydrophobicContact CZ-CD2 4.49Å; F417-Y528 HydrophobicContact CZ-CE1 4.05Å; F417-Y528 HydrophobicContact CZ-CE2 4.42Å; F417-Y528 HydrophobicContact CZ-CG 4.35Å
418	Q	85.4	Confident	86.9	Confident	95 Å²	95	40.9 Å²	40.9	44%	0.444	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	133.5	171.9	-179.2	177.5	-26.5	0	0	110.5	L484 V517 I518	Q418-L484 WeakPolarHBondContact CG-O 3.43Å; Q418-V517 HydrophobicContact CB-CG1 4.23Å; Q418-I518 PolarHBondContact N-O 3.38Å
419	G	83.1	Confident	86.7	Confident	50 Å²	50	39.5 Å²	39.5	52%	0.515	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.5	-15.4	-178.1	0	0	0	0	0	115.2	F417 L484	F417-G419 PolarHBondContact O-N 2.8Å; G419-L484 PolarHBondContact N-O 3.31Å
420	M	86.3	Confident	86.4	Confident	56 Å²	56	40.3 Å²	40.3	28%	0.276	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-67	166.9	173	-68.6	-176.1	163.4	0	0	112.2	F416 F417 A483 L484 P531	F416-M420 HydrophobicContact CD1-CB 4.32Å; F416-M420 HydrophobicContact CD1-SD 4.28Å; F417-M420 HydrophobicContact CB-CE 4.13Å; F417-M420 HydrophobicContact CB-CG 4.27Å; F417-M420 HydrophobicContact CB-SD 3.97Å; F417-M420 HydrophobicContact CD2-CE 3.73Å; F417-M420 HydrophobicContact CD2-SD 4.12Å; F417-M420 HydrophobicContact CG-CE 4.4Å; F417-M420 WeakPolarHBondContact O-CB 3.5Å; F417-M420 WeakPolarHBondContact O-CG 3.37Å; F417-M420 PolarHBondContact O-N 3.47Å; F417-M420 VanDerWaalsContact O-N 3.15Å; M420-A483 WeakPolarHBondContact O-CA 3.3Å; M420-A483 PolarHBondContact O-N 2.82Å; M420-L484 HydrophobicContact CB-CD1 4.15Å; M420-L484 WeakPolarHBondContact O-CG 3.3Å; M420-L484 PolarHBondContact O-N 2.91Å; M420-P531 HydrophobicContact CE-CG 3.73Å; M420-P531 HydrophobicContact SD-CG 4.34Å
421	V	86.8	Confident	85.7	Confident	74 Å²	74	40.6 Å²	40.6	45%	0.448	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-97.9	127	165.3	-178.4	0	0	0	0	107.8	Q480 I481	V421-Q480 HydrophobicContact CG1-CG 3.71Å; V421-I481 WeakPolarHBondContact CA-O 3.29Å
422	A	86.4	Confident	84.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	137.3	165.8	0	0	0	0	0	109.7	F416 Q480 I481 L484 L515	F416-A422 HydrophobicContact CD1-CB 4.36Å; F416-A422 HydrophobicContact CD2-CB 4.3Å; F416-A422 HydrophobicContact CE1-CB 3.97Å; F416-A422 HydrophobicContact CE2-CB 3.87Å; F416-A422 HydrophobicContact CZ-CB 3.69Å; A422-Q480 CarbonylContact O-C 3.56Å; A422-Q480 WeakPolarHBondContact O-CA 3.4Å; A422-I481 PolarHBondContact N-O 3.45Å; A422-I481 PolarHBondContact O-N 3.12Å; A422-L484 HydrophobicContact CB-CD1 3.85Å; A422-L484 HydrophobicContact CB-CD2 4.04Å; A422-L484 HydrophobicContact CB-CG 4.3Å; A422-L515 HydrophobicContact CB-CD1 4.5Å
423	T	88.5	Confident	83.4	Confident	60 Å²	60	41.2 Å²	41.2	37%	0.368	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	118.2	161.4	-56.2	0	0	0	0	107.6	L474 L479	T423-L474 HydrophobicContact CG2-CD1 4.02Å; T423-L479 CarbonylContact C-O 3.58Å; T423-L479 WeakPolarHBondContact CA-O 3.31Å
424	L	90	Very high	82	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	111	178.6	-60.6	-178.5	0	0	0	108.1	P411 W456 S478 L479 Y492	P411-L424 HydrophobicContact CB-CB 4.2Å; L424-W456 HydrophobicContact CB-CH2 3.64Å; L424-W456 HydrophobicContact CB-CZ2 4.43Å; L424-W456 HydrophobicContact CB-CZ3 4.09Å; L424-W456 HydrophobicContact CD1-CZ3 4.15Å; L424-S478 CarbonylContact O-C 3.59Å; L424-S478 VanDerWaalsContact O-CA 3.29Å; L424-S478 WeakPolarHBondContact O-CA 3.06Å; L424-S478 VanDerWaalsContact O-CB 3.32Å; L424-S478 WeakPolarHBondContact O-CB 3.01Å; L424-L479 HydrophobicContact CB-CB 4.37Å; L424-L479 HydrophobicContact CD1-CD2 4.48Å; L424-L479 PolarHBondContact N-O 2.94Å; L424-L479 PolarHBondContact O-N 2.95Å; L424-Y492 HydrophobicContact CD1-CD1 3.5Å; L424-Y492 VanDerWaalsContact CD1-CD1 3.5Å; L424-Y492 HydrophobicContact CD1-CD2 4.37Å; L424-Y492 HydrophobicContact CD1-CE1 4.25Å; L424-Y492 HydrophobicContact CD1-CG 3.58Å
425	P	90.7	Very high	80.8	Confident	13 Å²	13	34.7 Å²	34.7	8%	0.084	20%	0.199	C	C	.	.			trans	-67.9	144.5	-176.6	26.7	-33.6	0	0	0	111.7	I409 G410 P411 S478	I409-P425 HydrophobicContact CG2-CB 4.04Å; I409-P425 HydrophobicContact CG2-CG 3.95Å; G410-P425 CarbonylContact C-O 3.49Å; P411-P425 VanDerWaalsContact CD-O 3.29Å; P411-P425 WeakPolarHBondContact CD-O 3.37Å; P425-S478 WeakPolarHBondContact CA-OG 3.22Å
426	C	90.7	Very high	79.2	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.205	C	C	.	.			trans	-146	65.5	163.8	-169.5	0	0	0	0	110.3	I409 S428 W456 S478 C494	I409-C426 CarbonylContact O-C 3.15Å; I409-C426 VanDerWaalsContact O-CA 3.32Å; I409-C426 WeakPolarHBondContact O-CA 3.38Å; C426-S428 PolarHBondContact O-N 3Å; C426-W456 HydrophobicContact CB-CH2 4.2Å; C426-W456 HydrophobicContact CB-CZ2 3.52Å; C426-S478 PolarHBondContact N-OG 2.86Å; C426-C494 HydrophobicContact CB-CB 3.67Å; C426-C494 WeakPolarHBondContact CB-SG 3.22Å; C426-C494 WeakPolarHBondContact SG-CB 3.34Å; C426-C494 CovalentContact SG-SG 2.02Å; C426-C494 PolarHBondContact SG-SG 2.94Å
427	H	89.4	Confident	77.5	Confident	60 Å²	60	40.4 Å²	40.4	28%	0.278	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	123.3	178.7	-53.9	152.4	0	0	0	108.5	I407 E408 I409 S478	I407-H427 CarbonylContact C-O 3.5Å; E408-H427 PolarHBondContact N-O 3.27Å; I409-H427 HydrophobicContact CB-CB 4.4Å; I409-H427 PolarHBondContact N-O 2.63Å; I409-H427 PolarHBondContact O-N 3.08Å; H427-S478 PolarHBondContact CD2-OG 2.86Å; H427-S478 PolarHBondContact NE2-OG 3.06Å
428	S	87.4	Confident	75.6	Confident	35 Å²	35	41 Å²	41	25%	0.245	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	155.3	-170.9	51.6	0	0	0	0	113.2	L406 C426	L406-S428 CarbonylContact O-C 3.51Å; L406-S428 WeakPolarHBondContact O-CA 3.24Å; L406-S428 WeakPolarHBondContact O-CB 3.43Å; C426-S428 PolarHBondContact O-N 3Å
429	T	84.8	Confident	73.7	Confident	41 Å²	41	40.6 Å²	40.6	25%	0.252	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	166.7	-176.8	-168.2	0	0	0	0	110.9	L406 E408 L431	L406-T429 HydrophobicContact CB-CG2 3.89Å; L406-T429 HydrophobicContact CD2-CG2 3.9Å; L406-T429 HydrophobicContact CG-CG2 4.18Å; L406-T429 PolarHBondContact N-O 2.94Å; L406-T429 PolarHBondContact O-N 2.86Å; E408-T429 HydrophobicContact CG-CG2 3.89Å; E408-T429 WeakPolarHBondContact OE1-CG2 3.4Å; T429-L431 HydrophobicContact CG2-CD2 4.24Å
430	V	79.5	Confident	71.8	Confident	20 Å²	20	40 Å²	40	12%	0.121	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	120.1	172	-170.3	0	0	0	0	109.4	Q432 I452 V498	V430-Q432 HydrophobicContact CG1-CG 4.26Å; V430-Q432 PolarHBondContact O-N 2.87Å; V430-I452 HydrophobicContact CG2-CD1 3.75Å; V430-I452 HydrophobicContact CG2-CG1 3.53Å; V430-V498 HydrophobicContact CG1-CG1 4.29Å; V430-V498 HydrophobicContact CG2-CG2 3.8Å
431	L	75.4	Confident	70	Confident	7 Å²	7	38 Å²	38	4%	0.037	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	102.5	169.6	-56.3	-176.3	0	0	0	108.8	L404 L406 T429 Y433 W597 I637	L404-L431 HydrophobicContact CB-CB 4.39Å; L404-L431 PolarHBondContact N-O 2.85Å; L404-L431 PolarHBondContact O-N 2.96Å; L406-L431 HydrophobicContact CB-CD1 4.3Å; L406-L431 HydrophobicContact CB-CG 4.15Å; L406-L431 HydrophobicContact CD2-CD1 4.03Å; L406-L431 HydrophobicContact CD2-CD2 4.11Å; L406-L431 HydrophobicContact CD2-CG 4.2Å; T429-L431 HydrophobicContact CG2-CD2 4.24Å; L431-Y433 HydrophobicContact CB-CD2 4.25Å; L431-Y433 HydrophobicContact CB-CE2 3.57Å; L431-Y433 HydrophobicContact CD1-CE2 4.19Å; L431-Y433 WeakPolarHBondContact CD1-OH 3.49Å; L431-W597 HydrophobicContact CD1-CH2 4.49Å; L431-W597 HydrophobicContact CD1-CZ2 3.95Å; L431-I637 HydrophobicContact CD1-CD1 3.77Å; L431-I637 HydrophobicContact CD1-CG1 4.41Å; L431-I637 HydrophobicContact CD1-CG2 4.46Å; L431-I637 HydrophobicContact CD2-CD1 3.68Å; L431-I637 HydrophobicContact CG-CD1 4.39Å
432	Q	68.9	Low	68.2	Low	13 Å²	13	37.2 Å²	37.2	6%	0.061	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	132	168.1	-67.4	-172.8	1.9	0	0	110.4	I402 V430 T448 T450	I402-Q432 WeakPolarHBondContact O-CA 3.42Å; V430-Q432 HydrophobicContact CG1-CG 4.26Å; V430-Q432 PolarHBondContact O-N 2.87Å; Q432-T448 PolarHBondContact NE2-OG1 2.89Å; Q432-T448 PolarHBondContact OE1-OG1 2.96Å; Q432-T450 PolarHBondContact NE2-OG1 2.83Å
433	Y	62.3	Low	66.4	Low	9 Å²	9	42.6 Å²	42.6	4%	0.035	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	123.8	-178.7	-69.4	-72.2	0	0	0	111.8	V401 I402 L404 L431 L441 H621 I637	V401-Y433 WeakPolarHBondContact CA-O 3.37Å; I402-Y433 PolarHBondContact N-O 2.86Å; I402-Y433 VanDerWaalsContact N-O 3.15Å; I402-Y433 PolarHBondContact O-N 2.79Å; L404-Y433 HydrophobicContact CD1-CD2 4.19Å; L404-Y433 HydrophobicContact CD1-CE2 3.94Å; L431-Y433 HydrophobicContact CB-CD2 4.25Å; L431-Y433 HydrophobicContact CB-CE2 3.57Å; L431-Y433 HydrophobicContact CD1-CE2 4.19Å; L431-Y433 WeakPolarHBondContact CD1-OH 3.49Å; Y433-L441 HydrophobicContact CD1-CB 4.05Å; Y433-L441 HydrophobicContact CD1-CD1 3.88Å; Y433-L441 HydrophobicContact CD1-CD2 4.06Å; Y433-L441 HydrophobicContact CD1-CG 4.22Å; Y433-L441 HydrophobicContact CE1-CB 4.41Å; Y433-L441 HydrophobicContact CE1-CD1 3.85Å; Y433-H621 AromaticContact CD1-CE1 3.69Å; Y433-H621 AromaticContact CD2-CE1 3.34Å; Y433-H621 WeakPolarHBondContact CD2-CE1 3.46Å; Y433-H621 AromaticContact CD2-ND1 4Å; Y433-H621 AromaticContact CD2-NE2 3.81Å; Y433-H621 AromaticContact CE1-CE1 3.7Å; Y433-H621 AromaticContact CE1-ND1 3.72Å; Y433-H621 AromaticContact CE2-CE1 3.34Å; Y433-H621 WeakPolarHBondContact CE2-CE1 3.48Å; Y433-H621 AromaticContact CE2-ND1 3.51Å; Y433-H621 AromaticContact CE2-NE2 3.95Å; Y433-H621 AromaticContact CG-CE1 3.48Å; Y433-H621 VanDerWaalsContact CG-CE1 3.48Å; Y433-H621 AromaticContact CZ-CE1 3.5Å; Y433-H621 AromaticContact CZ-ND1 3.33Å; Y433-H621 VanDerWaalsContact CZ-ND1 3.33Å; Y433-I637 WeakPolarHBondContact OH-CG2 3.34Å
434	T	57.4	Low	64.4	Low	27 Å²	27	40.9 Å²	40.9	17%	0.166	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	127.2	162.4	43.7	0	0	0	0	109.9	V401 Q436 V442	V401-T434 HydrophobicContact CG2-CG2 4.03Å; T434-Q436 PolarHBondContact O-N 2.96Å; T434-V442 PolarHBondContact OG1-O 3.25Å
435	L	53.7	Low	62.1	Low	18 Å²	18	47.4 Å²	47.4	9%	0.094	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	111.5	168.9	-74.2	164.3	0	0	0	109.4	L372 S399 L441 F591 L641	L372-L435 HydrophobicContact CD1-CD1 3.88Å; L372-L435 HydrophobicContact CD1-CD2 4.17Å; L372-L435 HydrophobicContact CD2-CD1 3.95Å; S399-L435 WeakPolarHBondContact CB-O 3.2Å; L435-L441 HydrophobicContact CD2-CD2 4.25Å; L435-F591 HydrophobicContact CD1-CE1 3.59Å; L435-F591 HydrophobicContact CD1-CE2 4.29Å; L435-F591 HydrophobicContact CD1-CZ 3.31Å; L435-F591 HydrophobicContact CD2-CE2 4.08Å; L435-F591 HydrophobicContact CD2-CZ 3.91Å; L435-F591 HydrophobicContact CG-CE1 4.3Å; L435-F591 HydrophobicContact CG-CE2 4.1Å; L435-F591 HydrophobicContact CG-CZ 3.55Å; L435-L641 HydrophobicContact CD2-CD2 4.06Å
436	Q	50.4	Low	60	Low	101 Å²	101	50.6 Å²	50.6	47%	0.472	28%	0.281	S	S	.	.			trans	-89.8	152.2	164.8	-64.9	-162.6	-19.7	0	0	111.4	T434 S438 N439 S440 V442	T434-Q436 PolarHBondContact O-N 2.96Å; Q436-S438 PolarHBondContact O-N 2.79Å; Q436-N439 PolarHBondContact O-N 2.87Å; Q436-S440 PolarHBondContact N-O 3.1Å; Q436-V442 VanDerWaalsContact CD-CG2 3.41Å; Q436-V442 HydrophobicContact CG-CG2 4.05Å
437	V	47.1	Very low	57.7	Low	104 Å²	104	58.1 Å²	58.1	63%	0.63	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-19.8	-176.9	-171.3	0	0	0	0	113.5	F396 N439	F396-V437 HydrophobicContact CD1-CG1 4.48Å; F396-V437 HydrophobicContact CD1-CG2 3.92Å; F396-V437 HydrophobicContact CE1-CG2 4.37Å; V437-N439 VanDerWaalsContact C-N 3.34Å; V437-N439 PolarHBondContact O-N 3.02Å
438	S	43.2	Very low	55.7	Low	76 Å²	76	58.9 Å²	58.9	53%	0.531	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	10.7	177.7	60.3	0	0	0	0	115.2	Q436 S440	Q436-S438 PolarHBondContact O-N 2.79Å; S438-S440 PolarHBondContact O-N 2.75Å; S438-S440 VanDerWaalsContact O-N 3.13Å; S438-S440 VanDerWaalsContact OG-CB 3.26Å; S438-S440 WeakPolarHBondContact OG-CB 3.46Å; S438-S440 PolarHBondContact OG-N 3.38Å; S438-S440 PolarHBondContact OG-OG 3.47Å
439	N	46.7	Very low	54.2	Low	86 Å²	86	66.9 Å²	66.9	46%	0.46	36%	0.362	S	S	.	.	S	Bend	trans	54.6	20.2	-165.8	-73.5	-32.5	0	0	0	113.9	Q436 V437	Q436-N439 PolarHBondContact O-N 2.87Å; V437-N439 VanDerWaalsContact C-N 3.34Å; V437-N439 PolarHBondContact O-N 3.02Å
440	S	41.8	Very low	53.1	Low	38 Å²	38	66.5 Å²	66.5	27%	0.266	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-90.5	126.8	174.9	-56.3	0	0	0	0	109.2	Q436 S438 V442	Q436-S440 PolarHBondContact N-O 3.1Å; S438-S440 PolarHBondContact O-N 2.75Å; S438-S440 VanDerWaalsContact O-N 3.13Å; S438-S440 VanDerWaalsContact OG-CB 3.26Å; S438-S440 WeakPolarHBondContact OG-CB 3.46Å; S438-S440 PolarHBondContact OG-N 3.38Å; S438-S440 PolarHBondContact OG-OG 3.47Å; S440-V442 PolarHBondContact O-N 2.85Å
441	L	49.6	Very low	52.5	Low	15 Å²	15	70.2 Å²	70.2	8%	0.079	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	106.6	170.1	-65.9	174.2	0	0	0	107.4	Y433 L435 H443 L641	Y433-L441 HydrophobicContact CD1-CB 4.05Å; Y433-L441 HydrophobicContact CD1-CD1 3.88Å; Y433-L441 HydrophobicContact CD1-CD2 4.06Å; Y433-L441 HydrophobicContact CD1-CG 4.22Å; Y433-L441 HydrophobicContact CE1-CB 4.41Å; Y433-L441 HydrophobicContact CE1-CD1 3.85Å; L435-L441 HydrophobicContact CD2-CD2 4.25Å; L441-H443 PolarHBondContact O-N 2.59Å; L441-L641 HydrophobicContact CD1-CB 4.15Å; L441-L641 HydrophobicContact CG-CB 4.42Å
442	V	47.7	Very low	52.6	Low	57 Å²	57	72.7 Å²	72.7	35%	0.345	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	115	168.5	175.4	0	0	0	0	107.1	T434 Q436 S440 S444	T434-V442 PolarHBondContact OG1-O 3.25Å; Q436-V442 VanDerWaalsContact CD-CG2 3.41Å; Q436-V442 HydrophobicContact CG-CG2 4.05Å; S440-V442 PolarHBondContact O-N 2.85Å; V442-S444 VanDerWaalsContact C-N 3.33Å; V442-S444 PolarHBondContact O-N 2.85Å
443	H	48.5	Very low	53.3	Low	112 Å²	112	74.6 Å²	74.6	52%	0.519	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	97.1	166.5	-172.7	64.1	0	0	0	107.5	L441	L441-H443 PolarHBondContact O-N 2.59Å
444	S	47.4	Very low	54.5	Low	24 Å²	24	76.2 Å²	76.2	17%	0.168	43%	0.425	C	S	.	.			trans	-86.4	112.5	-177.4	51.9	0	0	0	0	109.2	V442 I446	V442-S444 VanDerWaalsContact C-N 3.33Å; V442-S444 PolarHBondContact O-N 2.85Å; S444-I446 PolarHBondContact O-N 3.08Å
445	N	40.9	Very low	56.1	Low	139 Å²	139	79.4 Å²	79.4	74%	0.743	44%	0.438	S	S	*	.			trans	-67.2	71.5	163.9	-72.6	16.8	0	0	0	109.1
446	I	46.5	Very low	57.9	Low	80 Å²	80	78.7 Å²	78.7	41%	0.41	43%	0.434	S	S	.	.			trans	-85.2	117.5	167.6	-48	-179.6	0	0	0	105.3	S444 T448	S444-I446 PolarHBondContact O-N 3.08Å; I446-T448 HydrophobicContact CG2-CG2 3.72Å; I446-T448 WeakPolarHBondContact CG2-OG1 3.21Å; I446-T448 PolarHBondContact O-N 3.2Å; I446-T448 PolarHBondContact O-OG1 2.87Å
447	D	42.8	Very low	59.9	Low	158 Å²	158	75.5 Å²	75.5	85%	0.845	42%	0.42	S	S	*	.			trans	-69.9	25.6	178.6	-60.4	-57.8	0	0	0	113.2	F449	D447-F449 PolarHBondContact O-N 2.95Å
448	T	48.6	Very low	61.9	Low	76 Å²	76	72.3 Å²	72.3	47%	0.466	40%	0.401	S	S	.	.			trans	-68.6	97.2	166.3	41.7	0	0	0	0	109.2	Q432 I446 T450	Q432-T448 PolarHBondContact NE2-OG1 2.89Å; Q432-T448 PolarHBondContact OE1-OG1 2.96Å; I446-T448 HydrophobicContact CG2-CG2 3.72Å; I446-T448 WeakPolarHBondContact CG2-OG1 3.21Å; I446-T448 PolarHBondContact O-N 3.2Å; I446-T448 PolarHBondContact O-OG1 2.87Å; T448-T450 VanDerWaalsContact C-N 3.27Å; T448-T450 PolarHBondContact O-N 2.83Å; T448-T450 PolarHBondContact O-OG1 2.97Å
449	F	55.1	Low	64	Low	204 Å²	204	72.6 Å²	72.6	90%	0.895	40%	0.396	S	S	*	.			trans	-50.5	93	163	-99.4	-99.5	0	0	0	109.9	D447 P451	D447-F449 PolarHBondContact O-N 2.95Å; F449-P451 WeakPolarHBondContact O-CD 3.14Å
450	T	61.4	Low	65.7	Low	32 Å²	32	75.1 Å²	75.1	20%	0.196	41%	0.41	C	S	.	.			trans	-87.4	110.4	171.6	20.9	0	0	0	0	105.7	Q432 T448 I452	Q432-T450 PolarHBondContact NE2-OG1 2.83Å; T448-T450 VanDerWaalsContact C-N 3.27Å; T448-T450 PolarHBondContact O-N 2.83Å; T448-T450 PolarHBondContact O-OG1 2.97Å; T450-I452 PolarHBondContact O-N 2.88Å
451	P	67.4	Low	67.8	Low	99 Å²	99	77.1 Å²	77.1	64%	0.643	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-67.7	120.4	-170.2	26.3	-33.6	0	0	0	110.3	F449	F449-P451 WeakPolarHBondContact O-CD 3.14Å
452	I	76.4	Confident	69.5	Low	59 Å²	59	80 Å²	80	30%	0.303	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	122	172.7	-55.5	179.4	0	0	0	108.1	V430 T450 V496 V498	V430-I452 HydrophobicContact CG2-CD1 3.75Å; V430-I452 HydrophobicContact CG2-CG1 3.53Å; T450-I452 PolarHBondContact O-N 2.88Å; I452-V496 HydrophobicContact CG2-CG1 3.36Å; I452-V498 HydrophobicContact CG1-CG2 4.25Å
453	A	85.4	Confident	71.3	Confident	53 Å²	53	78.9 Å²	78.9	44%	0.438	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.2	168.3	0	0	0	0	0	109.6	V496 E497	A453-V496 CarbonylContact O-C 3.5Å; A453-V496 WeakPolarHBondContact O-CA 3.37Å; A453-E497 HydrophobicContact CB-CB 4.37Å; A453-E497 PolarHBondContact N-O 3.49Å; A453-E497 PolarHBondContact O-N 2.93Å
454	T	87.3	Confident	72.5	Confident	42 Å²	42	76.2 Å²	76.2	26%	0.258	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.3	178.1	-56.5	0	0	0	0	110.1	C494 E495 V496	T454-C494 VanDerWaalsContact CG2-SG 3.58Å; T454-E495 WeakPolarHBondContact CA-O 3.38Å; T454-V496 HydrophobicContact CG2-CG2 4.26Å
455	Q	89.5	Confident	73.8	Confident	94 Å²	94	78.2 Å²	78.2	44%	0.439	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	157.6	174.2	69.1	179.6	5.7	0	0	111.5	E495	Q455-E495 HydrophobicContact CG-CB 3.9Å; Q455-E495 HydrophobicContact CG-CG 4.49Å; Q455-E495 PolarHBondContact N-O 3.45Å; Q455-E495 PolarHBondContact NE2-OE2 3.42Å; Q455-E495 PolarHBondContact O-N 2.86Å
456	W	92.8	Very high	75.5	Confident	4 Å²	4	76.9 Å²	76.9	2%	0.015	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.6	176	-76	84.6	0	0	0	111.1	P411 L424 C426 V463 G477 L479 T493 C494	P411-W456 HydrophobicContact CB-CH2 4.01Å; P411-W456 HydrophobicContact CB-CZ3 4.18Å; P411-W456 HydrophobicContact CG-CH2 3.95Å; P411-W456 HydrophobicContact CG-CZ3 3.96Å; L424-W456 HydrophobicContact CB-CH2 3.64Å; L424-W456 HydrophobicContact CB-CZ2 4.43Å; L424-W456 HydrophobicContact CB-CZ3 4.09Å; L424-W456 HydrophobicContact CD1-CZ3 4.15Å; C426-W456 HydrophobicContact CB-CH2 4.2Å; C426-W456 HydrophobicContact CB-CZ2 3.52Å; W456-V463 HydrophobicContact CB-CB 4.15Å; W456-V463 HydrophobicContact CB-CG2 3.84Å; W456-V463 WeakPolarHBondContact O-CG2 3.27Å; W456-V463 PolarHBondContact O-N 3.31Å; W456-G477 PolarHBondContact NE1-O 2.81Å; W456-L479 HydrophobicContact CB-CD1 4.39Å; W456-L479 HydrophobicContact CB-CD2 4.42Å; W456-L479 HydrophobicContact CD2-CB 3.68Å; W456-L479 HydrophobicContact CD2-CD1 4.5Å; W456-L479 HydrophobicContact CD2-CD2 4.04Å; W456-L479 HydrophobicContact CD2-CG 4.3Å; W456-L479 VanDerWaalsContact CE2-CB 3.49Å; W456-L479 HydrophobicContact CE3-CB 4.09Å; W456-L479 HydrophobicContact CE3-CD2 3.99Å; W456-L479 HydrophobicContact CG-CB 4.13Å; W456-L479 HydrophobicContact CG-CD1 4.1Å; W456-L479 HydrophobicContact CG-CD2 4.24Å; W456-L479 HydrophobicContact CG-CG 4.41Å; W456-L479 HydrophobicContact CH2-CB 4.09Å; W456-L479 HydrophobicContact CZ2-CB 3.69Å; W456-L479 HydrophobicContact CZ3-CB 4.28Å; W456-T493 CarbonylContact C-O 3.58Å; W456-T493 WeakPolarHBondContact CA-O 3.32Å; W456-C494 HydrophobicContact CD2-CB 4.04Å; W456-C494 HydrophobicContact CE3-CB 4.06Å; W456-C494 HydrophobicContact CH2-CB 3.78Å; W456-C494 HydrophobicContact CZ2-CB 3.73Å; W456-C494 HydrophobicContact CZ3-CB 3.93Å
457	L	91.3	Very high	76.9	Confident	34 Å²	34	77.6 Å²	77.6	18%	0.178	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	141.5	172.2	-46.9	172.5	0	0	0	108.9	S461 A462 T493	L457-S461 CarbonylContact C-O 3.58Å; L457-S461 WeakPolarHBondContact CA-O 2.99Å; L457-A462 HydrophobicContact CD2-CB 4.1Å; L457-T493 HydrophobicContact CD1-CG2 4.5Å; L457-T493 PolarHBondContact N-O 3.12Å; L457-T493 PolarHBondContact O-N 3.03Å
458	V	89.7	Confident	78.7	Confident	36 Å²	36	72.3 Å²	72.3	22%	0.218	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	115.7	171.9	175.7	0	0	0	0	107.9	D460 S461 V463 F491 Y492	V458-D460 VanDerWaalsContact C-N 3.28Å; V458-D460 PolarHBondContact O-N 3.31Å; V458-S461 PolarHBondContact N-O 3.16Å; V458-S461 WeakPolarHBondContact O-CB 3.48Å; V458-S461 PolarHBondContact O-N 3.05Å; V458-V463 HydrophobicContact CB-CG2 4.39Å; V458-V463 HydrophobicContact CG2-CG2 3.53Å; V458-F491 WeakPolarHBondContact CA-O 3.39Å; V458-Y492 HydrophobicContact CB-CE1 4.44Å; V458-Y492 HydrophobicContact CG1-CE1 4.33Å; V458-Y492 HydrophobicContact CG1-CE2 4.24Å; V458-Y492 HydrophobicContact CG2-CD1 3.52Å; V458-Y492 HydrophobicContact CG2-CE1 3.25Å; V458-Y492 HydrophobicContact CG2-CE2 4.47Å; V458-Y492 HydrophobicContact CG2-CG 4.23Å
459	N	87	Confident	80.4	Confident	82 Å²	82	74.3 Å²	74.3	44%	0.439	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.5	56.5	-170.3	-54.2	-40.5	0	0	0	110.6	S461 F491	N459-S461 PolarHBondContact O-N 3.27Å; N459-S461 PolarHBondContact O-OG 3.31Å; N459-F491 PolarHBondContact N-O 3.37Å; N459-F491 PolarHBondContact OD1-N 3.27Å
460	D	81.9	Confident	82.1	Confident	139 Å²	139	66 Å²	66	74%	0.743	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	6.4	-178.5	-49.1	-42.9	0	0	0	116.5	V458	V458-D460 VanDerWaalsContact C-N 3.28Å; V458-D460 PolarHBondContact O-N 3.31Å
461	S	87.6	Confident	83.4	Confident	80 Å²	80	65.1 Å²	65.1	56%	0.559	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.5	179	-57.5	0	0	0	0	111.6	L457 V458 N459	L457-S461 CarbonylContact C-O 3.58Å; L457-S461 WeakPolarHBondContact CA-O 2.99Å; V458-S461 PolarHBondContact N-O 3.16Å; V458-S461 WeakPolarHBondContact O-CB 3.48Å; V458-S461 PolarHBondContact O-N 3.05Å; N459-S461 PolarHBondContact O-N 3.27Å; N459-S461 PolarHBondContact O-OG 3.31Å
462	A	85.1	Confident	84.4	Confident	75 Å²	75	63.3 Å²	63.3	62%	0.62	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	135	-177	0	0	0	0	0	113.6	L457 S464	L457-A462 HydrophobicContact CD2-CB 4.1Å; A462-S464 PolarHBondContact O-N 3.02Å; A462-S464 VanDerWaalsContact O-N 3.11Å
463	V	84	Confident	85	Confident	34 Å²	34	63.3 Å²	63.3	21%	0.206	39%	0.392	C	S	.	.			trans	-74.1	101	-179.3	176.6	0	0	0	0	110.9	W456 V458 T465 V471 L479	W456-V463 HydrophobicContact CB-CB 4.15Å; W456-V463 HydrophobicContact CB-CG2 3.84Å; W456-V463 WeakPolarHBondContact O-CG2 3.27Å; W456-V463 PolarHBondContact O-N 3.31Å; V458-V463 HydrophobicContact CB-CG2 4.39Å; V458-V463 HydrophobicContact CG2-CG2 3.53Å; V463-T465 HydrophobicContact CG1-CG2 4.37Å; V463-T465 PolarHBondContact O-N 3.4Å; V463-V471 HydrophobicContact CG1-CG1 3.51Å; V463-L479 HydrophobicContact CG1-CD1 4.31Å
464	S	74.5	Confident	85.1	Confident	56 Å²	56	63.3 Å²	63.3	39%	0.392	39%	0.385	S	S	.	.			trans	-81.5	99.2	168.5	-176.6	0	0	0	0	110.7	A462 S466 S467	A462-S464 PolarHBondContact O-N 3.02Å; A462-S464 VanDerWaalsContact O-N 3.11Å; S464-S466 PolarHBondContact O-N 2.82Å; S464-S466 PolarHBondContact OG-OG 3.19Å; S464-S466 VanDerWaalsContact OG-OG 3.1Å; S464-S467 PolarHBondContact O-N 3.01Å; S464-S467 PolarHBondContact O-OG 2.69Å
465	T	74.7	Confident	84.9	Confident	66 Å²	66	70 Å²	70	41%	0.405	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.3	177.9	52.9	0	0	0	0	112.9	V463 S467 I473	V463-T465 HydrophobicContact CG1-CG2 4.37Å; V463-T465 PolarHBondContact O-N 3.4Å; T465-S467 VanDerWaalsContact C-N 3.3Å; T465-S467 PolarHBondContact O-N 2.92Å; T465-I473 HydrophobicContact CG2-CD1 4.21Å; T465-I473 HydrophobicContact CG2-CG1 4.11Å
466	S	75.7	Confident	84.6	Confident	111 Å²	111	68.4 Å²	68.4	78%	0.776	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-17	174.9	61.3	0	0	0	0	114	S464	S464-S466 PolarHBondContact O-N 2.82Å; S464-S466 PolarHBondContact OG-OG 3.19Å; S464-S466 VanDerWaalsContact OG-OG 3.1Å
467	S	76	Confident	84.2	Confident	95 Å²	95	68.5 Å²	68.5	66%	0.664	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-21.2	179.2	77.5	0	0	0	0	114.1	S464 T465	S464-S467 PolarHBondContact O-N 3.01Å; S464-S467 PolarHBondContact O-OG 2.69Å; T465-S467 VanDerWaalsContact C-N 3.3Å; T465-S467 PolarHBondContact O-N 2.92Å
468	N	82.3	Confident	84.1	Confident	48 Å²	48	67 Å²	67	26%	0.257	41%	0.413	S	S	.	.			trans	-141.7	93	-175.7	-179	9.6	0	0	0	110.5	R470 V471	N468-R470 PolarHBondContact ND2-NH2 2.98Å; N468-R470 PolarHBondContact O-N 2.66Å; N468-R470 WeakPolarHBondContact OD1-CB 3.5Å; N468-R470 PolarHBondContact OD1-NE 2.62Å; N468-V471 VanDerWaalsContact ND2-CG2 3.31Å; N468-V471 WeakPolarHBondContact ND2-CG2 3.39Å; N468-V471 PolarHBondContact O-N 3.16Å
469	P	84	Confident	84.2	Confident	118 Å²	118	65.3 Å²	65.3	77%	0.766	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-0	-173.4	28.7	-37	0	0	0	114.6	V471	P469-V471 VanDerWaalsContact C-N 3.35Å
470	R	90.1	Very high	84.4	Confident	30 Å²	30	63.9 Å²	63.9	11%	0.113	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-23.4	168.3	-61.2	-175	-55.4	125.5	2.5	112.7	N468 N482 A483 D488	N468-R470 PolarHBondContact ND2-NH2 2.98Å; N468-R470 PolarHBondContact O-N 2.66Å; N468-R470 WeakPolarHBondContact OD1-CB 3.5Å; N468-R470 PolarHBondContact OD1-NE 2.62Å; R470-N482 WeakPolarHBondContact CB-O 3.37Å; R470-N482 WeakPolarHBondContact CD-O 3.43Å; R470-N482 WeakPolarHBondContact O-CB 3.16Å; R470-N482 PolarHBondContact O-N 2.96Å; R470-N482 PolarHBondContact O-ND2 3.41Å; R470-A483 PolarHBondContact NH1-O 2.8Å; R470-D488 IonicContact CZ-OD1 2.68Å; R470-D488 IonicContact CZ-OD2 2.86Å; R470-D488 IonicContact NH1-OD1 2.61Å; R470-D488 IonicContact NH1-OD2 3.74Å; R470-D488 PolarHBondContact NH1-OD2 2.85Å; R470-D488 IonicContact NH2-OD1 3.25Å; R470-D488 PolarHBondContact NH2-OD1 3.06Å; R470-D488 IonicContact NH2-OD2 2.75Å; R470-D488 PolarHBondContact NH2-OD2 2.97Å
471	V	88.9	Confident	84.8	Confident	13 Å²	13	57.2 Å²	57.2	8%	0.079	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.1	-169.3	-179	0	0	0	0	109.4	V463 N468 P469 L479 Q480 I481	V463-V471 HydrophobicContact CG1-CG1 3.51Å; N468-V471 VanDerWaalsContact ND2-CG2 3.31Å; N468-V471 WeakPolarHBondContact ND2-CG2 3.39Å; N468-V471 PolarHBondContact O-N 3.16Å; P469-V471 VanDerWaalsContact C-N 3.35Å; V471-L479 HydrophobicContact CG1-CD1 3.63Å; V471-L479 HydrophobicContact CG1-CD2 4.33Å; V471-L479 HydrophobicContact CG1-CG 4.16Å; V471-Q480 WeakPolarHBondContact CA-O 3.47Å; V471-I481 HydrophobicContact CG2-CG1 4.41Å; V471-I481 HydrophobicContact CG2-CG2 4.16Å
472	V	89.3	Confident	84.8	Confident	60 Å²	60	55.8 Å²	55.8	36%	0.364	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	128	-173	-177.3	0	0	0	0	108.8	L474 Q480	V472-L474 HydrophobicContact CG1-CD2 4.33Å; V472-Q480 PolarHBondContact N-O 2.99Å; V472-Q480 PolarHBondContact O-N 3.09Å
473	I	87.4	Confident	85	Confident	59 Å²	59	54.8 Å²	54.8	30%	0.303	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.9	167.1	-59.8	169.6	0	0	0	106.9	T465 L479	T465-I473 HydrophobicContact CG2-CD1 4.21Å; T465-I473 HydrophobicContact CG2-CG1 4.11Å; I473-L479 HydrophobicContact CG1-CD1 3.6Å
474	L	88.3	Confident	85.2	Confident	54 Å²	54	53.2 Å²	53.2	28%	0.283	33%	0.326	S	S	.	.			trans	-81.5	159.1	179.8	-58.3	178.5	0	0	0	110.7	T423 V472 S476 G477 S478 Q480	T423-L474 HydrophobicContact CG2-CD1 4.02Å; V472-L474 HydrophobicContact CG1-CD2 4.33Å; L474-S476 PolarHBondContact O-N 2.92Å; L474-G477 PolarHBondContact O-N 3.44Å; L474-S478 WeakPolarHBondContact CB-O 3.37Å; L474-S478 WeakPolarHBondContact CG-O 3.39Å; L474-S478 PolarHBondContact N-O 2.03Å; L474-Q480 HydrophobicContact CD1-CB 4.3Å; L474-Q480 HydrophobicContact CD2-CB 4.29Å; L474-Q480 HydrophobicContact CG-CB 4.25Å
475	N	83.9	Confident	86	Confident	183 Å²	183	56.9 Å²	56.9	98%	0.979	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-16.6	176.9	-66.7	8.4	0	0	0	113.9	G477	N475-G477 VanDerWaalsContact C-N 3.3Å
476	S	82.2	Confident	86.6	Confident	59 Å²	59	56.8 Å²	56.8	41%	0.413	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	5.4	173.8	59.4	0	0	0	0	114.3	L474 S478	L474-S476 PolarHBondContact O-N 2.92Å; S476-S478 PolarHBondContact O-N 2.82Å; S476-S478 WeakPolarHBondContact OG-CB 3.43Å; S476-S478 PolarHBondContact OG-OG 2.88Å
477	G	85.1	Confident	87.2	Confident	7 Å²	7	56 Å²	56	7%	0.072	33%	0.325	C	S	.	.	S	Bend	trans	80.4	-16.6	-171.7	0	0	0	0	0	114.4	W456 L474 N475	W456-G477 PolarHBondContact NE1-O 2.81Å; L474-G477 PolarHBondContact O-N 3.44Å; N475-G477 VanDerWaalsContact C-N 3.3Å
478	S	89.7	Confident	87.9	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.021	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-68.8	143.1	-177.1	-53.6	0	0	0	0	113.2	L424 P425 C426 H427 L474 S476	L424-S478 CarbonylContact O-C 3.59Å; L424-S478 VanDerWaalsContact O-CA 3.29Å; L424-S478 WeakPolarHBondContact O-CA 3.06Å; L424-S478 VanDerWaalsContact O-CB 3.32Å; L424-S478 WeakPolarHBondContact O-CB 3.01Å; P425-S478 WeakPolarHBondContact CA-OG 3.22Å; C426-S478 PolarHBondContact N-OG 2.86Å; H427-S478 PolarHBondContact CD2-OG 2.86Å; H427-S478 PolarHBondContact NE2-OG 3.06Å; L474-S478 WeakPolarHBondContact CB-O 3.37Å; L474-S478 WeakPolarHBondContact CG-O 3.39Å; L474-S478 PolarHBondContact N-O 2.03Å; S476-S478 PolarHBondContact O-N 2.82Å; S476-S478 WeakPolarHBondContact OG-CB 3.43Å; S476-S478 PolarHBondContact OG-OG 2.88Å
479	L	90.8	Very high	88.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	122.1	179.7	-170.3	74.8	0	0	0	111.5	T423 L424 W456 V463 V471 I473 I481 Y492	T423-L479 CarbonylContact C-O 3.58Å; T423-L479 WeakPolarHBondContact CA-O 3.31Å; L424-L479 HydrophobicContact CB-CB 4.37Å; L424-L479 HydrophobicContact CD1-CD2 4.48Å; L424-L479 PolarHBondContact N-O 2.94Å; L424-L479 PolarHBondContact O-N 2.95Å; W456-L479 HydrophobicContact CB-CD1 4.39Å; W456-L479 HydrophobicContact CB-CD2 4.42Å; W456-L479 HydrophobicContact CD2-CB 3.68Å; W456-L479 HydrophobicContact CD2-CD1 4.5Å; W456-L479 HydrophobicContact CD2-CD2 4.04Å; W456-L479 HydrophobicContact CD2-CG 4.3Å; W456-L479 VanDerWaalsContact CE2-CB 3.49Å; W456-L479 HydrophobicContact CE3-CB 4.09Å; W456-L479 HydrophobicContact CE3-CD2 3.99Å; W456-L479 HydrophobicContact CG-CB 4.13Å; W456-L479 HydrophobicContact CG-CD1 4.1Å; W456-L479 HydrophobicContact CG-CD2 4.24Å; W456-L479 HydrophobicContact CG-CG 4.41Å; W456-L479 HydrophobicContact CH2-CB 4.09Å; W456-L479 HydrophobicContact CZ2-CB 3.69Å; W456-L479 HydrophobicContact CZ3-CB 4.28Å; V463-L479 HydrophobicContact CG1-CD1 4.31Å; V471-L479 HydrophobicContact CG1-CD1 3.63Å; V471-L479 HydrophobicContact CG1-CD2 4.33Å; V471-L479 HydrophobicContact CG1-CG 4.16Å; I473-L479 HydrophobicContact CG1-CD1 3.6Å; L479-I481 HydrophobicContact CD2-CD1 4.36Å; L479-I481 HydrophobicContact CD2-CG1 4.34Å; L479-I481 HydrophobicContact CG-CG1 4.43Å; L479-Y492 HydrophobicContact CD2-CD1 3.71Å; L479-Y492 HydrophobicContact CD2-CE1 3.84Å
480	Q	90.5	Very high	88.7	Confident	51 Å²	51	46.7 Å²	46.7	24%	0.238	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132.2	172.7	-173.3	173.6	-36.5	0	0	111.1	V421 A422 V471 V472 L474 N482	V421-Q480 HydrophobicContact CG1-CG 3.71Å; A422-Q480 CarbonylContact O-C 3.56Å; A422-Q480 WeakPolarHBondContact O-CA 3.4Å; V471-Q480 WeakPolarHBondContact CA-O 3.47Å; V472-Q480 PolarHBondContact N-O 2.99Å; V472-Q480 PolarHBondContact O-N 3.09Å; L474-Q480 HydrophobicContact CD1-CB 4.3Å; L474-Q480 HydrophobicContact CD2-CB 4.29Å; L474-Q480 HydrophobicContact CG-CB 4.25Å; Q480-N482 PolarHBondContact NE2-OD1 2.86Å
481	I	90.3	Very high	88.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	106.6	178.1	-49.8	172.9	0	0	0	108.5	V421 A422 V471 L479 L484 Y492 L515	V421-I481 WeakPolarHBondContact CA-O 3.29Å; A422-I481 PolarHBondContact N-O 3.45Å; A422-I481 PolarHBondContact O-N 3.12Å; V471-I481 HydrophobicContact CG2-CG1 4.41Å; V471-I481 HydrophobicContact CG2-CG2 4.16Å; L479-I481 HydrophobicContact CD2-CD1 4.36Å; L479-I481 HydrophobicContact CD2-CG1 4.34Å; L479-I481 HydrophobicContact CG-CG1 4.43Å; I481-L484 HydrophobicContact CB-CD2 3.95Å; I481-L484 HydrophobicContact CD1-CD2 4.39Å; I481-L484 HydrophobicContact CG2-CD2 3.68Å; I481-Y492 HydrophobicContact CD1-CD1 4.28Å; I481-Y492 HydrophobicContact CD1-CE1 3.4Å; I481-L515 HydrophobicContact CD1-CD2 3.83Å
482	N	89.3	Confident	89.1	Confident	49 Å²	49	50.6 Å²	50.6	26%	0.262	28%	0.281	S	S	.	.	S	Bend	trans	-82.8	133.3	-178.9	-62.5	-50	0	0	0	111.3	R470 Q480	R470-N482 WeakPolarHBondContact CB-O 3.37Å; R470-N482 WeakPolarHBondContact CD-O 3.43Å; R470-N482 WeakPolarHBondContact O-CB 3.16Å; R470-N482 PolarHBondContact O-N 2.96Å; R470-N482 PolarHBondContact O-ND2 3.41Å; Q480-N482 PolarHBondContact NE2-OD1 2.86Å
483	A	87.9	Confident	89.3	Confident	54 Å²	54	48.2 Å²	48.2	45%	0.446	27%	0.266	S	S	.	.	S	Bend	trans	51.3	72.6	-179.1	0	0	0	0	0	112.7	M420 R470	M420-A483 WeakPolarHBondContact O-CA 3.3Å; M420-A483 PolarHBondContact O-N 2.82Å; R470-A483 PolarHBondContact NH1-O 2.8Å
484	L	88.6	Confident	89.5	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	25%	0.252	C	S	.	.			trans	-53.4	143.4	177.7	-71.5	166.5	0	0	0	112.7	F416 Q418 G419 M420 A422 I481 D488 L515 V517	F416-L484 HydrophobicContact CB-CD1 3.46Å; F416-L484 VanDerWaalsContact CB-CD1 3.46Å; F416-L484 HydrophobicContact CD1-CD1 4Å; F416-L484 HydrophobicContact CD2-CD1 4.43Å; F416-L484 HydrophobicContact CG-CD1 3.76Å; Q418-L484 WeakPolarHBondContact CG-O 3.43Å; G419-L484 PolarHBondContact N-O 3.31Å; M420-L484 HydrophobicContact CB-CD1 4.15Å; M420-L484 WeakPolarHBondContact O-CG 3.3Å; M420-L484 PolarHBondContact O-N 2.91Å; A422-L484 HydrophobicContact CB-CD1 3.85Å; A422-L484 HydrophobicContact CB-CD2 4.04Å; A422-L484 HydrophobicContact CB-CG 4.3Å; I481-L484 HydrophobicContact CB-CD2 3.95Å; I481-L484 HydrophobicContact CD1-CD2 4.39Å; I481-L484 HydrophobicContact CG2-CD2 3.68Å; L484-D488 WeakPolarHBondContact CA-OD2 3.08Å; L484-D488 HydrophobicContact CD2-CB 4.31Å; L484-L515 HydrophobicContact CD2-CD2 4.08Å; L484-V517 HydrophobicContact CB-CG1 3.98Å; L484-V517 HydrophobicContact CB-CG2 4.22Å; L484-V517 HydrophobicContact CD1-CG2 4.42Å; L484-V517 HydrophobicContact CD2-CG2 4.08Å; L484-V517 HydrophobicContact CG-CG2 4.49Å
485	R	90.3	Very high	89.7	Confident	132 Å²	132	44.8 Å²	44.8	50%	0.498	25%	0.247	S	C	.	.			trans	-121.2	155.6	175.9	-60.9	173.2	-178.2	-174.9	-1.9	108.8	S487 D488 V517	R485-S487 VanDerWaalsContact CB-OG 3.27Å; R485-S487 WeakPolarHBondContact CB-OG 3.21Å; R485-S487 PolarHBondContact O-N 2.66Å; R485-S487 VanDerWaalsContact O-N 3.13Å; R485-D488 PolarHBondContact N-OD2 2.03Å; R485-D488 WeakPolarHBondContact O-CB 3.1Å; R485-D488 PolarHBondContact O-N 3.25Å; R485-V517 WeakPolarHBondContact O-CB 3.24Å; R485-V517 WeakPolarHBondContact O-CG1 3.33Å
486	V	87.6	Confident	89.9	Confident	65 Å²	65	36.1 Å²	36.1	39%	0.394	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-55.6	-32.3	172.8	-176	0	0	0	0	111.4	D488 T489 Q519	V486-D488 PolarHBondContact O-N 3.26Å; V486-T489 VanDerWaalsContact O-CB 3.25Å; V486-T489 WeakPolarHBondContact O-CB 3.19Å; V486-T489 PolarHBondContact O-N 3.18Å; V486-T489 VanDerWaalsContact O-N 3.11Å; V486-T489 PolarHBondContact O-OG1 2.95Å; V486-Q519 HydrophobicContact CG2-CG 3.73Å
487	S	88.9	Confident	90.2	Very high	95 Å²	95	36.2 Å²	36.2	66%	0.664	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-64.9	-13	173.6	61.8	0	0	0	0	115.5	R485 T489	R485-S487 VanDerWaalsContact CB-OG 3.27Å; R485-S487 WeakPolarHBondContact CB-OG 3.21Å; R485-S487 PolarHBondContact O-N 2.66Å; R485-S487 VanDerWaalsContact O-N 3.13Å; S487-T489 VanDerWaalsContact C-N 3.27Å
488	D	90.4	Very high	90	Very high	15 Å²	15	36 Å²	36	8%	0.08	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-91.8	10.2	175	-47	-31.9	0	0	0	111.2	R470 L484 R485 V486 Y492 V517	R470-D488 IonicContact CZ-OD1 2.68Å; R470-D488 IonicContact CZ-OD2 2.86Å; R470-D488 IonicContact NH1-OD1 2.61Å; R470-D488 IonicContact NH1-OD2 3.74Å; R470-D488 PolarHBondContact NH1-OD2 2.85Å; R470-D488 IonicContact NH2-OD1 3.25Å; R470-D488 PolarHBondContact NH2-OD1 3.06Å; R470-D488 IonicContact NH2-OD2 2.75Å; R470-D488 PolarHBondContact NH2-OD2 2.97Å; L484-D488 WeakPolarHBondContact CA-OD2 3.08Å; L484-D488 HydrophobicContact CD2-CB 4.31Å; R485-D488 PolarHBondContact N-OD2 2.03Å; R485-D488 WeakPolarHBondContact O-CB 3.1Å; R485-D488 PolarHBondContact O-N 3.25Å; V486-D488 PolarHBondContact O-N 3.26Å; D488-Y492 WeakPolarHBondContact O-CE2 3.33Å; D488-Y492 PolarHBondContact O-OH 2.97Å; D488-V517 HydrophobicContact CB-CG2 4.48Å
489	T	91.9	Very high	89.1	Confident	46 Å²	46	41.1 Å²	41.1	28%	0.282	22%	0.216	S	C	.	.			trans	-73.4	128.9	169.9	-61.3	0	0	0	0	109.9	V486 S487 F514 L515 V517	V486-T489 VanDerWaalsContact O-CB 3.25Å; V486-T489 WeakPolarHBondContact O-CB 3.19Å; V486-T489 PolarHBondContact O-N 3.18Å; V486-T489 VanDerWaalsContact O-N 3.11Å; V486-T489 PolarHBondContact O-OG1 2.95Å; S487-T489 VanDerWaalsContact C-N 3.27Å; T489-F514 HydrophobicContact CG2-CE1 4.31Å; T489-F514 HydrophobicContact CG2-CE2 4.44Å; T489-F514 HydrophobicContact CG2-CZ 3.73Å; T489-L515 VanDerWaalsContact CA-O 3.28Å; T489-L515 WeakPolarHBondContact CA-O 3.46Å; T489-V517 PolarHBondContact OG1-N 2.61Å
490	G	92	Very high	87.8	Confident	4 Å²	4	41.6 Å²	41.6	4%	0.041	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.8	-172.6	-179.7	0	0	0	0	0	114.2	F514 L515	G490-F514 WeakPolarHBondContact O-CD2 3.47Å; G490-L515 PolarHBondContact N-O 3.13Å; G490-L515 PolarHBondContact O-N 3.2Å
491	F	93.3	Very high	86.1	Confident	113 Å²	113	45.2 Å²	45.2	50%	0.496	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	127.9	173.3	-67.2	-79.3	0	0	0	110.6	V458 N459 T512 S513 F514	V458-F491 WeakPolarHBondContact CA-O 3.39Å; N459-F491 PolarHBondContact N-O 3.37Å; N459-F491 PolarHBondContact OD1-N 3.27Å; F491-T512 HydrophobicContact CB-CG2 4.02Å; F491-T512 HydrophobicContact CD1-CG2 4.03Å; F491-T512 HydrophobicContact CG-CG2 4.46Å; F491-S513 WeakPolarHBondContact CA-O 3.34Å; F491-F514 HydrophobicContact CD1-CB 4.27Å; F491-F514 AromaticContact CD1-CD2 3.92Å; F491-F514 HydrophobicContact CD1-CD2 3.92Å; F491-F514 HydrophobicContact CD2-CD2 4.23Å; F491-F514 HydrophobicContact CE1-CB 4.12Å; F491-F514 AromaticContact CE1-CD2 3.73Å; F491-F514 HydrophobicContact CE1-CD2 3.73Å; F491-F514 HydrophobicContact CE1-CG 4.34Å; F491-F514 HydrophobicContact CE2-CD2 4.05Å; F491-F514 HydrophobicContact CE2-CE2 4.26Å; F491-F514 HydrophobicContact CG-CD2 4.17Å; F491-F514 AromaticContact CZ-CD2 3.8Å; F491-F514 HydrophobicContact CZ-CD2 3.8Å; F491-F514 HydrophobicContact CZ-CE2 4.32Å
492	Y	93.4	Very high	84.4	Confident	12 Å²	12	48.9 Å²	48.9	5%	0.047	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	113.5	178.7	-77.8	-102.1	0	0	0	108.9	L424 V458 L479 I481 D488 T512 S513 L515	L424-Y492 HydrophobicContact CD1-CD1 3.5Å; L424-Y492 VanDerWaalsContact CD1-CD1 3.5Å; L424-Y492 HydrophobicContact CD1-CD2 4.37Å; L424-Y492 HydrophobicContact CD1-CE1 4.25Å; L424-Y492 HydrophobicContact CD1-CG 3.58Å; V458-Y492 HydrophobicContact CB-CE1 4.44Å; V458-Y492 HydrophobicContact CG1-CE1 4.33Å; V458-Y492 HydrophobicContact CG1-CE2 4.24Å; V458-Y492 HydrophobicContact CG2-CD1 3.52Å; V458-Y492 HydrophobicContact CG2-CE1 3.25Å; V458-Y492 HydrophobicContact CG2-CE2 4.47Å; V458-Y492 HydrophobicContact CG2-CG 4.23Å; L479-Y492 HydrophobicContact CD2-CD1 3.71Å; L479-Y492 HydrophobicContact CD2-CE1 3.84Å; I481-Y492 HydrophobicContact CD1-CD1 4.28Å; I481-Y492 HydrophobicContact CD1-CE1 3.4Å; D488-Y492 WeakPolarHBondContact O-CE2 3.33Å; D488-Y492 PolarHBondContact O-OH 2.97Å; Y492-T512 CarbonylContact O-C 3.54Å; Y492-T512 WeakPolarHBondContact O-CA 3.24Å; Y492-S513 PolarHBondContact N-O 3.1Å; Y492-S513 PolarHBondContact O-N 3.25Å; Y492-L515 HydrophobicContact CD2-CB 3.6Å; Y492-L515 HydrophobicContact CD2-CD2 4.12Å; Y492-L515 HydrophobicContact CE2-CB 3.72Å; Y492-L515 HydrophobicContact CE2-CD2 3.61Å; Y492-L515 HydrophobicContact CE2-CG 4.24Å
493	T	93.3	Very high	82.7	Confident	10 Å²	10	48.6 Å²	48.6	6%	0.061	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	120.5	177.6	-55.4	0	0	0	0	109	W456 L457 W511 T512	W456-T493 CarbonylContact C-O 3.58Å; W456-T493 WeakPolarHBondContact CA-O 3.32Å; L457-T493 HydrophobicContact CD1-CG2 4.5Å; L457-T493 PolarHBondContact N-O 3.12Å; L457-T493 PolarHBondContact O-N 3.03Å; T493-W511 WeakPolarHBondContact CA-O 3.29Å; T493-T512 WeakPolarHBondContact OG1-CG2 3.32Å; T493-T512 PolarHBondContact OG1-OG1 3.26Å
494	C	93.1	Very high	81	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	134.5	158.6	-174.9	0	0	0	0	108.4	C426 T454 W456 S510 W511	C426-C494 HydrophobicContact CB-CB 3.67Å; C426-C494 WeakPolarHBondContact CB-SG 3.22Å; C426-C494 WeakPolarHBondContact SG-CB 3.34Å; C426-C494 CovalentContact SG-SG 2.02Å; C426-C494 PolarHBondContact SG-SG 2.94Å; T454-C494 VanDerWaalsContact CG2-SG 3.58Å; W456-C494 HydrophobicContact CD2-CB 4.04Å; W456-C494 HydrophobicContact CE3-CB 4.06Å; W456-C494 HydrophobicContact CH2-CB 3.78Å; W456-C494 HydrophobicContact CZ2-CB 3.73Å; W456-C494 HydrophobicContact CZ3-CB 3.93Å; C494-S510 CarbonylContact O-C 2.98Å; C494-S510 WeakPolarHBondContact O-CA 3.25Å; C494-S510 WeakPolarHBondContact O-CB 3.32Å; C494-W511 PolarHBondContact N-O 3.39Å; C494-W511 PolarHBondContact O-N 2.95Å
495	E	91.1	Very high	79.8	Confident	41 Å²	41	55.5 Å²	55.5	19%	0.192	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.8	169.1	-179.6	175.2	-161.1	0	0	110.1	T454 Q455 S508	T454-E495 WeakPolarHBondContact CA-O 3.38Å; Q455-E495 HydrophobicContact CG-CB 3.9Å; Q455-E495 HydrophobicContact CG-CG 4.49Å; Q455-E495 PolarHBondContact N-O 3.45Å; Q455-E495 PolarHBondContact NE2-OE2 3.42Å; Q455-E495 PolarHBondContact O-N 2.86Å; E495-S508 VanDerWaalsContact OE1-CB 3.32Å; E495-S508 WeakPolarHBondContact OE1-CB 3.44Å; E495-S508 PolarHBondContact OE1-OG 2.94Å
496	V	89.4	Confident	78.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	114.7	-171.8	176.2	0	0	0	0	108.7	P405 I407 I452 A453 T454 S508 T509	P405-V496 HydrophobicContact CB-CG1 4.04Å; I407-V496 HydrophobicContact CD1-CB 4.37Å; I407-V496 HydrophobicContact CD1-CG2 3.86Å; I407-V496 HydrophobicContact CG1-CB 4.17Å; I407-V496 HydrophobicContact CG1-CG2 3.64Å; I452-V496 HydrophobicContact CG2-CG1 3.36Å; A453-V496 CarbonylContact O-C 3.5Å; A453-V496 WeakPolarHBondContact O-CA 3.37Å; T454-V496 HydrophobicContact CG2-CG2 4.26Å; V496-S508 CarbonylContact O-C 3.54Å; V496-S508 WeakPolarHBondContact O-CA 3.33Å; V496-T509 HydrophobicContact CB-CG2 4.32Å; V496-T509 PolarHBondContact N-O 3Å; V496-T509 PolarHBondContact O-N 3.24Å
497	E	87.5	Confident	78.4	Confident	62 Å²	62	53.3 Å²	53.3	29%	0.29	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	137	-177.3	-173.9	-177.9	-129.5	0	0	110.8	A453 R506 R507	A453-E497 HydrophobicContact CB-CB 4.37Å; A453-E497 PolarHBondContact N-O 3.49Å; A453-E497 PolarHBondContact O-N 2.93Å; E497-R506 HydrophobicContact CG-CB 4.42Å; E497-R506 WeakPolarHBondContact OE1-CD 3.33Å; E497-R506 IonicContact OE1-CZ 2.71Å; E497-R506 IonicContact OE1-NE 2.79Å; E497-R506 IonicContact OE1-NH1 3.83Å; E497-R506 PolarHBondContact OE1-NH1 3.47Å; E497-R506 IonicContact OE2-NH1 3.81Å; E497-R506 PolarHBondContact OE2-NH1 2.86Å; E497-R507 WeakPolarHBondContact CA-O 3.22Å
498	V	80.5	Confident	78.3	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.018	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	133.9	171.1	168.1	0	0	0	0	108.8	P405 V430 I452 R507	P405-V498 HydrophobicContact CB-CB 4.34Å; P405-V498 HydrophobicContact CB-CG2 3.85Å; V430-V498 HydrophobicContact CG1-CG1 4.29Å; V430-V498 HydrophobicContact CG2-CG2 3.8Å; I452-V498 HydrophobicContact CG1-CG2 4.25Å; V498-R507 PolarHBondContact N-O 3.11Å; V498-R507 PolarHBondContact O-N 3.44Å; V498-R507 VanDerWaalsContact O-N 3.09Å
499	Q	71	Confident	78.2	Confident	110 Å²	110	50 Å²	50	51%	0.514	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.5	173.5	-174.4	172.5	-10	0	0	109.8
500	D	63.1	Low	78.1	Confident	9 Å²	9	51.1 Å²	51.1	5%	0.048	28%	0.28	C	S	.	.			trans	-68.2	142.3	173.1	177	7.1	0	0	0	110.3	S502 S503	D500-S502 VanDerWaalsContact CG-OG 3.31Å; D500-S502 WeakPolarHBondContact OD1-CB 3.19Å; D500-S502 PolarHBondContact OD1-N 2.9Å; D500-S502 PolarHBondContact OD1-OG 2.78Å; D500-S502 PolarHBondContact OD2-OG 3.01Å; D500-S502 VanDerWaalsContact OD2-OG 3.11Å; D500-S503 VanDerWaalsContact O-O 3.06Å; D500-S503 VanDerWaalsContact OD2-CB 3.29Å; D500-S503 WeakPolarHBondContact OD2-CB 3.17Å; D500-S503 PolarHBondContact OD2-N 3.03Å; D500-S503 PolarHBondContact OD2-OG 3.09Å
501	S	55.7	Low	78.1	Confident	127 Å²	127	52.4 Å²	52.4	89%	0.888	28%	0.284	S	S	*	.	S	Bend	trans	-86.6	-20.5	177.5	59.6	0	0	0	0	112.9
502	S	53.8	Low	77.9	Confident	78 Å²	78	50.4 Å²	50.4	55%	0.545	28%	0.281	S	S	.	.	S	Bend	trans	-94.4	-27.6	-178.8	72.6	0	0	0	0	113.3	D500	D500-S502 VanDerWaalsContact CG-OG 3.31Å; D500-S502 WeakPolarHBondContact OD1-CB 3.19Å; D500-S502 PolarHBondContact OD1-N 2.9Å; D500-S502 PolarHBondContact OD1-OG 2.78Å; D500-S502 PolarHBondContact OD2-OG 3.01Å; D500-S502 VanDerWaalsContact OD2-OG 3.11Å
503	S	53.4	Low	77.7	Confident	42 Å²	42	50 Å²	50	29%	0.294	28%	0.28	S	S	.	.	S	Bend	trans	-128.7	145.8	175.3	78.6	0	0	0	0	111.7	D500 S505	D500-S503 VanDerWaalsContact O-O 3.06Å; D500-S503 VanDerWaalsContact OD2-CB 3.29Å; D500-S503 WeakPolarHBondContact OD2-CB 3.17Å; D500-S503 PolarHBondContact OD2-N 3.03Å; D500-S503 PolarHBondContact OD2-OG 3.09Å; S503-S505 PolarHBondContact O-N 3.31Å; S503-S505 PolarHBondContact OG-N 3.3Å; S503-S505 PolarHBondContact OG-OG 2.9Å
504	L	52.9	Low	77.6	Confident	167 Å²	167	52.7 Å²	52.7	87%	0.874	29%	0.291	S	S	*	.	S	Bend	trans	-70.7	11.2	171.3	-79.3	157.6	0	0	0	113
505	S	62.5	Low	77.5	Confident	35 Å²	35	52.7 Å²	52.7	25%	0.245	29%	0.291	C	S	.	.			trans	-75.5	125.4	174.1	74.7	0	0	0	0	109.8	S503	S503-S505 PolarHBondContact O-N 3.31Å; S503-S505 PolarHBondContact OG-N 3.3Å; S503-S505 PolarHBondContact OG-OG 2.9Å
506	R	71.6	Confident	77.4	Confident	139 Å²	139	54.6 Å²	54.6	53%	0.525	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	132.8	164.4	-56.3	-161.8	-168.1	-178.2	-0.8	108.2	E497	E497-R506 HydrophobicContact CG-CB 4.42Å; E497-R506 WeakPolarHBondContact OE1-CD 3.33Å; E497-R506 IonicContact OE1-CZ 2.71Å; E497-R506 IonicContact OE1-NE 2.79Å; E497-R506 IonicContact OE1-NH1 3.83Å; E497-R506 PolarHBondContact OE1-NH1 3.47Å; E497-R506 IonicContact OE2-NH1 3.81Å; E497-R506 PolarHBondContact OE2-NH1 2.86Å
507	R	77.8	Confident	77.4	Confident	11 Å²	11	54.9 Å²	54.9	4%	0.042	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	129.7	174.6	-57.8	-165.4	-170.3	-156.5	8.9	107.5	P405 E497 V498 F591 N595	P405-R507 HydrophobicContact CG-CB 4.32Å; E497-R507 WeakPolarHBondContact CA-O 3.22Å; V498-R507 PolarHBondContact N-O 3.11Å; V498-R507 PolarHBondContact O-N 3.44Å; V498-R507 VanDerWaalsContact O-N 3.09Å; R507-F591 PolarHBondContact NH1-O 2.91Å; R507-N595 CarbonylContact C-O 3.51Å; R507-N595 WeakPolarHBondContact CA-O 3.37Å; R507-N595 VanDerWaalsContact CB-O 3.3Å; R507-N595 WeakPolarHBondContact CB-O 3.27Å
508	S	85.9	Confident	77.3	Confident	30 Å²	30	54.5 Å²	54.5	21%	0.21	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	149.1	174.9	77.6	0	0	0	0	111	E495 V496 N595 S596	E495-S508 VanDerWaalsContact OE1-CB 3.32Å; E495-S508 WeakPolarHBondContact OE1-CB 3.44Å; E495-S508 PolarHBondContact OE1-OG 2.94Å; V496-S508 CarbonylContact O-C 3.54Å; V496-S508 WeakPolarHBondContact O-CA 3.33Å; S508-N595 PolarHBondContact N-O 2.82Å; S508-S596 WeakPolarHBondContact O-CA 3.49Å; S508-S596 WeakPolarHBondContact O-CB 3.08Å
509	T	88.4	Confident	77.2	Confident	10 Å²	10	60.7 Å²	60.7	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	141.5	171.6	-162.6	0	0	0	0	108.7	P405 I407 V496	P405-T509 HydrophobicContact CB-CG2 4.03Å; P405-T509 HydrophobicContact CG-CG2 4.17Å; I407-T509 HydrophobicContact CD1-CG2 4.08Å; I407-T509 HydrophobicContact CG1-CG2 3.96Å; V496-T509 HydrophobicContact CB-CG2 4.32Å; V496-T509 PolarHBondContact N-O 3Å; V496-T509 PolarHBondContact O-N 3.24Å
510	S	90.5	Very high	76.8	Confident	71 Å²	71	58.9 Å²	58.9	50%	0.497	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	155.5	-176	59.5	0	0	0	0	111.8	C494	C494-S510 CarbonylContact O-C 2.98Å; C494-S510 WeakPolarHBondContact O-CA 3.25Å; C494-S510 WeakPolarHBondContact O-CB 3.32Å
511	W	90.8	Very high	76.4	Confident	31 Å²	31	61.3 Å²	61.3	12%	0.117	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	115.1	-179.1	-169.5	-53.6	0	0	0	109.4	I407 P411 T493 C494 V632	I407-W511 HydrophobicContact CB-CE3 4.18Å; I407-W511 HydrophobicContact CD1-CB 3.75Å; I407-W511 HydrophobicContact CG2-CB 4.4Å; I407-W511 HydrophobicContact CG2-CD2 4.3Å; I407-W511 HydrophobicContact CG2-CE3 3.75Å; I407-W511 HydrophobicContact CG2-CZ3 4.37Å; P411-W511 VanDerWaalsContact CD-CD1 3.47Å; P411-W511 HydrophobicContact CG-CG 4.49Å; P411-W511 WeakPolarHBondContact CG-O 3.28Å; P411-W511 VanDerWaalsContact O-CD1 3.29Å; P411-W511 PolarHBondContact O-NE1 2.95Å; T493-W511 WeakPolarHBondContact CA-O 3.29Å; C494-W511 PolarHBondContact N-O 3.39Å; C494-W511 PolarHBondContact O-N 2.95Å; W511-V632 HydrophobicContact CH2-CB 4Å; W511-V632 HydrophobicContact CH2-CG1 4.12Å; W511-V632 HydrophobicContact CZ2-CB 3.89Å; W511-V632 HydrophobicContact CZ2-CG1 4.47Å; W511-V632 HydrophobicContact CZ2-CG2 4.3Å
512	T	90.7	Very high	75.9	Confident	71 Å²	71	61.4 Å²	61.4	44%	0.436	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	139.3	-179.7	-51.4	0	0	0	0	111.2	F491 Y492 T493	F491-T512 HydrophobicContact CB-CG2 4.02Å; F491-T512 HydrophobicContact CD1-CG2 4.03Å; F491-T512 HydrophobicContact CG-CG2 4.46Å; Y492-T512 CarbonylContact O-C 3.54Å; Y492-T512 WeakPolarHBondContact O-CA 3.24Å; T493-T512 WeakPolarHBondContact OG1-CG2 3.32Å; T493-T512 PolarHBondContact OG1-OG1 3.26Å
513	S	89.6	Confident	75.5	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.021	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	164.4	163.1	93.3	0	0	0	0	112	P411 Q412 N413 F491 Y492	P411-S513 WeakPolarHBondContact O-CB 3.02Å; Q412-S513 WeakPolarHBondContact O-CB 3.16Å; Q412-S513 PolarHBondContact O-OG 2.93Å; N413-S513 WeakPolarHBondContact OD1-CA 3.5Å; N413-S513 WeakPolarHBondContact OD1-CB 3.02Å; F491-S513 WeakPolarHBondContact CA-O 3.34Å; Y492-S513 PolarHBondContact N-O 3.1Å; Y492-S513 PolarHBondContact O-N 3.25Å
514	F	91	Very high	74.8	Confident	66 Å²	66	65 Å²	65	29%	0.289	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	124.6	172.8	-169	-105.5	0	0	0	111	N413 R414 T489 G490 F491 Q516	N413-F514 WeakPolarHBondContact CA-O 3.5Å; N413-F514 PolarHBondContact OD1-N 3.16Å; R414-F514 PolarHBondContact N-O 3.47Å; R414-F514 VanDerWaalsContact N-O 3.11Å; T489-F514 HydrophobicContact CG2-CE1 4.31Å; T489-F514 HydrophobicContact CG2-CE2 4.44Å; T489-F514 HydrophobicContact CG2-CZ 3.73Å; G490-F514 WeakPolarHBondContact O-CD2 3.47Å; F491-F514 HydrophobicContact CD1-CB 4.27Å; F491-F514 AromaticContact CD1-CD2 3.92Å; F491-F514 HydrophobicContact CD1-CD2 3.92Å; F491-F514 HydrophobicContact CD2-CD2 4.23Å; F491-F514 HydrophobicContact CE1-CB 4.12Å; F491-F514 AromaticContact CE1-CD2 3.73Å; F491-F514 HydrophobicContact CE1-CD2 3.73Å; F491-F514 HydrophobicContact CE1-CG 4.34Å; F491-F514 HydrophobicContact CE2-CD2 4.05Å; F491-F514 HydrophobicContact CE2-CE2 4.26Å; F491-F514 HydrophobicContact CG-CD2 4.17Å; F491-F514 AromaticContact CZ-CD2 3.8Å; F491-F514 HydrophobicContact CZ-CD2 3.8Å; F491-F514 HydrophobicContact CZ-CE2 4.32Å; F514-Q516 HydrophobicContact CD1-CB 4.25Å; F514-Q516 HydrophobicContact CE1-CB 3.89Å; F514-Q516 HydrophobicContact CE1-CG 4.35Å
515	L	89.9	Confident	74.2	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121	171.1	179.6	62.5	0	0	0	108.9	F416 A422 I481 L484 T489 G490 Y492 V517	F416-L515 HydrophobicContact CD2-CD1 3.39Å; F416-L515 HydrophobicContact CE2-CD1 3.65Å; F416-L515 HydrophobicContact CG-CD1 4.46Å; A422-L515 HydrophobicContact CB-CD1 4.5Å; I481-L515 HydrophobicContact CD1-CD2 3.83Å; L484-L515 HydrophobicContact CD2-CD2 4.08Å; T489-L515 VanDerWaalsContact CA-O 3.28Å; T489-L515 WeakPolarHBondContact CA-O 3.46Å; G490-L515 PolarHBondContact N-O 3.13Å; G490-L515 PolarHBondContact O-N 3.2Å; Y492-L515 HydrophobicContact CD2-CB 3.6Å; Y492-L515 HydrophobicContact CD2-CD2 4.12Å; Y492-L515 HydrophobicContact CE2-CB 3.72Å; Y492-L515 HydrophobicContact CE2-CD2 3.61Å; Y492-L515 HydrophobicContact CE2-CG 4.24Å; L515-V517 HydrophobicContact CG-CG2 4.34Å
516	Q	89.6	Confident	73.2	Confident	81 Å²	81	65 Å²	65	38%	0.379	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.3	175.6	-171.4	172.6	-9.2	0	0	110.6	R414 T415 F416 F514 I518	R414-Q516 PolarHBondContact O-N 3.42Å; T415-Q516 CarbonylContact C-O 3.6Å; T415-Q516 WeakPolarHBondContact CA-O 3.37Å; T415-Q516 HydrophobicContact CG2-CB 4.39Å; T415-Q516 HydrophobicContact CG2-CG 4.43Å; F416-Q516 PolarHBondContact N-O 2.68Å; F514-Q516 HydrophobicContact CD1-CB 4.25Å; F514-Q516 HydrophobicContact CE1-CB 3.89Å; F514-Q516 HydrophobicContact CE1-CG 4.35Å; Q516-I518 HydrophobicContact CG-CD1 4.5Å; Q516-I518 HydrophobicContact CG-CG1 4.11Å
517	V	88.3	Confident	72	Confident	5 Å²	5	64.2 Å²	64.2	3%	0.03	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	112.6	177.9	-174.1	0	0	0	0	110.8	F416 Q418 L484 R485 D488 T489 L515	F416-V517 WeakPolarHBondContact O-CA 3.44Å; Q418-V517 HydrophobicContact CB-CG1 4.23Å; L484-V517 HydrophobicContact CB-CG1 3.98Å; L484-V517 HydrophobicContact CB-CG2 4.22Å; L484-V517 HydrophobicContact CD1-CG2 4.42Å; L484-V517 HydrophobicContact CD2-CG2 4.08Å; L484-V517 HydrophobicContact CG-CG2 4.49Å; R485-V517 WeakPolarHBondContact O-CB 3.24Å; R485-V517 WeakPolarHBondContact O-CG1 3.33Å; D488-V517 HydrophobicContact CB-CG2 4.48Å; T489-V517 PolarHBondContact OG1-N 2.61Å; L515-V517 HydrophobicContact CG-CG2 4.34Å
518	I	86.3	Confident	70.6	Confident	54 Å²	54	68.2 Å²	68.2	28%	0.277	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	141.7	-175.4	-56	-175.6	0	0	0	110.8	T415 F416 F417 Q418 Q516	T415-I518 HydrophobicContact CG2-CD1 3.4Å; T415-I518 VanDerWaalsContact CG2-CD1 3.4Å; T415-I518 HydrophobicContact CG2-CG1 3.77Å; F416-I518 PolarHBondContact O-N 3.23Å; F417-I518 CarbonylContact C-O 3.58Å; F417-I518 WeakPolarHBondContact CA-O 3.42Å; Q418-I518 PolarHBondContact N-O 3.38Å; Q516-I518 HydrophobicContact CG-CD1 4.5Å; Q516-I518 HydrophobicContact CG-CG1 4.11Å
519	Q	78.1	Confident	69	Low	133 Å²	133	70.2 Å²	70.2	62%	0.621	46%	0.456	S	S	*	.			trans	-72	132.2	169.8	-88.6	170.8	-2.3	0	0	111.2	V486 G521	V486-Q519 HydrophobicContact CG2-CG 3.73Å; Q519-G521 PolarHBondContact O-N 2.76Å
520	G	63.5	Low	67.1	Low	72 Å²	72	76 Å²	76	74%	0.742	49%	0.486	S	S	*	.			trans	-62.4	103.3	-179	0	0	0	0	0	112.2
521	G	55.1	Low	64.8	Low	60 Å²	60	77.7 Å²	77.7	62%	0.619	49%	0.494	S	S	*	.			trans	-143.2	142.7	176.6	0	0	0	0	0	110.5	Q519 S523	Q519-G521 PolarHBondContact O-N 2.76Å; G521-S523 PolarHBondContact O-N 3.1Å
522	S	43.4	Very low	62.8	Low	129 Å²	129	79.7 Å²	79.7	90%	0.902	53%	0.525	S	S	*	.			trans	-79	101.4	-164.6	56.4	0	0	0	0	114.6
523	S	46.7	Very low	60.9	Low	110 Å²	110	80.1 Å²	80.1	77%	0.769	53%	0.525	S	S	*	.			trans	-154.8	135.8	155	58.4	0	0	0	0	110.5	G521	G521-S523 PolarHBondContact O-N 3.1Å
524	G	38.2	Very low	59.2	Low	86 Å²	86	86.7 Å²	86.7	89%	0.887	56%	0.555	S	S	*	*			trans	-81.8	132	-173.1	0	0	0	0	0	114
525	S	41.1	Very low	57.5	Low	78 Å²	78	84 Å²	84	55%	0.545	55%	0.545	S	S	.	.			trans	-142.6	144.8	159.3	-171.5	0	0	0	0	108.8	T527 Y528	S525-T527 PolarHBondContact O-N 3.08Å; S525-Y528 VanDerWaalsContact O-CD2 3.29Å; S525-Y528 WeakPolarHBondContact O-CD2 3.41Å; S525-Y528 WeakPolarHBondContact O-CE2 3.5Å
526	S	41	Very low	56	Low	123 Å²	123	86.7 Å²	86.7	86%	0.86	56%	0.56	S	S	*	*	S	Bend	trans	-94.3	31.6	-154.3	-165.5	0	0	0	0	115.5
527	T	45.8	Very low	54.8	Low	123 Å²	123	88.6 Å²	88.6	76%	0.755	57%	0.572	S	S	*	*			trans	-138.1	44.1	-173.4	56.8	0	0	0	0	113.4	S525	S525-T527 PolarHBondContact O-N 3.08Å
528	Y	49.7	Very low	54.1	Low	96 Å²	96	89.3 Å²	89.3	38%	0.376	58%	0.576	S	S	.	*			trans	-108.4	119.2	169.8	-59.5	-73.8	0	0	0	109.6	T415 F417 S525	T415-Y528 HydrophobicContact CG2-CE1 3.94Å; F417-Y528 HydrophobicContact CE2-CD1 4.03Å; F417-Y528 HydrophobicContact CE2-CE1 4.38Å; F417-Y528 HydrophobicContact CE2-CG 4.22Å; F417-Y528 HydrophobicContact CZ-CD1 4.13Å; F417-Y528 HydrophobicContact CZ-CD2 4.49Å; F417-Y528 HydrophobicContact CZ-CE1 4.05Å; F417-Y528 HydrophobicContact CZ-CE2 4.42Å; F417-Y528 HydrophobicContact CZ-CG 4.35Å; S525-Y528 VanDerWaalsContact O-CD2 3.29Å; S525-Y528 WeakPolarHBondContact O-CD2 3.41Å; S525-Y528 WeakPolarHBondContact O-CE2 3.5Å
529	L	51.4	Low	53.8	Low	72 Å²	72	87.2 Å²	87.2	38%	0.377	57%	0.565	S	S	.	*			trans	-74.4	140.9	168.1	-67.3	174	0	0	0	109.6	D533 L538 Y630	L529-D533 HydrophobicContact CB-CB 4.28Å; L529-D533 HydrophobicContact CD2-CB 4.25Å; L529-L538 HydrophobicContact CD1-CD1 3.47Å; L529-L538 VanDerWaalsContact CD1-CD1 3.47Å; L529-L538 HydrophobicContact CD2-CD1 3.44Å; L529-L538 VanDerWaalsContact CD2-CD1 3.44Å; L529-L538 HydrophobicContact CG-CD1 4.1Å; L529-Y630 HydrophobicContact CD1-CD1 4.13Å; L529-Y630 HydrophobicContact CD1-CE1 4.34Å; L529-Y630 HydrophobicContact CD2-CE1 4Å; L529-Y630 HydrophobicContact CG-CE1 4.42Å
530	L	48.8	Very low	53.9	Low	132 Å²	132	81.3 Å²	81.3	69%	0.691	54%	0.538	S	S	*	.			trans	-85.4	151.1	-177.5	-74.7	163.9	0	0	0	110.6	G532 D533	L530-G532 PolarHBondContact O-N 3.43Å; L530-D533 PolarHBondContact N-OD2 2.96Å; L530-D533 PolarHBondContact O-N 2.92Å
531	P	42.6	Very low	54.7	Low	105 Å²	105	82.1 Å²	82.1	68%	0.682	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	96.4	173.3	-20.6	33.2	0	0	0	110.7	M420	M420-P531 HydrophobicContact CE-CG 3.73Å; M420-P531 HydrophobicContact SD-CG 4.34Å
532	G	47.5	Very low	56	Low	74 Å²	74	81.6 Å²	81.6	76%	0.763	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	144.8	-22.4	-171.1	0	0	0	0	0	113.5	L530 E534	L530-G532 PolarHBondContact O-N 3.43Å; G532-E534 PolarHBondContact O-N 2.75Å
533	D	51.5	Low	57.8	Low	80 Å²	80	75.6 Å²	75.6	43%	0.428	47%	0.469	S	S	.	.			trans	-69.2	113.3	171.6	-68.4	-43.3	0	0	0	110.2	L529 L530 G535	L529-D533 HydrophobicContact CB-CB 4.28Å; L529-D533 HydrophobicContact CD2-CB 4.25Å; L530-D533 PolarHBondContact N-OD2 2.96Å; L530-D533 PolarHBondContact O-N 2.92Å; D533-G535 VanDerWaalsContact C-N 3.34Å; D533-G535 PolarHBondContact O-N 2.96Å
534	E	53.7	Low	59.2	Low	140 Å²	140	75.6 Å²	75.6	65%	0.654	46%	0.456	S	S	*	.			trans	-65.7	91.8	171.3	-74	-167.2	159.1	0	0	109.8	G532 D536 L537	G532-E534 PolarHBondContact O-N 2.75Å; E534-D536 PolarHBondContact O-N 2.69Å; E534-L537 HydrophobicContact CB-CD1 3.87Å; E534-L537 HydrophobicContact CB-CG 3.9Å; E534-L537 WeakPolarHBondContact O-CB 3.32Å; E534-L537 PolarHBondContact O-N 2.86Å
535	G	55.8	Low	60.9	Low	9 Å²	9	74.8 Å²	74.8	9%	0.093	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-61	-15.6	-172.8	0	0	0	0	0	115.7	D533 L537 L538	D533-G535 VanDerWaalsContact C-N 3.34Å; D533-G535 PolarHBondContact O-N 2.96Å; G535-L537 VanDerWaalsContact C-N 3.34Å; G535-L538 PolarHBondContact O-N 3.35Å
536	D	58.7	Low	62.8	Low	59 Å²	59	71.5 Å²	71.5	32%	0.316	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-68.1	-30.5	170.9	-84	32.1	0	0	0	112.1	I409 E534 L538 L539 R634	I409-D536 WeakPolarHBondContact CD1-OD2 3.05Å; E534-D536 PolarHBondContact O-N 2.69Å; D536-L538 PolarHBondContact O-N 2.86Å; D536-L539 PolarHBondContact O-N 3.11Å; D536-R634 IonicContact OD2-NH2 3.41Å
537	L	63.5	Low	64.7	Low	120 Å²	120	70.8 Å²	70.8	63%	0.628	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-69.7	-15.8	176.7	-61	-179.5	0	0	0	113.3	E534 G535	E534-L537 HydrophobicContact CB-CD1 3.87Å; E534-L537 HydrophobicContact CB-CG 3.9Å; E534-L537 WeakPolarHBondContact O-CB 3.32Å; E534-L537 PolarHBondContact O-N 2.86Å; G535-L537 VanDerWaalsContact C-N 3.34Å
538	L	73.7	Confident	66.5	Low	20 Å²	20	67.4 Å²	67.4	11%	0.105	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-97.5	-15.8	-176.1	-58.6	177	0	0	0	112.8	L529 G535 D536 L575 N628 Y630	L529-L538 HydrophobicContact CD1-CD1 3.47Å; L529-L538 VanDerWaalsContact CD1-CD1 3.47Å; L529-L538 HydrophobicContact CD2-CD1 3.44Å; L529-L538 VanDerWaalsContact CD2-CD1 3.44Å; L529-L538 HydrophobicContact CG-CD1 4.1Å; G535-L538 PolarHBondContact O-N 3.35Å; D536-L538 PolarHBondContact O-N 2.86Å; L538-L575 HydrophobicContact CD2-CD2 3.41Å; L538-L575 VanDerWaalsContact CD2-CD2 3.41Å; L538-N628 PolarHBondContact O-ND2 3.37Å; L538-Y630 HydrophobicContact CB-CD1 4.13Å; L538-Y630 HydrophobicContact CB-CD2 3.81Å; L538-Y630 HydrophobicContact CB-CE2 4.22Å; L538-Y630 HydrophobicContact CB-CG 3.74Å; L538-Y630 HydrophobicContact CD1-CD1 4.01Å; L538-Y630 HydrophobicContact CD1-CE1 3.95Å; L538-Y630 HydrophobicContact CD1-CG 4.47Å; L538-Y630 HydrophobicContact CD2-CE2 4.38Å; L538-Y630 WeakPolarHBondContact O-CD2 3.33Å
539	L	79.5	Confident	68	Low	11 Å²	11	66.3 Å²	66.3	6%	0.058	37%	0.371	C	S	.	.	S	Bend	trans	-73.2	152.3	173.3	-65.3	177.3	0	0	0	110.6	I409 Q412 D536	I409-L539 HydrophobicContact CG2-CD1 4.04Å; Q412-L539 HydrophobicContact CG-CD2 4.33Å; D536-L539 PolarHBondContact O-N 3.11Å
540	P	80.8	Confident	69.2	Low	9 Å²	9	66.8 Å²	66.8	6%	0.058	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-77.5	145.3	179.6	32.2	-34.2	0	0	0	111.5	I581 Y626 G633	P540-I581 HydrophobicContact CB-CG1 4.45Å; P540-Y626 VanDerWaalsContact CG-C 3.47Å; P540-Y626 WeakPolarHBondContact CG-O 3.41Å; P540-G633 VanDerWaalsContact O-CA 3.31Å; P540-G633 WeakPolarHBondContact O-CA 3.41Å
541	D	80.8	Confident	70.7	Confident	88 Å²	88	62.7 Å²	62.7	47%	0.471	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-67.9	152.8	174.4	-52.5	-85.4	0	0	0	111	K572 Y626	D541-K572 IonicContact OD2-NZ 3.28Å; D541-K572 PolarHBondContact OD2-NZ 3.47Å; D541-Y626 WeakPolarHBondContact O-CD2 3.44Å
542	P	82.5	Confident	72.2	Confident	49 Å²	49	57.7 Å²	57.7	32%	0.318	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-65.2	151.1	177.3	26.1	-33.4	0	0	0	112.1	K544 F636	P542-K544 PolarHBondContact O-N 3.29Å; P542-F636 HydrophobicContact CB-CB 4.18Å
543	P	81.1	Confident	73.6	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.019	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-52	129.1	172.8	-23.1	28.3	0	0	0	112.2	N545 V546 I624 Y626 F636	P543-N545 PolarHBondContact O-N 3.25Å; P543-V546 HydrophobicContact CB-CG2 3.71Å; P543-V546 HydrophobicContact CG-CG2 4.38Å; P543-I624 HydrophobicContact CG-CB 4.39Å; P543-I624 HydrophobicContact CG-CG2 3.97Å; P543-Y626 HydrophobicContact CB-CE2 4.12Å; P543-Y626 HydrophobicContact CG-CD1 4.25Å; P543-Y626 HydrophobicContact CG-CD2 4.21Å; P543-Y626 HydrophobicContact CG-CE1 3.86Å; P543-Y626 HydrophobicContact CG-CE2 3.86Å; P543-Y626 HydrophobicContact CG-CG 4.4Å; P543-F636 HydrophobicContact CB-CB 4.31Å; P543-F636 HydrophobicContact CG-CB 4.23Å; P543-F636 WeakPolarHBondContact O-CD2 3.47Å
544	K	74.7	Confident	75.1	Confident	111 Å²	111	53.4 Å²	53.4	48%	0.483	28%	0.282	S	S	.	.	S	Bend	trans	-72.2	-23.8	-175.3	-64.6	-178.5	-170.1	169.3	0	114.4	P542 N563 D568	P542-K544 PolarHBondContact O-N 3.29Å; K544-N563 WeakPolarHBondContact CD-O 3.24Å; K544-N563 PolarHBondContact NZ-O 2.78Å; K544-D568 IonicContact NZ-OD2 3.25Å; K544-D568 PolarHBondContact NZ-OD2 2.92Å
545	N	75.1	Confident	76.5	Confident	68 Å²	68	48.2 Å²	48.2	36%	0.364	26%	0.256	S	S	.	.			trans	-159.8	112.9	-176.2	-169.7	-17.1	0	0	0	110.5	P543 I561	P543-N545 PolarHBondContact O-N 3.25Å; N545-I561 HydrophobicContact CB-CB 4.26Å; N545-I561 PolarHBondContact O-N 3.39Å
546	V	80	Confident	77.9	Confident	10 Å²	10	47.8 Å²	47.8	6%	0.061	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	136.2	177.8	-177.5	0	0	0	0	110	P543 L558 D559 L560 I624 F636 L638	P543-V546 HydrophobicContact CB-CG2 3.71Å; P543-V546 HydrophobicContact CG-CG2 4.38Å; V546-L558 HydrophobicContact CG1-CB 4.09Å; V546-L558 HydrophobicContact CG1-CD2 4.46Å; V546-D559 WeakPolarHBondContact CA-O 3.36Å; V546-L560 HydrophobicContact CB-CD2 4.2Å; V546-L560 HydrophobicContact CG1-CD2 3.72Å; V546-L560 HydrophobicContact CG2-CD2 3.55Å; V546-I624 HydrophobicContact CB-CD1 4.43Å; V546-I624 HydrophobicContact CG1-CD1 3.95Å; V546-I624 HydrophobicContact CG2-CD1 4.31Å; V546-F636 HydrophobicContact CB-CD1 3.88Å; V546-F636 HydrophobicContact CB-CE1 3.62Å; V546-F636 HydrophobicContact CB-CZ 4.28Å; V546-F636 HydrophobicContact CG2-CD1 3.59Å; V546-F636 HydrophobicContact CG2-CE1 3.82Å; V546-F636 HydrophobicContact CG2-CG 4.08Å; V546-F636 HydrophobicContact CG2-CZ 4.45Å; V546-L638 HydrophobicContact CG1-CD1 4.48Å
547	K	81.8	Confident	79.2	Confident	108 Å²	108	46.3 Å²	46.3	47%	0.47	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.1	-179.9	-63.3	-177.5	-176.1	172.9	0	111.6	T549 L558 D559 I561	K547-T549 PolarHBondContact O-N 3.42Å; K547-L558 CarbonylContact O-C 3.59Å; K547-L558 WeakPolarHBondContact O-CA 3.47Å; K547-D559 PolarHBondContact N-O 2.73Å; K547-D559 PolarHBondContact O-N 2.83Å; K547-I561 HydrophobicContact CD-CD1 3.92Å; K547-I561 HydrophobicContact CG-CD1 4.44Å
548	V	82.8	Confident	80.2	Confident	52 Å²	52	40.6 Å²	40.6	32%	0.315	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	116.6	165.1	178.6	0	0	0	0	108.3	I551 V556 V557 L558 L638 V642	V548-I551 HydrophobicContact CG1-CD1 3.89Å; V548-I551 HydrophobicContact CG1-CG1 3.61Å; V548-V556 HydrophobicContact CG1-CG1 3.94Å; V548-V556 HydrophobicContact CG2-CG1 4.32Å; V548-V557 WeakPolarHBondContact CA-O 3.18Å; V548-L558 HydrophobicContact CG2-CD2 3.74Å; V548-L638 HydrophobicContact CG2-CD1 4.43Å; V548-L638 HydrophobicContact CG2-CD2 3.61Å; V548-V642 HydrophobicContact CG1-CG1 4.42Å; V548-V642 HydrophobicContact CG2-CG1 4.49Å; V548-V642 HydrophobicContact CG2-CG2 3.85Å
549	T	81.4	Confident	80.7	Confident	73 Å²	73	42.5 Å²	42.5	45%	0.448	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-28.6	-178.2	49.5	0	0	0	0	113.3	K547 V557 D559	K547-T549 PolarHBondContact O-N 3.42Å; T549-V557 PolarHBondContact N-O 2.74Å; T549-V557 WeakPolarHBondContact OG1-CG1 3.3Å; T549-D559 WeakPolarHBondContact CB-OD1 3.26Å; T549-D559 HydrophobicContact CG2-CB 3.84Å; T549-D559 WeakPolarHBondContact CG2-OD1 3.49Å; T549-D559 PolarHBondContact OG1-OD1 2.96Å
550	N	77.5	Confident	80.7	Confident	81 Å²	81	42.1 Å²	42.1	43%	0.433	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	152.9	173.7	-158.3	-12	0	0	0	111.8	W555 V557	N550-W555 HydrophobicContact CB-CH2 4.44Å; N550-W555 HydrophobicContact CB-CZ3 4.03Å; N550-V557 HydrophobicContact CB-CB 4.24Å; N550-V557 HydrophobicContact CB-CG2 4.28Å; N550-V557 PolarHBondContact O-N 3.42Å
551	I	80	Confident	79.9	Confident	47 Å²	47	44.9 Å²	44.9	24%	0.241	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	126.4	-174.9	-60.9	179.2	0	0	0	108.8	V548 V642 F643 K645	V548-I551 HydrophobicContact CG1-CD1 3.89Å; V548-I551 HydrophobicContact CG1-CG1 3.61Å; I551-V642 HydrophobicContact CD1-CG1 3.86Å; I551-V642 HydrophobicContact CG1-CG1 4.23Å; I551-F643 VanDerWaalsContact CG2-O 3.25Å; I551-F643 WeakPolarHBondContact CG2-O 3.31Å; I551-K645 HydrophobicContact CG2-CG 4.33Å; I551-K645 WeakPolarHBondContact O-CD 3.44Å; I551-K645 WeakPolarHBondContact O-CE 3.38Å; I551-K645 PolarHBondContact O-NZ 2.76Å
552	G	74.5	Confident	78.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.			trans	-99.9	-171.4	169.5	0	0	0	0	0	112.9	W555 T644 K645	G552-W555 WeakPolarHBondContact CA-O 3.29Å; G552-W555 PolarHBondContact N-O 2.9Å; G552-T644 WeakPolarHBondContact O-CA 3.44Å; G552-K645 PolarHBondContact O-N 2.93Å
553	D	76.5	Confident	77.4	Confident	10 Å²	10	47 Å²	47	5%	0.053	25%	0.246	C	C	.	.	S	Bend	trans	-77.9	-31.6	166.3	45.4	13.1	0	0	0	112.7	L615 P616 T644 K645 T646 G648 R651	D553-L615 CarbonylContact O-C 3.59Å; D553-P616 VanDerWaalsContact O-CA 3.22Å; D553-P616 WeakPolarHBondContact O-CA 3.49Å; D553-T644 VanDerWaalsContact O-CB 3.28Å; D553-T644 WeakPolarHBondContact O-CB 3.47Å; D553-K645 HydrophobicContact CB-CB 4.49Å; D553-T646 WeakPolarHBondContact CB-O 3.17Å; D553-G648 PolarHBondContact OD2-N 3.31Å; D553-R651 VanDerWaalsContact CG-CZ 3.5Å; D553-R651 IonicContact OD1-CZ 3.6Å; D553-R651 IonicContact OD1-NE 3.75Å; D553-R651 IonicContact OD1-NH1 3.6Å; D553-R651 PolarHBondContact OD1-NH1 2.91Å; D553-R651 IonicContact OD1-NH2 3.9Å; D553-R651 PolarHBondContact OD1-NH2 2.69Å; D553-R651 WeakPolarHBondContact OD2-CD 3.5Å; D553-R651 IonicContact OD2-CZ 2.97Å; D553-R651 IonicContact OD2-NE 2.72Å; D553-R651 PolarHBondContact OD2-NE 2.82Å; D553-R651 IonicContact OD2-NH1 2.76Å; D553-R651 IonicContact OD2-NH2 2.74Å
554	T	82	Confident	76.1	Confident	53 Å²	53	50.2 Å²	50.2	33%	0.325	26%	0.26	S	S	.	.	S	Bend	trans	-129.6	12.3	-176.7	58.8	0	0	0	0	113.7	S612 G613 L614 P616	T554-S612 CarbonylContact O-C 3.52Å; T554-G613 PolarHBondContact O-N 2.85Å; T554-L614 VanDerWaalsContact CA-O 3.26Å; T554-L614 WeakPolarHBondContact CA-O 3.47Å; T554-L614 WeakPolarHBondContact CB-O 3.33Å; T554-L614 WeakPolarHBondContact CG2-O 3.26Å; T554-L614 PolarHBondContact O-N 3.12Å; T554-P616 HydrophobicContact CG2-CG 4.19Å
555	W	84	Confident	74.6	Confident	31 Å²	31	47 Å²	47	12%	0.117	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-156.3	161.2	-177.7	56.1	-95.8	0	0	0	113.2	N550 G552 V557 R610 V611 R651	N550-W555 HydrophobicContact CB-CH2 4.44Å; N550-W555 HydrophobicContact CB-CZ3 4.03Å; G552-W555 WeakPolarHBondContact CA-O 3.29Å; G552-W555 PolarHBondContact N-O 2.9Å; W555-V557 HydrophobicContact CE3-CG2 4.01Å; W555-V557 HydrophobicContact CZ3-CG2 3.78Å; W555-R610 VanDerWaalsContact CD1-NH2 3.29Å; W555-R610 VanDerWaalsContact NE1-NH2 3.15Å; W555-V611 CarbonylContact C-O 3.55Å; W555-V611 WeakPolarHBondContact CA-O 3.07Å; W555-V611 WeakPolarHBondContact CB-O 3.18Å; W555-R651 VanDerWaalsContact NE1-NH2 3.18Å
556	V	85.2	Confident	73	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	142.7	174.9	171.7	0	0	0	0	108.4	V548 L558 R610 V611 L614 I622 V642	V548-V556 HydrophobicContact CG1-CG1 3.94Å; V548-V556 HydrophobicContact CG2-CG1 4.32Å; V556-L558 HydrophobicContact CG1-CD2 3.84Å; V556-L558 HydrophobicContact CG1-CG 4.31Å; V556-R610 CarbonylContact O-C 3.52Å; V556-R610 WeakPolarHBondContact O-CA 3.2Å; V556-V611 PolarHBondContact N-O 3.24Å; V556-V611 PolarHBondContact O-N 2.93Å; V556-V611 VanDerWaalsContact O-N 3.09Å; V556-L614 HydrophobicContact CB-CD1 4.26Å; V556-L614 HydrophobicContact CG2-CD1 3.7Å; V556-I622 HydrophobicContact CG1-CD1 4.29Å; V556-V642 HydrophobicContact CG1-CG1 4.1Å; V556-V642 HydrophobicContact CG2-CG1 3.61Å
557	V	85.2	Confident	71.5	Confident	28 Å²	28	54.8 Å²	54.8	17%	0.17	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.9	171.1	-178.5	0	0	0	0	109.5	V548 T549 N550 W555 V609 R610	V548-V557 WeakPolarHBondContact CA-O 3.18Å; T549-V557 PolarHBondContact N-O 2.74Å; T549-V557 WeakPolarHBondContact OG1-CG1 3.3Å; N550-V557 HydrophobicContact CB-CB 4.24Å; N550-V557 HydrophobicContact CB-CG2 4.28Å; N550-V557 PolarHBondContact O-N 3.42Å; W555-V557 HydrophobicContact CE3-CG2 4.01Å; W555-V557 HydrophobicContact CZ3-CG2 3.78Å; V557-V609 WeakPolarHBondContact CA-O 3.4Å; V557-R610 HydrophobicContact CG2-CB 4.38Å; V557-R610 HydrophobicContact CG2-CG 3.91Å
558	L	85.7	Confident	70	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119.2	-179.5	-56.2	173.6	0	0	0	109.5	V546 K547 V548 V556 V586 S608 V609 V611 I622 I624	V546-L558 HydrophobicContact CG1-CB 4.09Å; V546-L558 HydrophobicContact CG1-CD2 4.46Å; K547-L558 CarbonylContact O-C 3.59Å; K547-L558 WeakPolarHBondContact O-CA 3.47Å; V548-L558 HydrophobicContact CG2-CD2 3.74Å; V556-L558 HydrophobicContact CG1-CD2 3.84Å; V556-L558 HydrophobicContact CG1-CG 4.31Å; L558-V586 HydrophobicContact CD1-CG1 4.37Å; L558-S608 CarbonylContact O-C 3.56Å; L558-S608 VanDerWaalsContact O-CA 3.25Å; L558-S608 WeakPolarHBondContact O-CA 3.48Å; L558-V609 PolarHBondContact N-O 2.79Å; L558-V609 PolarHBondContact O-N 3.29Å; L558-V611 HydrophobicContact CD1-CG2 3.58Å; L558-V611 HydrophobicContact CG-CG2 4.18Å; L558-I622 HydrophobicContact CD1-CG2 3.87Å; L558-I624 HydrophobicContact CD1-CD1 4.24Å; L558-I624 HydrophobicContact CD1-CG1 4.07Å
559	D	83.7	Confident	68.4	Low	60 Å²	60	52.5 Å²	52.5	32%	0.321	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	125.5	172.8	-74.6	38.5	0	0	0	109.4	V546 K547 T549	V546-D559 WeakPolarHBondContact CA-O 3.36Å; K547-D559 PolarHBondContact N-O 2.73Å; K547-D559 PolarHBondContact O-N 2.83Å; T549-D559 WeakPolarHBondContact CB-OD1 3.26Å; T549-D559 HydrophobicContact CG2-CB 3.84Å; T549-D559 WeakPolarHBondContact CG2-OD1 3.49Å; T549-D559 PolarHBondContact OG1-OD1 2.96Å
560	L	78.6	Confident	66.8	Low	3 Å²	3	54 Å²	54	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	97.6	-179.1	-54.1	-177.5	0	0	0	108.9	V546 N562 V584 N607 V609 I624 Y626	V546-L560 HydrophobicContact CB-CD2 4.2Å; V546-L560 HydrophobicContact CG1-CD2 3.72Å; V546-L560 HydrophobicContact CG2-CD2 3.55Å; L560-N562 PolarHBondContact O-N 2.96Å; L560-V584 HydrophobicContact CD1-CB 4.48Å; L560-V584 HydrophobicContact CD1-CG1 3.92Å; L560-V584 HydrophobicContact CD1-CG2 3.81Å; L560-N607 PolarHBondContact N-O 3.1Å; L560-V609 HydrophobicContact CD1-CG2 3.71Å; L560-V609 HydrophobicContact CG-CG2 4.35Å; L560-I624 HydrophobicContact CD1-CG2 4.47Å; L560-I624 HydrophobicContact CD2-CG2 4.05Å; L560-Y626 HydrophobicContact CD1-CE1 4.13Å
561	I	65.3	Low	65.4	Low	68 Å²	68	58 Å²	58	35%	0.349	30%	0.303	S	S	.	.			trans	-80.5	91.9	-176.8	-55.3	178	0	0	0	108.6	N545 K547 N563	N545-I561 HydrophobicContact CB-CB 4.26Å; N545-I561 PolarHBondContact O-N 3.39Å; K547-I561 HydrophobicContact CD-CD1 3.92Å; K547-I561 HydrophobicContact CG-CD1 4.44Å; I561-N563 PolarHBondContact O-N 3.03Å
562	N	60.2	Low	64.1	Low	64 Å²	64	59.1 Å²	59.1	34%	0.342	31%	0.306	S	S	.	.			trans	-67.6	70.7	179.1	-91.4	-42.8	0	0	0	113.1	L560 H564 N607 Y626	L560-N562 PolarHBondContact O-N 2.96Å; N562-H564 PolarHBondContact O-N 3.27Å; N562-N607 PolarHBondContact ND2-OD1 3.43Å; N562-Y626 PolarHBondContact OD1-OH 3.15Å
563	N	49.8	Very low	62.7	Low	118 Å²	118	68.3 Å²	68.3	63%	0.631	34%	0.341	S	S	*	.			trans	-81.8	52	172.4	-151.1	25.1	0	0	0	111.2	K544 I561 S565	K544-N563 WeakPolarHBondContact CD-O 3.24Å; K544-N563 PolarHBondContact NZ-O 2.78Å; I561-N563 PolarHBondContact O-N 3.03Å; N563-S565 PolarHBondContact O-N 2.74Å
564	H	53.3	Low	61.4	Low	70 Å²	70	72.8 Å²	72.8	32%	0.324	37%	0.373	S	S	.	.			trans	-70.8	105.7	162.6	-78.2	-63.1	0	0	0	107.3	N562 D568	N562-H564 PolarHBondContact O-N 3.27Å; H564-D568 IonicContact ND1-OD2 2.75Å; H564-D568 PolarHBondContact ND1-OD2 2.94Å
565	S	43.7	Very low	60	Low	42 Å²	42	73.3 Å²	73.3	29%	0.294	37%	0.374	S	S	.	.			trans	-62.7	152.2	170.5	51.8	0	0	0	0	108.5	N563 E567 D568	N563-S565 PolarHBondContact O-N 2.74Å; S565-E567 PolarHBondContact O-N 3.3Å; S565-D568 WeakPolarHBondContact O-CB 3.17Å; S565-D568 PolarHBondContact O-N 2.94Å
566	V	42.4	Very low	58.5	Low	111 Å²	111	74 Å²	74	67%	0.673	39%	0.391	S	S	*	.	H	α-helix	trans	-56.4	-25.4	-179.4	-175.2	0	0	0	0	111.3	V569 I570	V566-V569 PolarHBondContact O-N 2.91Å; V566-I570 HydrophobicContact CG1-CD1 3.9Å; V566-I570 HydrophobicContact CG1-CG1 4.37Å; V566-I570 VanDerWaalsContact O-CG1 3.26Å; V566-I570 WeakPolarHBondContact O-CG1 3.24Å; V566-I570 PolarHBondContact O-N 2.71Å
567	E	47.5	Very low	56.9	Low	131 Å²	131	81.7 Å²	81.7	61%	0.612	43%	0.426	S	S	*	.	H	α-helix	trans	-65.6	-38.6	174.9	-58.6	176.9	122.7	0	0	114.3	S565 V569 I570 K571	S565-E567 PolarHBondContact O-N 3.3Å; E567-V569 VanDerWaalsContact C-N 3.27Å; E567-V569 PolarHBondContact O-N 2.89Å; E567-I570 PolarHBondContact O-N 2.99Å; E567-K571 PolarHBondContact O-N 3.35Å
568	D	51.6	Low	55.4	Low	54 Å²	54	82.1 Å²	82.1	29%	0.289	43%	0.43	S	S	.	.	H	α-helix	trans	-61	-42.6	174.6	-68.6	-21.8	0	0	0	109.9	K544 H564 S565 K571 K572	K544-D568 IonicContact NZ-OD2 3.25Å; K544-D568 PolarHBondContact NZ-OD2 2.92Å; H564-D568 IonicContact ND1-OD2 2.75Å; H564-D568 PolarHBondContact ND1-OD2 2.94Å; S565-D568 WeakPolarHBondContact O-CB 3.17Å; S565-D568 PolarHBondContact O-N 2.94Å; D568-K571 PolarHBondContact O-N 3.18Å; D568-K572 PolarHBondContact O-N 2.68Å; D568-K572 VanDerWaalsContact O-N 3.09Å
569	V	48.7	Very low	54.3	Low	59 Å²	59	83 Å²	83	36%	0.358	44%	0.438	S	S	.	.	H	α-helix	trans	-69.8	-36.9	178.8	-175.6	0	0	0	0	111.3	V566 E567 R573	V566-V569 PolarHBondContact O-N 2.91Å; E567-V569 VanDerWaalsContact C-N 3.27Å; E567-V569 PolarHBondContact O-N 2.89Å; V569-R573 WeakPolarHBondContact O-CG 3.24Å; V569-R573 PolarHBondContact O-N 3.41Å; V569-R573 VanDerWaalsContact O-N 3.17Å
570	I	47.5	Very low	53.6	Low	103 Å²	103	86 Å²	86	53%	0.528	45%	0.448	S	S	.	.	H	α-helix	trans	-66.7	-40.4	175.3	-73.8	166	0	0	0	111.2	V566 E567	V566-I570 HydrophobicContact CG1-CD1 3.9Å; V566-I570 HydrophobicContact CG1-CG1 4.37Å; V566-I570 VanDerWaalsContact O-CG1 3.26Å; V566-I570 WeakPolarHBondContact O-CG1 3.24Å; V566-I570 PolarHBondContact O-N 2.71Å; E567-I570 PolarHBondContact O-N 2.99Å
571	K	49.1	Very low	53.5	Low	166 Å²	166	88.1 Å²	88.1	72%	0.722	46%	0.459	S	S	*	.	H	α-helix	trans	-70.1	-36	177.8	-76.3	-179.9	178.4	173.6	0	113.3	E567 D568 S574	E567-K571 PolarHBondContact O-N 3.35Å; D568-K571 PolarHBondContact O-N 3.18Å; K571-S574 PolarHBondContact O-OG 2.75Å
572	K	51.6	Low	54	Low	71 Å²	71	87.6 Å²	87.6	31%	0.309	46%	0.459	S	S	.	.	H	α-helix	trans	-82.8	-8	178.4	-66.9	-170	173	-172.7	0	114.4	D541 D568 S574 L575	D541-K572 IonicContact OD2-NZ 3.28Å; D541-K572 PolarHBondContact OD2-NZ 3.47Å; D568-K572 PolarHBondContact O-N 2.68Å; D568-K572 VanDerWaalsContact O-N 3.09Å; K572-S574 PolarHBondContact O-N 3.44Å; K572-S574 VanDerWaalsContact O-N 3.15Å; K572-L575 PolarHBondContact O-N 2.83Å
573	R	46.1	Very low	55.1	Low	192 Å²	192	84.9 Å²	84.9	73%	0.725	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.1	177.5	-100.3	176.8	177.8	-176.9	-0.2	115.7	V569 L575	V569-R573 WeakPolarHBondContact O-CG 3.24Å; V569-R573 PolarHBondContact O-N 3.41Å; V569-R573 VanDerWaalsContact O-N 3.17Å; R573-L575 VanDerWaalsContact C-N 3.33Å
574	S	49	Very low	56.8	Low	104 Å²	104	79.3 Å²	79.3	73%	0.727	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-9.1	171.1	50.3	0	0	0	0	113.9	K571 K572	K571-S574 PolarHBondContact O-OG 2.75Å; K572-S574 PolarHBondContact O-N 3.44Å; K572-S574 VanDerWaalsContact O-N 3.15Å
575	L	51.4	Low	58.5	Low	65 Å²	65	77.4 Å²	77.4	34%	0.34	41%	0.408	S	S	.	.	S	Bend	trans	-108.8	24.6	-171.9	-63.9	112.9	0	0	0	114.1	L538 K572 R573 S578 A579	L538-L575 HydrophobicContact CD2-CD2 3.41Å; L538-L575 VanDerWaalsContact CD2-CD2 3.41Å; K572-L575 PolarHBondContact O-N 2.83Å; R573-L575 VanDerWaalsContact C-N 3.33Å; L575-S578 PolarHBondContact O-OG 3.3Å; L575-A579 HydrophobicContact CB-CB 4.09Å
576	G	52.5	Low	60.6	Low	46 Å²	46	75.4 Å²	75.4	47%	0.474	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	-175	172	0	0	0	0	0	115.3	S578	G576-S578 PolarHBondContact O-N 3.16Å
577	E	51.5	Low	62.9	Low	160 Å²	160	70.7 Å²	70.7	75%	0.748	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-70.7	-22.4	176.1	-62.9	-175.7	129	0	0	112.4	A579 F580	E577-A579 PolarHBondContact O-N 2.79Å; E577-A579 VanDerWaalsContact O-N 3.16Å; E577-F580 HydrophobicContact CB-CD2 4.18Å; E577-F580 HydrophobicContact CB-CE2 4.34Å; E577-F580 HydrophobicContact CG-CE2 4.28Å; E577-F580 VanDerWaalsContact O-CD2 3.29Å; E577-F580 WeakPolarHBondContact O-CD2 3.46Å; E577-F580 PolarHBondContact O-N 2.93Å; E577-F580 VanDerWaalsContact O-N 3.15Å
578	S	55	Low	64.9	Low	37 Å²	37	64.5 Å²	64.5	26%	0.259	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-59.5	-24	178.1	38.2	0	0	0	0	114.2	L575 G576 H629 Y630	L575-S578 PolarHBondContact O-OG 3.3Å; G576-S578 PolarHBondContact O-N 3.16Å; S578-H629 WeakPolarHBondContact O-CB 3.27Å; S578-H629 PolarHBondContact O-N 3.1Å; S578-Y630 PolarHBondContact OG-OH 3.08Å
579	A	61.2	Low	66.4	Low	18 Å²	18	62 Å²	62	15%	0.149	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-78.1	-14.4	178.7	0	0	0	0	0	114.6	L575 E577	L575-A579 HydrophobicContact CB-CB 4.09Å; E577-A579 PolarHBondContact O-N 2.79Å; E577-A579 VanDerWaalsContact O-N 3.16Å
580	F	70	Confident	68	Low	125 Å²	125	60 Å²	60	55%	0.548	31%	0.309	S	S	.	.	S	Bend	trans	-70.6	147.5	-177.5	-69.3	-57.6	0	0	0	113.2	E577 T582 N628	E577-F580 HydrophobicContact CB-CD2 4.18Å; E577-F580 HydrophobicContact CB-CE2 4.34Å; E577-F580 HydrophobicContact CG-CE2 4.28Å; E577-F580 VanDerWaalsContact O-CD2 3.29Å; E577-F580 WeakPolarHBondContact O-CD2 3.46Å; E577-F580 PolarHBondContact O-N 2.93Å; E577-F580 VanDerWaalsContact O-N 3.15Å; F580-T582 PolarHBondContact O-N 3.05Å; F580-N628 WeakPolarHBondContact O-CB 3.34Å
581	I	75.8	Confident	69	Low	46 Å²	46	55.5 Å²	55.5	24%	0.236	29%	0.286	C	S	.	.			trans	-67.9	113.5	176.9	-61	163.8	0	0	0	108.9	P540 G583 Y626 V627	P540-I581 HydrophobicContact CB-CG1 4.45Å; I581-G583 WeakPolarHBondContact CG2-O 3.1Å; I581-Y626 HydrophobicContact CD1-CD1 4.41Å; I581-Y626 HydrophobicContact CD1-CD2 3.46Å; I581-Y626 VanDerWaalsContact CD1-CD2 3.46Å; I581-Y626 HydrophobicContact CD1-CE2 3.71Å; I581-Y626 HydrophobicContact CD1-CG 3.85Å; I581-Y626 HydrophobicContact CG1-CD2 4.22Å; I581-Y626 HydrophobicContact CG1-CG 4.21Å; I581-Y626 HydrophobicContact CG2-CD1 3.93Å; I581-Y626 HydrophobicContact CG2-CG 4.01Å; I581-V627 CarbonylContact C-O 3.14Å; I581-V627 WeakPolarHBondContact CA-O 3.46Å
582	T	77.2	Confident	69.7	Low	57 Å²	57	51.7 Å²	51.7	35%	0.35	27%	0.273	S	S	.	.			trans	-89.2	-18.9	178.8	55.9	0	0	0	0	112.7	F580 P605 V627 N628 H629	F580-T582 PolarHBondContact O-N 3.05Å; T582-P605 WeakPolarHBondContact O-CD 3.28Å; T582-V627 PolarHBondContact N-O 3.29Å; T582-V627 PolarHBondContact OG1-O 2.82Å; T582-N628 WeakPolarHBondContact OG1-CA 3.4Å; T582-H629 VanDerWaalsContact CG2-CD2 3.47Å; T582-H629 WeakPolarHBondContact CG2-CD2 2.93Å; T582-H629 VanDerWaalsContact CG2-NE2 3.32Å; T582-H629 WeakPolarHBondContact CG2-NE2 3.19Å
583	G	81.8	Confident	70.3	Confident	7 Å²	7	52.9 Å²	52.9	7%	0.072	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.3	-176.3	179.7	0	0	0	0	0	114.7	I581 S603 V627	I581-G583 WeakPolarHBondContact CG2-O 3.1Å; G583-S603 CarbonylContact C-O 3.54Å; G583-S603 WeakPolarHBondContact CA-O 3.38Å; G583-V627 PolarHBondContact N-O 3.26Å; G583-V627 PolarHBondContact O-N 3.34Å
584	V	85.8	Confident	71.1	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.8	179.7	-169.4	0	0	0	0	109.3	L560 V586 S602 S603 V609 I624 R625 Y626	L560-V584 HydrophobicContact CD1-CB 4.48Å; L560-V584 HydrophobicContact CD1-CG1 3.92Å; L560-V584 HydrophobicContact CD1-CG2 3.81Å; V584-V586 HydrophobicContact CG1-CG2 4.2Å; V584-S602 WeakPolarHBondContact O-CA 3.29Å; V584-S603 PolarHBondContact N-O 3.44Å; V584-S603 PolarHBondContact O-N 3.37Å; V584-S603 VanDerWaalsContact O-N 3.14Å; V584-V609 HydrophobicContact CB-CG2 4.37Å; V584-V609 HydrophobicContact CG1-CG2 4.31Å; V584-V609 HydrophobicContact CG2-CG2 4.38Å; V584-I624 HydrophobicContact CG1-CG2 3.43Å; V584-I624 VanDerWaalsContact CG1-CG2 3.43Å; V584-R625 WeakPolarHBondContact CA-O 3.34Å; V584-Y626 HydrophobicContact CG2-CD1 4.08Å; V584-Y626 HydrophobicContact CG2-CE1 4.08Å
585	Q	88.3	Confident	72	Confident	30 Å²	30	44.2 Å²	44.2	14%	0.14	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	125.4	169.5	172.9	170.5	-52.6	0	0	108.9	E587 V599 R625 V627 V632	Q585-E587 PolarHBondContact NE2-OE1 3.14Å; Q585-V599 HydrophobicContact CG-CG1 4.15Å; Q585-V599 HydrophobicContact CG-CG2 4.3Å; Q585-R625 HydrophobicContact CB-CB 4.38Å; Q585-R625 PolarHBondContact N-O 2.97Å; Q585-R625 PolarHBondContact O-N 3.07Å; Q585-V627 HydrophobicContact CB-CG2 4.04Å; Q585-V632 HydrophobicContact CB-CG1 4.38Å
586	V	88.8	Confident	73.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	122.3	174.1	-176.8	0	0	0	0	110.2	L558 V584 V588 V599 V600 E601 V609 V611 I622 I624	L558-V586 HydrophobicContact CD1-CG1 4.37Å; V584-V586 HydrophobicContact CG1-CG2 4.2Å; V586-V588 HydrophobicContact CG1-CG1 4.41Å; V586-V599 WeakPolarHBondContact O-CA 3.47Å; V586-V600 PolarHBondContact O-N 3.05Å; V586-E601 PolarHBondContact N-O 2.83Å; V586-V609 HydrophobicContact CG2-CG1 3.81Å; V586-V611 HydrophobicContact CB-CG2 4.44Å; V586-V611 HydrophobicContact CG1-CG2 3.73Å; V586-I622 HydrophobicContact CG1-CG2 3.8Å; V586-I624 HydrophobicContact CG2-CG1 4.24Å; V586-I624 HydrophobicContact CG2-CG2 4.29Å
587	E	89.9	Confident	74.7	Confident	12 Å²	12	42.5 Å²	42.5	6%	0.056	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	141.3	172.6	-69.6	146.5	-120.4	0	0	109.7	Q585 W597 R598 V599 L623 R625	Q585-E587 PolarHBondContact NE2-OE1 3.14Å; E587-W597 HydrophobicContact CB-CB 4.45Å; E587-W597 HydrophobicContact CB-CE3 4.08Å; E587-R598 CarbonylContact C-O 3.47Å; E587-R598 VanDerWaalsContact CA-O 3.28Å; E587-R598 WeakPolarHBondContact CA-O 3.1Å; E587-V599 HydrophobicContact CG-CG2 3.8Å; E587-L623 HydrophobicContact CB-CD1 3.76Å; E587-L623 HydrophobicContact CB-CG 3.89Å; E587-L623 HydrophobicContact CG-CD1 4.2Å; E587-L623 PolarHBondContact N-O 3.08Å; E587-L623 PolarHBondContact O-N 3.45Å; E587-R625 VanDerWaalsContact OE1-CD 3.26Å; E587-R625 WeakPolarHBondContact OE1-CD 3.42Å; E587-R625 IonicContact OE1-CZ 3.88Å; E587-R625 IonicContact OE1-NE 2.78Å; E587-R625 PolarHBondContact OE1-NE 3.14Å; E587-R625 IonicContact OE1-NH2 3.15Å; E587-R625 IonicContact OE2-CZ 3.6Å; E587-R625 IonicContact OE2-NE 3.56Å; E587-R625 IonicContact OE2-NH2 3.5Å; E587-R625 PolarHBondContact OE2-NH2 3.36Å
588	V	89.2	Confident	76.3	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	156.4	171.5	-45.3	0	0	0	0	110.9	V586 R598 V600 V611 L614 Y620 H621 I622	V586-V588 HydrophobicContact CG1-CG1 4.41Å; V588-R598 HydrophobicContact CG2-CG 3.76Å; V588-R598 PolarHBondContact N-O 2.98Å; V588-R598 PolarHBondContact O-N 2.83Å; V588-V600 HydrophobicContact CB-CG2 4.28Å; V588-V600 HydrophobicContact CG1-CG2 3.92Å; V588-V600 HydrophobicContact CG2-CG2 3.5Å; V588-V611 HydrophobicContact CG1-CG1 3.87Å; V588-L614 HydrophobicContact CG2-CD2 4.19Å; V588-Y620 HydrophobicContact CB-CD1 3.96Å; V588-Y620 HydrophobicContact CG2-CD1 3.68Å; V588-Y620 HydrophobicContact CG2-CE1 3.89Å; V588-H621 VanDerWaalsContact CA-O 3.25Å; V588-H621 WeakPolarHBondContact CA-O 3.32Å; V588-H621 WeakPolarHBondContact CB-O 3.47Å; V588-I622 HydrophobicContact CG1-CG1 4.02Å; V588-I622 HydrophobicContact CG1-CG2 4.3Å
589	T	84.7	Confident	77.6	Confident	1 Å²	1	41 Å²	41	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	141.3	164.5	-166.3	0	0	0	0	109.2	L404 S594 S596 W597 Y620 H621	L404-T589 HydrophobicContact CD1-CG2 3.68Å; L404-T589 HydrophobicContact CD2-CG2 4.02Å; T589-S594 PolarHBondContact OG1-OG 2.88Å; T589-S596 WeakPolarHBondContact CB-O 3.29Å; T589-S596 PolarHBondContact OG1-O 3Å; T589-W597 HydrophobicContact CG2-CD2 3.92Å; T589-W597 HydrophobicContact CG2-CE3 3.86Å; T589-W597 HydrophobicContact CG2-CH2 3.76Å; T589-W597 HydrophobicContact CG2-CZ2 3.8Å; T589-W597 HydrophobicContact CG2-CZ3 3.8Å; T589-Y620 WeakPolarHBondContact O-CA 3.39Å; T589-H621 HydrophobicContact CG2-CB 3.88Å; T589-H621 PolarHBondContact N-O 2.82Å; T589-H621 PolarHBondContact O-N 3.08Å
590	E	80.6	Confident	78.3	Confident	17 Å²	17	42.1 Å²	42.1	8%	0.079	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	132.5	179.2	-66.4	171.7	-177.9	0	0	109.7	N592 T593 S594 R598 L615 T618 Y620	E590-N592 VanDerWaalsContact C-N 3.25Å; E590-N592 PolarHBondContact O-N 2.93Å; E590-T593 WeakPolarHBondContact CB-OG1 3.44Å; E590-T593 PolarHBondContact OE2-OG1 2.78Å; E590-S594 WeakPolarHBondContact CB-OG 3.46Å; E590-S594 PolarHBondContact N-OG 2.99Å; E590-S594 PolarHBondContact O-OG 3.22Å; E590-R598 IonicContact OE1-CZ 3.4Å; E590-R598 IonicContact OE1-NH1 2.69Å; E590-R598 PolarHBondContact OE1-NH1 3.42Å; E590-R598 IonicContact OE1-NH2 3.5Å; E590-L615 WeakPolarHBondContact OE1-CD1 3.24Å; E590-T618 HydrophobicContact CB-CG2 4.23Å; E590-T618 HydrophobicContact CG-CG2 3.88Å; E590-Y620 HydrophobicContact CB-CE1 4.34Å; E590-Y620 HydrophobicContact CG-CD1 3.83Å; E590-Y620 HydrophobicContact CG-CE1 3.14Å; E590-Y620 PolarHBondContact OE1-OH 2.88Å
591	F	70.5	Confident	78.3	Confident	10 Å²	10	38.3 Å²	38.3	4%	0.044	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-47.8	-169.2	-174.7	-109	0	0	0	113.3	L315 I402 L435 R507 G619 H621 L641	L315-F591 HydrophobicContact CD2-CD1 4.3Å; L315-F591 HydrophobicContact CD2-CE1 4.12Å; I402-F591 HydrophobicContact CD1-CD1 4.02Å; I402-F591 HydrophobicContact CD1-CD2 4.13Å; I402-F591 HydrophobicContact CD1-CE1 3.57Å; I402-F591 HydrophobicContact CD1-CE2 3.71Å; I402-F591 HydrophobicContact CD1-CG 4.25Å; I402-F591 HydrophobicContact CD1-CZ 3.37Å; I402-F591 WeakPolarHBondContact CD1-O 3.19Å; I402-F591 HydrophobicContact CG1-CE2 4.39Å; I402-F591 HydrophobicContact CG1-CZ 4.06Å; L435-F591 HydrophobicContact CD1-CE1 3.59Å; L435-F591 HydrophobicContact CD1-CE2 4.29Å; L435-F591 HydrophobicContact CD1-CZ 3.31Å; L435-F591 HydrophobicContact CD2-CE2 4.08Å; L435-F591 HydrophobicContact CD2-CZ 3.91Å; L435-F591 HydrophobicContact CG-CE1 4.3Å; L435-F591 HydrophobicContact CG-CE2 4.1Å; L435-F591 HydrophobicContact CG-CZ 3.55Å; R507-F591 PolarHBondContact NH1-O 2.91Å; F591-G619 WeakPolarHBondContact CB-O 3.47Å; F591-G619 PolarHBondContact N-O 2.92Å; F591-H621 AromaticContact CD2-NE2 3.36Å; F591-H621 WeakPolarHBondContact CD2-NE2 3.06Å; F591-H621 AromaticContact CE2-NE2 3.79Å; F591-L641 HydrophobicContact CB-CD1 4.16Å; F591-L641 HydrophobicContact CB-CD2 4.12Å; F591-L641 HydrophobicContact CD1-CD2 4.37Å; F591-L641 HydrophobicContact CD2-CD1 3.64Å; F591-L641 HydrophobicContact CD2-CD2 3.46Å; F591-L641 VanDerWaalsContact CD2-CD2 3.46Å; F591-L641 HydrophobicContact CD2-CG 4.24Å; F591-L641 HydrophobicContact CE2-CD2 3.99Å; F591-L641 HydrophobicContact CG-CD1 4.23Å; F591-L641 HydrophobicContact CG-CD2 3.7Å
592	N	63.1	Low	77.7	Confident	85 Å²	85	40.6 Å²	40.6	46%	0.455	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.1	5.6	-168.2	-144	29.7	0	0	0	115.2	E590	E590-N592 VanDerWaalsContact C-N 3.25Å; E590-N592 PolarHBondContact O-N 2.93Å
593	T	63.9	Low	76.9	Confident	96 Å²	96	39.1 Å²	39.1	59%	0.589	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.4	-25	-169	42.5	0	0	0	0	115.5	E590	E590-T593 WeakPolarHBondContact CB-OG1 3.44Å; E590-T593 PolarHBondContact OE2-OG1 2.78Å
594	S	62.2	Low	76	Confident	22 Å²	22	39.9 Å²	39.9	15%	0.154	23%	0.231	C	C	.	.			trans	-105.6	134.1	-179.7	54.2	0	0	0	0	112.9	T589 E590 S596	T589-S594 PolarHBondContact OG1-OG 2.88Å; E590-S594 WeakPolarHBondContact CB-OG 3.46Å; E590-S594 PolarHBondContact N-OG 2.99Å; E590-S594 PolarHBondContact O-OG 3.22Å; S594-S596 VanDerWaalsContact C-N 3.29Å; S594-S596 PolarHBondContact O-N 2.85Å
595	N	68	Low	74.8	Confident	92 Å²	92	44.2 Å²	44.2	49%	0.492	26%	0.259	S	S	.	.	S	Bend	trans	-80.8	-7.6	179.4	-64	-8.8	0	0	0	113.5	R507 S508	R507-N595 CarbonylContact C-O 3.51Å; R507-N595 WeakPolarHBondContact CA-O 3.37Å; R507-N595 VanDerWaalsContact CB-O 3.3Å; R507-N595 WeakPolarHBondContact CB-O 3.27Å; S508-N595 PolarHBondContact N-O 2.82Å
596	S	76.4	Confident	73.7	Confident	55 Å²	55	49.2 Å²	49.2	39%	0.385	28%	0.278	S	S	.	.	S	Bend	trans	-144.3	169.5	-172.1	63.7	0	0	0	0	112.9	S508 T589 S594	S508-S596 WeakPolarHBondContact O-CA 3.49Å; S508-S596 WeakPolarHBondContact O-CB 3.08Å; T589-S596 WeakPolarHBondContact CB-O 3.29Å; T589-S596 PolarHBondContact OG1-O 3Å; S594-S596 VanDerWaalsContact C-N 3.29Å; S594-S596 PolarHBondContact O-N 2.85Å
597	W	84.5	Confident	73	Confident	20 Å²	20	54.6 Å²	54.6	8%	0.076	31%	0.306	C	S	.	.			trans	-84.1	140.3	166.2	-65.7	89.9	0	0	0	110.5	L404 P405 L431 E587 T589 H621 L623	L404-W597 HydrophobicContact CD1-CZ2 4.45Å; P405-W597 PolarHBondContact O-NE1 2.8Å; L431-W597 HydrophobicContact CD1-CH2 4.49Å; L431-W597 HydrophobicContact CD1-CZ2 3.95Å; E587-W597 HydrophobicContact CB-CB 4.45Å; E587-W597 HydrophobicContact CB-CE3 4.08Å; T589-W597 HydrophobicContact CG2-CD2 3.92Å; T589-W597 HydrophobicContact CG2-CE3 3.86Å; T589-W597 HydrophobicContact CG2-CH2 3.76Å; T589-W597 HydrophobicContact CG2-CZ2 3.8Å; T589-W597 HydrophobicContact CG2-CZ3 3.8Å; W597-H621 HydrophobicContact CH2-CB 3.81Å; W597-H621 HydrophobicContact CZ3-CB 4.14Å; W597-L623 HydrophobicContact CD2-CD2 4.19Å; W597-L623 HydrophobicContact CE3-CD2 3.94Å; W597-L623 HydrophobicContact CE3-CG 4.15Å; W597-L623 HydrophobicContact CH2-CD2 3.95Å; W597-L623 HydrophobicContact CH2-CG 4.45Å; W597-L623 HydrophobicContact CZ2-CD2 4.2Å; W597-L623 HydrophobicContact CZ3-CB 4.35Å; W597-L623 HydrophobicContact CZ3-CD2 3.81Å; W597-L623 HydrophobicContact CZ3-CG 3.93Å
598	R	84.6	Confident	72.4	Confident	83 Å²	83	57.1 Å²	57.1	31%	0.313	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.8	171.3	71.4	-178.5	-170.3	-131.2	8.4	110.6	E587 V588 E590 V600 G613 Y620	E587-R598 CarbonylContact C-O 3.47Å; E587-R598 VanDerWaalsContact CA-O 3.28Å; E587-R598 WeakPolarHBondContact CA-O 3.1Å; V588-R598 HydrophobicContact CG2-CG 3.76Å; V588-R598 PolarHBondContact N-O 2.98Å; V588-R598 PolarHBondContact O-N 2.83Å; E590-R598 IonicContact OE1-CZ 3.4Å; E590-R598 IonicContact OE1-NH1 2.69Å; E590-R598 PolarHBondContact OE1-NH1 3.42Å; E590-R598 IonicContact OE1-NH2 3.5Å; R598-V600 HydrophobicContact CG-CG2 3.88Å; R598-V600 PolarHBondContact O-N 2.94Å; R598-G613 PolarHBondContact NH2-O 2.87Å; R598-Y620 PolarHBondContact NH2-OH 2.83Å
599	V	84.1	Confident	72	Confident	82 Å²	82	57.2 Å²	57.2	50%	0.497	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	125.2	166	179.8	0	0	0	0	107.8	Q585 V586 E587	Q585-V599 HydrophobicContact CG-CG1 4.15Å; Q585-V599 HydrophobicContact CG-CG2 4.3Å; V586-V599 WeakPolarHBondContact O-CA 3.47Å; E587-V599 HydrophobicContact CG-CG2 3.8Å
600	V	75.8	Confident	72	Confident	42 Å²	42	63.4 Å²	63.4	26%	0.255	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-34.6	-178.9	179.4	0	0	0	0	111.8	V586 V588 R598 V611 S612	V586-V600 PolarHBondContact O-N 3.05Å; V588-V600 HydrophobicContact CB-CG2 4.28Å; V588-V600 HydrophobicContact CG1-CG2 3.92Å; V588-V600 HydrophobicContact CG2-CG2 3.5Å; R598-V600 HydrophobicContact CG-CG2 3.88Å; R598-V600 PolarHBondContact O-N 2.94Å; V600-V611 HydrophobicContact CB-CG1 4.06Å; V600-V611 HydrophobicContact CG1-CG1 3.67Å; V600-V611 HydrophobicContact CG2-CG1 4.47Å; V600-S612 WeakPolarHBondContact CG1-O 3.39Å
601	E	68.9	Low	72.2	Confident	45 Å²	45	62.6 Å²	62.6	21%	0.21	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	135.4	179.4	-153.8	-179.2	142.7	0	0	110	V586 S603 V609 R610 V611	V586-E601 PolarHBondContact N-O 2.83Å; E601-S603 WeakPolarHBondContact OE1-CB 3.42Å; E601-S603 PolarHBondContact OE1-OG 2.93Å; E601-V609 HydrophobicContact CB-CG1 4.45Å; E601-V609 VanDerWaalsContact CD-CG1 3.44Å; E601-V609 HydrophobicContact CG-CG1 4.41Å; E601-V609 WeakPolarHBondContact OE2-CG1 3.31Å; E601-R610 PolarHBondContact OE2-N 2.9Å; E601-V611 PolarHBondContact OE2-N 2.83Å
602	S	62.6	Low	72.9	Confident	94 Å²	94	64.6 Å²	64.6	66%	0.657	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	102.1	167.1	-174.8	0	0	0	0	106.4	V584	V584-S602 WeakPolarHBondContact O-CA 3.29Å
603	S	61.5	Low	73.7	Confident	26 Å²	26	63.5 Å²	63.5	18%	0.182	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	168.8	-168.8	63.8	0	0	0	0	111.6	G583 V584 E601	G583-S603 CarbonylContact C-O 3.54Å; G583-S603 WeakPolarHBondContact CA-O 3.38Å; V584-S603 PolarHBondContact N-O 3.44Å; V584-S603 PolarHBondContact O-N 3.37Å; V584-S603 VanDerWaalsContact O-N 3.14Å; E601-S603 WeakPolarHBondContact OE1-CB 3.42Å; E601-S603 PolarHBondContact OE1-OG 2.93Å
604	G	62	Low	74.7	Confident	24 Å²	24	59.1 Å²	59.1	25%	0.247	34%	0.342	C	S	.	.	S	Bend	trans	-64.6	-177.4	-174.5	0	0	0	0	0	114.5	Y606	G604-Y606 VanDerWaalsContact C-N 3.32Å; G604-Y606 WeakPolarHBondContact O-CD2 3.32Å; G604-Y606 PolarHBondContact O-N 2.83Å
605	P	61.8	Low	75.5	Confident	93 Å²	93	62.3 Å²	62.3	60%	0.604	36%	0.357	S	S	*	.	S	Bend	trans	-74.1	82.4	-175.3	31	-34.7	0	0	0	111.4	T582	T582-P605 WeakPolarHBondContact O-CD 3.28Å
606	Y	65.5	Low	75.6	Confident	135 Å²	135	60 Å²	60	53%	0.529	35%	0.347	S	S	.	.			trans	-104.2	142.6	177.7	-60.2	-66	0	0	0	111.9	G604 S608	G604-Y606 VanDerWaalsContact C-N 3.32Å; G604-Y606 WeakPolarHBondContact O-CD2 3.32Å; G604-Y606 PolarHBondContact O-N 2.83Å; Y606-S608 VanDerWaalsContact CB-O 3.3Å; Y606-S608 WeakPolarHBondContact CB-O 3.42Å; Y606-S608 PolarHBondContact O-N 3.28Å
607	N	73.1	Confident	75.2	Confident	112 Å²	112	63.1 Å²	63.1	60%	0.599	36%	0.356	S	S	*	.	S	Bend	trans	-77.8	-4	170.5	-68.5	-29.4	0	0	0	112.9	L560 N562	L560-N607 PolarHBondContact N-O 3.1Å; N562-N607 PolarHBondContact ND2-OD1 3.43Å
608	S	77.7	Confident	74.5	Confident	65 Å²	65	63.6 Å²	63.6	46%	0.455	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	139.2	173.7	57.4	0	0	0	0	111	L558 Y606	L558-S608 CarbonylContact O-C 3.56Å; L558-S608 VanDerWaalsContact O-CA 3.25Å; L558-S608 WeakPolarHBondContact O-CA 3.48Å; Y606-S608 VanDerWaalsContact CB-O 3.3Å; Y606-S608 WeakPolarHBondContact CB-O 3.42Å; Y606-S608 PolarHBondContact O-N 3.28Å
609	V	81.1	Confident	74.1	Confident	3 Å²	3	60 Å²	60	2%	0.018	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.9	-172.3	-179.1	0	0	0	0	109.2	V557 L558 L560 V584 V586 E601	V557-V609 WeakPolarHBondContact CA-O 3.4Å; L558-V609 PolarHBondContact N-O 2.79Å; L558-V609 PolarHBondContact O-N 3.29Å; L560-V609 HydrophobicContact CD1-CG2 3.71Å; L560-V609 HydrophobicContact CG-CG2 4.35Å; V584-V609 HydrophobicContact CB-CG2 4.37Å; V584-V609 HydrophobicContact CG1-CG2 4.31Å; V584-V609 HydrophobicContact CG2-CG2 4.38Å; V586-V609 HydrophobicContact CG2-CG1 3.81Å; E601-V609 HydrophobicContact CB-CG1 4.45Å; E601-V609 VanDerWaalsContact CD-CG1 3.44Å; E601-V609 HydrophobicContact CG-CG1 4.41Å; E601-V609 WeakPolarHBondContact OE2-CG1 3.31Å
610	R	84.7	Confident	74.1	Confident	130 Å²	130	56 Å²	56	49%	0.491	33%	0.325	S	S	.	.			trans	-121.9	74	-172.9	-170.4	-174.7	167.5	-166.4	-5.9	111.7	W555 V556 V557 E601 S612	W555-R610 VanDerWaalsContact CD1-NH2 3.29Å; W555-R610 VanDerWaalsContact NE1-NH2 3.15Å; V556-R610 CarbonylContact O-C 3.52Å; V556-R610 WeakPolarHBondContact O-CA 3.2Å; V557-R610 HydrophobicContact CG2-CB 4.38Å; V557-R610 HydrophobicContact CG2-CG 3.91Å; E601-R610 PolarHBondContact OE2-N 2.9Å; R610-S612 PolarHBondContact O-N 3.42Å; R610-S612 VanDerWaalsContact O-N 3.07Å; R610-S612 PolarHBondContact O-OG 2.93Å
611	V	85.1	Confident	74.3	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.313	C	S	.	.			trans	-45	114.7	170.1	-167.5	0	0	0	0	109.8	W555 V556 L558 V586 V588 V600 E601 L614	W555-V611 CarbonylContact C-O 3.55Å; W555-V611 WeakPolarHBondContact CA-O 3.07Å; W555-V611 WeakPolarHBondContact CB-O 3.18Å; V556-V611 PolarHBondContact N-O 3.24Å; V556-V611 PolarHBondContact O-N 2.93Å; V556-V611 VanDerWaalsContact O-N 3.09Å; L558-V611 HydrophobicContact CD1-CG2 3.58Å; L558-V611 HydrophobicContact CG-CG2 4.18Å; V586-V611 HydrophobicContact CB-CG2 4.44Å; V586-V611 HydrophobicContact CG1-CG2 3.73Å; V588-V611 HydrophobicContact CG1-CG1 3.87Å; V600-V611 HydrophobicContact CB-CG1 4.06Å; V600-V611 HydrophobicContact CG1-CG1 3.67Å; V600-V611 HydrophobicContact CG2-CG1 4.47Å; E601-V611 PolarHBondContact OE2-N 2.83Å; V611-L614 HydrophobicContact CG1-CD1 4.27Å; V611-L614 HydrophobicContact CG1-CD2 3.99Å; V611-L614 HydrophobicContact CG1-CG 4.35Å
612	S	84.6	Confident	75.2	Confident	53 Å²	53	52 Å²	52	37%	0.371	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-131.8	163.5	-172.6	-64.2	0	0	0	0	111	T554 V600 R610	T554-S612 CarbonylContact O-C 3.52Å; V600-S612 WeakPolarHBondContact CG1-O 3.39Å; R610-S612 PolarHBondContact O-N 3.42Å; R610-S612 VanDerWaalsContact O-N 3.07Å; R610-S612 PolarHBondContact O-OG 2.93Å
613	G	80	Confident	76.5	Confident	61 Å²	61	47.5 Å²	47.5	63%	0.629	27%	0.272	S	S	*	.			trans	77.2	30.2	-173.4	0	0	0	0	0	113.1	T554 R598	T554-G613 PolarHBondContact O-N 2.85Å; R598-G613 PolarHBondContact NH2-O 2.87Å
614	L	84.3	Confident	77.8	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.026	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-84.2	154.5	170.3	-54.9	-177.4	0	0	0	110.4	T554 V556 V588 V611 Y620 T644	T554-L614 VanDerWaalsContact CA-O 3.26Å; T554-L614 WeakPolarHBondContact CA-O 3.47Å; T554-L614 WeakPolarHBondContact CB-O 3.33Å; T554-L614 WeakPolarHBondContact CG2-O 3.26Å; T554-L614 PolarHBondContact O-N 3.12Å; V556-L614 HydrophobicContact CB-CD1 4.26Å; V556-L614 HydrophobicContact CG2-CD1 3.7Å; V588-L614 HydrophobicContact CG2-CD2 4.19Å; V611-L614 HydrophobicContact CG1-CD1 4.27Å; V611-L614 HydrophobicContact CG1-CD2 3.99Å; V611-L614 HydrophobicContact CG1-CG 4.35Å; L614-Y620 HydrophobicContact CB-CD2 4.36Å; L614-Y620 HydrophobicContact CB-CE2 3.7Å; L614-Y620 HydrophobicContact CD1-CD2 4.18Å; L614-Y620 HydrophobicContact CD1-CE2 4.35Å; L614-Y620 HydrophobicContact CD2-CD1 4.09Å; L614-Y620 HydrophobicContact CD2-CD2 4.33Å; L614-Y620 HydrophobicContact CD2-CE1 3.83Å; L614-Y620 HydrophobicContact CD2-CE2 4.1Å; L614-Y620 HydrophobicContact CD2-CG 4.34Å; L614-Y620 HydrophobicContact CG-CE2 4.26Å; L614-T644 HydrophobicContact CB-CG2 3.74Å; L614-T644 HydrophobicContact CD1-CG2 3.92Å
615	L	78.3	Confident	79.1	Confident	88 Å²	88	45.2 Å²	45.2	46%	0.461	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-79.1	144.4	173	-63	179.5	0	0	0	110.5	D553 E590 T618 Y620 T644	D553-L615 CarbonylContact O-C 3.59Å; E590-L615 WeakPolarHBondContact OE1-CD1 3.24Å; L615-T618 HydrophobicContact CB-CG2 4.37Å; L615-T618 WeakPolarHBondContact CB-OG1 3.44Å; L615-T618 WeakPolarHBondContact O-CB 3.44Å; L615-Y620 WeakPolarHBondContact CB-OH 3.42Å; L615-Y620 PolarHBondContact N-OH 2.87Å; L615-T644 WeakPolarHBondContact O-CB 3.14Å; L615-T644 WeakPolarHBondContact O-CG2 3.33Å; L615-T644 PolarHBondContact O-OG1 2.74Å
616	P	71	Confident	80.3	Confident	45 Å²	45	40.9 Å²	40.9	29%	0.292	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	154.5	172.1	-23.4	34.9	0	0	0	114	D553 T554 T618 T644	D553-P616 VanDerWaalsContact O-CA 3.22Å; D553-P616 WeakPolarHBondContact O-CA 3.49Å; T554-P616 HydrophobicContact CG2-CG 4.19Å; P616-T618 PolarHBondContact O-N 2.84Å; P616-T618 PolarHBondContact O-OG1 2.88Å; P616-T644 VanDerWaalsContact C-OG1 3.29Å; P616-T644 WeakPolarHBondContact CA-OG1 3.49Å
617	Q	68.2	Low	81.1	Confident	120 Å²	120	35.8 Å²	35.8	56%	0.561	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	17.7	-178.1	-57.1	-169.5	-106.7	0	0	116	T644 K645 T646	Q617-T644 WeakPolarHBondContact CA-O 3.21Å; Q617-T644 PolarHBondContact N-OG1 2.85Å; Q617-T644 VanDerWaalsContact N-OG1 3.08Å; Q617-K645 PolarHBondContact N-O 2.98Å; Q617-T646 VanDerWaalsContact CD-CG2 3.44Å; Q617-T646 HydrophobicContact CG-CG2 3.68Å
618	T	70.5	Confident	81.5	Confident	30 Å²	30	30.9 Å²	30.9	18%	0.184	18%	0.18	C	C	.	.			trans	-106.4	134	-169.3	-60.9	0	0	0	0	109.7	E590 L615 P616 Y620 F643 T644	E590-T618 HydrophobicContact CB-CG2 4.23Å; E590-T618 HydrophobicContact CG-CG2 3.88Å; L615-T618 HydrophobicContact CB-CG2 4.37Å; L615-T618 WeakPolarHBondContact CB-OG1 3.44Å; L615-T618 WeakPolarHBondContact O-CB 3.44Å; P616-T618 PolarHBondContact O-N 2.84Å; P616-T618 PolarHBondContact O-OG1 2.88Å; T618-Y620 HydrophobicContact CG2-CD2 4.31Å; T618-Y620 HydrophobicContact CG2-CE2 3.66Å; T618-Y620 WeakPolarHBondContact O-CD2 3.43Å; T618-F643 WeakPolarHBondContact O-CA 3.39Å; T618-T644 PolarHBondContact N-OG1 2.75Å; T618-T644 PolarHBondContact O-N 2.7Å; T618-T644 VanDerWaalsContact O-N 3.1Å; T618-T644 PolarHBondContact O-OG1 2.92Å
619	G	76.2	Confident	81.4	Confident	6 Å²	6	34.4 Å²	34.4	6%	0.062	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129	176.6	0	0	0	0	0	111.2	F591 F643	F591-G619 WeakPolarHBondContact CB-O 3.47Å; F591-G619 PolarHBondContact N-O 2.92Å; G619-F643 VanDerWaalsContact CA-CD1 3.48Å; G619-F643 VanDerWaalsContact CA-CE1 3.49Å
620	Y	82.4	Confident	81.3	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130	-179.3	-74.6	-84.5	0	0	0	111.9	V588 T589 E590 R598 L614 L615 T618 L641 V642 T644	V588-Y620 HydrophobicContact CB-CD1 3.96Å; V588-Y620 HydrophobicContact CG2-CD1 3.68Å; V588-Y620 HydrophobicContact CG2-CE1 3.89Å; T589-Y620 WeakPolarHBondContact O-CA 3.39Å; E590-Y620 HydrophobicContact CB-CE1 4.34Å; E590-Y620 HydrophobicContact CG-CD1 3.83Å; E590-Y620 HydrophobicContact CG-CE1 3.14Å; E590-Y620 PolarHBondContact OE1-OH 2.88Å; R598-Y620 PolarHBondContact NH2-OH 2.83Å; L614-Y620 HydrophobicContact CB-CD2 4.36Å; L614-Y620 HydrophobicContact CB-CE2 3.7Å; L614-Y620 HydrophobicContact CD1-CD2 4.18Å; L614-Y620 HydrophobicContact CD1-CE2 4.35Å; L614-Y620 HydrophobicContact CD2-CD1 4.09Å; L614-Y620 HydrophobicContact CD2-CD2 4.33Å; L614-Y620 HydrophobicContact CD2-CE1 3.83Å; L614-Y620 HydrophobicContact CD2-CE2 4.1Å; L614-Y620 HydrophobicContact CD2-CG 4.34Å; L614-Y620 HydrophobicContact CG-CE2 4.26Å; L615-Y620 WeakPolarHBondContact CB-OH 3.42Å; L615-Y620 PolarHBondContact N-OH 2.87Å; T618-Y620 HydrophobicContact CG2-CD2 4.31Å; T618-Y620 HydrophobicContact CG2-CE2 3.66Å; T618-Y620 WeakPolarHBondContact O-CD2 3.43Å; Y620-L641 WeakPolarHBondContact O-CD1 3.45Å; Y620-V642 PolarHBondContact N-O 2.86Å; Y620-V642 PolarHBondContact O-N 3.09Å; Y620-T644 HydrophobicContact CD2-CG2 4.25Å; Y620-T644 HydrophobicContact CE2-CG2 4.15Å
621	H	81.8	Confident	81.2	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	141.6	152.4	-64.9	-83.9	0	0	0	108.3	Y433 V588 T589 F591 W597	Y433-H621 AromaticContact CD1-CE1 3.69Å; Y433-H621 AromaticContact CD2-CE1 3.34Å; Y433-H621 WeakPolarHBondContact CD2-CE1 3.46Å; Y433-H621 AromaticContact CD2-ND1 4Å; Y433-H621 AromaticContact CD2-NE2 3.81Å; Y433-H621 AromaticContact CE1-CE1 3.7Å; Y433-H621 AromaticContact CE1-ND1 3.72Å; Y433-H621 AromaticContact CE2-CE1 3.34Å; Y433-H621 WeakPolarHBondContact CE2-CE1 3.48Å; Y433-H621 AromaticContact CE2-ND1 3.51Å; Y433-H621 AromaticContact CE2-NE2 3.95Å; Y433-H621 AromaticContact CG-CE1 3.48Å; Y433-H621 VanDerWaalsContact CG-CE1 3.48Å; Y433-H621 AromaticContact CZ-CE1 3.5Å; Y433-H621 AromaticContact CZ-ND1 3.33Å; Y433-H621 VanDerWaalsContact CZ-ND1 3.33Å; V588-H621 VanDerWaalsContact CA-O 3.25Å; V588-H621 WeakPolarHBondContact CA-O 3.32Å; V588-H621 WeakPolarHBondContact CB-O 3.47Å; T589-H621 HydrophobicContact CG2-CB 3.88Å; T589-H621 PolarHBondContact N-O 2.82Å; T589-H621 PolarHBondContact O-N 3.08Å; F591-H621 AromaticContact CD2-NE2 3.36Å; F591-H621 WeakPolarHBondContact CD2-NE2 3.06Å; F591-H621 AromaticContact CE2-NE2 3.79Å; W597-H621 HydrophobicContact CH2-CB 3.81Å; W597-H621 HydrophobicContact CZ3-CB 4.14Å
622	I	87.7	Confident	81.3	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	133.1	-178.1	-54.9	-176.2	0	0	0	108.1	V556 L558 V586 V588 I624 L638 V642	V556-I622 HydrophobicContact CG1-CD1 4.29Å; L558-I622 HydrophobicContact CD1-CG2 3.87Å; V586-I622 HydrophobicContact CG1-CG2 3.8Å; V588-I622 HydrophobicContact CG1-CG1 4.02Å; V588-I622 HydrophobicContact CG1-CG2 4.3Å; I622-I624 HydrophobicContact CG2-CD1 4.11Å; I622-L638 HydrophobicContact CB-CB 4.44Å; I622-L638 WeakPolarHBondContact O-CB 3.45Å; I622-L638 PolarHBondContact O-N 2.84Å; I622-V642 HydrophobicContact CD1-CB 4.16Å; I622-V642 HydrophobicContact CD1-CG2 3.9Å; I622-V642 HydrophobicContact CG1-CG2 4.46Å
623	L	88.9	Confident	81.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	153.2	167.9	74.2	75	0	0	0	111	L406 E587 W597 R625 P635 F636 I637	L406-L623 HydrophobicContact CD1-CD2 3.53Å; E587-L623 HydrophobicContact CB-CD1 3.76Å; E587-L623 HydrophobicContact CB-CG 3.89Å; E587-L623 HydrophobicContact CG-CD1 4.2Å; E587-L623 PolarHBondContact N-O 3.08Å; E587-L623 PolarHBondContact O-N 3.45Å; W597-L623 HydrophobicContact CD2-CD2 4.19Å; W597-L623 HydrophobicContact CE3-CD2 3.94Å; W597-L623 HydrophobicContact CE3-CG 4.15Å; W597-L623 HydrophobicContact CH2-CD2 3.95Å; W597-L623 HydrophobicContact CH2-CG 4.45Å; W597-L623 HydrophobicContact CZ2-CD2 4.2Å; W597-L623 HydrophobicContact CZ3-CB 4.35Å; W597-L623 HydrophobicContact CZ3-CD2 3.81Å; W597-L623 HydrophobicContact CZ3-CG 3.93Å; L623-R625 HydrophobicContact CD1-CG 4.08Å; L623-P635 HydrophobicContact CB-CB 4.29Å; L623-P635 HydrophobicContact CD1-CB 3.74Å; L623-P635 HydrophobicContact CD2-CB 4.11Å; L623-P635 HydrophobicContact CG-CB 4.28Å; L623-F636 CarbonylContact C-O 3.51Å; L623-F636 WeakPolarHBondContact CA-O 3.34Å; L623-F636 WeakPolarHBondContact CB-O 3Å; L623-I637 HydrophobicContact CB-CG1 4.17Å
624	I	88.5	Confident	81.8	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	130.7	-172.1	-54	90.4	0	0	0	108.9	P543 V546 L558 L560 V584 V586 I622 F636	P543-I624 HydrophobicContact CG-CB 4.39Å; P543-I624 HydrophobicContact CG-CG2 3.97Å; V546-I624 HydrophobicContact CB-CD1 4.43Å; V546-I624 HydrophobicContact CG1-CD1 3.95Å; V546-I624 HydrophobicContact CG2-CD1 4.31Å; L558-I624 HydrophobicContact CD1-CD1 4.24Å; L558-I624 HydrophobicContact CD1-CG1 4.07Å; L560-I624 HydrophobicContact CD1-CG2 4.47Å; L560-I624 HydrophobicContact CD2-CG2 4.05Å; V584-I624 HydrophobicContact CG1-CG2 3.43Å; V584-I624 VanDerWaalsContact CG1-CG2 3.43Å; V586-I624 HydrophobicContact CG2-CG1 4.24Å; V586-I624 HydrophobicContact CG2-CG2 4.29Å; I622-I624 HydrophobicContact CG2-CD1 4.11Å; I624-F636 HydrophobicContact CD1-CD1 4.17Å; I624-F636 PolarHBondContact N-O 3.44Å; I624-F636 PolarHBondContact O-N 2.79Å
625	R	89.2	Confident	82	Confident	1 Å²	1	33.5 Å²	33.5	0%	0.004	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	146.4	175.4	-59	172.4	-170	-95	2.4	109.9	I407 E408 V584 Q585 E587 L623 V632 G633 P635	I407-R625 PolarHBondContact O-NH2 3.41Å; E408-R625 PolarHBondContact O-NH1 2.76Å; V584-R625 WeakPolarHBondContact CA-O 3.34Å; Q585-R625 HydrophobicContact CB-CB 4.38Å; Q585-R625 PolarHBondContact N-O 2.97Å; Q585-R625 PolarHBondContact O-N 3.07Å; E587-R625 VanDerWaalsContact OE1-CD 3.26Å; E587-R625 WeakPolarHBondContact OE1-CD 3.42Å; E587-R625 IonicContact OE1-CZ 3.88Å; E587-R625 IonicContact OE1-NE 2.78Å; E587-R625 PolarHBondContact OE1-NE 3.14Å; E587-R625 IonicContact OE1-NH2 3.15Å; E587-R625 IonicContact OE2-CZ 3.6Å; E587-R625 IonicContact OE2-NE 3.56Å; E587-R625 IonicContact OE2-NH2 3.5Å; E587-R625 PolarHBondContact OE2-NH2 3.36Å; L623-R625 HydrophobicContact CD1-CG 4.08Å; R625-V632 HydrophobicContact CB-CG1 3.65Å; R625-V632 VanDerWaalsContact CD-CG1 3.4Å; R625-V632 HydrophobicContact CG-CG1 4.16Å; R625-G633 WeakPolarHBondContact CD-O 3.36Å; R625-G633 PolarHBondContact NH1-O 2.96Å; R625-P635 HydrophobicContact CG-CB 4.06Å
626	Y	86.6	Confident	82.5	Confident	3 Å²	3	31.7 Å²	31.7	1%	0.012	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	154	162.7	-70.4	-34.3	0	0	0	111.1	P540 D541 P543 L560 N562 I581 V584 G633	P540-Y626 VanDerWaalsContact CG-C 3.47Å; P540-Y626 WeakPolarHBondContact CG-O 3.41Å; D541-Y626 WeakPolarHBondContact O-CD2 3.44Å; P543-Y626 HydrophobicContact CB-CE2 4.12Å; P543-Y626 HydrophobicContact CG-CD1 4.25Å; P543-Y626 HydrophobicContact CG-CD2 4.21Å; P543-Y626 HydrophobicContact CG-CE1 3.86Å; P543-Y626 HydrophobicContact CG-CE2 3.86Å; P543-Y626 HydrophobicContact CG-CG 4.4Å; L560-Y626 HydrophobicContact CD1-CE1 4.13Å; N562-Y626 PolarHBondContact OD1-OH 3.15Å; I581-Y626 HydrophobicContact CD1-CD1 4.41Å; I581-Y626 HydrophobicContact CD1-CD2 3.46Å; I581-Y626 VanDerWaalsContact CD1-CD2 3.46Å; I581-Y626 HydrophobicContact CD1-CE2 3.71Å; I581-Y626 HydrophobicContact CD1-CG 3.85Å; I581-Y626 HydrophobicContact CG1-CD2 4.22Å; I581-Y626 HydrophobicContact CG1-CG 4.21Å; I581-Y626 HydrophobicContact CG2-CD1 3.93Å; I581-Y626 HydrophobicContact CG2-CG 4.01Å; V584-Y626 HydrophobicContact CG2-CD1 4.08Å; V584-Y626 HydrophobicContact CG2-CE1 4.08Å; Y626-G633 PolarHBondContact O-N 3.49Å
627	V	84.2	Confident	83.2	Confident	28 Å²	28	32 Å²	32	17%	0.17	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140	178	-170.9	0	0	0	0	108.1	I581 T582 G583 Q585 G631 V632	I581-V627 CarbonylContact C-O 3.14Å; I581-V627 WeakPolarHBondContact CA-O 3.46Å; T582-V627 PolarHBondContact N-O 3.29Å; T582-V627 PolarHBondContact OG1-O 2.82Å; G583-V627 PolarHBondContact N-O 3.26Å; G583-V627 PolarHBondContact O-N 3.34Å; Q585-V627 HydrophobicContact CB-CG2 4.04Å; V627-G631 WeakPolarHBondContact CA-O 3.45Å; V627-V632 HydrophobicContact CG1-CG2 4.37Å; V627-V632 HydrophobicContact CG2-CG1 4.26Å; V627-V632 HydrophobicContact CG2-CG2 4.26Å
628	N	80	Confident	83.8	Confident	8 Å²	8	26.7 Å²	26.7	4%	0.043	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	-171.6	168.4	71.9	8.2	0	0	0	110.7	L538 F580 T582 Y630 G631	L538-N628 PolarHBondContact O-ND2 3.37Å; F580-N628 WeakPolarHBondContact O-CB 3.34Å; T582-N628 WeakPolarHBondContact OG1-CA 3.4Å; N628-Y630 PolarHBondContact O-N 3.34Å; N628-Y630 WeakPolarHBondContact OD1-CB 3.39Å; N628-Y630 PolarHBondContact OD1-N 3.46Å; N628-G631 PolarHBondContact N-O 3.09Å; N628-G631 PolarHBondContact O-N 3.27Å; N628-G631 PolarHBondContact OD1-N 2.87Å; N628-G631 PolarHBondContact OD1-O 2.9Å
629	H	76.9	Confident	83.9	Confident	139 Å²	139	30.6 Å²	30.6	64%	0.644	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-13.3	-178.8	-67.7	-86.1	0	0	0	114.5	S578 T582	S578-H629 WeakPolarHBondContact O-CB 3.27Å; S578-H629 PolarHBondContact O-N 3.1Å; T582-H629 VanDerWaalsContact CG2-CD2 3.47Å; T582-H629 WeakPolarHBondContact CG2-CD2 2.93Å; T582-H629 VanDerWaalsContact CG2-NE2 3.32Å; T582-H629 WeakPolarHBondContact CG2-NE2 3.19Å
630	Y	77.9	Confident	83.5	Confident	57 Å²	57	36 Å²	36	22%	0.224	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-18.6	177.4	-60	-74.1	0	0	0	113.5	L529 L538 S578 N628	L529-Y630 HydrophobicContact CD1-CD1 4.13Å; L529-Y630 HydrophobicContact CD1-CE1 4.34Å; L529-Y630 HydrophobicContact CD2-CE1 4Å; L529-Y630 HydrophobicContact CG-CE1 4.42Å; L538-Y630 HydrophobicContact CB-CD1 4.13Å; L538-Y630 HydrophobicContact CB-CD2 3.81Å; L538-Y630 HydrophobicContact CB-CE2 4.22Å; L538-Y630 HydrophobicContact CB-CG 3.74Å; L538-Y630 HydrophobicContact CD1-CD1 4.01Å; L538-Y630 HydrophobicContact CD1-CE1 3.95Å; L538-Y630 HydrophobicContact CD1-CG 4.47Å; L538-Y630 HydrophobicContact CD2-CE2 4.38Å; L538-Y630 WeakPolarHBondContact O-CD2 3.33Å; S578-Y630 PolarHBondContact OG-OH 3.08Å; N628-Y630 PolarHBondContact O-N 3.34Å; N628-Y630 WeakPolarHBondContact OD1-CB 3.39Å; N628-Y630 PolarHBondContact OD1-N 3.46Å
631	G	83.2	Confident	83.1	Confident	13 Å²	13	36.7 Å²	36.7	13%	0.134	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.2	-160.4	178.8	0	0	0	0	0	114.6	V627 N628	V627-G631 WeakPolarHBondContact CA-O 3.45Å; N628-G631 PolarHBondContact N-O 3.09Å; N628-G631 PolarHBondContact O-N 3.27Å; N628-G631 PolarHBondContact OD1-N 2.87Å; N628-G631 PolarHBondContact OD1-O 2.9Å
632	V	87.4	Confident	82.9	Confident	19 Å²	19	37 Å²	37	12%	0.115	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	133.2	178.8	-169.4	0	0	0	0	110.1	W511 Q585 R625 V627	W511-V632 HydrophobicContact CH2-CB 4Å; W511-V632 HydrophobicContact CH2-CG1 4.12Å; W511-V632 HydrophobicContact CZ2-CB 3.89Å; W511-V632 HydrophobicContact CZ2-CG1 4.47Å; W511-V632 HydrophobicContact CZ2-CG2 4.3Å; Q585-V632 HydrophobicContact CB-CG1 4.38Å; R625-V632 HydrophobicContact CB-CG1 3.65Å; R625-V632 VanDerWaalsContact CD-CG1 3.4Å; R625-V632 HydrophobicContact CG-CG1 4.16Å; V627-V632 HydrophobicContact CG1-CG2 4.37Å; V627-V632 HydrophobicContact CG2-CG1 4.26Å; V627-V632 HydrophobicContact CG2-CG2 4.26Å
633	G	86.9	Confident	82.4	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.19	C	C	.	.			trans	-78.3	-178.1	-176.9	0	0	0	0	0	116.1	P540 R625 Y626	P540-G633 VanDerWaalsContact O-CA 3.31Å; P540-G633 WeakPolarHBondContact O-CA 3.41Å; R625-G633 WeakPolarHBondContact CD-O 3.36Å; R625-G633 PolarHBondContact NH1-O 2.96Å; Y626-G633 PolarHBondContact O-N 3.49Å
634	R	87.8	Confident	81.7	Confident	125 Å²	125	40.3 Å²	40.3	47%	0.472	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-64.2	153.6	170.6	-71.4	-176.8	-175.5	144.7	10.5	110.7	I409 D536	I409-R634 HydrophobicContact CD1-CG 4.04Å; I409-R634 HydrophobicContact CG1-CG 3.86Å; D536-R634 IonicContact OD2-NH2 3.41Å
635	P	89.3	Confident	80.7	Confident	20 Å²	20	45.7 Å²	45.7	13%	0.13	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-87.2	140.7	-175.2	33.1	-30.7	0	0	0	112.9	L406 L623 R625	L406-P635 HydrophobicContact CD1-CG 4.39Å; L406-P635 HydrophobicContact CD2-CG 3.9Å; L623-P635 HydrophobicContact CB-CB 4.29Å; L623-P635 HydrophobicContact CD1-CB 3.74Å; L623-P635 HydrophobicContact CD2-CB 4.11Å; L623-P635 HydrophobicContact CG-CB 4.28Å; R625-P635 HydrophobicContact CG-CB 4.06Å
636	F	88.3	Confident	79.5	Confident	49 Å²	49	49.9 Å²	49.9	22%	0.215	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.2	153.1	179	-86.1	0	0	0	108.6	P542 P543 V546 L623 I624 L638	P542-F636 HydrophobicContact CB-CB 4.18Å; P543-F636 HydrophobicContact CB-CB 4.31Å; P543-F636 HydrophobicContact CG-CB 4.23Å; P543-F636 WeakPolarHBondContact O-CD2 3.47Å; V546-F636 HydrophobicContact CB-CD1 3.88Å; V546-F636 HydrophobicContact CB-CE1 3.62Å; V546-F636 HydrophobicContact CB-CZ 4.28Å; V546-F636 HydrophobicContact CG2-CD1 3.59Å; V546-F636 HydrophobicContact CG2-CE1 3.82Å; V546-F636 HydrophobicContact CG2-CG 4.08Å; V546-F636 HydrophobicContact CG2-CZ 4.45Å; L623-F636 CarbonylContact C-O 3.51Å; L623-F636 WeakPolarHBondContact CA-O 3.34Å; L623-F636 WeakPolarHBondContact CB-O 3Å; I624-F636 HydrophobicContact CD1-CD1 4.17Å; I624-F636 PolarHBondContact N-O 3.44Å; I624-F636 PolarHBondContact O-N 2.79Å; F636-L638 HydrophobicContact CE1-CD1 4.37Å
637	I	84.9	Confident	78	Confident	51 Å²	51	53.7 Å²	53.7	26%	0.262	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.3	179.7	-59.4	159.1	0	0	0	108.7	L406 L431 Y433 L623 N639	L406-I637 HydrophobicContact CD2-CD1 3.89Å; L431-I637 HydrophobicContact CD1-CD1 3.77Å; L431-I637 HydrophobicContact CD1-CG1 4.41Å; L431-I637 HydrophobicContact CD1-CG2 4.46Å; L431-I637 HydrophobicContact CD2-CD1 3.68Å; L431-I637 HydrophobicContact CG-CD1 4.39Å; Y433-I637 WeakPolarHBondContact OH-CG2 3.34Å; L623-I637 HydrophobicContact CB-CG1 4.17Å; I637-N639 PolarHBondContact O-N 2.82Å
638	L	81.5	Confident	76.5	Confident	9 Å²	9	53.3 Å²	53.3	5%	0.047	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-72.1	119.7	178.3	-165	78.7	0	0	0	110.5	V546 V548 I622 F636 K640 V642	V546-L638 HydrophobicContact CG1-CD1 4.48Å; V548-L638 HydrophobicContact CG2-CD1 4.43Å; V548-L638 HydrophobicContact CG2-CD2 3.61Å; I622-L638 HydrophobicContact CB-CB 4.44Å; I622-L638 WeakPolarHBondContact O-CB 3.45Å; I622-L638 PolarHBondContact O-N 2.84Å; F636-L638 HydrophobicContact CE1-CD1 4.37Å; L638-K640 PolarHBondContact O-N 2.86Å; L638-V642 HydrophobicContact CD2-CG2 3.31Å
639	N	71.9	Confident	75.1	Confident	112 Å²	112	56.3 Å²	56.3	60%	0.599	29%	0.292	S	S	*	.	S	Bend	trans	-74.4	16.6	-175.3	69.3	-9	0	0	0	115.5	I637	I637-N639 PolarHBondContact O-N 2.82Å
640	K	68.9	Low	74	Confident	119 Å²	119	50.3 Å²	50.3	52%	0.517	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-144.4	143.1	179.1	-65.7	-172	-179.5	-171.5	0	109.9	L638	L638-K640 PolarHBondContact O-N 2.86Å
641	L	72.8	Confident	72.6	Confident	15 Å²	15	51.7 Å²	51.7	8%	0.079	27%	0.27	C	S	.	.			trans	-77.7	130.3	175.8	-164.3	67	0	0	0	109.9	L435 L441 F591 Y620 F643	L435-L641 HydrophobicContact CD2-CD2 4.06Å; L441-L641 HydrophobicContact CD1-CB 4.15Å; L441-L641 HydrophobicContact CG-CB 4.42Å; F591-L641 HydrophobicContact CB-CD1 4.16Å; F591-L641 HydrophobicContact CB-CD2 4.12Å; F591-L641 HydrophobicContact CD1-CD2 4.37Å; F591-L641 HydrophobicContact CD2-CD1 3.64Å; F591-L641 HydrophobicContact CD2-CD2 3.46Å; F591-L641 VanDerWaalsContact CD2-CD2 3.46Å; F591-L641 HydrophobicContact CD2-CG 4.24Å; F591-L641 HydrophobicContact CE2-CD2 3.99Å; F591-L641 HydrophobicContact CG-CD1 4.23Å; F591-L641 HydrophobicContact CG-CD2 3.7Å; Y620-L641 WeakPolarHBondContact O-CD1 3.45Å; L641-F643 HydrophobicContact CB-CE2 4.27Å; L641-F643 HydrophobicContact CD2-CE1 4.46Å; L641-F643 HydrophobicContact CD2-CE2 3.63Å; L641-F643 HydrophobicContact CD2-CZ 3.48Å; L641-F643 VanDerWaalsContact CD2-CZ 3.48Å; L641-F643 HydrophobicContact CG-CE2 3.99Å; L641-F643 HydrophobicContact CG-CZ 4.2Å
642	V	78.6	Confident	71.4	Confident	7 Å²	7	58 Å²	58	4%	0.042	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	110.5	-176.5	-166.6	0	0	0	0	110.3	V548 I551 V556 Y620 I622 L638	V548-V642 HydrophobicContact CG1-CG1 4.42Å; V548-V642 HydrophobicContact CG2-CG1 4.49Å; V548-V642 HydrophobicContact CG2-CG2 3.85Å; I551-V642 HydrophobicContact CD1-CG1 3.86Å; I551-V642 HydrophobicContact CG1-CG1 4.23Å; V556-V642 HydrophobicContact CG1-CG1 4.1Å; V556-V642 HydrophobicContact CG2-CG1 3.61Å; Y620-V642 PolarHBondContact N-O 2.86Å; Y620-V642 PolarHBondContact O-N 3.09Å; I622-V642 HydrophobicContact CD1-CB 4.16Å; I622-V642 HydrophobicContact CD1-CG2 3.9Å; I622-V642 HydrophobicContact CG1-CG2 4.46Å; L638-V642 HydrophobicContact CD2-CG2 3.31Å
643	F	76.8	Confident	70.2	Confident	64 Å²	64	59.9 Å²	59.9	28%	0.281	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.7	174	-71.9	-85.8	0	0	0	111.1	L372 I551 T618 G619 L641	L372-F643 HydrophobicContact CB-CZ 4.27Å; L372-F643 HydrophobicContact CD1-CE1 4.4Å; L372-F643 HydrophobicContact CD1-CZ 3.64Å; I551-F643 VanDerWaalsContact CG2-O 3.25Å; I551-F643 WeakPolarHBondContact CG2-O 3.31Å; T618-F643 WeakPolarHBondContact O-CA 3.39Å; G619-F643 VanDerWaalsContact CA-CD1 3.48Å; G619-F643 VanDerWaalsContact CA-CE1 3.49Å; L641-F643 HydrophobicContact CB-CE2 4.27Å; L641-F643 HydrophobicContact CD2-CE1 4.46Å; L641-F643 HydrophobicContact CD2-CE2 3.63Å; L641-F643 HydrophobicContact CD2-CZ 3.48Å; L641-F643 VanDerWaalsContact CD2-CZ 3.48Å; L641-F643 HydrophobicContact CG-CE2 3.99Å; L641-F643 HydrophobicContact CG-CZ 4.2Å
644	T	75	Confident	69.4	Low	7 Å²	7	65.1 Å²	65.1	4%	0.043	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-67.8	155	164.9	53.6	0	0	0	0	111.3	G552 D553 L614 L615 P616 Q617 T618 Y620	G552-T644 WeakPolarHBondContact O-CA 3.44Å; D553-T644 VanDerWaalsContact O-CB 3.28Å; D553-T644 WeakPolarHBondContact O-CB 3.47Å; L614-T644 HydrophobicContact CB-CG2 3.74Å; L614-T644 HydrophobicContact CD1-CG2 3.92Å; L615-T644 WeakPolarHBondContact O-CB 3.14Å; L615-T644 WeakPolarHBondContact O-CG2 3.33Å; L615-T644 PolarHBondContact O-OG1 2.74Å; P616-T644 VanDerWaalsContact C-OG1 3.29Å; P616-T644 WeakPolarHBondContact CA-OG1 3.49Å; Q617-T644 WeakPolarHBondContact CA-O 3.21Å; Q617-T644 PolarHBondContact N-OG1 2.85Å; Q617-T644 VanDerWaalsContact N-OG1 3.08Å; T618-T644 PolarHBondContact N-OG1 2.75Å; T618-T644 PolarHBondContact O-N 2.7Å; T618-T644 VanDerWaalsContact O-N 3.1Å; T618-T644 PolarHBondContact O-OG1 2.92Å; Y620-T644 HydrophobicContact CD2-CG2 4.25Å; Y620-T644 HydrophobicContact CE2-CG2 4.15Å
645	K	67.5	Low	68.5	Low	113 Å²	113	61 Å²	61	49%	0.491	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-71.4	166.7	176.3	-68.6	171.5	178.4	161.7	0	111.4	I551 G552 D553 Q617	I551-K645 HydrophobicContact CG2-CG 4.33Å; I551-K645 WeakPolarHBondContact O-CD 3.44Å; I551-K645 WeakPolarHBondContact O-CE 3.38Å; I551-K645 PolarHBondContact O-NZ 2.76Å; G552-K645 PolarHBondContact O-N 2.93Å; D553-K645 HydrophobicContact CB-CB 4.49Å; Q617-K645 PolarHBondContact N-O 2.98Å
646	T	62.3	Low	67.9	Low	90 Å²	90	64.3 Å²	64.3	55%	0.552	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-54.5	142.4	161.2	32.4	0	0	0	0	110.6	D553 Q617 G648	D553-T646 WeakPolarHBondContact CB-O 3.17Å; Q617-T646 VanDerWaalsContact CD-CG2 3.44Å; Q617-T646 HydrophobicContact CG-CG2 3.68Å; T646-G648 PolarHBondContact O-N 3.23Å; T646-G648 VanDerWaalsContact O-N 3.08Å
647	S	55.7	Low	67.5	Low	83 Å²	83	65.5 Å²	65.5	58%	0.58	35%	0.351	S	S	*	.			trans	-60	113.7	175.7	-169.4	0	0	0	0	109.9	S649	S647-S649 PolarHBondContact O-N 3.3Å; S647-S649 VanDerWaalsContact O-N 3.12Å
648	G	52.2	Low	67.1	Low	19 Å²	19	63 Å²	63	20%	0.196	34%	0.339	C	S	.	.			trans	-82.1	91.6	-174.6	0	0	0	0	0	111	D553 T646 T650 R651	D553-G648 PolarHBondContact OD2-N 3.31Å; T646-G648 PolarHBondContact O-N 3.23Å; T646-G648 VanDerWaalsContact O-N 3.08Å; G648-T650 PolarHBondContact O-N 2.94Å; G648-R651 WeakPolarHBondContact O-CB 3.47Å; G648-R651 PolarHBondContact O-N 2.03Å
649	S	51.2	Low	67	Low	72 Å²	72	66 Å²	66	50%	0.503	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-49.1	-29.9	169	-175.9	0	0	0	0	112.2	S647 R651 Y653 L695	S647-S649 PolarHBondContact O-N 3.3Å; S647-S649 VanDerWaalsContact O-N 3.12Å; S649-R651 VanDerWaalsContact C-N 3.27Å; S649-R651 PolarHBondContact O-N 3.35Å; S649-Y653 WeakPolarHBondContact O-CE2 3.45Å; S649-L695 WeakPolarHBondContact OG-CD2 3.42Å
650	T	53.3	Low	67.5	Low	13 Å²	13	65.2 Å²	65.2	8%	0.08	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-63.8	-18.8	175.4	58.2	0	0	0	0	115.1	G648 N652 Y653 L695 V817	G648-T650 PolarHBondContact O-N 2.94Å; T650-N652 VanDerWaalsContact C-N 3.29Å; T650-N652 PolarHBondContact O-N 3.43Å; T650-Y653 PolarHBondContact O-N 2.76Å; T650-L695 HydrophobicContact CG2-CD2 4.13Å; T650-V817 HydrophobicContact CG2-CG1 3.35Å
651	R	50.2	Low	68.1	Low	86 Å²	86	62.4 Å²	62.4	33%	0.325	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-68.6	-22.2	-178.8	-80	-170.6	169.3	-176.7	9.1	114.9	D553 W555 G648 S649 Y653 P820	D553-R651 VanDerWaalsContact CG-CZ 3.5Å; D553-R651 IonicContact OD1-CZ 3.6Å; D553-R651 IonicContact OD1-NE 3.75Å; D553-R651 IonicContact OD1-NH1 3.6Å; D553-R651 PolarHBondContact OD1-NH1 2.91Å; D553-R651 IonicContact OD1-NH2 3.9Å; D553-R651 PolarHBondContact OD1-NH2 2.69Å; D553-R651 WeakPolarHBondContact OD2-CD 3.5Å; D553-R651 IonicContact OD2-CZ 2.97Å; D553-R651 IonicContact OD2-NE 2.72Å; D553-R651 PolarHBondContact OD2-NE 2.82Å; D553-R651 IonicContact OD2-NH1 2.76Å; D553-R651 IonicContact OD2-NH2 2.74Å; W555-R651 VanDerWaalsContact NE1-NH2 3.18Å; G648-R651 WeakPolarHBondContact O-CB 3.47Å; G648-R651 PolarHBondContact O-N 2.03Å; S649-R651 VanDerWaalsContact C-N 3.27Å; S649-R651 PolarHBondContact O-N 3.35Å; R651-Y653 PolarHBondContact O-N 3.48Å; R651-P820 HydrophobicContact CG-CG 4.01Å
652	N	58	Low	68.4	Low	146 Å²	146	61.7 Å²	61.7	78%	0.781	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-85.3	3.9	-176.4	-67.3	-6.5	0	0	0	113	T650	T650-N652 VanDerWaalsContact C-N 3.29Å; T650-N652 PolarHBondContact O-N 3.43Å
653	Y	62.3	Low	68.6	Low	57 Å²	57	67.7 Å²	67.7	22%	0.224	37%	0.365	C	S	.	.	S	Bend	trans	-117.9	134.8	-178.3	-59.4	-75.8	0	0	0	110.3	S649 T650 R651 L658 K661 L695	S649-Y653 WeakPolarHBondContact O-CE2 3.45Å; T650-Y653 PolarHBondContact O-N 2.76Å; R651-Y653 PolarHBondContact O-N 3.48Å; Y653-L658 HydrophobicContact CD2-CD1 4.08Å; Y653-L658 HydrophobicContact CG-CD1 4.23Å; Y653-K661 HydrophobicContact CD1-CD 4.23Å; Y653-K661 HydrophobicContact CE1-CD 3.62Å; Y653-K661 PolarHBondContact OH-NZ 3.42Å; Y653-L695 HydrophobicContact CD2-CD1 4.35Å; Y653-L695 HydrophobicContact CE2-CD1 3.88Å; Y653-L695 HydrophobicContact CE2-CD2 4.07Å
654	L	69.3	Low	68.9	Low	111 Å²	111	67.3 Å²	67.3	58%	0.581	37%	0.37	S	S	*	.			trans	-65.4	153.5	162.1	-65.3	163.2	0	0	0	108.9	T656 D657 L658	L654-T656 PolarHBondContact O-N 3.34Å; L654-T656 VanDerWaalsContact O-N 3.11Å; L654-D657 WeakPolarHBondContact CB-OD2 3.45Å; L654-D657 PolarHBondContact N-OD2 2.99Å; L654-D657 PolarHBondContact O-N 3.37Å; L654-L658 PolarHBondContact O-N 2.87Å
655	P	68.7	Low	69.2	Low	39 Å²	39	67 Å²	67	25%	0.253	37%	0.368	S	S	.	.	H	α-helix	trans	-54.5	-32.7	178.7	-27.8	35.4	0	0	0	113.8	L659 H822 I825	P655-L659 WeakPolarHBondContact O-CB 3.22Å; P655-L659 PolarHBondContact O-N 3.49Å; P655-L659 VanDerWaalsContact O-N 3.1Å; P655-H822 WeakPolarHBondContact CG-CD2 3.39Å; P655-I825 HydrophobicContact CB-CD1 3.77Å; P655-I825 HydrophobicContact CG-CD1 4.43Å
656	T	77	Confident	69.9	Low	89 Å²	89	64.2 Å²	64.2	55%	0.546	36%	0.358	S	S	.	.	H	α-helix	trans	-63.8	-49.4	172.9	42.9	0	0	0	0	112.2	L654 L658 L659 V660	L654-T656 PolarHBondContact O-N 3.34Å; L654-T656 VanDerWaalsContact O-N 3.11Å; T656-L658 VanDerWaalsContact C-N 3.33Å; T656-L658 PolarHBondContact O-N 3.42Å; T656-L659 PolarHBondContact O-N 3.37Å; T656-V660 WeakPolarHBondContact O-CG2 3.46Å; T656-V660 PolarHBondContact O-N 2.98Å
657	D	79.8	Confident	70.9	Confident	73 Å²	73	61 Å²	61	39%	0.39	34%	0.337	S	S	.	.	H	α-helix	trans	-70.7	-37.1	-173.6	-43.7	-12	0	0	0	110.1	L654 V660 K661	L654-D657 WeakPolarHBondContact CB-OD2 3.45Å; L654-D657 PolarHBondContact N-OD2 2.99Å; L654-D657 PolarHBondContact O-N 3.37Å; D657-V660 PolarHBondContact O-N 2.92Å; D657-K661 WeakPolarHBondContact O-CB 3.44Å; D657-K661 PolarHBondContact O-N 2.83Å
658	L	76.2	Confident	72.1	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62.3	-45.3	171.7	-169.2	74.7	0	0	0	111	Y653 L654 T656 K661 L662 L695 V817 I825	Y653-L658 HydrophobicContact CD2-CD1 4.08Å; Y653-L658 HydrophobicContact CG-CD1 4.23Å; L654-L658 PolarHBondContact O-N 2.87Å; T656-L658 VanDerWaalsContact C-N 3.33Å; T656-L658 PolarHBondContact O-N 3.42Å; L658-K661 PolarHBondContact O-N 3.18Å; L658-L662 HydrophobicContact CG-CD1 4.04Å; L658-L662 WeakPolarHBondContact O-CB 3.36Å; L658-L662 WeakPolarHBondContact O-CD1 3.24Å; L658-L662 WeakPolarHBondContact O-CG 3.37Å; L658-L662 PolarHBondContact O-N 2.94Å; L658-L695 HydrophobicContact CD1-CB 4.49Å; L658-L695 HydrophobicContact CD1-CD1 3.75Å; L658-V817 HydrophobicContact CD2-CB 4.04Å; L658-V817 HydrophobicContact CD2-CG1 3.87Å; L658-V817 HydrophobicContact CD2-CG2 4.46Å; L658-I825 HydrophobicContact CD2-CB 4.29Å; L658-I825 HydrophobicContact CD2-CD1 3.7Å; L658-I825 HydrophobicContact CD2-CG2 4.38Å
659	L	79	Confident	73.4	Confident	71 Å²	71	61.5 Å²	61.5	37%	0.372	34%	0.335	S	S	.	.	H	α-helix	trans	-63.9	-41.2	177.3	-175	64.6	0	0	0	111.8	P655 T656 L662 Q663 I825 F826 A827	P655-L659 WeakPolarHBondContact O-CB 3.22Å; P655-L659 PolarHBondContact O-N 3.49Å; P655-L659 VanDerWaalsContact O-N 3.1Å; T656-L659 PolarHBondContact O-N 3.37Å; L659-L662 PolarHBondContact O-N 2.83Å; L659-Q663 WeakPolarHBondContact O-CG 3.48Å; L659-Q663 PolarHBondContact O-N 2.95Å; L659-I825 HydrophobicContact CD1-CG2 4.43Å; L659-F826 WeakPolarHBondContact CD1-O 3.22Å; L659-A827 HydrophobicContact CD1-CB 4.33Å
660	V	83.3	Confident	74.8	Confident	95 Å²	95	58.7 Å²	58.7	58%	0.576	31%	0.314	S	S	*	.	H	α-helix	trans	-64.2	-43.2	174.5	171.1	0	0	0	0	111.2	T656 D657 L662 Q663	T656-V660 WeakPolarHBondContact O-CG2 3.46Å; T656-V660 PolarHBondContact O-N 2.98Å; D657-V660 PolarHBondContact O-N 2.92Å; V660-L662 PolarHBondContact O-N 2.82Å; V660-Q663 WeakPolarHBondContact O-CB 3.38Å; V660-Q663 PolarHBondContact O-N 3.2Å
661	K	81.2	Confident	76.1	Confident	60 Å²	60	61.5 Å²	61.5	26%	0.261	33%	0.327	S	S	.	.	H	α-helix	trans	-58.3	-47	172.5	-89.1	-163.2	162	-156.2	0	111.7	Y653 D657 L658 Q663 S664 D691 V692 L695	Y653-K661 HydrophobicContact CD1-CD 4.23Å; Y653-K661 HydrophobicContact CE1-CD 3.62Å; Y653-K661 PolarHBondContact OH-NZ 3.42Å; D657-K661 WeakPolarHBondContact O-CB 3.44Å; D657-K661 PolarHBondContact O-N 2.83Å; L658-K661 PolarHBondContact O-N 3.18Å; K661-Q663 PolarHBondContact O-N 2.77Å; K661-Q663 VanDerWaalsContact O-N 3.16Å; K661-S664 PolarHBondContact O-N 2.89Å; K661-S664 PolarHBondContact O-OG 2.74Å; K661-D691 IonicContact NZ-OD2 3.62Å; K661-D691 PolarHBondContact NZ-OD2 2.77Å; K661-V692 HydrophobicContact CB-CG1 4.41Å; K661-V692 HydrophobicContact CB-CG2 4.19Å; K661-V692 HydrophobicContact CD-CG2 4.17Å; K661-V692 HydrophobicContact CG-CG2 4.34Å; K661-V692 WeakPolarHBondContact O-CG1 3.49Å; K661-L695 HydrophobicContact CD-CD1 4.44Å
662	L	79.9	Confident	77.7	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.5	-14.1	-178	-65.7	163	0	0	0	114	L658 L659 V660 S664 V665 V692 I696 V817 A827	L658-L662 HydrophobicContact CG-CD1 4.04Å; L658-L662 WeakPolarHBondContact O-CB 3.36Å; L658-L662 WeakPolarHBondContact O-CD1 3.24Å; L658-L662 WeakPolarHBondContact O-CG 3.37Å; L658-L662 PolarHBondContact O-N 2.94Å; L659-L662 PolarHBondContact O-N 2.83Å; V660-L662 PolarHBondContact O-N 2.82Å; L662-S664 PolarHBondContact O-N 3.08Å; L662-V665 PolarHBondContact O-N 2.75Å; L662-V692 HydrophobicContact CD2-CG1 4.15Å; L662-I696 HydrophobicContact CD2-CG1 3.99Å; L662-V817 HydrophobicContact CD1-CB 4.49Å; L662-V817 HydrophobicContact CD1-CG2 3.58Å; L662-V817 HydrophobicContact CD2-CG2 3.88Å; L662-V817 HydrophobicContact CG-CG2 4.33Å; L662-A827 HydrophobicContact CB-CB 3.38Å; L662-A827 HydrophobicContact CD1-CB 3.78Å; L662-A827 HydrophobicContact CG-CB 4.13Å
663	Q	82.1	Confident	78.9	Confident	133 Å²	133	55.8 Å²	55.8	62%	0.621	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-15.5	170	-70.3	170.5	6.7	0	0	113.3	L659 V660 K661 V665	L659-Q663 WeakPolarHBondContact O-CG 3.48Å; L659-Q663 PolarHBondContact O-N 2.95Å; V660-Q663 WeakPolarHBondContact O-CB 3.38Å; V660-Q663 PolarHBondContact O-N 3.2Å; K661-Q663 PolarHBondContact O-N 2.77Å; K661-Q663 VanDerWaalsContact O-N 3.16Å; Q663-V665 PolarHBondContact O-N 2.56Å
664	S	81.9	Confident	79.8	Confident	56 Å²	56	53.6 Å²	53.6	39%	0.392	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	3.8	173.6	76	0	0	0	0	113.8	K661 L662 G688 P689	K661-S664 PolarHBondContact O-N 2.89Å; K661-S664 PolarHBondContact O-OG 2.74Å; L662-S664 PolarHBondContact O-N 3.08Å; S664-G688 WeakPolarHBondContact O-CA 3.26Å; S664-P689 VanDerWaalsContact OG-CD 3.24Å; S664-P689 WeakPolarHBondContact OG-CD 3.33Å
665	V	81.7	Confident	80.5	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.006	26%	0.263	C	S	.	.			trans	-99.6	128.7	176.4	-177.7	0	0	0	0	108.8	L662 Q663 L686 C687 V692 L693 I696 Q828	L662-V665 PolarHBondContact O-N 2.75Å; Q663-V665 PolarHBondContact O-N 2.56Å; V665-L686 HydrophobicContact CG1-CB 4.31Å; V665-L686 HydrophobicContact CG1-CD1 4.1Å; V665-L686 HydrophobicContact CG1-CD2 3.96Å; V665-L686 HydrophobicContact CG1-CG 4.37Å; V665-C687 CarbonylContact C-O 3.59Å; V665-C687 WeakPolarHBondContact CA-O 3.35Å; V665-V692 HydrophobicContact CG2-CB 4.49Å; V665-V692 HydrophobicContact CG2-CG1 3.57Å; V665-L693 HydrophobicContact CG1-CD2 3.91Å; V665-L693 HydrophobicContact CG2-CD2 4.09Å; V665-I696 HydrophobicContact CG1-CD1 4.19Å; V665-I696 HydrophobicContact CG2-CD1 4.32Å; V665-Q828 WeakPolarHBondContact O-CB 3.46Å; V665-Q828 VanDerWaalsContact O-CG 3.22Å; V665-Q828 WeakPolarHBondContact O-CG 3.5Å
666	D	82.9	Confident	81.1	Confident	54 Å²	54	46.9 Å²	46.9	29%	0.289	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	157.3	174.1	-142.7	-11.4	0	0	0	110.3	C687 R763 Q828	D666-C687 PolarHBondContact N-O 2.88Å; D666-C687 PolarHBondContact O-N 3.47Å; D666-R763 IonicContact OD2-CZ 2.71Å; D666-R763 IonicContact OD2-NE 3.75Å; D666-R763 IonicContact OD2-NH2 3.06Å; D666-R763 PolarHBondContact OD2-NH2 2.8Å; D666-Q828 PolarHBondContact OD1-NE2 3.5Å
667	F	84	Confident	81.5	Confident	22 Å²	22	43.5 Å²	43.5	10%	0.096	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	143.4	178.6	-83.8	-104.2	0	0	0	110.9	L670 W684 L686 F699 I813 T815 Q828	F667-L670 HydrophobicContact CD1-CD2 4.05Å; F667-W684 AromaticContact CD1-CD1 3.56Å; F667-W684 HydrophobicContact CD1-CG 4.13Å; F667-W684 AromaticContact CD1-NE1 3.98Å; F667-W684 AromaticContact CE1-CD1 3.67Å; F667-W684 HydrophobicContact CE1-CG 4.33Å; F667-W684 AromaticContact CE1-NE1 3.58Å; F667-L686 HydrophobicContact CD1-CD2 3.96Å; F667-L686 HydrophobicContact CD2-CD2 4.03Å; F667-L686 HydrophobicContact CE1-CD2 3.98Å; F667-L686 HydrophobicContact CE2-CD2 4.03Å; F667-L686 HydrophobicContact CG-CD2 4.01Å; F667-L686 HydrophobicContact CZ-CD2 4.02Å; F667-F699 HydrophobicContact CE1-CD1 4.45Å; F667-F699 HydrophobicContact CE1-CE1 4.38Å; F667-F699 HydrophobicContact CZ-CD1 4.28Å; F667-F699 HydrophobicContact CZ-CE1 4.3Å; F667-I813 HydrophobicContact CE1-CB 4.04Å; F667-I813 HydrophobicContact CE1-CG2 3.86Å; F667-I813 HydrophobicContact CZ-CB 4.39Å; F667-I813 HydrophobicContact CZ-CG2 4.07Å; F667-T815 HydrophobicContact CE2-CG2 3.93Å; F667-T815 HydrophobicContact CZ-CG2 3.85Å; F667-Q828 HydrophobicContact CD2-CG 4.1Å; F667-Q828 HydrophobicContact CE2-CB 4.46Å; F667-Q828 HydrophobicContact CE2-CG 4.39Å; F667-Q828 WeakPolarHBondContact CE2-O 3.22Å
668	S	80.9	Confident	81.8	Confident	15 Å²	15	41.9 Å²	41.9	11%	0.105	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-62.3	164.6	157.2	77.4	0	0	0	0	110.5	L670 W684 F685	S668-L670 PolarHBondContact O-N 2.95Å; S668-W684 WeakPolarHBondContact OG-CA 3.33Å; S668-F685 PolarHBondContact N-O 3.08Å; S668-F685 PolarHBondContact OG-N 3.38Å
669	P	78.3	Confident	82.2	Confident	98 Å²	98	42 Å²	42	64%	0.636	23%	0.225	S	C	*	.	P	Polyproline II helix	trans	-49.9	137	161.1	-24.8	35.2	0	0	0	110.4	H671	P669-H671 PolarHBondContact O-N 2.9Å
670	L	81.6	Confident	82.6	Confident	13 Å²	13	38.6 Å²	38.6	7%	0.068	21%	0.207	C	C	.	.			trans	-80	114.7	175.3	-57.7	-173.1	0	0	0	109.1	F667 S668 I672 W684 I813 S830 S833	F667-L670 HydrophobicContact CD1-CD2 4.05Å; S668-L670 PolarHBondContact O-N 2.95Å; L670-I672 HydrophobicContact CB-CD1 4.17Å; L670-I672 HydrophobicContact CB-CG1 4.04Å; L670-I672 HydrophobicContact CD1-CD1 4.22Å; L670-W684 HydrophobicContact CD2-CB 3.55Å; L670-W684 HydrophobicContact CD2-CD2 4.14Å; L670-W684 HydrophobicContact CD2-CE3 4.3Å; L670-W684 HydrophobicContact CD2-CG 3.83Å; L670-I813 HydrophobicContact CD1-CB 4.39Å; L670-I813 HydrophobicContact CD1-CD1 3.9Å; L670-I813 HydrophobicContact CD1-CG1 3.83Å; L670-I813 HydrophobicContact CD2-CD1 4.1Å; L670-S830 WeakPolarHBondContact CD1-OG 3.28Å; L670-S833 PolarHBondContact O-OG 2.85Å
671	H	80.9	Confident	82.7	Confident	73 Å²	73	34.3 Å²	34.3	34%	0.338	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	116.2	169.1	-170.8	-106.7	0	0	0	108.6	P669 A682 E683	P669-H671 PolarHBondContact O-N 2.9Å; H671-A682 CarbonylContact O-C 3.56Å; H671-E683 PolarHBondContact N-O 2.97Å; H671-E683 PolarHBondContact O-N 3.32Å
672	I	82.8	Confident	82.9	Confident	12 Å²	12	31.5 Å²	31.5	6%	0.062	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	123.6	-175.8	-49.9	-173.3	0	0	0	110.2	L670 L680 L681 A682 I811 A835	L670-I672 HydrophobicContact CB-CD1 4.17Å; L670-I672 HydrophobicContact CB-CG1 4.04Å; L670-I672 HydrophobicContact CD1-CD1 4.22Å; I672-L680 HydrophobicContact CG2-CB 4.19Å; I672-L680 HydrophobicContact CG2-CD1 4.38Å; I672-L681 VanDerWaalsContact CA-O 3.31Å; I672-L681 WeakPolarHBondContact CA-O 3.22Å; I672-A682 HydrophobicContact CD1-CB 4.19Å; I672-A682 HydrophobicContact CG1-CB 3.95Å; I672-I811 HydrophobicContact CD1-CB 3.77Å; I672-I811 HydrophobicContact CD1-CD1 4.03Å; I672-I811 HydrophobicContact CD1-CG1 4.21Å; I672-I811 HydrophobicContact CD1-CG2 3.94Å; I672-A835 HydrophobicContact CB-CB 4.23Å; I672-A835 HydrophobicContact CG2-CB 3.66Å
673	R	82.3	Confident	83	Confident	100 Å²	100	33.2 Å²	33.2	38%	0.377	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	151.5	175.7	66.9	179.6	-176.5	-177.5	-1	111.6	I675 L680 L681	R673-I675 HydrophobicContact CG-CG2 4.42Å; R673-L680 CarbonylContact O-C 3.54Å; R673-L680 WeakPolarHBondContact O-CA 3.24Å; R673-L681 HydrophobicContact CG-CB 4.25Å; R673-L681 PolarHBondContact N-O 3.43Å; R673-L681 PolarHBondContact O-N 3.45Å
674	A	82.8	Confident	83.2	Confident	10 Å²	10	27 Å²	27	8%	0.083	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	142.1	166.2	0	0	0	0	0	110.2	L680 Y838	A674-L680 HydrophobicContact CB-CD2 3.99Å; A674-Y838 HydrophobicContact CB-CD1 4.33Å; A674-Y838 HydrophobicContact CB-CD2 3.59Å; A674-Y838 HydrophobicContact CB-CE1 4.28Å; A674-Y838 HydrophobicContact CB-CE2 3.55Å; A674-Y838 HydrophobicContact CB-CG 3.99Å; A674-Y838 WeakPolarHBondContact O-CE2 3.15Å; A674-Y838 PolarHBondContact O-OH 3.37Å
675	I	82.3	Confident	83.1	Confident	9 Å²	9	27.3 Å²	27.3	5%	0.046	14%	0.143	C	C	.	.	S	Bend	trans	-119.7	-19.2	169.9	60.5	171.3	0	0	0	111.8	W343 Q384 K385 R673 E679 L681	W343-I675 HydrophobicContact CH2-CD1 3.99Å; Q384-I675 CarbonylContact C-O 3.42Å; Q384-I675 WeakPolarHBondContact CA-O 3.25Å; Q384-I675 PolarHBondContact N-O 2.86Å; K385-I675 PolarHBondContact N-O 3.31Å; R673-I675 HydrophobicContact CG-CG2 4.42Å; I675-E679 HydrophobicContact CD1-CB 4.07Å; I675-E679 HydrophobicContact CG1-CB 3.75Å; I675-E679 WeakPolarHBondContact CG1-O 3.48Å; I675-E679 PolarHBondContact N-O 3.12Å; I675-L681 HydrophobicContact CD1-CB 4.41Å; I675-L681 HydrophobicContact CG2-CB 3.66Å; I675-L681 HydrophobicContact CG2-CD2 4.44Å
676	S	83.2	Confident	83	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	-151.5	177.9	168.1	80.3	0	0	0	0	110	Q384 S678 E679	Q384-S676 WeakPolarHBondContact O-CA 3.49Å; Q384-S676 VanDerWaalsContact O-CB 3.27Å; Q384-S676 WeakPolarHBondContact O-CB 3.14Å; S676-S678 PolarHBondContact O-N 2.89Å; S676-S678 PolarHBondContact OG-N 2.84Å; S676-S678 VanDerWaalsContact OG-N 3.13Å; S676-E679 PolarHBondContact N-O 3.39Å; S676-E679 PolarHBondContact OG-N 3Å
677	P	84	Confident	82.9	Confident	19 Å²	19	27.3 Å²	27.3	12%	0.123	14%	0.144	C	C	.	.	S	Bend	trans	-64.9	-12.8	172.6	-22.2	35.8	0	0	0	113.6	K385 R804 P805	K385-P677 WeakPolarHBondContact O-CD 3.49Å; K385-P677 WeakPolarHBondContact O-CG 3.42Å; P677-R804 CarbonylContact O-C 3.47Å; P677-P805 HydrophobicContact CB-CB 3.91Å; P677-P805 HydrophobicContact CB-CG 3.79Å; P677-P805 WeakPolarHBondContact O-CA 3.4Å; P677-P805 VanDerWaalsContact O-N 3.16Å
678	S	85.8	Confident	82.6	Confident	39 Å²	39	28 Å²	28	27%	0.273	16%	0.158	S	C	.	.	S	Bend	trans	-129.3	4	-177.5	59.7	0	0	0	0	115.2	I388 S676 N802 L803	I388-S678 WeakPolarHBondContact CD1-OG 3.37Å; S676-S678 PolarHBondContact O-N 2.89Å; S676-S678 PolarHBondContact OG-N 2.84Å; S676-S678 VanDerWaalsContact OG-N 3.13Å; S678-N802 PolarHBondContact O-N 3.37Å; S678-L803 WeakPolarHBondContact CA-O 3.33Å; S678-L803 VanDerWaalsContact CB-O 3.24Å; S678-L803 WeakPolarHBondContact CB-O 3.44Å; S678-L803 WeakPolarHBondContact O-CB 3.32Å; S678-L803 PolarHBondContact O-N 3.41Å
679	E	85.9	Confident	82.6	Confident	1 Å²	1	30 Å²	30	1%	0.005	17%	0.171	C	C	.	.			trans	-134.5	136.5	174.1	-68.7	-164.7	122.3	0	0	113.3	R334 K381 S383 I388 I675 S676 I800 S801	R334-E679 IonicContact NH2-OE1 2.65Å; R334-E679 PolarHBondContact NH2-OE1 2.94Å; R334-E679 VanDerWaalsContact NH2-OE1 3.16Å; K381-E679 VanDerWaalsContact CE-OE2 3.27Å; K381-E679 WeakPolarHBondContact CE-OE2 3.28Å; K381-E679 IonicContact NZ-OE1 2.65Å; K381-E679 PolarHBondContact NZ-OE1 2.82Å; K381-E679 IonicContact NZ-OE2 2.76Å; K381-E679 PolarHBondContact NZ-OE2 2.79Å; S383-E679 PolarHBondContact OG-OE2 2.96Å; I388-E679 HydrophobicContact CD1-CG 4Å; I675-E679 HydrophobicContact CD1-CB 4.07Å; I675-E679 HydrophobicContact CG1-CB 3.75Å; I675-E679 WeakPolarHBondContact CG1-O 3.48Å; I675-E679 PolarHBondContact N-O 3.12Å; S676-E679 PolarHBondContact N-O 3.39Å; S676-E679 PolarHBondContact OG-N 3Å; E679-I800 VanDerWaalsContact CA-O 3.27Å; E679-I800 WeakPolarHBondContact CA-O 3.43Å; E679-S801 WeakPolarHBondContact OE1-CB 3.23Å
680	L	87.4	Confident	82.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	140	166.9	-65.6	171.3	0	0	0	109.1	I672 R673 A674 A799 I800 L803 I811 A835 T837	I672-L680 HydrophobicContact CG2-CB 4.19Å; I672-L680 HydrophobicContact CG2-CD1 4.38Å; R673-L680 CarbonylContact O-C 3.54Å; R673-L680 WeakPolarHBondContact O-CA 3.24Å; A674-L680 HydrophobicContact CB-CD2 3.99Å; L680-A799 CarbonylContact O-C 3.55Å; L680-A799 WeakPolarHBondContact O-CA 3.44Å; L680-I800 PolarHBondContact N-O 3.31Å; L680-I800 PolarHBondContact O-N 3.46Å; L680-L803 HydrophobicContact CB-CD1 4.06Å; L680-L803 HydrophobicContact CD1-CD1 3.7Å; L680-L803 HydrophobicContact CG-CD1 3.5Å; L680-L803 VanDerWaalsContact CG-CD1 3.5Å; L680-I811 HydrophobicContact CD1-CD1 3.9Å; L680-I811 HydrophobicContact CD1-CG1 4.43Å; L680-A835 HydrophobicContact CD1-CB 3.96Å; L680-A835 HydrophobicContact CD2-CB 3.84Å; L680-T837 HydrophobicContact CD2-CG2 4.15Å; L680-T837 HydrophobicContact CG-CG2 4.21Å
681	L	84.5	Confident	82.1	Confident	6 Å²	6	32.8 Å²	32.8	3%	0.031	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.8	164.8	175.3	62.6	0	0	0	108.9	W343 I672 R673 I675 K797	W343-L681 HydrophobicContact CH2-CD1 3.87Å; W343-L681 HydrophobicContact CZ2-CD1 3.49Å; W343-L681 VanDerWaalsContact CZ2-CD1 3.49Å; I672-L681 VanDerWaalsContact CA-O 3.31Å; I672-L681 WeakPolarHBondContact CA-O 3.22Å; R673-L681 HydrophobicContact CG-CB 4.25Å; R673-L681 PolarHBondContact N-O 3.43Å; R673-L681 PolarHBondContact O-N 3.45Å; I675-L681 HydrophobicContact CD1-CB 4.41Å; I675-L681 HydrophobicContact CG2-CB 3.66Å; I675-L681 HydrophobicContact CG2-CD2 4.44Å; L681-K797 HydrophobicContact CD1-CB 4.12Å
682	A	85.3	Confident	82	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	136.7	167.1	0	0	0	0	0	110.1	H671 I672 W684 M798 I813	H671-A682 CarbonylContact O-C 3.56Å; I672-A682 HydrophobicContact CD1-CB 4.19Å; I672-A682 HydrophobicContact CG1-CB 3.95Å; A682-W684 HydrophobicContact CB-CE3 4.41Å; A682-W684 HydrophobicContact CB-CZ3 4.14Å; A682-W684 WeakPolarHBondContact O-CZ3 3.41Å; A682-M798 PolarHBondContact N-O 2.89Å; A682-M798 PolarHBondContact O-N 2.9Å; A682-I813 HydrophobicContact CB-CD1 4.09Å
683	E	83.3	Confident	81.7	Confident	36 Å²	36	30.3 Å²	30.3	17%	0.168	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	134.5	-176.8	-178	163	-174.1	0	0	111	H671 S795 I796 K797	H671-E683 PolarHBondContact N-O 2.97Å; H671-E683 PolarHBondContact O-N 3.32Å; E683-S795 WeakPolarHBondContact OE1-CB 3.38Å; E683-S795 PolarHBondContact OE1-OG 3.02Å; E683-I796 WeakPolarHBondContact CA-O 3.16Å; E683-K797 HydrophobicContact CB-CG 4.31Å; E683-K797 HydrophobicContact CG-CG 3.88Å; E683-K797 WeakPolarHBondContact OE1-CE 3.35Å; E683-K797 IonicContact OE1-NZ 2.76Å; E683-K797 WeakPolarHBondContact OE2-CE 3.5Å
684	W	84.6	Confident	81.1	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.008	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	171.9	-177.9	68.3	96.6	0	0	0	112.5	F667 S668 L670 A682 F699 I796 M798 I813	F667-W684 AromaticContact CD1-CD1 3.56Å; F667-W684 HydrophobicContact CD1-CG 4.13Å; F667-W684 AromaticContact CD1-NE1 3.98Å; F667-W684 AromaticContact CE1-CD1 3.67Å; F667-W684 HydrophobicContact CE1-CG 4.33Å; F667-W684 AromaticContact CE1-NE1 3.58Å; S668-W684 WeakPolarHBondContact OG-CA 3.33Å; L670-W684 HydrophobicContact CD2-CB 3.55Å; L670-W684 HydrophobicContact CD2-CD2 4.14Å; L670-W684 HydrophobicContact CD2-CE3 4.3Å; L670-W684 HydrophobicContact CD2-CG 3.83Å; A682-W684 HydrophobicContact CB-CE3 4.41Å; A682-W684 HydrophobicContact CB-CZ3 4.14Å; A682-W684 WeakPolarHBondContact O-CZ3 3.41Å; W684-F699 HydrophobicContact CZ2-CB 4.22Å; W684-F699 AromaticContact CZ2-CD1 3.66Å; W684-F699 HydrophobicContact CZ2-CD1 3.66Å; W684-F699 HydrophobicContact CZ2-CD2 4Å; W684-F699 AromaticContact CZ2-CE1 3.93Å; W684-F699 HydrophobicContact CZ2-CE1 3.93Å; W684-F699 HydrophobicContact CZ2-CE2 4.27Å; W684-F699 AromaticContact CZ2-CG 3.7Å; W684-F699 HydrophobicContact CZ2-CG 3.7Å; W684-F699 HydrophobicContact CZ2-CZ 4.24Å; W684-F699 AromaticContact NE1-CD1 3.99Å; W684-F699 AromaticContact NE1-CE1 3.49Å; W684-F699 AromaticContact NE1-CZ 3.92Å; W684-I796 HydrophobicContact CD2-CB 4.25Å; W684-I796 HydrophobicContact CH2-CG2 3.91Å; W684-I796 HydrophobicContact CZ2-CB 4.03Å; W684-I796 HydrophobicContact CZ2-CG2 3.43Å; W684-I796 VanDerWaalsContact CZ2-CG2 3.43Å; W684-I796 PolarHBondContact N-O 3.45Å; W684-I796 VanDerWaalsContact N-O 3.09Å; W684-I796 PolarHBondContact O-N 3.35Å; W684-M798 HydrophobicContact CH2-CB 3.63Å; W684-M798 HydrophobicContact CH2-SD 4.4Å; W684-M798 HydrophobicContact CZ3-CB 3.74Å; W684-I813 HydrophobicContact CD2-CD1 4.12Å; W684-I813 HydrophobicContact CE3-CD1 3.54Å; W684-I813 HydrophobicContact CH2-CD1 3.63Å; W684-I813 HydrophobicContact CH2-CG2 4.28Å; W684-I813 HydrophobicContact CZ2-CD1 4.17Å; W684-I813 HydrophobicContact CZ2-CG2 4Å; W684-I813 HydrophobicContact CZ3-CD1 3.29Å
685	F	80.2	Confident	80.7	Confident	64 Å²	64	28.2 Å²	28.2	28%	0.281	18%	0.18	S	C	.	.			trans	-120.1	155.6	168.6	-57.3	-95.6	0	0	0	109.8	S668 P758 S795	S668-F685 PolarHBondContact N-O 3.08Å; S668-F685 PolarHBondContact OG-N 3.38Å; F685-P758 HydrophobicContact CB-CB 4.05Å; F685-P758 HydrophobicContact CD1-CB 4.22Å; F685-P758 HydrophobicContact CD1-CG 3.79Å; F685-P758 HydrophobicContact CD2-CB 3.52Å; F685-P758 HydrophobicContact CD2-CG 3.57Å; F685-P758 HydrophobicContact CE1-CG 3.7Å; F685-P758 HydrophobicContact CE2-CB 3.93Å; F685-P758 HydrophobicContact CE2-CG 3.49Å; F685-P758 VanDerWaalsContact CE2-CG 3.49Å; F685-P758 HydrophobicContact CG-CB 3.68Å; F685-P758 HydrophobicContact CG-CG 3.72Å; F685-P758 HydrophobicContact CZ-CB 4.42Å; F685-P758 HydrophobicContact CZ-CG 3.53Å; F685-S795 VanDerWaalsContact CE1-CA 3.5Å; F685-S795 VanDerWaalsContact CE1-N 3.35Å
686	L	80.1	Confident	80.4	Confident	26 Å²	26	28.3 Å²	28.3	14%	0.136	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	138.2	166.9	-70	-174.1	0	0	0	110.2	V665 F667 L693 I696 F699 I796 T815	V665-L686 HydrophobicContact CG1-CB 4.31Å; V665-L686 HydrophobicContact CG1-CD1 4.1Å; V665-L686 HydrophobicContact CG1-CD2 3.96Å; V665-L686 HydrophobicContact CG1-CG 4.37Å; F667-L686 HydrophobicContact CD1-CD2 3.96Å; F667-L686 HydrophobicContact CD2-CD2 4.03Å; F667-L686 HydrophobicContact CE1-CD2 3.98Å; F667-L686 HydrophobicContact CE2-CD2 4.03Å; F667-L686 HydrophobicContact CG-CD2 4.01Å; F667-L686 HydrophobicContact CZ-CD2 4.02Å; L686-L693 HydrophobicContact CB-CD2 3.7Å; L686-L693 HydrophobicContact CD1-CD2 3.88Å; L686-L693 HydrophobicContact CG-CD2 4.48Å; L686-I696 HydrophobicContact CD1-CD1 3.46Å; L686-I696 VanDerWaalsContact CD1-CD1 3.46Å; L686-F699 HydrophobicContact CD1-CE1 3.76Å; L686-F699 HydrophobicContact CD1-CZ 3.62Å; L686-F699 HydrophobicContact CD2-CE1 4.16Å; L686-F699 HydrophobicContact CG-CE1 4.12Å; L686-F699 HydrophobicContact CG-CZ 4.16Å; L686-I796 HydrophobicContact CD1-CD1 4.44Å; L686-I796 HydrophobicContact CG-CD1 4.22Å; L686-T815 HydrophobicContact CD1-CG2 4.11Å; L686-T815 HydrophobicContact CD2-CG2 4.25Å
687	C	80.9	Confident	79.8	Confident	29 Å²	29	30 Å²	30	20%	0.196	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.7	176.3	-57.7	0	0	0	0	109.1	V665 D666 C759	V665-C687 CarbonylContact C-O 3.59Å; V665-C687 WeakPolarHBondContact CA-O 3.35Å; D666-C687 PolarHBondContact N-O 2.88Å; D666-C687 PolarHBondContact O-N 3.47Å; C687-C759 VanDerWaalsContact CA-SG 3.51Å; C687-C759 HydrophobicContact CB-CB 3.85Å; C687-C759 WeakPolarHBondContact CB-SG 3.28Å; C687-C759 WeakPolarHBondContact SG-CA 3.5Å; C687-C759 WeakPolarHBondContact SG-CB 3.28Å; C687-C759 CovalentContact SG-SG 2.04Å; C687-C759 PolarHBondContact SG-SG 2.98Å
688	G	78.5	Confident	79.3	Confident	37 Å²	37	29 Å²	29	38%	0.381	19%	0.185	S	C	.	.	S	Bend	trans	169.7	178.7	-179.2	0	0	0	0	0	112.6	S664	S664-G688 WeakPolarHBondContact O-CA 3.26Å
689	P	81	Confident	79.2	Confident	57 Å²	57	27.2 Å²	27.2	37%	0.37	17%	0.172	S	C	.	.			trans	-61.8	136.9	176.1	-21.3	34	0	0	0	111.8	S664 D691 V692 L693	S664-P689 VanDerWaalsContact OG-CD 3.24Å; S664-P689 WeakPolarHBondContact OG-CD 3.33Å; P689-D691 VanDerWaalsContact C-N 3.29Å; P689-D691 VanDerWaalsContact CB-OD1 3.25Å; P689-D691 WeakPolarHBondContact CB-OD1 3.4Å; P689-D691 PolarHBondContact O-N 3.24Å; P689-V692 HydrophobicContact CB-CB 4.31Å; P689-V692 HydrophobicContact CB-CG2 4Å; P689-V692 HydrophobicContact CG-CG2 4.2Å; P689-V692 PolarHBondContact O-N 2.92Å; P689-V692 VanDerWaalsContact O-N 3.07Å; P689-L693 WeakPolarHBondContact O-CG 3.46Å; P689-L693 PolarHBondContact O-N 2.78Å
690	S	73.3	Confident	79	Confident	94 Å²	94	28.9 Å²	28.9	66%	0.657	18%	0.179	S	C	*	.	H	α-helix	trans	-64.9	-29.3	-175	50.2	0	0	0	0	113.8	A694	S690-A694 WeakPolarHBondContact O-CB 3.28Å; S690-A694 PolarHBondContact O-N 3.49Å; S690-A694 VanDerWaalsContact O-N 3.09Å
691	D	74.9	Confident	78.9	Confident	75 Å²	75	28.9 Å²	28.9	40%	0.401	18%	0.179	S	C	.	.	H	α-helix	trans	-67.9	-36.7	172.9	74.6	-59.4	0	0	0	112.1	K661 P689	K661-D691 IonicContact NZ-OD2 3.62Å; K661-D691 PolarHBondContact NZ-OD2 2.77Å; P689-D691 VanDerWaalsContact C-N 3.29Å; P689-D691 VanDerWaalsContact CB-OD1 3.25Å; P689-D691 WeakPolarHBondContact CB-OD1 3.4Å; P689-D691 PolarHBondContact O-N 3.24Å
692	V	78.5	Confident	79	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.024	18%	0.179	C	C	.	.	H	α-helix	trans	-74.4	-41.9	177.1	-179.5	0	0	0	0	110.8	K661 L662 V665 P689 A694 L695	K661-V692 HydrophobicContact CB-CG1 4.41Å; K661-V692 HydrophobicContact CB-CG2 4.19Å; K661-V692 HydrophobicContact CD-CG2 4.17Å; K661-V692 HydrophobicContact CG-CG2 4.34Å; K661-V692 WeakPolarHBondContact O-CG1 3.49Å; L662-V692 HydrophobicContact CD2-CG1 4.15Å; V665-V692 HydrophobicContact CG2-CB 4.49Å; V665-V692 HydrophobicContact CG2-CG1 3.57Å; P689-V692 HydrophobicContact CB-CB 4.31Å; P689-V692 HydrophobicContact CB-CG2 4Å; P689-V692 HydrophobicContact CG-CG2 4.2Å; P689-V692 PolarHBondContact O-N 2.92Å; P689-V692 VanDerWaalsContact O-N 3.07Å; V692-A694 PolarHBondContact O-N 3.43Å; V692-L695 WeakPolarHBondContact O-CB 3.44Å; V692-L695 PolarHBondContact O-N 3.31Å
693	L	76.4	Confident	79.1	Confident	29 Å²	29	29 Å²	29	15%	0.152	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-33.6	174.5	-65.6	177.1	0	0	0	111.6	V665 L686 P689 L695 I696 V791	V665-L693 HydrophobicContact CG1-CD2 3.91Å; V665-L693 HydrophobicContact CG2-CD2 4.09Å; L686-L693 HydrophobicContact CB-CD2 3.7Å; L686-L693 HydrophobicContact CD1-CD2 3.88Å; L686-L693 HydrophobicContact CG-CD2 4.48Å; P689-L693 WeakPolarHBondContact O-CG 3.46Å; P689-L693 PolarHBondContact O-N 2.78Å; L693-L695 PolarHBondContact O-N 2.85Å; L693-I696 HydrophobicContact CD2-CD1 4Å; L693-I696 PolarHBondContact O-N 3.1Å; L693-V791 HydrophobicContact CB-CG1 4.4Å
694	A	71.1	Confident	79.2	Confident	62 Å²	62	29.3 Å²	29.3	51%	0.512	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-9.5	174.9	0	0	0	0	0	115.2	S690 V692 V791	S690-A694 WeakPolarHBondContact O-CB 3.28Å; S690-A694 PolarHBondContact O-N 3.49Å; S690-A694 VanDerWaalsContact O-N 3.09Å; V692-A694 PolarHBondContact O-N 3.43Å; A694-V791 HydrophobicContact CB-CG2 3.75Å
695	L	74.7	Confident	79.1	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.016	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-18.2	174.9	-58.1	173.6	0	0	0	112.7	S649 T650 Y653 L658 K661 V692 L693 T697 V817	S649-L695 WeakPolarHBondContact OG-CD2 3.42Å; T650-L695 HydrophobicContact CG2-CD2 4.13Å; Y653-L695 HydrophobicContact CD2-CD1 4.35Å; Y653-L695 HydrophobicContact CE2-CD1 3.88Å; Y653-L695 HydrophobicContact CE2-CD2 4.07Å; L658-L695 HydrophobicContact CD1-CB 4.49Å; L658-L695 HydrophobicContact CD1-CD1 3.75Å; K661-L695 HydrophobicContact CD-CD1 4.44Å; V692-L695 WeakPolarHBondContact O-CB 3.44Å; V692-L695 PolarHBondContact O-N 3.31Å; L693-L695 PolarHBondContact O-N 2.85Å; L695-T697 PolarHBondContact O-N 2.83Å; L695-V817 HydrophobicContact CB-CG2 4.46Å; L695-V817 VanDerWaalsContact O-CG1 3.31Å; L695-V817 WeakPolarHBondContact O-CG1 3.5Å; L695-V817 VanDerWaalsContact O-CG2 3.29Å; L695-V817 WeakPolarHBondContact O-CG2 3.48Å
696	I	75.5	Confident	79	Confident	11 Å²	11	28.3 Å²	28.3	6%	0.056	18%	0.18	C	C	.	.			trans	-73.5	112.6	-174.2	-59.4	173	0	0	0	110.2	L662 V665 L686 L693 G698 F699 T815	L662-I696 HydrophobicContact CD2-CG1 3.99Å; V665-I696 HydrophobicContact CG1-CD1 4.19Å; V665-I696 HydrophobicContact CG2-CD1 4.32Å; L686-I696 HydrophobicContact CD1-CD1 3.46Å; L686-I696 VanDerWaalsContact CD1-CD1 3.46Å; L693-I696 HydrophobicContact CD2-CD1 4Å; L693-I696 PolarHBondContact O-N 3.1Å; I696-G698 WeakPolarHBondContact CG2-O 3.5Å; I696-F699 HydrophobicContact CG2-CZ 4.34Å; I696-T815 HydrophobicContact CD1-CG2 4.01Å; I696-T815 HydrophobicContact CG2-CG2 4.28Å
697	T	71	Confident	78.9	Confident	35 Å²	35	29.5 Å²	29.5	22%	0.215	19%	0.189	C	C	.	.			trans	-90.1	-14.2	178.8	68.4	0	0	0	0	112.8	L695 I787 H788 F816 V817 D818	L695-T697 PolarHBondContact O-N 2.83Å; T697-I787 WeakPolarHBondContact O-CA 3.39Å; T697-H788 PolarHBondContact O-N 3.26Å; T697-F816 PolarHBondContact N-O 2.88Å; T697-F816 WeakPolarHBondContact OG1-CE2 3.48Å; T697-V817 HydrophobicContact CG2-CG1 4.47Å; T697-D818 WeakPolarHBondContact CB-OD2 3.46Å; T697-D818 HydrophobicContact CG2-CB 4.28Å; T697-D818 VanDerWaalsContact OG1-CG 3.28Å; T697-D818 PolarHBondContact OG1-N 3.19Å; T697-D818 PolarHBondContact OG1-OD2 2.82Å
698	G	72.9	Confident	78.5	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.8	-172.3	175.9	0	0	0	0	0	116.4	I696 Y786 F816	I696-G698 WeakPolarHBondContact CG2-O 3.5Å; G698-Y786 CarbonylContact C-O 3.57Å; G698-Y786 VanDerWaalsContact CA-O 3.23Å; G698-Y786 WeakPolarHBondContact CA-O 3.18Å; G698-F816 VanDerWaalsContact C-CD1 3.48Å; G698-F816 VanDerWaalsContact C-CE1 3.42Å; G698-F816 PolarHBondContact N-O 2.81Å; G698-F816 PolarHBondContact O-N 2.82Å
699	F	83	Confident	78	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	141.5	-176.7	-60.9	-88.4	0	0	0	110.5	F667 W684 L686 I696 Y786 H788 I796 I813 E814 T815 F816	F667-F699 HydrophobicContact CE1-CD1 4.45Å; F667-F699 HydrophobicContact CE1-CE1 4.38Å; F667-F699 HydrophobicContact CZ-CD1 4.28Å; F667-F699 HydrophobicContact CZ-CE1 4.3Å; W684-F699 HydrophobicContact CZ2-CB 4.22Å; W684-F699 AromaticContact CZ2-CD1 3.66Å; W684-F699 HydrophobicContact CZ2-CD1 3.66Å; W684-F699 HydrophobicContact CZ2-CD2 4Å; W684-F699 AromaticContact CZ2-CE1 3.93Å; W684-F699 HydrophobicContact CZ2-CE1 3.93Å; W684-F699 HydrophobicContact CZ2-CE2 4.27Å; W684-F699 AromaticContact CZ2-CG 3.7Å; W684-F699 HydrophobicContact CZ2-CG 3.7Å; W684-F699 HydrophobicContact CZ2-CZ 4.24Å; W684-F699 AromaticContact NE1-CD1 3.99Å; W684-F699 AromaticContact NE1-CE1 3.49Å; W684-F699 AromaticContact NE1-CZ 3.92Å; L686-F699 HydrophobicContact CD1-CE1 3.76Å; L686-F699 HydrophobicContact CD1-CZ 3.62Å; L686-F699 HydrophobicContact CD2-CE1 4.16Å; L686-F699 HydrophobicContact CG-CE1 4.12Å; L686-F699 HydrophobicContact CG-CZ 4.16Å; I696-F699 HydrophobicContact CG2-CZ 4.34Å; F699-Y786 HydrophobicContact CD2-CD1 4.16Å; F699-Y786 PolarHBondContact N-O 2.9Å; F699-Y786 PolarHBondContact O-N 3.35Å; F699-Y786 VanDerWaalsContact O-O 3.11Å; F699-H788 HydrophobicContact CD2-CB 4.1Å; F699-H788 HydrophobicContact CE2-CB 3.79Å; F699-H788 AromaticContact CE2-CG 3.88Å; F699-I796 HydrophobicContact CD2-CG2 4.37Å; F699-I796 HydrophobicContact CE1-CD1 4.43Å; F699-I796 HydrophobicContact CE2-CD1 3.85Å; F699-I796 HydrophobicContact CE2-CG2 3.92Å; F699-I796 HydrophobicContact CZ-CD1 3.46Å; F699-I796 VanDerWaalsContact CZ-CD1 3.46Å; F699-I796 HydrophobicContact CZ-CG2 4.32Å; F699-I813 HydrophobicContact CB-CG2 3.94Å; F699-I813 HydrophobicContact CD1-CG2 3.91Å; F699-I813 HydrophobicContact CG-CG2 4.34Å; F699-E814 CarbonylContact C-O 3.54Å; F699-E814 WeakPolarHBondContact CA-O 3.34Å; F699-T815 HydrophobicContact CD1-CG2 3.99Å; F699-T815 HydrophobicContact CE1-CG2 3.66Å; F699-F816 VanDerWaalsContact N-CE1 3.28Å
700	K	82.3	Confident	77.7	Confident	36 Å²	36	35 Å²	35	16%	0.157	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	115.4	175.6	172.7	-173.4	157	-150.6	0	108.1	T702 V783 Y785 I813 E814 F816 F826	K700-T702 HydrophobicContact CG-CG2 4.43Å; K700-V783 HydrophobicContact CD-CG1 3.98Å; K700-V783 HydrophobicContact CG-CG1 3.48Å; K700-V783 VanDerWaalsContact CG-CG1 3.48Å; K700-Y785 HydrophobicContact CB-CD1 3.97Å; K700-Y785 HydrophobicContact CB-CE1 3.88Å; K700-Y785 HydrophobicContact CD-CE1 3.8Å; K700-Y785 HydrophobicContact CG-CD1 4.13Å; K700-Y785 HydrophobicContact CG-CE1 3.71Å; K700-I813 CarbonylContact O-C 3.56Å; K700-I813 WeakPolarHBondContact O-CA 3.36Å; K700-E814 HydrophobicContact CB-CB 4.35Å; K700-E814 WeakPolarHBondContact CD-OE2 3.46Å; K700-E814 WeakPolarHBondContact CE-OE2 3.43Å; K700-E814 PolarHBondContact N-O 2.94Å; K700-E814 IonicContact NZ-OE2 3.72Å; K700-E814 PolarHBondContact NZ-OE2 2.84Å; K700-E814 PolarHBondContact O-N 2.68Å; K700-F816 HydrophobicContact CB-CD1 4.32Å; K700-F826 HydrophobicContact CB-CE1 4.03Å; K700-F826 HydrophobicContact CD-CD1 3.96Å; K700-F826 HydrophobicContact CD-CE1 3.4Å; K700-F826 HydrophobicContact CD-CZ 3.99Å; K700-F826 HydrophobicContact CG-CE1 4.31Å
701	A	85	Confident	77.6	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	111.5	173.4	0	0	0	0	0	109.5	V783 D784 M798 I800 R812 I813	A701-V783 WeakPolarHBondContact O-CA 3.18Å; A701-D784 HydrophobicContact CB-CB 4.49Å; A701-D784 PolarHBondContact N-O 2.96Å; A701-D784 PolarHBondContact O-N 2.96Å; A701-M798 HydrophobicContact CB-CE 3.57Å; A701-M798 HydrophobicContact CB-SD 3.83Å; A701-I800 HydrophobicContact CB-CD1 4.06Å; A701-I800 HydrophobicContact CB-CG1 4.19Å; A701-R812 CarbonylContact C-O 3.55Å; A701-R812 WeakPolarHBondContact CA-O 3.11Å; A701-I813 HydrophobicContact CB-CG1 4.4Å
702	T	85.6	Confident	77.1	Confident	4 Å²	4	28.1 Å²	28.1	3%	0.025	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.9	170.9	51	0	0	0	0	109.1	K700 E781 K782 V783 R812	K700-T702 HydrophobicContact CG-CG2 4.43Å; T702-E781 WeakPolarHBondContact CB-OE1 3.35Å; T702-E781 WeakPolarHBondContact CG2-OE1 3.42Å; T702-K782 WeakPolarHBondContact CA-O 3.37Å; T702-V783 HydrophobicContact CG2-CG2 4.43Å; T702-R812 PolarHBondContact N-O 3.2Å; T702-R812 PolarHBondContact O-N 2.94Å; T702-R812 WeakPolarHBondContact OG1-CB 3.3Å; T702-R812 PolarHBondContact OG1-O 2.99Å; T702-R812 VanDerWaalsContact OG1-O 3.14Å
703	Y	87.8	Confident	75.9	Confident	6 Å²	6	30.6 Å²	30.6	2%	0.024	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	147.2	-178.7	60.9	-78.2	0	0	0	112.6	K782 D784 I800 S801 L803 Y809 A810	Y703-K782 HydrophobicContact CD1-CB 4.19Å; Y703-K782 HydrophobicContact CD2-CB 3.97Å; Y703-K782 HydrophobicContact CD2-CD 4.41Å; Y703-K782 HydrophobicContact CE1-CB 3.73Å; Y703-K782 HydrophobicContact CE2-CB 3.49Å; Y703-K782 VanDerWaalsContact CE2-CB 3.49Å; Y703-K782 HydrophobicContact CE2-CD 3.49Å; Y703-K782 VanDerWaalsContact CE2-CD 3.49Å; Y703-K782 HydrophobicContact CE2-CG 4.12Å; Y703-K782 HydrophobicContact CG-CB 4.29Å; Y703-K782 PolarHBondContact N-O 2.98Å; Y703-K782 PolarHBondContact O-N 3.49Å; Y703-D784 HydrophobicContact CE1-CB 4.02Å; Y703-D784 VanDerWaalsContact CE1-OD1 3.23Å; Y703-D784 WeakPolarHBondContact CE1-OD1 3.37Å; Y703-D784 PolarHBondContact OH-OD1 3.47Å; Y703-I800 HydrophobicContact CD1-CG2 3.7Å; Y703-I800 HydrophobicContact CD2-CG2 3.96Å; Y703-I800 HydrophobicContact CE1-CG2 3.61Å; Y703-I800 HydrophobicContact CE2-CG2 3.85Å; Y703-I800 HydrophobicContact CG-CG2 3.88Å; Y703-S801 PolarHBondContact OH-O 3.24Å; Y703-L803 HydrophobicContact CD2-CD2 3.62Å; Y703-L803 HydrophobicContact CE2-CD2 3.37Å; Y703-Y809 HydrophobicContact CD2-CD1 4.33Å; Y703-A810 VanDerWaalsContact CA-O 3.3Å; Y703-A810 WeakPolarHBondContact CA-O 3.3Å
704	R	85	Confident	74.4	Confident	41 Å²	41	33.4 Å²	33.4	16%	0.155	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	149.1	179.3	67.9	-172.2	-169.8	-172.1	4.4	110.8	V706 W772 Y809 A810	R704-V706 HydrophobicContact CG-CG1 4.23Å; R704-W772 HydrophobicContact CG-CH2 4.14Å; R704-W772 HydrophobicContact CG-CZ2 4.34Å; R704-W772 VanDerWaalsContact CZ-O 3.22Å; R704-W772 PolarHBondContact NH1-O 2.81Å; R704-W772 PolarHBondContact NH2-O 2.72Å; R704-Y809 WeakPolarHBondContact O-CA 2.98Å; R704-A810 PolarHBondContact N-O 2.8Å; R704-A810 VanDerWaalsContact N-O 3.12Å; R704-A810 PolarHBondContact O-N 3.41Å
705	S	83.2	Confident	73	Confident	27 Å²	27	33.1 Å²	33.1	19%	0.189	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	136.1	170	50.6	0	0	0	0	110.1	C808	S705-C808 WeakPolarHBondContact CA-O 3.49Å
706	V	79.2	Confident	71.6	Confident	19 Å²	19	38.3 Å²	38.3	12%	0.115	22%	0.222	C	C	.	.			trans	-121.7	159	176.2	-67.3	0	0	0	0	110.4	R704 M708 R710 C808 A810	R704-V706 HydrophobicContact CG-CG1 4.23Å; V706-M708 PolarHBondContact O-N 3.3Å; V706-R710 HydrophobicContact CB-CG 4.15Å; V706-R710 HydrophobicContact CG2-CB 3.84Å; V706-R710 HydrophobicContact CG2-CG 3.99Å; V706-C808 HydrophobicContact CG2-CB 4.22Å; V706-C808 PolarHBondContact N-O 2.92Å; V706-A810 HydrophobicContact CG1-CB 3.59Å; V706-A810 HydrophobicContact CG2-CB 4.22Å
707	P	77.1	Confident	70.2	Confident	51 Å²	51	44.2 Å²	44.2	33%	0.331	25%	0.254	S	S	.	.			trans	-53.2	139.4	177.5	-28.1	36.1	0	0	0	111.9	S709 R710 L778	P707-S709 PolarHBondContact O-N 2.89Å; P707-R710 WeakPolarHBondContact O-CB 3.47Å; P707-R710 PolarHBondContact O-N 3.48Å; P707-L778 HydrophobicContact CG-CD1 4.49Å
708	M	72.9	Confident	68.6	Low	55 Å²	55	47.9 Å²	47.9	27%	0.271	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-57	-25.4	-173.3	-171.8	61	85.1	0	0	113.1	V706 R710 C711 L712 F806 C808 L836	V706-M708 PolarHBondContact O-N 3.3Å; M708-R710 PolarHBondContact O-N 2.87Å; M708-R710 VanDerWaalsContact O-N 3.09Å; M708-C711 CarbonylContact O-C 3.3Å; M708-C711 PolarHBondContact O-N 2.88Å; M708-C711 HydrophobicContact SD-CB 4.23Å; M708-L712 HydrophobicContact CG-CB 4.37Å; M708-L712 HydrophobicContact CG-CD1 3.46Å; M708-L712 VanDerWaalsContact CG-CD1 3.46Å; M708-L712 HydrophobicContact CG-CG 3.72Å; M708-L712 PolarHBondContact O-N 2.78Å; M708-L712 HydrophobicContact SD-CD1 4.02Å; M708-L712 HydrophobicContact SD-CG 3.97Å; M708-F806 HydrophobicContact CE-CD1 3.78Å; M708-F806 HydrophobicContact CE-CE1 3.74Å; M708-F806 HydrophobicContact CE-CG 4.39Å; M708-F806 HydrophobicContact CE-CZ 4.33Å; M708-F806 WeakPolarHBondContact CE-O 3.36Å; M708-C808 HydrophobicContact SD-CB 3.96Å; M708-L836 HydrophobicContact CE-CD1 3.85Å; M708-L836 HydrophobicContact SD-CD1 3.96Å
709	S	68	Low	67.1	Low	84 Å²	84	55.3 Å²	55.3	59%	0.587	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-63.5	-5	172	55.9	0	0	0	0	115.8	P707 L712	P707-S709 PolarHBondContact O-N 2.89Å; S709-L712 CarbonylContact C-O 3.55Å; S709-L712 WeakPolarHBondContact CA-O 3.41Å
710	R	73.3	Confident	64.9	Low	100 Å²	100	55.7 Å²	55.7	38%	0.377	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-81	-32.6	165.4	-64.6	-65.2	-173	147.9	5.1	112	V706 P707 M708 V834	V706-R710 HydrophobicContact CB-CG 4.15Å; V706-R710 HydrophobicContact CG2-CB 3.84Å; V706-R710 HydrophobicContact CG2-CG 3.99Å; P707-R710 WeakPolarHBondContact O-CB 3.47Å; P707-R710 PolarHBondContact O-N 3.48Å; M708-R710 PolarHBondContact O-N 2.87Å; M708-R710 VanDerWaalsContact O-N 3.09Å; R710-V834 HydrophobicContact CB-CG1 4.35Å
711	C	71.3	Confident	62.9	Low	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-32.9	175.4	-69.7	0	0	0	0	113.1	M708 I723 K724 I727 C808 V834 L836	M708-C711 CarbonylContact O-C 3.3Å; M708-C711 PolarHBondContact O-N 2.88Å; M708-C711 HydrophobicContact SD-CB 4.23Å; C711-I723 WeakPolarHBondContact O-CA 3.49Å; C711-K724 WeakPolarHBondContact O-CB 3.22Å; C711-K724 PolarHBondContact O-N 2.73Å; C711-I727 HydrophobicContact CB-CD1 4Å; C711-C808 HydrophobicContact CB-CB 3.83Å; C711-C808 WeakPolarHBondContact CB-SG 3.33Å; C711-C808 PolarHBondContact N-SG 2.98Å; C711-C808 VanDerWaalsContact SG-CA 3.54Å; C711-C808 WeakPolarHBondContact SG-CB 3.13Å; C711-C808 CovalentContact SG-SG 2.03Å; C711-C808 PolarHBondContact SG-SG 3.06Å; C711-V834 VanDerWaalsContact SG-CG1 3.5Å; C711-L836 HydrophobicContact CB-CB 4.37Å
712	L	65.6	Low	60.7	Low	24 Å²	24	63.2 Å²	63.2	13%	0.126	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	143.8	-175.2	-57.7	-173.9	0	0	0	112.6	M708 S709 Y721 Y722 I723	M708-L712 HydrophobicContact CG-CB 4.37Å; M708-L712 HydrophobicContact CG-CD1 3.46Å; M708-L712 VanDerWaalsContact CG-CD1 3.46Å; M708-L712 HydrophobicContact CG-CG 3.72Å; M708-L712 PolarHBondContact O-N 2.78Å; M708-L712 HydrophobicContact SD-CD1 4.02Å; M708-L712 HydrophobicContact SD-CG 3.97Å; S709-L712 CarbonylContact C-O 3.55Å; S709-L712 WeakPolarHBondContact CA-O 3.41Å; L712-Y721 HydrophobicContact CB-CD1 4.33Å; L712-Y721 HydrophobicContact CD1-CD1 4.4Å; L712-Y721 HydrophobicContact CD1-CG 4.41Å; L712-Y722 CarbonylContact C-O 3.55Å; L712-Y722 VanDerWaalsContact CA-O 3.31Å; L712-Y722 WeakPolarHBondContact CA-O 3.19Å; L712-I723 HydrophobicContact CD2-CB 4.34Å; L712-I723 HydrophobicContact CD2-CD1 4.34Å; L712-I723 HydrophobicContact CD2-CG1 3.33Å
713	T	53.7	Low	59.1	Low	55 Å²	55	64.8 Å²	64.8	34%	0.337	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	128.6	168.6	41	0	0	0	0	109.6	Y722 K724	T713-Y722 PolarHBondContact N-O 2.99Å; T713-Y722 PolarHBondContact O-N 3.47Å; T713-Y722 PolarHBondContact OG1-O 3.27Å; T713-K724 HydrophobicContact CG2-CB 4.33Å; T713-K724 HydrophobicContact CG2-CD 3.86Å; T713-K724 HydrophobicContact CG2-CG 3.92Å
714	S	43.9	Very low	57.2	Low	88 Å²	88	68.7 Å²	68.7	62%	0.615	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	149.3	173	48.7	0	0	0	0	111.5
715	N	42.6	Very low	55.1	Low	56 Å²	56	76 Å²	76	30%	0.299	41%	0.405	S	S	.	.			trans	-91.5	136.2	169.2	179.4	-7.4	0	0	0	109.5	N717 G720 Y722	N715-N717 VanDerWaalsContact C-N 3.26Å; N715-N717 PolarHBondContact O-N 2.8Å; N715-N717 PolarHBondContact OD1-N 2.92Å; N715-G720 PolarHBondContact N-O 2.91Å; N715-G720 VanDerWaalsContact N-O 3.11Å; N715-Y722 HydrophobicContact CB-CD2 4.08Å; N715-Y722 HydrophobicContact CB-CE2 3.52Å
716	S	44.2	Very low	53.1	Low	113 Å²	113	79 Å²	79	79%	0.79	43%	0.427	S	S	*	.	S	Bend	trans	-72	-19.8	177.8	55.7	0	0	0	0	113.7
717	N	45.9	Very low	51.3	Low	135 Å²	135	78.9 Å²	78.9	72%	0.722	43%	0.425	S	S	*	.	S	Bend	trans	-109.6	-1.9	-167.2	-60.1	3.2	0	0	0	113.2	N715	N715-N717 VanDerWaalsContact C-N 3.26Å; N715-N717 PolarHBondContact O-N 2.8Å; N715-N717 PolarHBondContact OD1-N 2.92Å
718	N	38.7	Very low	49.4	Very low	111 Å²	111	79 Å²	79	59%	0.594	43%	0.425	S	S	*	.	S	Bend	trans	-158.9	138.2	171.9	-95.9	-33.4	0	0	0	107	G720	N718-G720 PolarHBondContact O-N 3.23Å
719	N	39.9	Very low	47.5	Very low	157 Å²	157	82.6 Å²	82.6	84%	0.84	44%	0.44	S	S	*	.	S	Bend	trans	-64.9	13.3	-171.4	-67.8	-1.9	0	0	0	116.2	H735	N719-H735 PolarHBondContact O-NE2 2.93Å
720	G	36.7	Very low	46	Very low	7 Å²	7	82 Å²	82	7%	0.072	43%	0.426	C	S	.	.			trans	-80.6	145.8	-178.5	0	0	0	0	0	114.6	N715 N718	N715-G720 PolarHBondContact N-O 2.91Å; N715-G720 VanDerWaalsContact N-O 3.11Å; N718-G720 PolarHBondContact O-N 3.23Å
721	Y	40.4	Very low	44.1	Very low	123 Å²	123	78.8 Å²	78.8	48%	0.482	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	137.7	166.7	-63.3	-93.9	0	0	0	110.4	L712 H735	L712-Y721 HydrophobicContact CB-CD1 4.33Å; L712-Y721 HydrophobicContact CD1-CD1 4.4Å; L712-Y721 HydrophobicContact CD1-CG 4.41Å; Y721-H735 AromaticContact CD2-NE2 3.96Å
722	Y	40.4	Very low	42.3	Very low	72 Å²	72	86.3 Å²	86.3	28%	0.282	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	143.1	176.6	-61	-96.1	0	0	0	108.8	L712 T713 N715 K732	L712-Y722 CarbonylContact C-O 3.55Å; L712-Y722 VanDerWaalsContact CA-O 3.31Å; L712-Y722 WeakPolarHBondContact CA-O 3.19Å; T713-Y722 PolarHBondContact N-O 2.99Å; T713-Y722 PolarHBondContact O-N 3.47Å; T713-Y722 PolarHBondContact OG1-O 3.27Å; N715-Y722 HydrophobicContact CB-CD2 4.08Å; N715-Y722 HydrophobicContact CB-CE2 3.52Å; Y722-K732 HydrophobicContact CD1-CG 4.27Å; Y722-K732 HydrophobicContact CE1-CB 4.07Å; Y722-K732 HydrophobicContact CE1-CD 4.06Å; Y722-K732 HydrophobicContact CE1-CG 3.81Å
723	I	51.8	Low	40.9	Very low	36 Å²	36	87 Å²	87	19%	0.185	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	134.8	170.1	-75	161.3	0	0	0	108.4	C711 L712 I727 Y730 L836	C711-I723 WeakPolarHBondContact O-CA 3.49Å; L712-I723 HydrophobicContact CD2-CB 4.34Å; L712-I723 HydrophobicContact CD2-CD1 4.34Å; L712-I723 HydrophobicContact CD2-CG1 3.33Å; I723-I727 HydrophobicContact CG2-CB 4.03Å; I723-I727 HydrophobicContact CG2-CG2 4.31Å; I723-Y730 VanDerWaalsContact CD1-CB 3.45Å; I723-Y730 HydrophobicContact CD1-CD1 3.52Å; I723-Y730 HydrophobicContact CD1-CD2 3.66Å; I723-Y730 HydrophobicContact CD1-CE1 4.04Å; I723-Y730 HydrophobicContact CD1-CE2 4.16Å; I723-Y730 HydrophobicContact CD1-CG 3.28Å; I723-Y730 HydrophobicContact CG1-CG 4.47Å; I723-L836 HydrophobicContact CD1-CD2 3.87Å; I723-L836 HydrophobicContact CG1-CD2 4.31Å
724	K	48.1	Very low	40.1	Very low	88 Å²	88	89.2 Å²	89.2	38%	0.383	47%	0.47	S	S	.	.			trans	-73	130.8	-169	-164.7	172.9	-165	164.8	0	110.3	C711 T713 S726 I727	C711-K724 WeakPolarHBondContact O-CB 3.22Å; C711-K724 PolarHBondContact O-N 2.73Å; T713-K724 HydrophobicContact CG2-CB 4.33Å; T713-K724 HydrophobicContact CG2-CD 3.86Å; T713-K724 HydrophobicContact CG2-CG 3.92Å; K724-S726 PolarHBondContact O-N 2.95Å; K724-I727 PolarHBondContact O-N 2.92Å
725	E	40.6	Very low	40	Very low	195 Å²	195	89.9 Å²	89.9	91%	0.911	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-17.4	-167.5	-61.5	170.8	150	0	0	116.1	I727	E725-I727 PolarHBondContact O-N 2.98Å
726	S	39.9	Very low	40	Very low	91 Å²	91	92.8 Å²	92.8	64%	0.636	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	0.9	169.7	60.2	0	0	0	0	114.5	K724	K724-S726 PolarHBondContact O-N 2.95Å
727	I	42.5	Very low	40	Very low	16 Å²	16	89.1 Å²	89.1	8%	0.082	45%	0.453	C	S	.	.	S	Bend	trans	-124.8	125.8	174.9	-48.5	-178.1	0	0	0	106.1	C711 I723 K724 E725 H729 V834	C711-I727 HydrophobicContact CB-CD1 4Å; I723-I727 HydrophobicContact CG2-CB 4.03Å; I723-I727 HydrophobicContact CG2-CG2 4.31Å; K724-I727 PolarHBondContact O-N 2.92Å; E725-I727 PolarHBondContact O-N 2.98Å; I727-H729 PolarHBondContact O-N 3.29Å; I727-H729 VanDerWaalsContact O-N 3.16Å; I727-V834 HydrophobicContact CD1-CB 4.13Å; I727-V834 HydrophobicContact CD1-CG1 3.8Å; I727-V834 WeakPolarHBondContact CG1-O 3.27Å
728	T	35.9	Very low	40.2	Very low	53 Å²	53	84.2 Å²	84.2	33%	0.325	43%	0.429	S	S	.	.			trans	-56.8	115.3	-163.3	50.8	0	0	0	0	114.2	Y730	T728-Y730 PolarHBondContact O-N 3.5Å
729	H	34.1	Very low	40.3	Very low	130 Å²	130	81.3 Å²	81.3	60%	0.602	42%	0.415	S	S	*	.			trans	32.7	71.2	154.3	-62.9	105.8	0	0	0	117.9	I727	I727-H729 PolarHBondContact O-N 3.29Å; I727-H729 VanDerWaalsContact O-N 3.16Å
730	Y	36.7	Very low	40.2	Very low	72 Å²	72	77.9 Å²	77.9	28%	0.282	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-92.1	134.8	159.4	-99.3	-103.8	0	0	0	111	I723 T728 Y838	I723-Y730 VanDerWaalsContact CD1-CB 3.45Å; I723-Y730 HydrophobicContact CD1-CD1 3.52Å; I723-Y730 HydrophobicContact CD1-CD2 3.66Å; I723-Y730 HydrophobicContact CD1-CE1 4.04Å; I723-Y730 HydrophobicContact CD1-CE2 4.16Å; I723-Y730 HydrophobicContact CD1-CG 3.28Å; I723-Y730 HydrophobicContact CG1-CG 4.47Å; T728-Y730 PolarHBondContact O-N 3.5Å; Y730-Y838 WeakPolarHBondContact OH-CD1 3.44Å; Y730-Y838 WeakPolarHBondContact OH-CE1 3.46Å
731	P	33.4	Very low	39.9	Very low	33 Å²	33	83.5 Å²	83.5	21%	0.214	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-72.2	161.4	177.5	29.1	-33.7	0	0	0	112.7	A733 F740 K741	P731-A733 PolarHBondContact O-N 3.49Å; P731-F740 HydrophobicContact CG-CB 4.03Å; P731-F740 HydrophobicContact CG-CD1 4.24Å; P731-K741 WeakPolarHBondContact CB-O 3.2Å
732	K	33.3	Very low	39.7	Very low	157 Å²	157	83.4 Å²	83.4	68%	0.683	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-61.2	126	-173.3	-53	-177.7	178.6	173.8	0	111.6	Y722	Y722-K732 HydrophobicContact CD1-CG 4.27Å; Y722-K732 HydrophobicContact CE1-CB 4.07Å; Y722-K732 HydrophobicContact CE1-CD 4.06Å; Y722-K732 HydrophobicContact CE1-CG 3.81Å
733	A	36	Very low	39.2	Very low	39 Å²	39	86.6 Å²	86.6	32%	0.322	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-81.3	120.9	167.3	0	0	0	0	0	110.3	P731	P731-A733 PolarHBondContact O-N 3.49Å
734	D	37.3	Very low	38.3	Very low	101 Å²	101	88 Å²	88	54%	0.54	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-89.7	134	160.7	-169.3	-21.8	0	0	0	108.1	N736 S737	D734-N736 PolarHBondContact O-N 2.97Å; D734-N736 PolarHBondContact OD1-N 3.03Å; D734-S737 PolarHBondContact O-N 3.45Å
735	H	42	Very low	37.4	Very low	102 Å²	102	86.8 Å²	86.8	47%	0.472	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-8.7	-173.6	-88.8	-87	0	0	0	114.5	N719 Y721	N719-H735 PolarHBondContact O-NE2 2.93Å; Y721-H735 AromaticContact CD2-NE2 3.96Å
736	N	42.2	Very low	37.1	Very low	117 Å²	117	85.7 Å²	85.7	63%	0.626	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	7.1	-176.8	-64.6	-72.9	0	0	0	115	D734	D734-N736 PolarHBondContact O-N 2.97Å; D734-N736 PolarHBondContact OD1-N 3.03Å
737	S	44	Very low	36.6	Very low	37 Å²	37	88.5 Å²	88.5	26%	0.259	45%	0.453	S	S	.	.			trans	-148.3	141.6	177.8	57.7	0	0	0	0	113.6	D734 T739	D734-S737 PolarHBondContact O-N 3.45Å; S737-T739 PolarHBondContact O-N 2.87Å; S737-T739 PolarHBondContact OG-OG1 2.88Å
738	C	51.2	Low	35.9	Very low	31 Å²	31	92 Å²	92	21%	0.209	47%	0.471	C	S	.	.			trans	-76.8	28.6	170.6	-41.6	0	0	0	0	112.3	S223 F740 C923	S223-C738 VanDerWaalsContact O-CB 3.26Å; S223-C738 WeakPolarHBondContact O-CB 3.38Å; S223-C738 PolarHBondContact O-SG 2.9Å; S223-C738 VanDerWaalsContact O-SG 3.36Å; C738-F740 PolarHBondContact O-N 2.93Å; C738-C923 HydrophobicContact CB-CB 4.38Å
739	T	39.3	Very low	35.8	Very low	51 Å²	51	92.6 Å²	92.6	31%	0.313	47%	0.472	S	S	.	.			trans	-86.9	90	178	50.9	0	0	0	0	110.5	S223 S737 K741	S223-T739 WeakPolarHBondContact OG-CG2 3.47Å; S737-T739 PolarHBondContact O-N 2.87Å; S737-T739 PolarHBondContact OG-OG1 2.88Å; T739-K741 PolarHBondContact O-N 3.4Å
740	F	38	Very low	35.8	Very low	84 Å²	84	91.6 Å²	91.6	37%	0.368	47%	0.471	S	S	.	.			trans	-74.2	114.4	154.6	-63.4	-82	0	0	0	107.4	P731 C738 D742	P731-F740 HydrophobicContact CG-CB 4.03Å; P731-F740 HydrophobicContact CG-CD1 4.24Å; C738-F740 PolarHBondContact O-N 2.93Å; F740-D742 PolarHBondContact O-N 3.42Å
741	K	31.6	Very low	35.5	Very low	126 Å²	126	91.5 Å²	91.5	55%	0.548	48%	0.481	S	S	.	.			trans	-80.1	96	175.9	-113.3	176.8	169	-77	0	108.8	P731 T739 E743	P731-K741 WeakPolarHBondContact CB-O 3.2Å; T739-K741 PolarHBondContact O-N 3.4Å; K741-E743 HydrophobicContact CB-CG 4.42Å; K741-E743 WeakPolarHBondContact CD-OE2 3.39Å; K741-E743 HydrophobicContact CG-CG 4.33Å; K741-E743 IonicContact NZ-OE1 3.99Å; K741-E743 PolarHBondContact NZ-OE1 2.88Å; K741-E743 IonicContact NZ-OE2 3.3Å; K741-E743 PolarHBondContact NZ-OE2 3Å; K741-E743 PolarHBondContact O-N 3.46Å
742	D	35.1	Very low	35.6	Very low	121 Å²	121	99.4 Å²	99.4	65%	0.647	51%	0.508	S	S	*	.			trans	-80.5	44.3	-171.4	-135.3	-13.8	0	0	0	113	F740 S744	F740-D742 PolarHBondContact O-N 3.42Å; D742-S744 PolarHBondContact O-N 2.65Å
743	E	30.2	Very low	36.2	Very low	138 Å²	138	97.6 Å²	97.6	65%	0.645	50%	0.502	S	S	*	.			trans	-96.7	24	-162.4	-65.2	179.2	148.6	0	0	114.2	K741	K741-E743 HydrophobicContact CB-CG 4.42Å; K741-E743 WeakPolarHBondContact CD-OE2 3.39Å; K741-E743 HydrophobicContact CG-CG 4.33Å; K741-E743 IonicContact NZ-OE1 3.99Å; K741-E743 PolarHBondContact NZ-OE1 2.88Å; K741-E743 IonicContact NZ-OE2 3.3Å; K741-E743 PolarHBondContact NZ-OE2 3Å; K741-E743 PolarHBondContact O-N 3.46Å
744	S	33.1	Very low	36.1	Very low	65 Å²	65	101.7 Å²	101.7	46%	0.455	52%	0.519	S	S	.	.	S	Bend	trans	-159	-14.3	-177.4	50.4	0	0	0	0	118.7	D742	D742-S744 PolarHBondContact O-N 2.65Å
745	M	29.6	Very low	36.2	Very low	63 Å²	63	106.2 Å²	106.2	31%	0.31	54%	0.536	S	S	.	.	S	Bend	trans	-84.3	-29.8	-161.5	-169	155.3	50.6	0	0	115.8	L749	M745-L749 HydrophobicContact CG-CD1 4.18Å
746	E	33.9	Very low	36.2	Very low	173 Å²	173	105.5 Å²	105.5	81%	0.808	54%	0.539	S	S	*	.	H	α-helix	trans	-71.1	-49	178.5	-64.6	-170.4	137.3	0	0	111.6	L748 L749	E746-L748 PolarHBondContact O-N 2.65Å; E746-L748 VanDerWaalsContact O-N 3.1Å; E746-L749 PolarHBondContact O-N 2.7Å
747	N	29	Very low	36.5	Very low	149 Å²	149	104.4 Å²	104.4	80%	0.797	54%	0.536	S	S	*	.	H	α-helix	trans	-69.3	-8.5	-175.9	-67.4	-13.1	0	0	0	115.5
748	L	27.7	Very low	37	Very low	90 Å²	90	104.7 Å²	104.7	47%	0.471	54%	0.538	S	S	.	.	H	α-helix	trans	-105.2	-16	-179	-97.4	164.7	0	0	0	114	E746 S751	E746-L748 PolarHBondContact O-N 2.65Å; E746-L748 VanDerWaalsContact O-N 3.1Å; L748-S751 PolarHBondContact O-OG 3.34Å
749	L	34	Very low	37.5	Very low	66 Å²	66	107 Å²	107	35%	0.346	55%	0.553	S	S	.	*	H	α-helix	trans	-83.4	-39.3	177.3	-80.1	166.6	0	0	0	111.6	M745 E746 S751 Y752	M745-L749 HydrophobicContact CG-CD1 4.18Å; E746-L749 PolarHBondContact O-N 2.7Å; L749-S751 PolarHBondContact O-N 3.27Å; L749-Y752 PolarHBondContact O-N 2.76Å
750	D	33.5	Very low	38.2	Very low	109 Å²	109	108.2 Å²	108.2	58%	0.583	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-62.5	-33.6	172.7	-73.6	-5.9	0	0	0	111.4	Y752 E753	D750-Y752 PolarHBondContact O-N 3.3Å; D750-E753 PolarHBondContact O-N 2.97Å
751	S	30.4	Very low	38.7	Very low	69 Å²	69	109.2 Å²	109.2	48%	0.483	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-69.8	3.3	178.5	71.3	0	0	0	0	115.5	L748 L749	L748-S751 PolarHBondContact O-OG 3.34Å; L749-S751 PolarHBondContact O-N 3.27Å
752	Y	36.6	Very low	39.1	Very low	199 Å²	199	108.4 Å²	108.4	78%	0.78	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-120.5	-1.1	175.7	-113.4	-85.3	0	0	0	113.6	L749 D750	L749-Y752 PolarHBondContact O-N 2.76Å; D750-Y752 PolarHBondContact O-N 3.3Å
753	E	44.7	Very low	39.3	Very low	119 Å²	119	112.9 Å²	112.9	56%	0.556	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-7.8	173.7	-71.9	-174.7	-169.5	0	0	113	K346 D750	K346-E753 IonicContact NZ-OE1 3.94Å; K346-E753 PolarHBondContact NZ-OE1 2.72Å; K346-E753 IonicContact NZ-OE2 3.16Å; K346-E753 PolarHBondContact NZ-OE2 2.77Å; D750-E753 PolarHBondContact O-N 2.97Å
754	D	35.7	Very low	39.7	Very low	126 Å²	126	112.7 Å²	112.7	67%	0.674	59%	0.59	S	S	*	*	S	Bend	trans	-87	131.5	178.3	-80.1	-36.7	0	0	0	114.5	V756	D754-V756 VanDerWaalsContact C-N 3.29Å; D754-V756 PolarHBondContact O-N 2.85Å
755	E	38.9	Very low	39.7	Very low	196 Å²	196	115 Å²	115	92%	0.916	61%	0.606	S	S	*	*	S	Bend	trans	54	-17.4	164.5	-58	-154.2	135.8	0	0	121.7	T757	E755-T757 PolarHBondContact O-N 3.48Å
756	V	41.1	Very low	39.8	Very low	86 Å²	86	121.7 Å²	121.7	52%	0.521	63%	0.634	S	S	.	*			trans	-77.4	113.1	-177.6	-176.4	0	0	0	0	112.3	D754 P758 L761	D754-V756 VanDerWaalsContact C-N 3.29Å; D754-V756 PolarHBondContact O-N 2.85Å; V756-P758 VanDerWaalsContact O-CD 3.3Å; V756-P758 WeakPolarHBondContact O-CD 3.2Å; V756-L761 HydrophobicContact CG1-CD1 4.42Å; V756-L761 HydrophobicContact CG1-CD2 3.97Å; V756-L761 HydrophobicContact CG1-CG 4.07Å
757	T	48.7	Very low	39.9	Very low	94 Å²	94	120.8 Å²	120.8	58%	0.577	63%	0.629	S	S	*	*			trans	-67.3	116.9	170.1	36.6	0	0	0	0	110.7	E755 C759 S760	E755-T757 PolarHBondContact O-N 3.48Å; T757-C759 PolarHBondContact O-N 3.47Å; T757-S760 PolarHBondContact O-N 3.5Å; T757-S760 PolarHBondContact O-OG 3.03Å; T757-S760 WeakPolarHBondContact OG1-CB 3.49Å; T757-S760 PolarHBondContact OG1-OG 2.98Å
758	P	54.3	Low	40.2	Very low	44 Å²	44	123.2 Å²	123.2	29%	0.286	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.8	-26.7	-167.2	-28.5	35.8	0	0	0	115.7	F685 V756	F685-P758 HydrophobicContact CB-CB 4.05Å; F685-P758 HydrophobicContact CD1-CB 4.22Å; F685-P758 HydrophobicContact CD1-CG 3.79Å; F685-P758 HydrophobicContact CD2-CB 3.52Å; F685-P758 HydrophobicContact CD2-CG 3.57Å; F685-P758 HydrophobicContact CE1-CG 3.7Å; F685-P758 HydrophobicContact CE2-CB 3.93Å; F685-P758 HydrophobicContact CE2-CG 3.49Å; F685-P758 VanDerWaalsContact CE2-CG 3.49Å; F685-P758 HydrophobicContact CG-CB 3.68Å; F685-P758 HydrophobicContact CG-CG 3.72Å; F685-P758 HydrophobicContact CZ-CB 4.42Å; F685-P758 HydrophobicContact CZ-CG 3.53Å; V756-P758 VanDerWaalsContact O-CD 3.3Å; V756-P758 WeakPolarHBondContact O-CD 3.2Å
759	C	62.3	Low	40.7	Very low	78 Å²	78	122.6 Å²	122.6	53%	0.527	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.5	2.7	-179.7	-58.9	0	0	0	0	114.7	C687 T757	C687-C759 VanDerWaalsContact CA-SG 3.51Å; C687-C759 HydrophobicContact CB-CB 3.85Å; C687-C759 WeakPolarHBondContact CB-SG 3.28Å; C687-C759 WeakPolarHBondContact SG-CA 3.5Å; C687-C759 WeakPolarHBondContact SG-CB 3.28Å; C687-C759 CovalentContact SG-SG 2.04Å; C687-C759 PolarHBondContact SG-SG 2.98Å; T757-C759 PolarHBondContact O-N 3.47Å
760	S	53.5	Low	41.5	Very low	77 Å²	77	122.3 Å²	122.3	54%	0.538	63%	0.634	S	S	.	*	S	Bend	trans	-97.5	-7.5	175.1	68.4	0	0	0	0	113.9	T757	T757-S760 PolarHBondContact O-N 3.5Å; T757-S760 PolarHBondContact O-OG 3.03Å; T757-S760 WeakPolarHBondContact OG1-CB 3.49Å; T757-S760 PolarHBondContact OG1-OG 2.98Å
761	L	48.6	Very low	42.2	Very low	106 Å²	106	121.2 Å²	121.2	56%	0.555	63%	0.629	S	S	*	*	S	Bend	trans	-63.1	131.5	176.9	-73.9	171.7	0	0	0	111.6	V756	V756-L761 HydrophobicContact CG1-CD1 4.42Å; V756-L761 HydrophobicContact CG1-CD2 3.97Å; V756-L761 HydrophobicContact CG1-CG 4.07Å
762	P	40	Very low	43.3	Very low	109 Å²	109	119.8 Å²	119.8	71%	0.708	61%	0.613	S	S	*	*			trans	-57.9	143.2	174.5	-24.9	34.2	0	0	0	112.1	I764	P762-I764 PolarHBondContact O-N 2.97Å
763	R	40.8	Very low	43.8	Very low	215 Å²	215	115.6 Å²	115.6	81%	0.811	60%	0.604	S	S	*	*			trans	-59.7	97.5	173.7	-82.7	-178	162.2	165.3	-4.1	110.7	D666 S765	D666-R763 IonicContact OD2-CZ 2.71Å; D666-R763 IonicContact OD2-NE 3.75Å; D666-R763 IonicContact OD2-NH2 3.06Å; D666-R763 PolarHBondContact OD2-NH2 2.8Å; R763-S765 PolarHBondContact O-N 3.4Å
764	I	38	Very low	43.4	Very low	134 Å²	134	114.6 Å²	114.6	69%	0.687	61%	0.607	S	S	*	*			trans	-55.1	126.6	177.2	-59.8	178.6	0	0	0	108.9	P762 K766	P762-I764 PolarHBondContact O-N 2.97Å; I764-K766 PolarHBondContact O-N 3.47Å
765	S	32.7	Very low	43.6	Very low	114 Å²	114	111.9 Å²	111.9	80%	0.797	60%	0.597	S	S	*	*			trans	-69.8	89.9	-162.1	42.4	0	0	0	0	113.4	R763 Q767	R763-S765 PolarHBondContact O-N 3.4Å; S765-Q767 VanDerWaalsContact C-N 3.34Å; S765-Q767 PolarHBondContact O-N 3.1Å
766	K	31.5	Very low	43.7	Very low	203 Å²	203	108.7 Å²	108.7	88%	0.883	60%	0.596	S	S	*	*			trans	41.2	55.7	172.4	-70.4	-173.4	176.9	179	0	113.1	I764 K768	I764-K766 PolarHBondContact O-N 3.47Å; K766-K768 PolarHBondContact O-N 2.88Å
767	Q	35.4	Very low	43.8	Very low	153 Å²	153	112.4 Å²	112.4	72%	0.715	61%	0.606	S	S	*	*			trans	-49.4	121.3	168.8	-166.4	179.6	23.4	0	0	108.1	S765 S769	S765-Q767 VanDerWaalsContact C-N 3.34Å; S765-Q767 PolarHBondContact O-N 3.1Å; Q767-S769 PolarHBondContact O-N 3.38Å
768	K	36	Very low	43.6	Very low	201 Å²	201	111.7 Å²	111.7	87%	0.874	60%	0.598	S	S	*	*			trans	-54.6	102.2	-153.5	-170.1	173.4	-175.7	174.6	0	111.4	K766 L770	K766-K768 PolarHBondContact O-N 2.88Å; K768-L770 PolarHBondContact O-N 2.95Å
769	S	39.1	Very low	43.1	Very low	77 Å²	77	115.3 Å²	115.3	54%	0.538	62%	0.624	S	S	.	*			trans	-49.2	125.5	-164.9	-169.6	0	0	0	0	111	Q767 D771	Q767-S769 PolarHBondContact O-N 3.38Å; S769-D771 PolarHBondContact O-N 2.84Å
770	L	49.4	Very low	42.8	Very low	59 Å²	59	114.3 Å²	114.3	31%	0.309	63%	0.627	S	S	.	*			trans	-74	95.2	-174.9	-159.3	91.6	0	0	0	108.8	K768 W772 V832 V834	K768-L770 PolarHBondContact O-N 2.95Å; L770-W772 PolarHBondContact O-N 3.33Å; L770-V832 HydrophobicContact CB-CB 4.35Å; L770-V832 HydrophobicContact CB-CG1 4.41Å; L770-V832 HydrophobicContact CD2-CG1 4.07Å; L770-V834 HydrophobicContact CD2-CG2 3.33Å
771	D	48.6	Very low	43.3	Very low	87 Å²	87	115.2 Å²	115.2	47%	0.465	62%	0.623	S	S	.	*			trans	-53.7	127.6	-167.2	-167.2	1	0	0	0	112.4	S769 N773	S769-D771 PolarHBondContact O-N 2.84Å; D771-N773 VanDerWaalsContact C-N 3.29Å; D771-N773 VanDerWaalsContact CG-ND2 3.26Å; D771-N773 WeakPolarHBondContact OD1-CB 3.23Å; D771-N773 VanDerWaalsContact OD1-CG 3.25Å; D771-N773 PolarHBondContact OD1-N 3.04Å; D771-N773 PolarHBondContact OD1-ND2 3.1Å; D771-N773 PolarHBondContact OD2-ND2 2.97Å
772	W	54.6	Low	44.5	Very low	39 Å²	39	114.8 Å²	114.8	15%	0.148	62%	0.617	C	S	.	*			trans	-83.2	-7.1	179.8	-164.1	-100.4	0	0	0	111.9	R704 L770 E781 A810 V832	R704-W772 HydrophobicContact CG-CH2 4.14Å; R704-W772 HydrophobicContact CG-CZ2 4.34Å; R704-W772 VanDerWaalsContact CZ-O 3.22Å; R704-W772 PolarHBondContact NH1-O 2.81Å; R704-W772 PolarHBondContact NH2-O 2.72Å; L770-W772 PolarHBondContact O-N 3.33Å; W772-E781 PolarHBondContact NE1-OE2 3.03Å; W772-A810 HydrophobicContact CZ3-CB 3.81Å; W772-V832 HydrophobicContact CD2-CG2 4.46Å; W772-V832 HydrophobicContact CE3-CB 4.39Å; W772-V832 HydrophobicContact CE3-CG1 3.79Å; W772-V832 HydrophobicContact CE3-CG2 3.61Å; W772-V832 HydrophobicContact CZ3-CG1 3.79Å; W772-V832 HydrophobicContact CZ3-CG2 4.15Å
773	N	47	Very low	45.6	Very low	111 Å²	111	112.3 Å²	112.3	59%	0.594	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-55.4	137	172.7	-68.3	-37.1	0	0	0	111.5	D771	D771-N773 VanDerWaalsContact C-N 3.29Å; D771-N773 VanDerWaalsContact CG-ND2 3.26Å; D771-N773 WeakPolarHBondContact OD1-CB 3.23Å; D771-N773 VanDerWaalsContact OD1-CG 3.25Å; D771-N773 PolarHBondContact OD1-N 3.04Å; D771-N773 PolarHBondContact OD1-ND2 3.1Å; D771-N773 PolarHBondContact OD2-ND2 2.97Å
774	P	34.7	Very low	46.6	Very low	97 Å²	97	103.7 Å²	103.7	63%	0.63	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-87.8	143.1	-167	32.9	-35.5	0	0	0	113.6
775	P	41.1	Very low	47.4	Very low	70 Å²	70	102.9 Å²	102.9	46%	0.455	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-70.6	123.4	147	-4.7	22.8	0	0	0	108.1	F777	P775-F777 PolarHBondContact O-N 2.89Å
776	S	40.6	Very low	49	Very low	129 Å²	129	99.1 Å²	99.1	90%	0.902	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	37.3	-167.7	61.3	0	0	0	0	115.6
777	F	42.4	Very low	50	Low	164 Å²	164	90.9 Å²	90.9	72%	0.719	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.8	-4.7	-176.7	107.5	-86.7	0	0	0	115.6	P775	P775-F777 PolarHBondContact O-N 2.89Å
778	L	44.7	Very low	51.3	Low	79 Å²	79	85.4 Å²	85.4	41%	0.414	47%	0.467	S	S	.	.			trans	-113.6	106.3	-179.3	-67.5	173.6	0	0	0	111.1	P707	P707-L778 HydrophobicContact CG-CD1 4.49Å
779	S	43.5	Very low	51.9	Low	119 Å²	119	78.1 Å²	78.1	83%	0.832	44%	0.441	S	S	*	.			trans	-82.2	150.7	-179.1	53	0	0	0	0	113.4
780	G	57.1	Low	52.4	Low	58 Å²	58	76.8 Å²	76.8	60%	0.598	44%	0.439	S	S	*	.			trans	92.6	77.5	170	0	0	0	0	0	115.4
781	E	64.3	Low	52.2	Low	96 Å²	96	77.5 Å²	77.5	45%	0.449	45%	0.446	S	S	.	.			trans	-68.5	125.6	155.8	-174.7	167.3	151.9	0	0	108.6	T702 W772	T702-E781 WeakPolarHBondContact CB-OE1 3.35Å; T702-E781 WeakPolarHBondContact CG2-OE1 3.42Å; W772-E781 PolarHBondContact NE1-OE2 3.03Å
782	K	72.8	Confident	52.3	Low	97 Å²	97	76.3 Å²	76.3	42%	0.422	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	151.7	177	-73.1	-173.7	169.9	-164	0	110.5	T702 Y703 N802	T702-K782 WeakPolarHBondContact CA-O 3.37Å; Y703-K782 HydrophobicContact CD1-CB 4.19Å; Y703-K782 HydrophobicContact CD2-CB 3.97Å; Y703-K782 HydrophobicContact CD2-CD 4.41Å; Y703-K782 HydrophobicContact CE1-CB 3.73Å; Y703-K782 HydrophobicContact CE2-CB 3.49Å; Y703-K782 VanDerWaalsContact CE2-CB 3.49Å; Y703-K782 HydrophobicContact CE2-CD 3.49Å; Y703-K782 VanDerWaalsContact CE2-CD 3.49Å; Y703-K782 HydrophobicContact CE2-CG 4.12Å; Y703-K782 HydrophobicContact CG-CB 4.29Å; Y703-K782 PolarHBondContact N-O 2.98Å; Y703-K782 PolarHBondContact O-N 3.49Å; K782-N802 PolarHBondContact NZ-O 2.99Å
783	V	62.5	Low	52	Low	57 Å²	57	81.5 Å²	81.5	35%	0.345	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	109.8	-175	-171.5	0	0	0	0	110.3	K700 A701 T702 Y785	K700-V783 HydrophobicContact CD-CG1 3.98Å; K700-V783 HydrophobicContact CG-CG1 3.48Å; K700-V783 VanDerWaalsContact CG-CG1 3.48Å; A701-V783 WeakPolarHBondContact O-CA 3.18Å; T702-V783 HydrophobicContact CG2-CG2 4.43Å; V783-Y785 HydrophobicContact CB-CE2 4.45Å; V783-Y785 HydrophobicContact CG1-CD2 4.16Å; V783-Y785 HydrophobicContact CG1-CE1 4.4Å; V783-Y785 HydrophobicContact CG1-CE2 3.61Å
784	D	62	Low	52.7	Low	33 Å²	33	79.3 Å²	79.3	18%	0.176	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	135	170.6	-73.5	14.2	0	0	0	108.4	A701 Y703 M798 S801	A701-D784 HydrophobicContact CB-CB 4.49Å; A701-D784 PolarHBondContact N-O 2.96Å; A701-D784 PolarHBondContact O-N 2.96Å; Y703-D784 HydrophobicContact CE1-CB 4.02Å; Y703-D784 VanDerWaalsContact CE1-OD1 3.23Å; Y703-D784 WeakPolarHBondContact CE1-OD1 3.37Å; Y703-D784 PolarHBondContact OH-OD1 3.47Å; D784-M798 HydrophobicContact CB-CE 3.57Å; D784-S801 PolarHBondContact OD2-N 3.46Å
785	Y	56.4	Low	54.4	Low	117 Å²	117	76.1 Å²	76.1	46%	0.459	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.6	176.4	-71	-85.3	0	0	0	110.8	K700 V783 F816 F826	K700-Y785 HydrophobicContact CB-CD1 3.97Å; K700-Y785 HydrophobicContact CB-CE1 3.88Å; K700-Y785 HydrophobicContact CD-CE1 3.8Å; K700-Y785 HydrophobicContact CG-CD1 4.13Å; K700-Y785 HydrophobicContact CG-CE1 3.71Å; V783-Y785 HydrophobicContact CB-CE2 4.45Å; V783-Y785 HydrophobicContact CG1-CD2 4.16Å; V783-Y785 HydrophobicContact CG1-CE1 4.4Å; V783-Y785 HydrophobicContact CG1-CE2 3.61Å; Y785-F816 HydrophobicContact CD1-CD1 4.45Å; Y785-F816 AromaticContact CD1-CE1 3.88Å; Y785-F816 HydrophobicContact CD1-CE1 3.88Å; Y785-F816 HydrophobicContact CD1-CZ 4.45Å; Y785-F826 HydrophobicContact CE1-CE1 4.02Å; Y785-F826 HydrophobicContact CE1-CZ 4.01Å
786	Y	64.5	Low	56	Low	35 Å²	35	73.6 Å²	73.6	14%	0.137	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	137.3	173.2	-175.1	-81.8	0	0	0	109.1	S341 G698 F699 H788 M798	S341-Y786 PolarHBondContact O-OH 2.63Å; G698-Y786 CarbonylContact C-O 3.57Å; G698-Y786 VanDerWaalsContact CA-O 3.23Å; G698-Y786 WeakPolarHBondContact CA-O 3.18Å; F699-Y786 HydrophobicContact CD2-CD1 4.16Å; F699-Y786 PolarHBondContact N-O 2.9Å; F699-Y786 PolarHBondContact O-N 3.35Å; F699-Y786 VanDerWaalsContact O-O 3.11Å; Y786-H788 HydrophobicContact CD1-CB 4.42Å; Y786-H788 HydrophobicContact CE1-CB 4.2Å; Y786-M798 HydrophobicContact CD2-CB 4.24Å; Y786-M798 HydrophobicContact CD2-CG 3.96Å; Y786-M798 HydrophobicContact CD2-SD 4.47Å; Y786-M798 HydrophobicContact CG-CG 4.4Å; Y786-M798 HydrophobicContact CG-SD 4.35Å
787	I	53.9	Low	57.8	Low	30 Å²	30	69.8 Å²	69.8	15%	0.154	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.3	176	-77.6	170.4	0	0	0	108.3	K339 T697 F816	K339-I787 HydrophobicContact CB-CB 4.26Å; K339-I787 HydrophobicContact CB-CD1 4.36Å; K339-I787 HydrophobicContact CB-CG2 4.32Å; K339-I787 HydrophobicContact CD-CD1 3.54Å; K339-I787 HydrophobicContact CG-CD1 4Å; T697-I787 WeakPolarHBondContact O-CA 3.39Å; I787-F816 HydrophobicContact CG1-CZ 3.97Å
788	H	61.7	Low	59.5	Low	39 Å²	39	62.3 Å²	62.3	18%	0.181	37%	0.366	C	S	.	.			trans	-106.7	131.5	-170.5	-179.2	57.7	0	0	0	109.8	T697 F699 Y786 G790	T697-H788 PolarHBondContact O-N 3.26Å; F699-H788 HydrophobicContact CD2-CB 4.1Å; F699-H788 HydrophobicContact CE2-CB 3.79Å; F699-H788 AromaticContact CE2-CG 3.88Å; Y786-H788 HydrophobicContact CD1-CB 4.42Å; Y786-H788 HydrophobicContact CE1-CB 4.2Å; H788-G790 PolarHBondContact NE2-O 2.8Å
789	S	48.8	Very low	61.3	Low	48 Å²	48	59.1 Å²	59.1	34%	0.336	35%	0.351	S	S	.	.			trans	-117.9	87.1	-169.3	60.1	0	0	0	0	112
790	G	49.3	Very low	63.3	Low	49 Å²	49	53.5 Å²	53.5	51%	0.505	31%	0.312	S	S	.	.	S	Bend	trans	93.4	139.9	173.7	0	0	0	0	0	113.8	H788 T792	H788-G790 PolarHBondContact NE2-O 2.8Å; G790-T792 PolarHBondContact O-N 3.15Å
791	V	45.3	Very low	64.5	Low	74 Å²	74	51.9 Å²	51.9	45%	0.448	29%	0.291	S	S	.	.			trans	-72.7	120.6	179.4	-173.5	0	0	0	0	109.8	L693 A694	L693-V791 HydrophobicContact CB-CG1 4.4Å; A694-V791 HydrophobicContact CB-CG2 3.75Å
792	T	51	Low	65.4	Low	61 Å²	61	53.3 Å²	53.3	37%	0.374	30%	0.302	S	S	.	.			trans	-130.9	148.5	169.5	55.4	0	0	0	0	110.3	G790 T794	G790-T792 PolarHBondContact O-N 3.15Å; T792-T794 PolarHBondContact O-N 3.25Å; T792-T794 PolarHBondContact OG1-OG1 3.22Å
793	T	48.4	Very low	66	Low	149 Å²	149	49.2 Å²	49.2	91%	0.914	29%	0.285	S	S	*	.	S	Bend	trans	-79.7	32.8	-178.1	55.5	0	0	0	0	112.9
794	T	61.1	Low	67.1	Low	64 Å²	64	51.3 Å²	51.3	39%	0.393	29%	0.286	S	S	.	.	S	Bend	trans	-117.5	163.1	-171.1	53.2	0	0	0	0	110.6	T792	T792-T794 PolarHBondContact O-N 3.25Å; T792-T794 PolarHBondContact OG1-OG1 3.22Å
795	S	70.8	Confident	68.2	Low	31 Å²	31	51.4 Å²	51.4	22%	0.217	29%	0.289	C	S	.	.			trans	-64.8	144.3	174.8	60.5	0	0	0	0	111.8	E683 F685 K797	E683-S795 WeakPolarHBondContact OE1-CB 3.38Å; E683-S795 PolarHBondContact OE1-OG 3.02Å; F685-S795 VanDerWaalsContact CE1-CA 3.5Å; F685-S795 VanDerWaalsContact CE1-N 3.35Å; S795-K797 WeakPolarHBondContact OG-CE 3.36Å
796	I	74.7	Confident	69.5	Low	16 Å²	16	48 Å²	48	8%	0.082	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.5	178	-52.6	-176.7	0	0	0	107	E683 W684 L686 F699	E683-I796 WeakPolarHBondContact CA-O 3.16Å; W684-I796 HydrophobicContact CD2-CB 4.25Å; W684-I796 HydrophobicContact CH2-CG2 3.91Å; W684-I796 HydrophobicContact CZ2-CB 4.03Å; W684-I796 HydrophobicContact CZ2-CG2 3.43Å; W684-I796 VanDerWaalsContact CZ2-CG2 3.43Å; W684-I796 PolarHBondContact N-O 3.45Å; W684-I796 VanDerWaalsContact N-O 3.09Å; W684-I796 PolarHBondContact O-N 3.35Å; L686-I796 HydrophobicContact CD1-CD1 4.44Å; L686-I796 HydrophobicContact CG-CD1 4.22Å; F699-I796 HydrophobicContact CD2-CG2 4.37Å; F699-I796 HydrophobicContact CE1-CD1 4.43Å; F699-I796 HydrophobicContact CE2-CD1 3.85Å; F699-I796 HydrophobicContact CE2-CG2 3.92Å; F699-I796 HydrophobicContact CZ-CD1 3.46Å; F699-I796 VanDerWaalsContact CZ-CD1 3.46Å; F699-I796 HydrophobicContact CZ-CG2 4.32Å
797	K	77.6	Confident	70.3	Confident	50 Å²	50	47.6 Å²	47.6	22%	0.217	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	115.9	-171.7	-72.1	176	177.9	172.4	0	110.6	W343 L681 E683 S795	W343-K797 HydrophobicContact CG-CB 4.3Å; W343-K797 HydrophobicContact CG-CD 4.48Å; W343-K797 PolarHBondContact NE1-O 3.27Å; L681-K797 HydrophobicContact CD1-CB 4.12Å; E683-K797 HydrophobicContact CB-CG 4.31Å; E683-K797 HydrophobicContact CG-CG 3.88Å; E683-K797 WeakPolarHBondContact OE1-CE 3.35Å; E683-K797 IonicContact OE1-NZ 2.76Å; E683-K797 WeakPolarHBondContact OE2-CE 3.5Å; S795-K797 WeakPolarHBondContact OG-CE 3.36Å
798	M	79.8	Confident	71.8	Confident	6 Å²	6	46.2 Å²	46.2	3%	0.03	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130	178.8	178.6	178.3	178.1	0	0	111.7	A682 W684 A701 D784 Y786	A682-M798 PolarHBondContact N-O 2.89Å; A682-M798 PolarHBondContact O-N 2.9Å; W684-M798 HydrophobicContact CH2-CB 3.63Å; W684-M798 HydrophobicContact CH2-SD 4.4Å; W684-M798 HydrophobicContact CZ3-CB 3.74Å; A701-M798 HydrophobicContact CB-CE 3.57Å; A701-M798 HydrophobicContact CB-SD 3.83Å; D784-M798 HydrophobicContact CB-CE 3.57Å; Y786-M798 HydrophobicContact CD2-CB 4.24Å; Y786-M798 HydrophobicContact CD2-CG 3.96Å; Y786-M798 HydrophobicContact CD2-SD 4.47Å; Y786-M798 HydrophobicContact CG-CG 4.4Å; Y786-M798 HydrophobicContact CG-SD 4.35Å
799	A	82.7	Confident	72.9	Confident	13 Å²	13	45 Å²	45	11%	0.107	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	124.7	166.9	0	0	0	0	0	110	W343 L680	W343-A799 HydrophobicContact CH2-CB 4.02Å; W343-A799 HydrophobicContact CZ2-CB 3.85Å; L680-A799 CarbonylContact O-C 3.55Å; L680-A799 WeakPolarHBondContact O-CA 3.44Å
800	I	84.8	Confident	74.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.9	167.8	-58.9	172.5	0	0	0	107.1	E679 L680 A701 Y703 L803 I811	E679-I800 VanDerWaalsContact CA-O 3.27Å; E679-I800 WeakPolarHBondContact CA-O 3.43Å; L680-I800 PolarHBondContact N-O 3.31Å; L680-I800 PolarHBondContact O-N 3.46Å; A701-I800 HydrophobicContact CB-CD1 4.06Å; A701-I800 HydrophobicContact CB-CG1 4.19Å; Y703-I800 HydrophobicContact CD1-CG2 3.7Å; Y703-I800 HydrophobicContact CD2-CG2 3.96Å; Y703-I800 HydrophobicContact CE1-CG2 3.61Å; Y703-I800 HydrophobicContact CE2-CG2 3.85Å; Y703-I800 HydrophobicContact CG-CG2 3.88Å; I800-L803 HydrophobicContact CG2-CD1 4.32Å; I800-L803 HydrophobicContact CG2-CD2 4.14Å; I800-L803 HydrophobicContact CG2-CG 4.5Å; I800-I811 HydrophobicContact CD1-CB 4.47Å; I800-I811 HydrophobicContact CD1-CG1 4.1Å; I800-I811 HydrophobicContact CD1-CG2 3.49Å; I800-I811 VanDerWaalsContact CD1-CG2 3.49Å
801	S	83.1	Confident	76.5	Confident	24 Å²	24	40.5 Å²	40.5	17%	0.168	22%	0.224	C	C	.	.			trans	-128.8	174.6	-164.8	71	0	0	0	0	114.7	E679 Y703 D784 L803	E679-S801 WeakPolarHBondContact OE1-CB 3.23Å; Y703-S801 PolarHBondContact OH-O 3.24Å; D784-S801 PolarHBondContact OD2-N 3.46Å; S801-L803 PolarHBondContact O-N 3.1Å
802	N	82	Confident	78.5	Confident	127 Å²	127	39.3 Å²	39.3	68%	0.679	21%	0.212	S	C	*	.	S	Bend	trans	56.4	40.1	-178	-53.1	-50.2	0	0	0	112.7	S678 K782	S678-N802 PolarHBondContact O-N 3.37Å; K782-N802 PolarHBondContact NZ-O 2.99Å
803	L	86.4	Confident	80.3	Confident	10 Å²	10	36.4 Å²	36.4	5%	0.052	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-87.3	161.9	172.9	-54	175.8	0	0	0	110.6	S678 L680 Y703 I800 S801 Y809 T837	S678-L803 WeakPolarHBondContact CA-O 3.33Å; S678-L803 VanDerWaalsContact CB-O 3.24Å; S678-L803 WeakPolarHBondContact CB-O 3.44Å; S678-L803 WeakPolarHBondContact O-CB 3.32Å; S678-L803 PolarHBondContact O-N 3.41Å; L680-L803 HydrophobicContact CB-CD1 4.06Å; L680-L803 HydrophobicContact CD1-CD1 3.7Å; L680-L803 HydrophobicContact CG-CD1 3.5Å; L680-L803 VanDerWaalsContact CG-CD1 3.5Å; Y703-L803 HydrophobicContact CD2-CD2 3.62Å; Y703-L803 HydrophobicContact CE2-CD2 3.37Å; I800-L803 HydrophobicContact CG2-CD1 4.32Å; I800-L803 HydrophobicContact CG2-CD2 4.14Å; I800-L803 HydrophobicContact CG2-CG 4.5Å; S801-L803 PolarHBondContact O-N 3.1Å; L803-Y809 HydrophobicContact CB-CE2 3.86Å; L803-Y809 HydrophobicContact CD1-CD2 4.45Å; L803-Y809 HydrophobicContact CD1-CE2 4.45Å; L803-Y809 HydrophobicContact CD2-CD1 4.15Å; L803-Y809 HydrophobicContact CD2-CD2 4.34Å; L803-Y809 HydrophobicContact CD2-CE1 3.84Å; L803-Y809 HydrophobicContact CD2-CE2 4.03Å; L803-Y809 HydrophobicContact CD2-CG 4.4Å; L803-Y809 HydrophobicContact CG-CE2 4.34Å; L803-T837 HydrophobicContact CB-CG2 3.87Å; L803-T837 HydrophobicContact CD1-CG2 3.84Å
804	R	84.3	Confident	82.1	Confident	102 Å²	102	30 Å²	30	39%	0.385	15%	0.153	S	C	.	.	P	Polyproline II helix	trans	-92.7	144.8	173.6	-72.9	-172.6	-69.6	-148.7	-1.7	110.6	P677 I807 Y809 T837	P677-R804 CarbonylContact O-C 3.47Å; R804-I807 HydrophobicContact CB-CB 4.5Å; R804-I807 HydrophobicContact CB-CG1 3.77Å; R804-Y809 PolarHBondContact N-OH 3.41Å; R804-T837 PolarHBondContact O-OG1 3.46Å
805	P	85.1	Confident	83.2	Confident	34 Å²	34	26.9 Å²	26.9	22%	0.221	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	144.8	172.4	-25.3	35.3	0	0	0	113	P677 I807 Y838 S840	P677-P805 HydrophobicContact CB-CB 3.91Å; P677-P805 HydrophobicContact CB-CG 3.79Å; P677-P805 WeakPolarHBondContact O-CA 3.4Å; P677-P805 VanDerWaalsContact O-N 3.16Å; P805-I807 VanDerWaalsContact C-N 3.29Å; P805-I807 PolarHBondContact O-N 3.45Å; P805-Y838 WeakPolarHBondContact CA-O 3.45Å; P805-S840 VanDerWaalsContact CB-OG 3.22Å; P805-S840 WeakPolarHBondContact CB-OG 3.49Å; P805-S840 WeakPolarHBondContact CG-OG 3.1Å
806	F	83.4	Confident	83.7	Confident	45 Å²	45	25.4 Å²	25.4	20%	0.197	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	48	43.4	178.3	-157	-110.2	0	0	0	115	M708 L836 T837 Y838 D839 G873 I875	M708-F806 HydrophobicContact CE-CD1 3.78Å; M708-F806 HydrophobicContact CE-CE1 3.74Å; M708-F806 HydrophobicContact CE-CG 4.39Å; M708-F806 HydrophobicContact CE-CZ 4.33Å; M708-F806 WeakPolarHBondContact CE-O 3.36Å; F806-L836 HydrophobicContact CD2-CD1 4.23Å; F806-L836 HydrophobicContact CD2-CD2 4.3Å; F806-L836 HydrophobicContact CD2-CG 4.5Å; F806-L836 HydrophobicContact CE2-CD2 3.99Å; F806-T837 WeakPolarHBondContact CA-O 3.4Å; F806-T837 PolarHBondContact N-OG1 2.89Å; F806-Y838 PolarHBondContact N-O 2.83Å; F806-D839 HydrophobicContact CB-CB 4.32Å; F806-D839 HydrophobicContact CD2-CB 3.95Å; F806-D839 HydrophobicContact CG-CB 4.42Å; F806-G873 VanDerWaalsContact CB-O 3.32Å; F806-G873 WeakPolarHBondContact CB-O 3.36Å; F806-I875 HydrophobicContact CE1-CG1 3.71Å; F806-I875 HydrophobicContact CZ-CD1 4.04Å; F806-I875 HydrophobicContact CZ-CG1 3.63Å
807	I	82.9	Confident	83.8	Confident	27 Å²	27	24.7 Å²	24.7	14%	0.138	12%	0.12	C	C	.	.			trans	-115.9	134.3	173.1	-64.9	-60.5	0	0	0	109.9	R804 P805 Y809 T837	R804-I807 HydrophobicContact CB-CB 4.5Å; R804-I807 HydrophobicContact CB-CG1 3.77Å; P805-I807 VanDerWaalsContact C-N 3.29Å; P805-I807 PolarHBondContact O-N 3.45Å; I807-Y809 HydrophobicContact CB-CD2 4.31Å; I807-Y809 HydrophobicContact CB-CE2 3.6Å; I807-Y809 HydrophobicContact CG2-CD2 4.05Å; I807-Y809 HydrophobicContact CG2-CE1 4.12Å; I807-Y809 HydrophobicContact CG2-CE2 3.55Å; I807-Y809 VanDerWaalsContact O-CD2 3.22Å; I807-Y809 WeakPolarHBondContact O-CD2 3.07Å; I807-T837 PolarHBondContact N-OG1 3.01Å; I807-T837 PolarHBondContact O-N 3.14Å; I807-T837 PolarHBondContact O-OG1 3.09Å
808	C	83.6	Confident	83.2	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.014	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	121.4	172.6	-169.7	0	0	0	0	109.8	S705 V706 M708 C711 V834	S705-C808 WeakPolarHBondContact CA-O 3.49Å; V706-C808 HydrophobicContact CG2-CB 4.22Å; V706-C808 PolarHBondContact N-O 2.92Å; M708-C808 HydrophobicContact SD-CB 3.96Å; C711-C808 HydrophobicContact CB-CB 3.83Å; C711-C808 WeakPolarHBondContact CB-SG 3.33Å; C711-C808 PolarHBondContact N-SG 2.98Å; C711-C808 VanDerWaalsContact SG-CA 3.54Å; C711-C808 WeakPolarHBondContact SG-CB 3.13Å; C711-C808 CovalentContact SG-SG 2.03Å; C711-C808 PolarHBondContact SG-SG 3.06Å; C808-V834 WeakPolarHBondContact SG-CG1 3.3Å
809	Y	86.4	Confident	82.6	Confident	12 Å²	12	25.7 Å²	25.7	5%	0.047	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.7	177.8	-70.9	-83.3	0	0	0	110.8	Y703 R704 L803 R804 I807 I811 V834 A835 T837	Y703-Y809 HydrophobicContact CD2-CD1 4.33Å; R704-Y809 WeakPolarHBondContact O-CA 2.98Å; L803-Y809 HydrophobicContact CB-CE2 3.86Å; L803-Y809 HydrophobicContact CD1-CD2 4.45Å; L803-Y809 HydrophobicContact CD1-CE2 4.45Å; L803-Y809 HydrophobicContact CD2-CD1 4.15Å; L803-Y809 HydrophobicContact CD2-CD2 4.34Å; L803-Y809 HydrophobicContact CD2-CE1 3.84Å; L803-Y809 HydrophobicContact CD2-CE2 4.03Å; L803-Y809 HydrophobicContact CD2-CG 4.4Å; L803-Y809 HydrophobicContact CG-CE2 4.34Å; R804-Y809 PolarHBondContact N-OH 3.41Å; I807-Y809 HydrophobicContact CB-CD2 4.31Å; I807-Y809 HydrophobicContact CB-CE2 3.6Å; I807-Y809 HydrophobicContact CG2-CD2 4.05Å; I807-Y809 HydrophobicContact CG2-CE1 4.12Å; I807-Y809 HydrophobicContact CG2-CE2 3.55Å; I807-Y809 VanDerWaalsContact O-CD2 3.22Å; I807-Y809 WeakPolarHBondContact O-CD2 3.07Å; Y809-I811 WeakPolarHBondContact O-CD1 3.33Å; Y809-V834 VanDerWaalsContact O-CA 3.29Å; Y809-V834 WeakPolarHBondContact O-CA 3.28Å; Y809-V834 WeakPolarHBondContact O-CG1 3.48Å; Y809-A835 PolarHBondContact N-O 3.13Å; Y809-A835 PolarHBondContact O-N 2.89Å; Y809-T837 HydrophobicContact CD2-CG2 4.14Å; Y809-T837 HydrophobicContact CE2-CG2 3.98Å
810	A	85.9	Confident	81.3	Confident	2 Å²	2	29.1 Å²	29.1	2%	0.017	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.5	163.4	0	0	0	0	0	109	Y703 R704 V706 W772 V832 V834	Y703-A810 VanDerWaalsContact CA-O 3.3Å; Y703-A810 WeakPolarHBondContact CA-O 3.3Å; R704-A810 PolarHBondContact N-O 2.8Å; R704-A810 VanDerWaalsContact N-O 3.12Å; R704-A810 PolarHBondContact O-N 3.41Å; V706-A810 HydrophobicContact CG1-CB 3.59Å; V706-A810 HydrophobicContact CG2-CB 4.22Å; W772-A810 HydrophobicContact CZ3-CB 3.81Å; A810-V832 HydrophobicContact CB-CG1 4.05Å; A810-V834 HydrophobicContact CB-CG2 4.22Å
811	I	87	Confident	80	Confident	1 Å²	1	32 Å²	32	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	137	-171.5	-56.1	95.2	0	0	0	109.3	I672 L680 I800 Y809 I813 V832 S833 A835	I672-I811 HydrophobicContact CD1-CB 3.77Å; I672-I811 HydrophobicContact CD1-CD1 4.03Å; I672-I811 HydrophobicContact CD1-CG1 4.21Å; I672-I811 HydrophobicContact CD1-CG2 3.94Å; L680-I811 HydrophobicContact CD1-CD1 3.9Å; L680-I811 HydrophobicContact CD1-CG1 4.43Å; I800-I811 HydrophobicContact CD1-CB 4.47Å; I800-I811 HydrophobicContact CD1-CG1 4.1Å; I800-I811 HydrophobicContact CD1-CG2 3.49Å; I800-I811 VanDerWaalsContact CD1-CG2 3.49Å; Y809-I811 WeakPolarHBondContact O-CD1 3.33Å; I811-I813 HydrophobicContact CG2-CG1 4.47Å; I811-V832 WeakPolarHBondContact O-CA 3.48Å; I811-S833 PolarHBondContact N-O 2.8Å; I811-S833 PolarHBondContact O-N 3.32Å; I811-A835 HydrophobicContact CD1-CB 4.2Å
812	R	87.9	Confident	79.1	Confident	50 Å²	50	36.3 Å²	36.3	19%	0.189	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	147.8	167.3	164.8	-173.1	-73	138.4	-5.4	108.8	A701 T702 K829 V832	A701-R812 CarbonylContact C-O 3.55Å; A701-R812 WeakPolarHBondContact CA-O 3.11Å; T702-R812 PolarHBondContact N-O 3.2Å; T702-R812 PolarHBondContact O-N 2.94Å; T702-R812 WeakPolarHBondContact OG1-CB 3.3Å; T702-R812 PolarHBondContact OG1-O 2.99Å; T702-R812 VanDerWaalsContact OG1-O 3.14Å; R812-K829 HydrophobicContact CG-CB 4.39Å; R812-V832 HydrophobicContact CB-CG2 4.45Å
813	I	87.7	Confident	78.3	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	138.4	177	-56.4	-177.3	0	0	0	109.1	F667 L670 A682 W684 F699 K700 A701 I811 K829 S830	F667-I813 HydrophobicContact CE1-CB 4.04Å; F667-I813 HydrophobicContact CE1-CG2 3.86Å; F667-I813 HydrophobicContact CZ-CB 4.39Å; F667-I813 HydrophobicContact CZ-CG2 4.07Å; L670-I813 HydrophobicContact CD1-CB 4.39Å; L670-I813 HydrophobicContact CD1-CD1 3.9Å; L670-I813 HydrophobicContact CD1-CG1 3.83Å; L670-I813 HydrophobicContact CD2-CD1 4.1Å; A682-I813 HydrophobicContact CB-CD1 4.09Å; W684-I813 HydrophobicContact CD2-CD1 4.12Å; W684-I813 HydrophobicContact CE3-CD1 3.54Å; W684-I813 HydrophobicContact CH2-CD1 3.63Å; W684-I813 HydrophobicContact CH2-CG2 4.28Å; W684-I813 HydrophobicContact CZ2-CD1 4.17Å; W684-I813 HydrophobicContact CZ2-CG2 4Å; W684-I813 HydrophobicContact CZ3-CD1 3.29Å; F699-I813 HydrophobicContact CB-CG2 3.94Å; F699-I813 HydrophobicContact CD1-CG2 3.91Å; F699-I813 HydrophobicContact CG-CG2 4.34Å; K700-I813 CarbonylContact O-C 3.56Å; K700-I813 WeakPolarHBondContact O-CA 3.36Å; A701-I813 HydrophobicContact CB-CG1 4.4Å; I811-I813 HydrophobicContact CG2-CG1 4.47Å; I813-K829 CarbonylContact O-C 3.59Å; I813-K829 WeakPolarHBondContact O-CA 3.32Å; I813-S830 PolarHBondContact N-OG 2.71Å; I813-S830 PolarHBondContact O-N 2.87Å; I813-S830 PolarHBondContact O-OG 3.12Å
814	E	86.8	Confident	77.7	Confident	13 Å²	13	38 Å²	38	6%	0.061	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	127.9	-175.8	-179.1	175.9	-151.5	0	0	108.7	F699 K700 F826 K829	F699-E814 CarbonylContact C-O 3.54Å; F699-E814 WeakPolarHBondContact CA-O 3.34Å; K700-E814 HydrophobicContact CB-CB 4.35Å; K700-E814 WeakPolarHBondContact CD-OE2 3.46Å; K700-E814 WeakPolarHBondContact CE-OE2 3.43Å; K700-E814 PolarHBondContact N-O 2.94Å; K700-E814 IonicContact NZ-OE2 3.72Å; K700-E814 PolarHBondContact NZ-OE2 2.84Å; K700-E814 PolarHBondContact O-N 2.68Å; E814-F826 HydrophobicContact CG-CB 4.07Å; E814-F826 HydrophobicContact CG-CD1 4.02Å; E814-F826 HydrophobicContact CG-CG 4.46Å; E814-F826 WeakPolarHBondContact OE1-CB 3.43Å; E814-K829 HydrophobicContact CB-CG 4.08Å; E814-K829 HydrophobicContact CG-CG 3.94Å; E814-K829 WeakPolarHBondContact OE1-CE 3.32Å; E814-K829 IonicContact OE1-NZ 4Å; E814-K829 PolarHBondContact OE1-NZ 3.39Å
815	T	85	Confident	77.4	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	147.2	174.9	46.2	0	0	0	0	110.8	F667 L686 I696 F699 F826 A827 Q828	F667-T815 HydrophobicContact CE2-CG2 3.93Å; F667-T815 HydrophobicContact CZ-CG2 3.85Å; L686-T815 HydrophobicContact CD1-CG2 4.11Å; L686-T815 HydrophobicContact CD2-CG2 4.25Å; I696-T815 HydrophobicContact CD1-CG2 4.01Å; I696-T815 HydrophobicContact CG2-CG2 4.28Å; F699-T815 HydrophobicContact CD1-CG2 3.99Å; F699-T815 HydrophobicContact CE1-CG2 3.66Å; T815-F826 WeakPolarHBondContact O-CA 3.12Å; T815-A827 PolarHBondContact O-N 3.42Å; T815-Q828 PolarHBondContact N-O 2.85Å; T815-Q828 VanDerWaalsContact N-O 3.07Å; T815-Q828 PolarHBondContact OG1-N 2.99Å; T815-Q828 PolarHBondContact OG1-O 3.47Å
816	F	80.2	Confident	77.1	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	157.9	169.4	73.2	-99.4	0	0	0	113.8	T697 G698 F699 K700 Y785 I787 R824 I825 F826	T697-F816 PolarHBondContact N-O 2.88Å; T697-F816 WeakPolarHBondContact OG1-CE2 3.48Å; G698-F816 VanDerWaalsContact C-CD1 3.48Å; G698-F816 VanDerWaalsContact C-CE1 3.42Å; G698-F816 PolarHBondContact N-O 2.81Å; G698-F816 PolarHBondContact O-N 2.82Å; F699-F816 VanDerWaalsContact N-CE1 3.28Å; K700-F816 HydrophobicContact CB-CD1 4.32Å; Y785-F816 HydrophobicContact CD1-CD1 4.45Å; Y785-F816 AromaticContact CD1-CE1 3.88Å; Y785-F816 HydrophobicContact CD1-CE1 3.88Å; Y785-F816 HydrophobicContact CD1-CZ 4.45Å; I787-F816 HydrophobicContact CG1-CZ 3.97Å; F816-R824 HydrophobicContact CD2-CG 3.91Å; F816-R824 HydrophobicContact CE2-CG 4.29Å; F816-I825 CarbonylContact C-O 3.49Å; F816-I825 VanDerWaalsContact CA-O 3.3Å; F816-I825 WeakPolarHBondContact CA-O 3.23Å; F816-F826 HydrophobicContact CB-CD1 3.58Å; F816-F826 HydrophobicContact CB-CE1 3.76Å; F816-F826 HydrophobicContact CB-CG 4.3Å; F816-F826 HydrophobicContact CD1-CE1 4.1Å; F816-F826 HydrophobicContact CG-CD1 4.42Å; F816-F826 HydrophobicContact CG-CE1 4.15Å
817	V	77.4	Confident	76.7	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	123.5	172.8	-178.4	0	0	0	0	109	T650 L658 L662 L695 T697 H819 R824 I825	T650-V817 HydrophobicContact CG2-CG1 3.35Å; L658-V817 HydrophobicContact CD2-CB 4.04Å; L658-V817 HydrophobicContact CD2-CG1 3.87Å; L658-V817 HydrophobicContact CD2-CG2 4.46Å; L662-V817 HydrophobicContact CD1-CB 4.49Å; L662-V817 HydrophobicContact CD1-CG2 3.58Å; L662-V817 HydrophobicContact CD2-CG2 3.88Å; L662-V817 HydrophobicContact CG-CG2 4.33Å; L695-V817 HydrophobicContact CB-CG2 4.46Å; L695-V817 VanDerWaalsContact O-CG1 3.31Å; L695-V817 WeakPolarHBondContact O-CG1 3.5Å; L695-V817 VanDerWaalsContact O-CG2 3.29Å; L695-V817 WeakPolarHBondContact O-CG2 3.48Å; T697-V817 HydrophobicContact CG2-CG1 4.47Å; V817-H819 PolarHBondContact O-N 3Å; V817-R824 WeakPolarHBondContact O-CA 3.5Å; V817-I825 PolarHBondContact N-O 3.02Å; V817-I825 PolarHBondContact O-N 3.17Å
818	D	65.7	Low	76.7	Confident	55 Å²	55	36.1 Å²	36.1	29%	0.294	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	109	170.2	-62.1	-68.3	0	0	0	109	T697 S823 R824	T697-D818 WeakPolarHBondContact CB-OD2 3.46Å; T697-D818 HydrophobicContact CG2-CB 4.28Å; T697-D818 VanDerWaalsContact OG1-CG 3.28Å; T697-D818 PolarHBondContact OG1-N 3.19Å; T697-D818 PolarHBondContact OG1-OD2 2.82Å; D818-S823 CarbonylContact C-O 3.5Å; D818-S823 WeakPolarHBondContact CA-O 3.25Å; D818-R824 WeakPolarHBondContact OD1-CG 3.36Å; D818-R824 IonicContact OD1-CZ 3.41Å; D818-R824 IonicContact OD1-NE 3.51Å; D818-R824 PolarHBondContact OD1-NE 3.37Å; D818-R824 IonicContact OD1-NH2 2.92Å
819	H	66.8	Low	76.8	Confident	22 Å²	22	40.8 Å²	40.8	10%	0.102	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	127.5	-176.6	177.4	-103.9	0	0	0	111.3	V817 G821 H822 S823 I825	V817-H819 PolarHBondContact O-N 3Å; H819-G821 PolarHBondContact ND1-N 3.16Å; H819-G821 PolarHBondContact O-N 2.76Å; H819-H822 AromaticContact CE1-CD2 3.99Å; H819-H822 AromaticContact ND1-CD2 3.74Å; H819-H822 PolarHBondContact ND1-N 3.21Å; H819-H822 PolarHBondContact O-N 3.26Å; H819-S823 PolarHBondContact N-O 2.98Å; H819-S823 PolarHBondContact O-N 3.28Å; H819-I825 HydrophobicContact CB-CD1 3.66Å; H819-I825 HydrophobicContact CB-CG1 4.15Å
820	P	54.7	Low	76.9	Confident	86 Å²	86	40.5 Å²	40.5	56%	0.558	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-27.4	-169.9	-30.4	37.1	0	0	0	116.8	R651	R651-P820 HydrophobicContact CG-CG 4.01Å
821	G	58.6	Low	76.7	Confident	59 Å²	59	46.4 Å²	46.4	61%	0.608	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-8.3	178.6	0	0	0	0	0	115.8	H819	H819-G821 PolarHBondContact ND1-N 3.16Å; H819-G821 PolarHBondContact O-N 2.76Å
822	H	63.8	Low	76.5	Confident	115 Å²	115	47.2 Å²	47.2	53%	0.532	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.7	16.7	-172.7	-76.8	-90.9	0	0	0	113.9	P655 H819 R824 I825	P655-H822 WeakPolarHBondContact CG-CD2 3.39Å; H819-H822 AromaticContact CE1-CD2 3.99Å; H819-H822 AromaticContact ND1-CD2 3.74Å; H819-H822 PolarHBondContact ND1-N 3.21Å; H819-H822 PolarHBondContact O-N 3.26Å; H822-R824 PolarHBondContact O-N 3.09Å; H822-I825 HydrophobicContact CB-CD1 4.27Å; H822-I825 HydrophobicContact CB-CG1 4.25Å
823	S	65.8	Low	76.3	Confident	100 Å²	100	46.2 Å²	46.2	70%	0.699	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	57.9	-85.3	-176.8	-61.5	0	0	0	0	113.2	D818 H819	D818-S823 CarbonylContact C-O 3.5Å; D818-S823 WeakPolarHBondContact CA-O 3.25Å; H819-S823 PolarHBondContact N-O 2.98Å; H819-S823 PolarHBondContact O-N 3.28Å
824	R	72.8	Confident	76	Confident	74 Å²	74	47.1 Å²	47.1	28%	0.279	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	120.3	-179.9	-78.1	-179.5	178	171.3	-4.6	111.7	F816 V817 D818 H822 F826	F816-R824 HydrophobicContact CD2-CG 3.91Å; F816-R824 HydrophobicContact CE2-CG 4.29Å; V817-R824 WeakPolarHBondContact O-CA 3.5Å; D818-R824 WeakPolarHBondContact OD1-CG 3.36Å; D818-R824 IonicContact OD1-CZ 3.41Å; D818-R824 IonicContact OD1-NE 3.51Å; D818-R824 PolarHBondContact OD1-NE 3.37Å; D818-R824 IonicContact OD1-NH2 2.92Å; H822-R824 PolarHBondContact O-N 3.09Å; R824-F826 HydrophobicContact CB-CE2 3.9Å; R824-F826 HydrophobicContact CB-CZ 3.98Å
825	I	77.4	Confident	75.8	Confident	18 Å²	18	46.6 Å²	46.6	9%	0.092	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	111.2	171.5	-64	172.4	0	0	0	107	P655 L658 L659 F816 V817 H819 H822	P655-I825 HydrophobicContact CB-CD1 3.77Å; P655-I825 HydrophobicContact CG-CD1 4.43Å; L658-I825 HydrophobicContact CD2-CB 4.29Å; L658-I825 HydrophobicContact CD2-CD1 3.7Å; L658-I825 HydrophobicContact CD2-CG2 4.38Å; L659-I825 HydrophobicContact CD1-CG2 4.43Å; F816-I825 CarbonylContact C-O 3.49Å; F816-I825 VanDerWaalsContact CA-O 3.3Å; F816-I825 WeakPolarHBondContact CA-O 3.23Å; V817-I825 PolarHBondContact N-O 3.02Å; V817-I825 PolarHBondContact O-N 3.17Å; H819-I825 HydrophobicContact CB-CD1 3.66Å; H819-I825 HydrophobicContact CB-CG1 4.15Å; H822-I825 HydrophobicContact CB-CD1 4.27Å; H822-I825 HydrophobicContact CB-CG1 4.25Å
826	F	80.2	Confident	75.7	Confident	62 Å²	62	47 Å²	47	27%	0.272	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	147.3	176	-62.8	-82.2	0	0	0	110.5	L659 K700 Y785 E814 T815 F816 R824	L659-F826 WeakPolarHBondContact CD1-O 3.22Å; K700-F826 HydrophobicContact CB-CE1 4.03Å; K700-F826 HydrophobicContact CD-CD1 3.96Å; K700-F826 HydrophobicContact CD-CE1 3.4Å; K700-F826 HydrophobicContact CD-CZ 3.99Å; K700-F826 HydrophobicContact CG-CE1 4.31Å; Y785-F826 HydrophobicContact CE1-CE1 4.02Å; Y785-F826 HydrophobicContact CE1-CZ 4.01Å; E814-F826 HydrophobicContact CG-CB 4.07Å; E814-F826 HydrophobicContact CG-CD1 4.02Å; E814-F826 HydrophobicContact CG-CG 4.46Å; E814-F826 WeakPolarHBondContact OE1-CB 3.43Å; T815-F826 WeakPolarHBondContact O-CA 3.12Å; F816-F826 HydrophobicContact CB-CD1 3.58Å; F816-F826 HydrophobicContact CB-CE1 3.76Å; F816-F826 HydrophobicContact CB-CG 4.3Å; F816-F826 HydrophobicContact CD1-CE1 4.1Å; F816-F826 HydrophobicContact CG-CD1 4.42Å; F816-F826 HydrophobicContact CG-CE1 4.15Å; R824-F826 HydrophobicContact CB-CE2 3.9Å; R824-F826 HydrophobicContact CB-CZ 3.98Å
827	A	75.2	Confident	75.9	Confident	18 Å²	18	47 Å²	47	15%	0.149	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	-125.6	-177	0	0	0	0	0	112.9	L659 L662 T815	L659-A827 HydrophobicContact CD1-CB 4.33Å; L662-A827 HydrophobicContact CB-CB 3.38Å; L662-A827 HydrophobicContact CD1-CB 3.78Å; L662-A827 HydrophobicContact CG-CB 4.13Å; T815-A827 PolarHBondContact O-N 3.42Å
828	Q	81.2	Confident	76.1	Confident	70 Å²	70	49.7 Å²	49.7	33%	0.327	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	143.8	-170.7	-174	70.7	-31.6	0	0	111.8	V665 D666 F667 T815	V665-Q828 WeakPolarHBondContact O-CB 3.46Å; V665-Q828 VanDerWaalsContact O-CG 3.22Å; V665-Q828 WeakPolarHBondContact O-CG 3.5Å; D666-Q828 PolarHBondContact OD1-NE2 3.5Å; F667-Q828 HydrophobicContact CD2-CG 4.1Å; F667-Q828 HydrophobicContact CE2-CB 4.46Å; F667-Q828 HydrophobicContact CE2-CG 4.39Å; F667-Q828 WeakPolarHBondContact CE2-O 3.22Å; T815-Q828 PolarHBondContact N-O 2.85Å; T815-Q828 VanDerWaalsContact N-O 3.07Å; T815-Q828 PolarHBondContact OG1-N 2.99Å; T815-Q828 PolarHBondContact OG1-O 3.47Å
829	K	86.4	Confident	76.9	Confident	99 Å²	99	47.7 Å²	47.7	43%	0.43	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	138.1	177.9	-74.1	161	-178.7	162.2	0	110.6	R812 I813 E814	R812-K829 HydrophobicContact CG-CB 4.39Å; I813-K829 CarbonylContact O-C 3.59Å; I813-K829 WeakPolarHBondContact O-CA 3.32Å; E814-K829 HydrophobicContact CB-CG 4.08Å; E814-K829 HydrophobicContact CG-CG 3.94Å; E814-K829 WeakPolarHBondContact OE1-CE 3.32Å; E814-K829 IonicContact OE1-NZ 4Å; E814-K829 PolarHBondContact OE1-NZ 3.39Å
830	S	88.1	Confident	77.7	Confident	6 Å²	6	47.5 Å²	47.5	4%	0.042	26%	0.261	C	S	.	.			trans	-61.9	163.7	168.4	76.7	0	0	0	0	111.7	L670 I813	L670-S830 WeakPolarHBondContact CD1-OG 3.28Å; I813-S830 PolarHBondContact N-OG 2.71Å; I813-S830 PolarHBondContact O-N 2.87Å; I813-S830 PolarHBondContact O-OG 3.12Å
831	Q	83	Confident	79.1	Confident	127 Å²	127	46.1 Å²	46.1	59%	0.593	25%	0.251	S	S	*	.			trans	-60.6	158.2	157.3	-63.2	-56.4	-34	0	0	110.6	S833	Q831-S833 PolarHBondContact O-N 3.04Å
832	V	82.8	Confident	80.5	Confident	17 Å²	17	43.4 Å²	43.4	10%	0.103	22%	0.223	C	C	.	.			trans	-83	111.2	176.3	177.5	0	0	0	0	108.9	L770 W772 A810 I811 R812	L770-V832 HydrophobicContact CB-CB 4.35Å; L770-V832 HydrophobicContact CB-CG1 4.41Å; L770-V832 HydrophobicContact CD2-CG1 4.07Å; W772-V832 HydrophobicContact CD2-CG2 4.46Å; W772-V832 HydrophobicContact CE3-CB 4.39Å; W772-V832 HydrophobicContact CE3-CG1 3.79Å; W772-V832 HydrophobicContact CE3-CG2 3.61Å; W772-V832 HydrophobicContact CZ3-CG1 3.79Å; W772-V832 HydrophobicContact CZ3-CG2 4.15Å; A810-V832 HydrophobicContact CB-CG1 4.05Å; I811-V832 WeakPolarHBondContact O-CA 3.48Å; R812-V832 HydrophobicContact CB-CG2 4.45Å
833	S	82.1	Confident	81.6	Confident	29 Å²	29	42.1 Å²	42.1	20%	0.203	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	159.1	169	-75	0	0	0	0	110.4	L670 I811 Q831	L670-S833 PolarHBondContact O-OG 2.85Å; I811-S833 PolarHBondContact N-O 2.8Å; I811-S833 PolarHBondContact O-N 3.32Å; Q831-S833 PolarHBondContact O-N 3.04Å
834	V	81.4	Confident	82.5	Confident	20 Å²	20	37.5 Å²	37.5	12%	0.121	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.3	-179.1	177.5	0	0	0	0	108.8	R710 C711 I727 L770 C808 Y809 A810	R710-V834 HydrophobicContact CB-CG1 4.35Å; C711-V834 VanDerWaalsContact SG-CG1 3.5Å; I727-V834 HydrophobicContact CD1-CB 4.13Å; I727-V834 HydrophobicContact CD1-CG1 3.8Å; I727-V834 WeakPolarHBondContact CG1-O 3.27Å; L770-V834 HydrophobicContact CD2-CG2 3.33Å; C808-V834 WeakPolarHBondContact SG-CG1 3.3Å; Y809-V834 VanDerWaalsContact O-CA 3.29Å; Y809-V834 WeakPolarHBondContact O-CA 3.28Å; Y809-V834 WeakPolarHBondContact O-CG1 3.48Å; A810-V834 HydrophobicContact CB-CG2 4.22Å
835	A	83.1	Confident	83.2	Confident	2 Å²	2	35.3 Å²	35.3	2%	0.017	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	152.2	177.7	0	0	0	0	0	111.3	I672 L680 Y809 I811	I672-A835 HydrophobicContact CB-CB 4.23Å; I672-A835 HydrophobicContact CG2-CB 3.66Å; L680-A835 HydrophobicContact CD1-CB 3.96Å; L680-A835 HydrophobicContact CD2-CB 3.84Å; Y809-A835 PolarHBondContact N-O 3.13Å; Y809-A835 PolarHBondContact O-N 2.89Å; I811-A835 HydrophobicContact CD1-CB 4.2Å
836	L	83.4	Confident	84	Confident	7 Å²	7	34.6 Å²	34.6	4%	0.037	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.1	175.9	177.7	57.3	0	0	0	108.8	M708 C711 I723 F806	M708-L836 HydrophobicContact CE-CD1 3.85Å; M708-L836 HydrophobicContact SD-CD1 3.96Å; C711-L836 HydrophobicContact CB-CB 4.37Å; I723-L836 HydrophobicContact CD1-CD2 3.87Å; I723-L836 HydrophobicContact CG1-CD2 4.31Å; F806-L836 HydrophobicContact CD2-CD1 4.23Å; F806-L836 HydrophobicContact CD2-CD2 4.3Å; F806-L836 HydrophobicContact CD2-CG 4.5Å; F806-L836 HydrophobicContact CE2-CD2 3.99Å
837	T	84.6	Confident	84.4	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-70	152.1	169.9	43.4	0	0	0	0	111.3	L680 L803 R804 F806 I807 Y809	L680-T837 HydrophobicContact CD2-CG2 4.15Å; L680-T837 HydrophobicContact CG-CG2 4.21Å; L803-T837 HydrophobicContact CB-CG2 3.87Å; L803-T837 HydrophobicContact CD1-CG2 3.84Å; R804-T837 PolarHBondContact O-OG1 3.46Å; F806-T837 WeakPolarHBondContact CA-O 3.4Å; F806-T837 PolarHBondContact N-OG1 2.89Å; I807-T837 PolarHBondContact N-OG1 3.01Å; I807-T837 PolarHBondContact O-N 3.14Å; I807-T837 PolarHBondContact O-OG1 3.09Å; Y809-T837 HydrophobicContact CD2-CG2 4.14Å; Y809-T837 HydrophobicContact CE2-CG2 3.98Å
838	Y	81.6	Confident	85.1	Confident	57 Å²	57	38.5 Å²	38.5	22%	0.224	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-59.8	155.1	175.6	-70.5	-58.3	0	0	0	112.2	K385 A674 Y730 P805 F806	K385-Y838 HydrophobicContact CB-CD2 3.95Å; K385-Y838 HydrophobicContact CB-CE2 4.08Å; K385-Y838 HydrophobicContact CB-CG 4.32Å; K385-Y838 HydrophobicContact CD-CD1 3.97Å; K385-Y838 HydrophobicContact CD-CE1 4.31Å; K385-Y838 HydrophobicContact CD-CG 4.15Å; K385-Y838 HydrophobicContact CG-CD1 4.07Å; K385-Y838 HydrophobicContact CG-CD2 3.89Å; K385-Y838 HydrophobicContact CG-CE2 4.37Å; K385-Y838 HydrophobicContact CG-CG 3.73Å; A674-Y838 HydrophobicContact CB-CD1 4.33Å; A674-Y838 HydrophobicContact CB-CD2 3.59Å; A674-Y838 HydrophobicContact CB-CE1 4.28Å; A674-Y838 HydrophobicContact CB-CE2 3.55Å; A674-Y838 HydrophobicContact CB-CG 3.99Å; A674-Y838 WeakPolarHBondContact O-CE2 3.15Å; A674-Y838 PolarHBondContact O-OH 3.37Å; Y730-Y838 WeakPolarHBondContact OH-CD1 3.44Å; Y730-Y838 WeakPolarHBondContact OH-CE1 3.46Å; P805-Y838 WeakPolarHBondContact CA-O 3.45Å; F806-Y838 PolarHBondContact N-O 2.83Å
839	D	80.9	Confident	85.5	Confident	14 Å²	14	38.9 Å²	38.9	8%	0.075	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-77.2	160.1	174.7	64.4	-51.7	0	0	0	112.8	K385 F806 G873 H924	K385-D839 WeakPolarHBondContact CE-OD1 3.19Å; K385-D839 IonicContact NZ-OD1 2.76Å; K385-D839 PolarHBondContact NZ-OD1 2.59Å; F806-D839 HydrophobicContact CB-CB 4.32Å; F806-D839 HydrophobicContact CD2-CB 3.95Å; F806-D839 HydrophobicContact CG-CB 4.42Å; D839-G873 CarbonylContact C-O 3.58Å; D839-G873 WeakPolarHBondContact CA-O 3.34Å; D839-H924 VanDerWaalsContact CG-ND1 3.3Å; D839-H924 PolarHBondContact O-CE1 2.95Å; D839-H924 PolarHBondContact O-ND1 2.93Å; D839-H924 IonicContact OD1-CE1 3.69Å; D839-H924 PolarHBondContact OD1-CE1 3.31Å; D839-H924 VanDerWaalsContact OD1-CE1 3.26Å; D839-H924 IonicContact OD1-ND1 3.48Å; D839-H924 IonicContact OD2-CE1 3.92Å; D839-H924 PolarHBondContact OD2-CE1 2.83Å; D839-H924 IonicContact OD2-ND1 3.33Å; D839-H924 PolarHBondContact OD2-ND1 3.36Å
840	S	83.6	Confident	85.6	Confident	17 Å²	17	36.8 Å²	36.8	12%	0.119	20%	0.203	C	C	.	.			trans	-144.1	-178.8	179.5	73.2	0	0	0	0	111.9	P805 G873 T922	P805-S840 VanDerWaalsContact CB-OG 3.22Å; P805-S840 WeakPolarHBondContact CB-OG 3.49Å; P805-S840 WeakPolarHBondContact CG-OG 3.1Å; S840-G873 PolarHBondContact N-O 3.12Å; S840-T922 PolarHBondContact O-OG1 3.16Å
841	T	84.1	Confident	85.6	Confident	57 Å²	57	39 Å²	39	35%	0.35	22%	0.217	S	C	.	.	S	Bend	trans	-64.8	153.6	161.1	48.1	0	0	0	0	111.3	H924	T841-H924 HydrophobicContact CG2-CB 4.05Å; T841-H924 WeakPolarHBondContact CG2-O 3.39Å
842	P	88	Confident	85.7	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.013	21%	0.211	C	C	.	.			trans	-63.2	131.2	174.6	-22.1	30.8	0	0	0	113.4	E871 R872 L876 A920 T922 G927 V928	P842-E871 CarbonylContact C-O 3.52Å; P842-R872 WeakPolarHBondContact CA-O 3.47Å; P842-R872 WeakPolarHBondContact CG-O 3.25Å; P842-L876 HydrophobicContact CG-CD2 4.05Å; P842-A920 HydrophobicContact CB-CB 4.01Å; P842-A920 HydrophobicContact CG-CB 3.76Å; P842-T922 HydrophobicContact CG-CG2 3.78Å; P842-G927 WeakPolarHBondContact O-CA 3.41Å; P842-V928 PolarHBondContact O-N 3.07Å; P842-V928 VanDerWaalsContact O-N 3.08Å
843	T	88	Confident	85.7	Confident	88 Å²	88	42.1 Å²	42.1	54%	0.54	22%	0.221	S	C	.	.	S	Bend	trans	-86.6	-20.6	174	58.6	0	0	0	0	112.6	E871 V928	T843-E871 PolarHBondContact N-O 2.85Å; T843-E871 PolarHBondContact OG1-O 3.4Å; T843-V928 VanDerWaalsContact O-CG2 3.26Å; T843-V928 WeakPolarHBondContact O-CG2 3.32Å
844	G	83.9	Confident	85.3	Confident	4 Å²	4	44.3 Å²	44.3	4%	0.041	23%	0.23	C	C	.	.	S	Bend	trans	-103	141.2	175.6	0	0	0	0	0	112.3	P867 E871	G844-P867 WeakPolarHBondContact O-CG 3.34Å; G844-E871 PolarHBondContact N-O 2.89Å; G844-E871 VanDerWaalsContact N-O 3.12Å
845	A	89.1	Confident	84.4	Confident	27 Å²	27	50.3 Å²	50.3	22%	0.223	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-83.4	149.3	173.1	0	0	0	0	0	111.8	V928 R929	A845-V928 WeakPolarHBondContact CA-O 3.31Å; A845-V928 HydrophobicContact CB-CG1 4.37Å; A845-V928 WeakPolarHBondContact CB-O 3.5Å; A845-R929 WeakPolarHBondContact CB-O 3.44Å
846	P	92.9	Very high	83.3	Confident	4 Å²	4	56.3 Å²	56.3	3%	0.026	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-59.3	137.7	168	-22.3	34.2	0	0	0	111.4	I848 N865 P867 Y879 L918 A920	P846-I848 PolarHBondContact O-N 2.96Å; P846-N865 WeakPolarHBondContact CA-O 3.47Å; P846-P867 HydrophobicContact CG-CG 4.34Å; P846-Y879 HydrophobicContact CB-CD1 4.45Å; P846-Y879 HydrophobicContact CB-CE1 4.38Å; P846-Y879 HydrophobicContact CG-CD1 3.79Å; P846-Y879 HydrophobicContact CG-CE1 3.97Å; P846-L918 HydrophobicContact CB-CD2 3.84Å; P846-L918 HydrophobicContact CB-CG 4.08Å; P846-L918 HydrophobicContact CG-CD2 4.41Å; P846-L918 HydrophobicContact CG-CG 4.13Å; P846-A920 HydrophobicContact CG-CB 4.02Å
847	Q	89.5	Confident	82.2	Confident	114 Å²	114	57 Å²	57	53%	0.533	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	108.7	178.2	-67.7	-177.2	-13.7	0	0	109.6	T849 W864 N865	Q847-T849 PolarHBondContact O-N 3.12Å; Q847-W864 CarbonylContact O-C 3.58Å; Q847-W864 WeakPolarHBondContact O-CA 3.48Å; Q847-W864 WeakPolarHBondContact O-CB 3.31Å; Q847-N865 HydrophobicContact CB-CB 4.36Å; Q847-N865 PolarHBondContact N-O 2.66Å; Q847-N865 VanDerWaalsContact N-O 3.1Å; Q847-N865 PolarHBondContact O-N 3.14Å
848	I	89.6	Confident	81.3	Confident	47 Å²	47	60.1 Å²	60.1	24%	0.241	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	122.9	173.3	-64.9	169.1	0	0	0	108.6	P846 V851 L862 D863 L918 S930 V933	P846-I848 PolarHBondContact O-N 2.96Å; I848-V851 HydrophobicContact CG2-CG2 3.81Å; I848-L862 HydrophobicContact CB-CD1 4.47Å; I848-L862 HydrophobicContact CD1-CD1 4.12Å; I848-L862 HydrophobicContact CG1-CD1 4.15Å; I848-L862 HydrophobicContact CG2-CD1 3.53Å; I848-D863 WeakPolarHBondContact CA-O 3.46Å; I848-L918 HydrophobicContact CD1-CB 4.11Å; I848-L918 HydrophobicContact CG1-CB 4.36Å; I848-L918 HydrophobicContact CG1-CD2 3.97Å; I848-S930 WeakPolarHBondContact CD1-OG 3.42Å; I848-V933 HydrophobicContact CD1-CG2 3.63Å; I848-V933 HydrophobicContact CG2-CG2 4.38Å
849	T	89.6	Confident	81.1	Confident	78 Å²	78	58.2 Å²	58.2	48%	0.479	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-29	-173.1	52.9	0	0	0	0	113.3	Q847 D863 N865	Q847-T849 PolarHBondContact O-N 3.12Å; T849-D863 PolarHBondContact N-O 3.24Å; T849-D863 PolarHBondContact OG1-O 2.83Å; T849-N865 HydrophobicContact CG2-CB 4.38Å
850	N	88.5	Confident	81.3	Confident	55 Å²	55	57.6 Å²	57.6	29%	0.294	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	146	-177.9	173	45.6	0	0	0	111.6	D863	N850-D863 HydrophobicContact CB-CB 4.1Å; N850-D863 PolarHBondContact ND2-OD2 2.99Å; N850-D863 PolarHBondContact O-N 3.32Å
851	V	88.3	Confident	81.5	Confident	54 Å²	54	57.7 Å²	57.7	33%	0.327	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	114.1	178.1	-176.4	0	0	0	0	107.8	I848 L860 Q861 L862 V933 I935	I848-V851 HydrophobicContact CG2-CG2 3.81Å; V851-L860 HydrophobicContact CG1-CD1 4.05Å; V851-L860 HydrophobicContact CG1-CD2 3.98Å; V851-L860 HydrophobicContact CG1-CG 4.23Å; V851-Q861 WeakPolarHBondContact CA-O 3.02Å; V851-L862 HydrophobicContact CG2-CD1 3.88Å; V851-V933 HydrophobicContact CG1-CG1 4.17Å; V851-V933 HydrophobicContact CG2-CG1 4Å; V851-V933 HydrophobicContact CG2-CG2 4.44Å; V851-I935 HydrophobicContact CG1-CG2 4.43Å
852	R	85.5	Confident	81.8	Confident	123 Å²	123	55 Å²	55	46%	0.464	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	148.4	-175.8	66.2	178.9	-177.7	-171.6	2.7	113.9	L860 Q861	R852-L860 CarbonylContact O-C 3.54Å; R852-Q861 HydrophobicContact CG-CB 4.03Å; R852-Q861 VanDerWaalsContact CZ-OE1 3.23Å; R852-Q861 PolarHBondContact N-O 3.29Å; R852-Q861 PolarHBondContact O-N 3.02Å
853	W	82.3	Confident	82.1	Confident	85 Å²	85	56 Å²	56	32%	0.322	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	130.5	169.7	-65.1	99.5	0	0	0	110.5	G857 V859 L860 L908 F936 A937	W853-G857 WeakPolarHBondContact CZ3-O 3.09Å; W853-V859 WeakPolarHBondContact CA-O 3.45Å; W853-L860 HydrophobicContact CD2-CD1 3.69Å; W853-L860 HydrophobicContact CE3-CB 4.2Å; W853-L860 HydrophobicContact CE3-CD1 4.11Å; W853-L860 HydrophobicContact CG-CD1 4.07Å; W853-L860 HydrophobicContact CH2-CD1 4.4Å; W853-L860 HydrophobicContact CZ2-CD1 4Å; W853-L860 HydrophobicContact CZ3-CB 4.18Å; W853-L860 HydrophobicContact CZ3-CD1 4.44Å; W853-L908 HydrophobicContact CH2-CD1 3.66Å; W853-L908 HydrophobicContact CZ3-CD1 3.97Å; W853-F936 WeakPolarHBondContact CZ2-O 3.34Å; W853-A937 HydrophobicContact CH2-CB 4.19Å
854	L	74.3	Confident	82.4	Confident	75 Å²	75	51.9 Å²	51.9	39%	0.393	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-34.1	-177.6	-77.3	-178.3	0	0	0	114.3	V859 Q861 H904	L854-V859 PolarHBondContact N-O 2.88Å; L854-Q861 HydrophobicContact CD1-CB 3.89Å; L854-Q861 HydrophobicContact CG-CB 3.98Å; L854-H904 WeakPolarHBondContact CD1-NE2 3.21Å
855	K	62	Low	82.8	Confident	146 Å²	146	55.4 Å²	55.4	64%	0.635	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.8	134.2	176	-68.9	-175.8	177.8	-178.1	0	107.6	G857 T858	K855-G857 PolarHBondContact O-N 2.75Å; K855-T858 PolarHBondContact O-N 2.83Å; K855-T858 PolarHBondContact O-OG1 2.92Å
856	N	60.3	Low	82.8	Confident	129 Å²	129	56.9 Å²	56.9	69%	0.69	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-10.7	93.5	179	-54.7	-1.1	0	0	0	112.8	T858 T940	N856-T858 WeakPolarHBondContact O-CB 3.32Å; N856-T858 WeakPolarHBondContact O-CG2 3.38Å; N856-T858 PolarHBondContact O-N 2.84Å; N856-T858 PolarHBondContact O-OG1 2.87Å; N856-T940 HydrophobicContact CB-CG2 3.5Å; N856-T940 VanDerWaalsContact CB-CG2 3.5Å; N856-T940 WeakPolarHBondContact O-CG2 3.14Å
857	G	59.7	Low	82.6	Confident	20 Å²	20	56.8 Å²	56.8	21%	0.206	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	7.5	173	0	0	0	0	0	119.1	W853 K855 Y938	W853-G857 WeakPolarHBondContact CZ3-O 3.09Å; K855-G857 PolarHBondContact O-N 2.75Å; G857-Y938 WeakPolarHBondContact CA-O 3.24Å
858	T	66	Low	82.4	Confident	66 Å²	66	54.8 Å²	54.8	41%	0.405	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-20.3	-162.8	40.6	0	0	0	0	114.6	K855 N856 T940	K855-T858 PolarHBondContact O-N 2.83Å; K855-T858 PolarHBondContact O-OG1 2.92Å; N856-T858 WeakPolarHBondContact O-CB 3.32Å; N856-T858 WeakPolarHBondContact O-CG2 3.38Å; N856-T858 PolarHBondContact O-N 2.84Å; N856-T858 PolarHBondContact O-OG1 2.87Å; T858-T940 HydrophobicContact CG2-CG2 4.43Å
859	V	76.3	Confident	81.8	Confident	18 Å²	18	59.5 Å²	59.5	11%	0.109	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	121.8	176.6	-174.5	0	0	0	0	109.9	W853 L854 H904 I905 Y906	W853-V859 WeakPolarHBondContact CA-O 3.45Å; L854-V859 PolarHBondContact N-O 2.88Å; V859-H904 HydrophobicContact CG1-CB 4.2Å; V859-I905 WeakPolarHBondContact CA-O 3.43Å; V859-Y906 HydrophobicContact CB-CD1 4.48Å; V859-Y906 HydrophobicContact CG1-CD1 3.96Å; V859-Y906 HydrophobicContact CG1-CE1 3.76Å; V859-Y906 HydrophobicContact CG2-CD1 3.74Å; V859-Y906 HydrophobicContact CG2-CE1 3.98Å
860	L	85.3	Confident	81.2	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.3	177	-167.9	87.7	0	0	0	110.1	V851 R852 W853 H904 I905 L908 L916 I935	V851-L860 HydrophobicContact CG1-CD1 4.05Å; V851-L860 HydrophobicContact CG1-CD2 3.98Å; V851-L860 HydrophobicContact CG1-CG 4.23Å; R852-L860 CarbonylContact O-C 3.54Å; W853-L860 HydrophobicContact CD2-CD1 3.69Å; W853-L860 HydrophobicContact CE3-CB 4.2Å; W853-L860 HydrophobicContact CE3-CD1 4.11Å; W853-L860 HydrophobicContact CG-CD1 4.07Å; W853-L860 HydrophobicContact CH2-CD1 4.4Å; W853-L860 HydrophobicContact CZ2-CD1 4Å; W853-L860 HydrophobicContact CZ3-CB 4.18Å; W853-L860 HydrophobicContact CZ3-CD1 4.44Å; L860-H904 CarbonylContact O-C 3.52Å; L860-H904 WeakPolarHBondContact O-CA 3.28Å; L860-I905 HydrophobicContact CB-CB 4.36Å; L860-I905 HydrophobicContact CD2-CD1 4.11Å; L860-I905 PolarHBondContact N-O 2.92Å; L860-I905 PolarHBondContact O-N 3.24Å; L860-L908 HydrophobicContact CB-CD1 4.28Å; L860-L916 HydrophobicContact CD2-CD1 3.92Å; L860-I935 HydrophobicContact CD2-CD1 3.76Å; L860-I935 HydrophobicContact CD2-CG2 4.22Å
861	Q	88.5	Confident	81	Confident	18 Å²	18	61.6 Å²	61.6	8%	0.084	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	134.5	167.4	177.4	176.9	-4.3	0	0	110	V851 R852 L854 D863 F903	V851-Q861 WeakPolarHBondContact CA-O 3.02Å; R852-Q861 HydrophobicContact CG-CB 4.03Å; R852-Q861 VanDerWaalsContact CZ-OE1 3.23Å; R852-Q861 PolarHBondContact N-O 3.29Å; R852-Q861 PolarHBondContact O-N 3.02Å; L854-Q861 HydrophobicContact CD1-CB 3.89Å; L854-Q861 HydrophobicContact CG-CB 3.98Å; Q861-D863 WeakPolarHBondContact CG-OD1 3.31Å; Q861-D863 VanDerWaalsContact NE2-CG 3.31Å; Q861-D863 PolarHBondContact NE2-OD1 2.92Å; Q861-D863 PolarHBondContact NE2-OD2 3.38Å; Q861-D863 VanDerWaalsContact NE2-OD2 3.08Å; Q861-F903 WeakPolarHBondContact CA-O 3.48Å
862	L	91.3	Very high	80.7	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.8	173.3	176.5	68.1	0	0	0	108.3	I848 V851 W864 L881 S902 F903	I848-L862 HydrophobicContact CB-CD1 4.47Å; I848-L862 HydrophobicContact CD1-CD1 4.12Å; I848-L862 HydrophobicContact CG1-CD1 4.15Å; I848-L862 HydrophobicContact CG2-CD1 3.53Å; V851-L862 HydrophobicContact CG2-CD1 3.88Å; L862-W864 HydrophobicContact CG-CE3 4.31Å; L862-W864 WeakPolarHBondContact O-CZ3 3.37Å; L862-L881 HydrophobicContact CD2-CD1 3.76Å; L862-L881 HydrophobicContact CD2-CD2 4.14Å; L862-S902 CarbonylContact O-C 3.52Å; L862-S902 WeakPolarHBondContact O-CA 3.41Å; L862-F903 PolarHBondContact N-O 3.48Å; L862-F903 PolarHBondContact O-N 2.86Å
863	D	93.1	Very high	80.5	Confident	24 Å²	24	56.3 Å²	56.3	13%	0.128	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	147.8	177.3	-51.7	-46.4	0	0	0	110.9	I848 T849 N850 Q861 S901 S902	I848-D863 WeakPolarHBondContact CA-O 3.46Å; T849-D863 PolarHBondContact N-O 3.24Å; T849-D863 PolarHBondContact OG1-O 2.83Å; N850-D863 HydrophobicContact CB-CB 4.1Å; N850-D863 PolarHBondContact ND2-OD2 2.99Å; N850-D863 PolarHBondContact O-N 3.32Å; Q861-D863 WeakPolarHBondContact CG-OD1 3.31Å; Q861-D863 VanDerWaalsContact NE2-CG 3.31Å; Q861-D863 PolarHBondContact NE2-OD1 2.92Å; Q861-D863 PolarHBondContact NE2-OD2 3.38Å; Q861-D863 VanDerWaalsContact NE2-OD2 3.08Å; D863-S901 WeakPolarHBondContact CA-O 3.01Å; D863-S902 WeakPolarHBondContact OD1-CB 3.41Å; D863-S902 PolarHBondContact OD1-OG 2.83Å
864	W	93.8	Very high	80.4	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	158.9	-178.3	66.9	92.2	0	0	0	114.6	Q847 L862 Y879 M896 Q900 S901 F903 L918	Q847-W864 CarbonylContact O-C 3.58Å; Q847-W864 WeakPolarHBondContact O-CA 3.48Å; Q847-W864 WeakPolarHBondContact O-CB 3.31Å; L862-W864 HydrophobicContact CG-CE3 4.31Å; L862-W864 WeakPolarHBondContact O-CZ3 3.37Å; W864-Y879 AromaticContact CZ2-CD2 3.91Å; W864-Y879 HydrophobicContact CZ2-CD2 3.91Å; W864-Y879 HydrophobicContact CZ2-CE2 4.36Å; W864-Y879 HydrophobicContact CZ2-CG 4.28Å; W864-Y879 AromaticContact NE1-CD1 3.8Å; W864-Y879 AromaticContact NE1-CD2 3.64Å; W864-Y879 AromaticContact NE1-CE1 3.64Å; W864-Y879 AromaticContact NE1-CE2 3.48Å; W864-Y879 AromaticContact NE1-CG 3.8Å; W864-Y879 AromaticContact NE1-CZ 3.48Å; W864-M896 HydrophobicContact CH2-CE 4.47Å; W864-M896 HydrophobicContact CH2-SD 3.47Å; W864-M896 WeakPolarHBondContact CH2-SD 2.96Å; W864-M896 HydrophobicContact CZ2-SD 4.1Å; W864-M896 HydrophobicContact CZ3-SD 4.18Å; W864-Q900 HydrophobicContact CH2-CB 4.38Å; W864-Q900 HydrophobicContact CZ2-CB 4.11Å; W864-Q900 WeakPolarHBondContact CZ2-O 3.41Å; W864-Q900 PolarHBondContact NE1-O 3.43Å; W864-S901 PolarHBondContact N-O 3.19Å; W864-S901 WeakPolarHBondContact O-CB 3.01Å; W864-F903 HydrophobicContact CH2-CB 3.86Å; W864-F903 HydrophobicContact CZ3-CB 3.71Å; W864-L918 HydrophobicContact CB-CD2 3.6Å; W864-L918 HydrophobicContact CD2-CD2 3.6Å; W864-L918 HydrophobicContact CE3-CD2 3.9Å; W864-L918 HydrophobicContact CG-CD2 3.46Å; W864-L918 VanDerWaalsContact CG-CD2 3.46Å
865	N	92.2	Very high	80.7	Confident	77 Å²	77	53 Å²	53	41%	0.412	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	149.6	166.1	-68	-20.1	0	0	0	110.8	P846 Q847 T849	P846-N865 WeakPolarHBondContact CA-O 3.47Å; Q847-N865 HydrophobicContact CB-CB 4.36Å; Q847-N865 PolarHBondContact N-O 2.66Å; Q847-N865 VanDerWaalsContact N-O 3.1Å; Q847-N865 PolarHBondContact O-N 3.14Å; T849-N865 HydrophobicContact CG2-CB 4.38Å
866	P	90.5	Very high	81.7	Confident	58 Å²	58	47.3 Å²	47.3	38%	0.377	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-63	157.3	171.3	27.8	-35.8	0	0	0	112	Y879	P866-Y879 WeakPolarHBondContact CB-OH 3.3Å
867	P	88.8	Confident	82.7	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.013	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-56.5	155.4	165.3	-20.8	31.4	0	0	0	112.2	G844 P846 E871 R872 A920	G844-P867 WeakPolarHBondContact O-CG 3.34Å; P846-P867 HydrophobicContact CG-CG 4.34Å; P867-E871 HydrophobicContact CB-CB 4.36Å; P867-R872 HydrophobicContact CB-CG 4.21Å; P867-R872 PolarHBondContact O-NE 3.45Å; P867-R872 PolarHBondContact O-NH2 2.85Å; P867-R872 VanDerWaalsContact O-NH2 3.16Å; P867-A920 HydrophobicContact CG-CB 3.75Å
868	N	84.8	Confident	84	Confident	73 Å²	73	43.6 Å²	43.6	39%	0.39	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-62.8	151.3	175.5	-60.4	-78.2	0	0	0	110.2	W870 E871 R872	N868-W870 HydrophobicContact CB-CZ2 4.37Å; N868-W870 PolarHBondContact O-N 2.84Å; N868-W870 VanDerWaalsContact O-N 3.11Å; N868-E871 HydrophobicContact CB-CG 4.1Å; N868-E871 VanDerWaalsContact CB-OE2 3.24Å; N868-E871 WeakPolarHBondContact CB-OE2 3.12Å; N868-E871 PolarHBondContact N-OE2 2.77Å; N868-E871 VanDerWaalsContact N-OE2 3.1Å; N868-E871 PolarHBondContact ND2-OE2 3.12Å; N868-E871 WeakPolarHBondContact O-CA 3.48Å; N868-E871 WeakPolarHBondContact O-CB 3.43Å; N868-E871 PolarHBondContact O-N 3.07Å; N868-R872 PolarHBondContact O-N 3.16Å
869	E	77	Confident	85.2	Confident	145 Å²	145	41 Å²	41	68%	0.678	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-57.3	-37.3	-169.4	-46.9	-144.3	113.8	0	0	113.5	E871 R872	E869-E871 PolarHBondContact O-N 2.95Å; E869-R872 PolarHBondContact O-N 3.46Å; E869-R872 IonicContact OE1-CZ 3.7Å; E869-R872 IonicContact OE1-NH1 3.84Å; E869-R872 PolarHBondContact OE1-NH1 3.39Å; E869-R872 IonicContact OE1-NH2 2.72Å
870	W	75.8	Confident	85.9	Confident	137 Å²	137	40.3 Å²	40.3	52%	0.519	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-77.7	-1.4	178.6	55.8	-89.3	0	0	0	114.6	N868	N868-W870 HydrophobicContact CB-CZ2 4.37Å; N868-W870 PolarHBondContact O-N 2.84Å; N868-W870 VanDerWaalsContact O-N 3.11Å
871	E	84.8	Confident	86.2	Confident	41 Å²	41	40.3 Å²	40.3	19%	0.192	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-112.6	-8.6	176.5	-54.3	177.5	122.5	0	0	112.9	P842 T843 G844 P867 N868 E869 G873	P842-E871 CarbonylContact C-O 3.52Å; T843-E871 PolarHBondContact N-O 2.85Å; T843-E871 PolarHBondContact OG1-O 3.4Å; G844-E871 PolarHBondContact N-O 2.89Å; G844-E871 VanDerWaalsContact N-O 3.12Å; P867-E871 HydrophobicContact CB-CB 4.36Å; N868-E871 HydrophobicContact CB-CG 4.1Å; N868-E871 VanDerWaalsContact CB-OE2 3.24Å; N868-E871 WeakPolarHBondContact CB-OE2 3.12Å; N868-E871 PolarHBondContact N-OE2 2.77Å; N868-E871 VanDerWaalsContact N-OE2 3.1Å; N868-E871 PolarHBondContact ND2-OE2 3.12Å; N868-E871 WeakPolarHBondContact O-CA 3.48Å; N868-E871 WeakPolarHBondContact O-CB 3.43Å; N868-E871 PolarHBondContact O-N 3.07Å; E869-E871 PolarHBondContact O-N 2.95Å; E871-G873 VanDerWaalsContact C-N 3.29Å; E871-G873 PolarHBondContact O-N 2.86Å
872	R	83.3	Confident	86.2	Confident	59 Å²	59	42.1 Å²	42.1	22%	0.223	21%	0.211	C	C	.	.	S	Bend	trans	-70.3	-23.2	-177.9	-68.7	174.7	-168.5	155.8	6.2	113.2	P842 P867 N868 E869 G874 L876 T922	P842-R872 WeakPolarHBondContact CA-O 3.47Å; P842-R872 WeakPolarHBondContact CG-O 3.25Å; P867-R872 HydrophobicContact CB-CG 4.21Å; P867-R872 PolarHBondContact O-NE 3.45Å; P867-R872 PolarHBondContact O-NH2 2.85Å; P867-R872 VanDerWaalsContact O-NH2 3.16Å; N868-R872 PolarHBondContact O-N 3.16Å; E869-R872 PolarHBondContact O-N 3.46Å; E869-R872 IonicContact OE1-CZ 3.7Å; E869-R872 IonicContact OE1-NH1 3.84Å; E869-R872 PolarHBondContact OE1-NH1 3.39Å; E869-R872 IonicContact OE1-NH2 2.72Å; R872-G874 PolarHBondContact O-N 3.22Å; R872-L876 HydrophobicContact CB-CD2 4.01Å; R872-L876 HydrophobicContact CB-CG 4.37Å; R872-L876 HydrophobicContact CG-CD1 4.17Å; R872-L876 HydrophobicContact CG-CD2 4.13Å; R872-L876 HydrophobicContact CG-CG 4.17Å; R872-T922 WeakPolarHBondContact O-CG2 3.46Å
873	G	79.6	Confident	86.1	Confident	7 Å²	7	42.5 Å²	42.5	7%	0.072	21%	0.213	C	C	.	.			trans	67.6	-13.1	-179.4	0	0	0	0	0	115.9	F806 D839 S840 E871	F806-G873 VanDerWaalsContact CB-O 3.32Å; F806-G873 WeakPolarHBondContact CB-O 3.36Å; D839-G873 CarbonylContact C-O 3.58Å; D839-G873 WeakPolarHBondContact CA-O 3.34Å; S840-G873 PolarHBondContact N-O 3.12Å; E871-G873 VanDerWaalsContact C-N 3.29Å; E871-G873 PolarHBondContact O-N 2.86Å
874	G	81.2	Confident	85.7	Confident	8 Å²	8	44 Å²	44	8%	0.082	22%	0.22	C	C	.	.	S	Bend	trans	-180	-170.6	-176.3	0	0	0	0	0	111.7	R872 L876	R872-G874 PolarHBondContact O-N 3.22Å; G874-L876 PolarHBondContact O-N 2.83Å
875	I	80.8	Confident	85.1	Confident	83 Å²	83	44.2 Å²	44.2	43%	0.426	22%	0.222	S	C	.	.			trans	-69.7	124	166	-57.3	179.9	0	0	0	107.8	F806	F806-I875 HydrophobicContact CE1-CG1 3.71Å; F806-I875 HydrophobicContact CZ-CD1 4.04Å; F806-I875 HydrophobicContact CZ-CG1 3.63Å
876	L	81.9	Confident	83.9	Confident	26 Å²	26	44.1 Å²	44.1	14%	0.136	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	136.4	174.7	-60.5	-176.3	0	0	0	109.9	P842 R872 G874 T898 A920 V921 T922	P842-L876 HydrophobicContact CG-CD2 4.05Å; R872-L876 HydrophobicContact CB-CD2 4.01Å; R872-L876 HydrophobicContact CB-CG 4.37Å; R872-L876 HydrophobicContact CG-CD1 4.17Å; R872-L876 HydrophobicContact CG-CD2 4.13Å; R872-L876 HydrophobicContact CG-CG 4.17Å; G874-L876 PolarHBondContact O-N 2.83Å; L876-T898 HydrophobicContact CB-CG2 4.33Å; L876-T898 WeakPolarHBondContact O-CG2 3.28Å; L876-A920 HydrophobicContact CD2-CB 4.03Å; L876-V921 CarbonylContact C-O 3.42Å; L876-V921 VanDerWaalsContact CA-O 3.29Å; L876-V921 WeakPolarHBondContact CA-O 3.32Å; L876-T922 HydrophobicContact CD2-CG2 3.95Å
877	T	81.2	Confident	82.6	Confident	66 Å²	66	44.9 Å²	44.9	41%	0.405	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-15.8	175.7	55.1	0	0	0	0	112.2	T898 V921 T922	T877-T898 VanDerWaalsContact C-CG2 3.45Å; T877-V921 PolarHBondContact N-O 2.91Å; T877-V921 PolarHBondContact OG1-O 2.8Å; T877-T922 PolarHBondContact OG1-O 3.42Å
878	G	87.1	Confident	81.4	Confident	4 Å²	4	49.2 Å²	49.2	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.2	-161.3	174	0	0	0	0	0	113.6	M896 V921	G878-M896 CarbonylContact C-O 3.55Å; G878-M896 WeakPolarHBondContact CA-O 3.17Å; G878-V921 PolarHBondContact O-N 2.85Å
879	Y	92	Very high	80.5	Confident	12 Å²	12	55.3 Å²	55.3	5%	0.047	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.3	173.2	-56.6	-83.3	0	0	0	111	P846 W864 P866 N895 M896 Q900 S919 A920	P846-Y879 HydrophobicContact CB-CD1 4.45Å; P846-Y879 HydrophobicContact CB-CE1 4.38Å; P846-Y879 HydrophobicContact CG-CD1 3.79Å; P846-Y879 HydrophobicContact CG-CE1 3.97Å; W864-Y879 AromaticContact CZ2-CD2 3.91Å; W864-Y879 HydrophobicContact CZ2-CD2 3.91Å; W864-Y879 HydrophobicContact CZ2-CE2 4.36Å; W864-Y879 HydrophobicContact CZ2-CG 4.28Å; W864-Y879 AromaticContact NE1-CD1 3.8Å; W864-Y879 AromaticContact NE1-CD2 3.64Å; W864-Y879 AromaticContact NE1-CE1 3.64Å; W864-Y879 AromaticContact NE1-CE2 3.48Å; W864-Y879 AromaticContact NE1-CG 3.8Å; W864-Y879 AromaticContact NE1-CZ 3.48Å; P866-Y879 WeakPolarHBondContact CB-OH 3.3Å; Y879-N895 WeakPolarHBondContact O-CA 3.24Å; Y879-M896 PolarHBondContact N-O 2.84Å; Y879-M896 PolarHBondContact O-N 2.83Å; Y879-Q900 VanDerWaalsContact CE2-O 3.24Å; Y879-Q900 WeakPolarHBondContact CE2-O 3.23Å; Y879-S919 CarbonylContact C-O 3.59Å; Y879-S919 VanDerWaalsContact CA-O 3.27Å; Y879-S919 WeakPolarHBondContact CA-O 3.21Å; Y879-A920 HydrophobicContact CD1-CB 4.3Å; Y879-A920 HydrophobicContact CE1-CB 4.37Å
880	S	90.3	Very high	79.9	Confident	4 Å²	4	53.1 Å²	53.1	3%	0.028	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	119.8	177.5	174.5	0	0	0	0	109.1	L918 S919 E926	S880-L918 CarbonylContact O-C 3.37Å; S880-L918 WeakPolarHBondContact O-CA 3.23Å; S880-S919 PolarHBondContact N-O 3.23Å; S880-S919 PolarHBondContact O-N 2.94Å; S880-E926 VanDerWaalsContact CB-OE2 3.32Å; S880-E926 WeakPolarHBondContact CB-OE2 3.29Å; S880-E926 PolarHBondContact OG-OE2 2.03Å
881	L	92.2	Very high	80.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	115.9	174.4	169.7	63.2	0	0	0	109.2	L862 I883 T893 V894 M896 F903 I905 L916 Y917 L918	L862-L881 HydrophobicContact CD2-CD1 3.76Å; L862-L881 HydrophobicContact CD2-CD2 4.14Å; L881-I883 HydrophobicContact CD2-CD1 4.39Å; L881-I883 HydrophobicContact CG-CD1 4.48Å; L881-I883 HydrophobicContact CG-CG1 4.11Å; L881-T893 CarbonylContact O-C 3.48Å; L881-T893 WeakPolarHBondContact O-CA 3.44Å; L881-V894 HydrophobicContact CB-CB 4.43Å; L881-V894 PolarHBondContact N-O 2.93Å; L881-V894 PolarHBondContact O-N 2.91Å; L881-M896 HydrophobicContact CB-CE 3.42Å; L881-M896 VanDerWaalsContact CB-CE 3.42Å; L881-M896 HydrophobicContact CB-SD 4.39Å; L881-F903 HydrophobicContact CD2-CD1 3.77Å; L881-F903 HydrophobicContact CD2-CE1 4.22Å; L881-I905 HydrophobicContact CD2-CD1 4.04Å; L881-I905 HydrophobicContact CD2-CG1 4.17Å; L881-L916 HydrophobicContact CD1-CB 4.24Å; L881-Y917 CarbonylContact C-O 3.54Å; L881-Y917 WeakPolarHBondContact CA-O 3.48Å; L881-L918 HydrophobicContact CB-CD1 4.26Å
882	K	88.4	Confident	79.9	Confident	57 Å²	57	53.4 Å²	53.4	25%	0.248	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.2	176.9	-167.3	172.8	-172.3	176.3	0	110.7	L884 S891 L916 Y917	K882-L884 HydrophobicContact CG-CD2 4.42Å; K882-S891 VanDerWaalsContact CE-OG 3.22Å; K882-S891 WeakPolarHBondContact CE-OG 3.35Å; K882-L916 CarbonylContact O-C 3.53Å; K882-L916 WeakPolarHBondContact O-CA 3.37Å; K882-Y917 PolarHBondContact N-O 3.31Å; K882-Y917 PolarHBondContact O-N 2.02Å
883	I	88.7	Confident	80	Confident	8 Å²	8	54.2 Å²	54.2	4%	0.041	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.5	-175.7	-51.5	178.2	0	0	0	107.8	L881 S891 R892 I905 Y914 L916	L881-I883 HydrophobicContact CD2-CD1 4.39Å; L881-I883 HydrophobicContact CG-CD1 4.48Å; L881-I883 HydrophobicContact CG-CG1 4.11Å; I883-S891 WeakPolarHBondContact O-CA 3.5Å; I883-R892 HydrophobicContact CB-CB 4.35Å; I883-R892 PolarHBondContact N-O 3.11Å; I883-R892 PolarHBondContact O-N 3.02Å; I883-I905 HydrophobicContact CD1-CD1 4.08Å; I883-I905 HydrophobicContact CD1-CG1 4.46Å; I883-I905 HydrophobicContact CD1-CG2 3.88Å; I883-Y914 HydrophobicContact CG2-CD1 3.9Å; I883-L916 HydrophobicContact CB-CD2 4.24Å; I883-L916 HydrophobicContact CG1-CD2 4Å; I883-L916 HydrophobicContact CG2-CD2 3.84Å
884	L	85.5	Confident	80.4	Confident	56 Å²	56	55.1 Å²	55.1	29%	0.293	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.4	176.3	-58	-178	0	0	0	110.2	K882 L890 Y914 T915 Y917	K882-L884 HydrophobicContact CG-CD2 4.42Å; L884-L890 WeakPolarHBondContact CA-O 3.48Å; L884-Y914 CarbonylContact O-C 3.15Å; L884-Y914 WeakPolarHBondContact O-CA 3.33Å; L884-T915 PolarHBondContact N-O 3.46Å; L884-T915 PolarHBondContact O-N 2.94Å; L884-Y917 HydrophobicContact CD1-CE2 3.93Å
885	S	80.8	Confident	80.7	Confident	6 Å²	6	59.9 Å²	59.9	4%	0.042	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	122.5	167.9	175.8	0	0	0	0	110.2	L888 K889 L890	S885-L888 PolarHBondContact OG-N 3.16Å; S885-K889 PolarHBondContact O-N 3.43Å; S885-L890 PolarHBondContact N-O 2.9Å
886	A	67.7	Low	81	Confident	75 Å²	75	56.4 Å²	56.4	62%	0.62	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-35.8	177.2	0	0	0	0	0	112.1	N913	A886-N913 HydrophobicContact CB-CB 4.33Å; A886-N913 PolarHBondContact N-O 3.12Å; A886-N913 VanDerWaalsContact N-O 3.15Å
887	A	63.5	Low	81.1	Confident	73 Å²	73	62.8 Å²	62.8	60%	0.603	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-41	-178.1	0	0	0	0	0	112.7
888	L	62	Low	81.1	Confident	93 Å²	93	62.9 Å²	62.9	49%	0.487	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-5.6	-173	-59	178.4	0	0	0	114.2	S885 L890 D909	S885-L888 PolarHBondContact OG-N 3.16Å; L888-L890 HydrophobicContact CB-CB 3.88Å; L888-L890 PolarHBondContact O-N 2.84Å; L888-L890 VanDerWaalsContact O-N 3.1Å; L888-D909 VanDerWaalsContact CD1-OD2 3.3Å; L888-D909 WeakPolarHBondContact CD1-OD2 3.48Å
889	K	65.9	Low	80.8	Confident	201 Å²	201	70.2 Å²	70.2	87%	0.874	37%	0.367	S	S	*	.			trans	53	22.3	-166.3	-57.4	-177.1	179.3	-179.9	0	113.5	S885	S885-K889 PolarHBondContact O-N 3.43Å
890	L	66.2	Low	80.4	Confident	100 Å²	100	72.7 Å²	72.7	52%	0.524	38%	0.379	S	S	.	.			trans	-89.2	136.1	-173.2	-173.5	66.2	0	0	0	110.8	L884 S885 L888	L884-L890 WeakPolarHBondContact CA-O 3.48Å; S885-L890 PolarHBondContact N-O 2.9Å; L888-L890 HydrophobicContact CB-CB 3.88Å; L888-L890 PolarHBondContact O-N 2.84Å; L888-L890 VanDerWaalsContact O-N 3.1Å
891	S	79.3	Confident	80.3	Confident	62 Å²	62	75.9 Å²	75.9	43%	0.434	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	119.7	173.3	171.4	0	0	0	0	109.7	K882 I883	K882-S891 VanDerWaalsContact CE-OG 3.22Å; K882-S891 WeakPolarHBondContact CE-OG 3.35Å; I883-S891 WeakPolarHBondContact O-CA 3.5Å
892	R	81.1	Confident	80.2	Confident	121 Å²	121	77.6 Å²	77.6	46%	0.457	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.1	177.7	178.1	-178.8	-178.2	-175.6	2.7	109.4	I883 V894	I883-R892 HydrophobicContact CB-CB 4.35Å; I883-R892 PolarHBondContact N-O 3.11Å; I883-R892 PolarHBondContact O-N 3.02Å; R892-V894 HydrophobicContact CG-CG2 4.37Å
893	T	85.4	Confident	80.3	Confident	76 Å²	76	77.3 Å²	77.3	47%	0.466	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	142	173	-53.9	0	0	0	0	109.7	L881	L881-T893 CarbonylContact O-C 3.48Å; L881-T893 WeakPolarHBondContact O-CA 3.44Å
894	V	86.9	Confident	80.4	Confident	26 Å²	26	79.8 Å²	79.8	16%	0.158	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	124.9	179.1	-175.4	0	0	0	0	109.4	L881 R892 F903	L881-V894 HydrophobicContact CB-CB 4.43Å; L881-V894 PolarHBondContact N-O 2.93Å; L881-V894 PolarHBondContact O-N 2.91Å; R892-V894 HydrophobicContact CG-CG2 4.37Å; V894-F903 HydrophobicContact CG1-CE1 4.12Å; V894-F903 HydrophobicContact CG1-CE2 4.09Å; V894-F903 HydrophobicContact CG1-CZ 3.64Å
895	N	87.1	Confident	80.5	Confident	109 Å²	109	77.2 Å²	77.2	58%	0.583	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	136.4	179.4	-60.9	-14.8	0	0	0	110.3	Y879	Y879-N895 WeakPolarHBondContact O-CA 3.24Å
896	M	88.1	Confident	80.7	Confident	10 Å²	10	82.2 Å²	82.2	5%	0.049	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	155.4	-177.1	-61.3	154.4	-72.1	0	0	110.6	W864 G878 Y879 L881 F903 L918	W864-M896 HydrophobicContact CH2-CE 4.47Å; W864-M896 HydrophobicContact CH2-SD 3.47Å; W864-M896 WeakPolarHBondContact CH2-SD 2.96Å; W864-M896 HydrophobicContact CZ2-SD 4.1Å; W864-M896 HydrophobicContact CZ3-SD 4.18Å; G878-M896 CarbonylContact C-O 3.55Å; G878-M896 WeakPolarHBondContact CA-O 3.17Å; Y879-M896 PolarHBondContact N-O 2.84Å; Y879-M896 PolarHBondContact O-N 2.83Å; L881-M896 HydrophobicContact CB-CE 3.42Å; L881-M896 VanDerWaalsContact CB-CE 3.42Å; L881-M896 HydrophobicContact CB-SD 4.39Å; M896-F903 HydrophobicContact CG-CD2 3.85Å; M896-F903 HydrophobicContact CG-CE2 4.29Å; M896-F903 HydrophobicContact CG-CG 4.37Å; M896-F903 HydrophobicContact SD-CB 3.72Å; M896-F903 HydrophobicContact SD-CD1 4.43Å; M896-F903 HydrophobicContact SD-CD2 3.81Å; M896-F903 HydrophobicContact SD-CG 3.72Å; M896-L918 HydrophobicContact CE-CD1 3.74Å
897	R	84.6	Confident	81	Confident	160 Å²	160	85.1 Å²	85.1	60%	0.604	43%	0.434	S	S	*	.			trans	-76.3	158.7	-178.8	-58.6	-178	-178.1	-172.3	-1	112.1	E899 Q900	R897-E899 PolarHBondContact O-N 2.95Å; R897-Q900 HydrophobicContact CB-CG 4.31Å; R897-Q900 WeakPolarHBondContact O-CB 3.31Å; R897-Q900 PolarHBondContact O-N 2.8Å; R897-Q900 VanDerWaalsContact O-N 3.08Å
898	T	80.6	Confident	81.6	Confident	67 Å²	67	82.3 Å²	82.3	41%	0.411	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-37.6	172.7	48.9	0	0	0	0	113.8	L876 T877 Q900	L876-T898 HydrophobicContact CB-CG2 4.33Å; L876-T898 WeakPolarHBondContact O-CG2 3.28Å; T877-T898 VanDerWaalsContact C-CG2 3.45Å; T898-Q900 PolarHBondContact O-N 3.19Å
899	E	80.5	Confident	82.2	Confident	159 Å²	159	81.2 Å²	81.2	74%	0.743	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-12.5	179.7	-59.7	170.1	153.8	0	0	113.6	R897	R897-E899 PolarHBondContact O-N 2.95Å
900	Q	83.6	Confident	82.5	Confident	63 Å²	63	75.5 Å²	75.5	29%	0.294	39%	0.387	S	S	.	.			trans	-91.8	130.3	-176.5	-63.2	-178.7	-108.2	0	0	111.6	W864 Y879 R897 T898	W864-Q900 HydrophobicContact CH2-CB 4.38Å; W864-Q900 HydrophobicContact CZ2-CB 4.11Å; W864-Q900 WeakPolarHBondContact CZ2-O 3.41Å; W864-Q900 PolarHBondContact NE1-O 3.43Å; Y879-Q900 VanDerWaalsContact CE2-O 3.24Å; Y879-Q900 WeakPolarHBondContact CE2-O 3.23Å; R897-Q900 HydrophobicContact CB-CG 4.31Å; R897-Q900 WeakPolarHBondContact O-CB 3.31Å; R897-Q900 PolarHBondContact O-N 2.8Å; R897-Q900 VanDerWaalsContact O-N 3.08Å; T898-Q900 PolarHBondContact O-N 3.19Å
901	S	88.5	Confident	82.7	Confident	71 Å²	71	79 Å²	79	50%	0.497	39%	0.393	S	S	.	.	S	Bend	trans	-116.8	5.3	168.9	53.9	0	0	0	0	112.8	D863 W864	D863-S901 WeakPolarHBondContact CA-O 3.01Å; W864-S901 PolarHBondContact N-O 3.19Å; W864-S901 WeakPolarHBondContact O-CB 3.01Å
902	S	90.4	Very high	82.6	Confident	37 Å²	37	76.6 Å²	76.6	26%	0.259	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	147.1	-178.1	-173.2	0	0	0	0	111.4	L862 D863	L862-S902 CarbonylContact O-C 3.52Å; L862-S902 WeakPolarHBondContact O-CA 3.41Å; D863-S902 WeakPolarHBondContact OD1-CB 3.41Å; D863-S902 PolarHBondContact OD1-OG 2.83Å
903	F	91	Very high	82.8	Confident	51 Å²	51	75 Å²	75	22%	0.224	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	147.4	177.2	-169.3	-102	0	0	0	111.8	Q861 L862 W864 L881 V894 M896 I905	Q861-F903 WeakPolarHBondContact CA-O 3.48Å; L862-F903 PolarHBondContact N-O 3.48Å; L862-F903 PolarHBondContact O-N 2.86Å; W864-F903 HydrophobicContact CH2-CB 3.86Å; W864-F903 HydrophobicContact CZ3-CB 3.71Å; L881-F903 HydrophobicContact CD2-CD1 3.77Å; L881-F903 HydrophobicContact CD2-CE1 4.22Å; V894-F903 HydrophobicContact CG1-CE1 4.12Å; V894-F903 HydrophobicContact CG1-CE2 4.09Å; V894-F903 HydrophobicContact CG1-CZ 3.64Å; M896-F903 HydrophobicContact CG-CD2 3.85Å; M896-F903 HydrophobicContact CG-CE2 4.29Å; M896-F903 HydrophobicContact CG-CG 4.37Å; M896-F903 HydrophobicContact SD-CB 3.72Å; M896-F903 HydrophobicContact SD-CD1 4.43Å; M896-F903 HydrophobicContact SD-CD2 3.81Å; M896-F903 HydrophobicContact SD-CG 3.72Å; F903-I905 HydrophobicContact CD1-CG1 4.14Å; F903-I905 HydrophobicContact CE1-CG1 4.35Å
904	H	90.2	Very high	82.7	Confident	59 Å²	59	71.9 Å²	71.9	27%	0.273	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120	175.1	-64.8	165.6	0	0	0	110.4	L854 V859 L860 Y906	L854-H904 WeakPolarHBondContact CD1-NE2 3.21Å; V859-H904 HydrophobicContact CG1-CB 4.2Å; L860-H904 CarbonylContact O-C 3.52Å; L860-H904 WeakPolarHBondContact O-CA 3.28Å; H904-Y906 HydrophobicContact CB-CD2 4.29Å; H904-Y906 HydrophobicContact CB-CE1 4.46Å; H904-Y906 HydrophobicContact CB-CE2 3.48Å; H904-Y906 VanDerWaalsContact CB-CE2 3.48Å; H904-Y906 PolarHBondContact ND1-OH 2.71Å; H904-Y906 VanDerWaalsContact O-CD2 3.24Å; H904-Y906 WeakPolarHBondContact O-CD2 3.38Å; H904-Y906 VanDerWaalsContact O-CE2 3.28Å; H904-Y906 WeakPolarHBondContact O-CE2 3.2Å
905	I	87.7	Confident	82.8	Confident	2 Å²	2	71.9 Å²	71.9	1%	0.01	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.4	171.3	-47.1	-179.8	0	0	0	108	V859 L860 L881 I883 F903 L908 L916	V859-I905 WeakPolarHBondContact CA-O 3.43Å; L860-I905 HydrophobicContact CB-CB 4.36Å; L860-I905 HydrophobicContact CD2-CD1 4.11Å; L860-I905 PolarHBondContact N-O 2.92Å; L860-I905 PolarHBondContact O-N 3.24Å; L881-I905 HydrophobicContact CD2-CD1 4.04Å; L881-I905 HydrophobicContact CD2-CG1 4.17Å; I883-I905 HydrophobicContact CD1-CD1 4.08Å; I883-I905 HydrophobicContact CD1-CG1 4.46Å; I883-I905 HydrophobicContact CD1-CG2 3.88Å; F903-I905 HydrophobicContact CD1-CG1 4.14Å; F903-I905 HydrophobicContact CE1-CG1 4.35Å; I905-L908 HydrophobicContact CG2-CD1 4.2Å; I905-L908 HydrophobicContact CG2-CD2 3.88Å; I905-L908 HydrophobicContact CG2-CG 4.03Å; I905-L916 HydrophobicContact CD1-CD1 3.76Å; I905-L916 HydrophobicContact CD1-CD2 3.92Å
906	Y	84	Confident	83	Confident	111 Å²	111	66.7 Å²	66.7	44%	0.435	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	161.1	177.2	-57.6	-90	0	0	0	110.1	V859 H904	V859-Y906 HydrophobicContact CB-CD1 4.48Å; V859-Y906 HydrophobicContact CG1-CD1 3.96Å; V859-Y906 HydrophobicContact CG1-CE1 3.76Å; V859-Y906 HydrophobicContact CG2-CD1 3.74Å; V859-Y906 HydrophobicContact CG2-CE1 3.98Å; H904-Y906 HydrophobicContact CB-CD2 4.29Å; H904-Y906 HydrophobicContact CB-CE1 4.46Å; H904-Y906 HydrophobicContact CB-CE2 3.48Å; H904-Y906 VanDerWaalsContact CB-CE2 3.48Å; H904-Y906 PolarHBondContact ND1-OH 2.71Å; H904-Y906 VanDerWaalsContact O-CD2 3.24Å; H904-Y906 WeakPolarHBondContact O-CD2 3.38Å; H904-Y906 VanDerWaalsContact O-CE2 3.28Å; H904-Y906 WeakPolarHBondContact O-CE2 3.2Å
907	D	74.7	Confident	83.1	Confident	136 Å²	136	69.1 Å²	69.1	73%	0.727	34%	0.338	S	S	*	.			trans	59.8	51.2	170.1	-42.2	-46.8	0	0	0	112.6
908	L	76.8	Confident	83.5	Confident	15 Å²	15	61.5 Å²	61.5	8%	0.079	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-86.3	128.8	168.8	-65.9	174	0	0	0	109.7	W853 L860 I905 Y914 I935 A937	W853-L908 HydrophobicContact CH2-CD1 3.66Å; W853-L908 HydrophobicContact CZ3-CD1 3.97Å; L860-L908 HydrophobicContact CB-CD1 4.28Å; I905-L908 HydrophobicContact CG2-CD1 4.2Å; I905-L908 HydrophobicContact CG2-CD2 3.88Å; I905-L908 HydrophobicContact CG2-CG 4.03Å; L908-Y914 HydrophobicContact CB-CE2 4.1Å; L908-Y914 HydrophobicContact CD2-CD1 4.2Å; L908-Y914 HydrophobicContact CD2-CD2 4.03Å; L908-Y914 HydrophobicContact CD2-CE1 3.97Å; L908-Y914 HydrophobicContact CD2-CE2 3.79Å; L908-Y914 HydrophobicContact CD2-CG 4.23Å; L908-Y914 HydrophobicContact CG-CE2 4.47Å; L908-I935 HydrophobicContact CD1-CD1 3.87Å; L908-A937 HydrophobicContact CB-CB 4.43Å
909	D	73.7	Confident	84	Confident	70 Å²	70	58.3 Å²	58.3	37%	0.374	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-65.7	124.4	-180	-52.4	-78.2	0	0	0	110.6	L888 S912 Y914 A937	L888-D909 VanDerWaalsContact CD1-OD2 3.3Å; L888-D909 WeakPolarHBondContact CD1-OD2 3.48Å; D909-S912 WeakPolarHBondContact O-CB 3.36Å; D909-S912 PolarHBondContact O-N 3.28Å; D909-Y914 WeakPolarHBondContact CA-OH 3.37Å; D909-Y914 WeakPolarHBondContact CB-OH 3.37Å; D909-Y914 VanDerWaalsContact CG-OH 3.29Å; D909-Y914 PolarHBondContact N-OH 3.3Å; D909-Y914 PolarHBondContact OD2-OH 2.9Å; D909-A937 VanDerWaalsContact O-CB 3.3Å; D909-A937 WeakPolarHBondContact O-CB 3.31Å
910	P	71.2	Confident	84.5	Confident	81 Å²	81	50.8 Å²	50.8	53%	0.526	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	147.3	176.5	-26.2	35.2	0	0	0	112.9	S912 P939	P910-S912 PolarHBondContact O-N 3.49Å; P910-P939 HydrophobicContact CB-CB 4.43Å
911	W	72.3	Confident	84.6	Confident	172 Å²	172	49.2 Å²	49.2	65%	0.652	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	10.5	-175.2	-53.5	108.7	0	0	0	115.9	F936 A937 P939	W911-F936 AromaticContact CE3-CE1 3.69Å; W911-F936 HydrophobicContact CE3-CE1 3.69Å; W911-F936 AromaticContact CE3-CZ 3.81Å; W911-F936 HydrophobicContact CE3-CZ 3.81Å; W911-F936 HydrophobicContact CZ3-CE1 4.28Å; W911-A937 WeakPolarHBondContact CA-O 3.46Å; W911-A937 PolarHBondContact N-O 3.03Å; W911-P939 HydrophobicContact CD2-CG 4.31Å; W911-P939 HydrophobicContact CH2-CG 4.08Å; W911-P939 HydrophobicContact CZ2-CG 3.42Å; W911-P939 VanDerWaalsContact CZ2-CG 3.42Å
912	S	76.8	Confident	84.3	Confident	13 Å²	13	46 Å²	46	9%	0.091	23%	0.227	C	C	.	.			trans	-94.6	142.7	177.4	-67.8	0	0	0	0	113.8	D909 P910 A937	D909-S912 WeakPolarHBondContact O-CB 3.36Å; D909-S912 PolarHBondContact O-N 3.28Å; P910-S912 PolarHBondContact O-N 3.49Å; S912-A937 PolarHBondContact O-N 3.27Å; S912-A937 VanDerWaalsContact O-N 3.16Å
913	N	84.1	Confident	83.5	Confident	87 Å²	87	45.7 Å²	45.7	47%	0.465	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	129.3	171.4	-61.4	8.8	0	0	0	109.9	A886 F936	A886-N913 HydrophobicContact CB-CB 4.33Å; A886-N913 PolarHBondContact N-O 3.12Å; A886-N913 VanDerWaalsContact N-O 3.15Å; N913-F936 WeakPolarHBondContact OD1-CD2 3.37Å; N913-F936 WeakPolarHBondContact OD1-CE2 3.09Å
914	Y	84.9	Confident	82.6	Confident	11 Å²	11	45.3 Å²	45.3	4%	0.043	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	149.6	172.2	-56.2	-97.2	0	0	0	112.7	I883 L884 L908 D909 Y934 I935 A937	I883-Y914 HydrophobicContact CG2-CD1 3.9Å; L884-Y914 CarbonylContact O-C 3.15Å; L884-Y914 WeakPolarHBondContact O-CA 3.33Å; L908-Y914 HydrophobicContact CB-CE2 4.1Å; L908-Y914 HydrophobicContact CD2-CD1 4.2Å; L908-Y914 HydrophobicContact CD2-CD2 4.03Å; L908-Y914 HydrophobicContact CD2-CE1 3.97Å; L908-Y914 HydrophobicContact CD2-CE2 3.79Å; L908-Y914 HydrophobicContact CD2-CG 4.23Å; L908-Y914 HydrophobicContact CG-CE2 4.47Å; D909-Y914 WeakPolarHBondContact CA-OH 3.37Å; D909-Y914 WeakPolarHBondContact CB-OH 3.37Å; D909-Y914 VanDerWaalsContact CG-OH 3.29Å; D909-Y914 PolarHBondContact N-OH 3.3Å; D909-Y914 PolarHBondContact OD2-OH 2.9Å; Y914-Y934 WeakPolarHBondContact O-CA 3.35Å; Y914-I935 HydrophobicContact CD2-CD1 4.43Å; Y914-I935 HydrophobicContact CD2-CG1 4.33Å; Y914-I935 HydrophobicContact CG-CG1 4.5Å; Y914-I935 PolarHBondContact N-O 2.7Å; Y914-I935 PolarHBondContact O-N 2.91Å; Y914-A937 HydrophobicContact CE2-CB 4.39Å
915	T	88.8	Confident	81.9	Confident	25 Å²	25	43.8 Å²	43.8	15%	0.153	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.2	169.7	-47.2	0	0	0	0	109.2	L884 Y917 P932 V933 Y934	L884-T915 PolarHBondContact N-O 3.46Å; L884-T915 PolarHBondContact O-N 2.94Å; T915-Y917 HydrophobicContact CG2-CD2 4.4Å; T915-Y917 HydrophobicContact CG2-CE2 3.63Å; T915-P932 HydrophobicContact CG2-CB 3.58Å; T915-V933 CarbonylContact C-O 3.48Å; T915-V933 WeakPolarHBondContact CA-O 3.2Å; T915-Y934 HydrophobicContact CG2-CD1 3.92Å; T915-Y934 HydrophobicContact CG2-CE1 3.7Å
916	L	90.2	Very high	81.6	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	140.1	179	-41.7	177.8	0	0	0	110.7	L860 L881 K882 I883 I905 P932 V933 I935	L860-L916 HydrophobicContact CD2-CD1 3.92Å; L881-L916 HydrophobicContact CD1-CB 4.24Å; K882-L916 CarbonylContact O-C 3.53Å; K882-L916 WeakPolarHBondContact O-CA 3.37Å; I883-L916 HydrophobicContact CB-CD2 4.24Å; I883-L916 HydrophobicContact CG1-CD2 4Å; I883-L916 HydrophobicContact CG2-CD2 3.84Å; I905-L916 HydrophobicContact CD1-CD1 3.76Å; I905-L916 HydrophobicContact CD1-CD2 3.92Å; L916-P932 WeakPolarHBondContact O-CA 3.43Å; L916-V933 HydrophobicContact CB-CB 4.19Å; L916-V933 HydrophobicContact CD1-CB 4.41Å; L916-V933 HydrophobicContact CD1-CG1 4.39Å; L916-V933 HydrophobicContact CG-CB 4.47Å; L916-V933 PolarHBondContact N-O 2.8Å; L916-V933 PolarHBondContact O-N 3.14Å; L916-I935 HydrophobicContact CD1-CD1 4.29Å; L916-I935 HydrophobicContact CD2-CD1 4.29Å; L916-I935 HydrophobicContact CG-CD1 4.46Å
917	Y	90.9	Very high	81.7	Confident	61 Å²	61	42.3 Å²	42.3	24%	0.239	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	136.9	169.7	-60.1	-92.9	0	0	0	109.7	L881 K882 L884 T915 R929 P932	L881-Y917 CarbonylContact C-O 3.54Å; L881-Y917 WeakPolarHBondContact CA-O 3.48Å; K882-Y917 PolarHBondContact N-O 3.31Å; K882-Y917 PolarHBondContact O-N 2.02Å; L884-Y917 HydrophobicContact CD1-CE2 3.93Å; T915-Y917 HydrophobicContact CG2-CD2 4.4Å; T915-Y917 HydrophobicContact CG2-CE2 3.63Å; Y917-R929 HydrophobicContact CD1-CB 4.22Å; Y917-P932 HydrophobicContact CD1-CB 4.38Å; Y917-P932 HydrophobicContact CE1-CB 3.71Å; Y917-P932 HydrophobicContact CE1-CG 4.36Å
918	L	92.7	Very high	82.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.4	178.3	-177.5	65.6	0	0	0	110.3	P846 I848 W864 S880 L881 M896 S930	P846-L918 HydrophobicContact CB-CD2 3.84Å; P846-L918 HydrophobicContact CB-CG 4.08Å; P846-L918 HydrophobicContact CG-CD2 4.41Å; P846-L918 HydrophobicContact CG-CG 4.13Å; I848-L918 HydrophobicContact CD1-CB 4.11Å; I848-L918 HydrophobicContact CG1-CB 4.36Å; I848-L918 HydrophobicContact CG1-CD2 3.97Å; W864-L918 HydrophobicContact CB-CD2 3.6Å; W864-L918 HydrophobicContact CD2-CD2 3.6Å; W864-L918 HydrophobicContact CE3-CD2 3.9Å; W864-L918 HydrophobicContact CG-CD2 3.46Å; W864-L918 VanDerWaalsContact CG-CD2 3.46Å; S880-L918 CarbonylContact O-C 3.37Å; S880-L918 WeakPolarHBondContact O-CA 3.23Å; L881-L918 HydrophobicContact CB-CD1 4.26Å; M896-L918 HydrophobicContact CE-CD1 3.74Å; L918-S930 PolarHBondContact N-OG 3.06Å; L918-S930 WeakPolarHBondContact O-CB 3.37Å; L918-S930 PolarHBondContact O-N 3.16Å
919	S	91.8	Very high	82.9	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.007	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	148	179.8	-47.6	0	0	0	0	110.8	Y879 S880 E926 R929	Y879-S919 CarbonylContact C-O 3.59Å; Y879-S919 VanDerWaalsContact CA-O 3.27Å; Y879-S919 WeakPolarHBondContact CA-O 3.21Å; S880-S919 PolarHBondContact N-O 3.23Å; S880-S919 PolarHBondContact O-N 2.94Å; S919-E926 VanDerWaalsContact OG-CD 3.32Å; S919-E926 WeakPolarHBondContact OG-CG 3.38Å; S919-E926 PolarHBondContact OG-OE1 3.13Å; S919-R929 WeakPolarHBondContact OG-CG 3.32Å
920	A	90.1	Very high	83.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	157.6	164.3	0	0	0	0	0	110.6	P842 P846 P867 L876 Y879 G927	P842-A920 HydrophobicContact CB-CB 4.01Å; P842-A920 HydrophobicContact CG-CB 3.76Å; P846-A920 HydrophobicContact CG-CB 4.02Å; P867-A920 HydrophobicContact CG-CB 3.75Å; L876-A920 HydrophobicContact CD2-CB 4.03Å; Y879-A920 HydrophobicContact CD1-CB 4.3Å; Y879-A920 HydrophobicContact CE1-CB 4.37Å; A920-G927 PolarHBondContact O-N 2.86Å
921	V	86.6	Confident	84.4	Confident	30 Å²	30	44.8 Å²	44.8	18%	0.182	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.2	-178.6	-170.8	0	0	0	0	109.8	L876 T877 G878 G925	L876-V921 CarbonylContact C-O 3.42Å; L876-V921 VanDerWaalsContact CA-O 3.29Å; L876-V921 WeakPolarHBondContact CA-O 3.32Å; T877-V921 PolarHBondContact N-O 2.91Å; T877-V921 PolarHBondContact OG1-O 2.8Å; G878-V921 PolarHBondContact O-N 2.85Å; V921-G925 WeakPolarHBondContact CA-O 3.27Å; V921-G925 WeakPolarHBondContact CG1-O 3.47Å
922	T	82.4	Confident	85.2	Confident	4 Å²	4	38.6 Å²	38.6	3%	0.025	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	-174.4	170.6	59.9	0	0	0	0	110.4	S840 P842 R872 L876 T877 H924 G925	S840-T922 PolarHBondContact O-OG1 3.16Å; P842-T922 HydrophobicContact CG-CG2 3.78Å; R872-T922 WeakPolarHBondContact O-CG2 3.46Å; L876-T922 HydrophobicContact CD2-CG2 3.95Å; T877-T922 PolarHBondContact OG1-O 3.42Å; T922-H924 PolarHBondContact O-N 2.82Å; T922-H924 VanDerWaalsContact O-N 3.14Å; T922-H924 PolarHBondContact OG1-N 2.83Å; T922-G925 PolarHBondContact N-O 2.84Å; T922-G925 VanDerWaalsContact N-O 3.07Å; T922-G925 PolarHBondContact O-N 3.46Å; T922-G925 VanDerWaalsContact O-N 3.14Å
923	C	72.1	Confident	85.7	Confident	30 Å²	30	39.4 Å²	39.4	20%	0.203	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.5	170.8	-60.4	0	0	0	0	114	C738	C738-C923 HydrophobicContact CB-CB 4.38Å
924	H	72.3	Confident	85.9	Confident	43 Å²	43	43.2 Å²	43.2	20%	0.199	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-3.8	178.3	-81.8	90.4	0	0	0	114.6	K385 D839 T841 T922	K385-H924 WeakPolarHBondContact CE-CE1 3.47Å; K385-H924 PolarHBondContact NZ-CE1 2.87Å; K385-H924 VanDerWaalsContact NZ-CE1 3.27Å; D839-H924 VanDerWaalsContact CG-ND1 3.3Å; D839-H924 PolarHBondContact O-CE1 2.95Å; D839-H924 PolarHBondContact O-ND1 2.93Å; D839-H924 IonicContact OD1-CE1 3.69Å; D839-H924 PolarHBondContact OD1-CE1 3.31Å; D839-H924 VanDerWaalsContact OD1-CE1 3.26Å; D839-H924 IonicContact OD1-ND1 3.48Å; D839-H924 IonicContact OD2-CE1 3.92Å; D839-H924 PolarHBondContact OD2-CE1 2.83Å; D839-H924 IonicContact OD2-ND1 3.33Å; D839-H924 PolarHBondContact OD2-ND1 3.36Å; T841-H924 HydrophobicContact CG2-CB 4.05Å; T841-H924 WeakPolarHBondContact CG2-O 3.39Å; T922-H924 PolarHBondContact O-N 2.82Å; T922-H924 VanDerWaalsContact O-N 3.14Å; T922-H924 PolarHBondContact OG1-N 2.83Å
925	G	75.1	Confident	86	Confident	28 Å²	28	43.6 Å²	43.6	29%	0.289	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	119.2	-163.5	175.4	0	0	0	0	0	115.7	V921 T922	V921-G925 WeakPolarHBondContact CA-O 3.27Å; V921-G925 WeakPolarHBondContact CG1-O 3.47Å; T922-G925 PolarHBondContact N-O 2.84Å; T922-G925 VanDerWaalsContact N-O 3.07Å; T922-G925 PolarHBondContact O-N 3.46Å; T922-G925 VanDerWaalsContact O-N 3.14Å
926	E	82.9	Confident	85.7	Confident	68 Å²	68	45.4 Å²	45.4	32%	0.318	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	131.6	-179.1	-167.7	179.7	121.8	0	0	111	S880 S919 R929	S880-E926 VanDerWaalsContact CB-OE2 3.32Å; S880-E926 WeakPolarHBondContact CB-OE2 3.29Å; S880-E926 PolarHBondContact OG-OE2 2.03Å; S919-E926 VanDerWaalsContact OG-CD 3.32Å; S919-E926 WeakPolarHBondContact OG-CG 3.38Å; S919-E926 PolarHBondContact OG-OE1 3.13Å; E926-R929 IonicContact OE1-CZ 2.72Å; E926-R929 VanDerWaalsContact OE1-CZ 3.25Å; E926-R929 IonicContact OE1-NE 3.57Å; E926-R929 PolarHBondContact OE1-NE 2.79Å; E926-R929 IonicContact OE1-NH2 3.19Å; E926-R929 PolarHBondContact OE1-NH2 2.94Å
927	G	84.8	Confident	85	Confident	13 Å²	13	45.4 Å²	45.4	13%	0.134	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-161.1	175.6	0	0	0	0	0	114	P842 A920	P842-G927 WeakPolarHBondContact O-CA 3.41Å; A920-G927 PolarHBondContact O-N 2.86Å
928	V	87.3	Confident	83.8	Confident	74 Å²	74	49.2 Å²	49.2	45%	0.448	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	136.7	178.2	-178.8	0	0	0	0	111.4	P842 T843 A845	P842-V928 PolarHBondContact O-N 3.07Å; P842-V928 VanDerWaalsContact O-N 3.08Å; T843-V928 VanDerWaalsContact O-CG2 3.26Å; T843-V928 WeakPolarHBondContact O-CG2 3.32Å; A845-V928 WeakPolarHBondContact CA-O 3.31Å; A845-V928 HydrophobicContact CB-CG1 4.37Å; A845-V928 WeakPolarHBondContact CB-O 3.5Å
929	R	90	Very high	82.1	Confident	117 Å²	117	51.8 Å²	51.8	44%	0.442	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	145.7	176.4	-79.6	170.5	-169.8	134.4	17.1	111.8	A845 Y917 S919 E926	A845-R929 WeakPolarHBondContact CB-O 3.44Å; Y917-R929 HydrophobicContact CD1-CB 4.22Å; S919-R929 WeakPolarHBondContact OG-CG 3.32Å; E926-R929 IonicContact OE1-CZ 2.72Å; E926-R929 VanDerWaalsContact OE1-CZ 3.25Å; E926-R929 IonicContact OE1-NE 3.57Å; E926-R929 PolarHBondContact OE1-NE 2.79Å; E926-R929 IonicContact OE1-NH2 3.19Å; E926-R929 PolarHBondContact OE1-NH2 2.94Å
930	S	90.7	Very high	80.2	Confident	11 Å²	11	55.6 Å²	55.6	8%	0.077	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-56.8	164.4	167.8	72.1	0	0	0	0	111.7	I848 L918	I848-S930 WeakPolarHBondContact CD1-OG 3.42Å; L918-S930 PolarHBondContact N-OG 3.06Å; L918-S930 WeakPolarHBondContact O-CB 3.37Å; L918-S930 PolarHBondContact O-N 3.16Å
931	L	85.4	Confident	78.1	Confident	153 Å²	153	65.6 Å²	65.6	80%	0.801	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-53.5	145.1	159.7	-65.7	175.4	0	0	0	110	V933	L931-V933 PolarHBondContact O-N 2.91Å
932	P	89.2	Confident	75.6	Confident	42 Å²	42	67.1 Å²	67.1	27%	0.273	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-66.8	129.3	179.5	25.2	-32.7	0	0	0	111.3	T915 L916 Y917 Y934	T915-P932 HydrophobicContact CG2-CB 3.58Å; L916-P932 WeakPolarHBondContact O-CA 3.43Å; Y917-P932 HydrophobicContact CD1-CB 4.38Å; Y917-P932 HydrophobicContact CE1-CB 3.71Å; Y917-P932 HydrophobicContact CE1-CG 4.36Å; P932-Y934 HydrophobicContact CB-CE1 4.41Å; P932-Y934 HydrophobicContact CB-CE2 3.87Å; P932-Y934 HydrophobicContact CG-CE2 3.73Å; P932-Y934 WeakPolarHBondContact CG-OH 3.37Å
933	V	88	Confident	73.4	Confident	29 Å²	29	74.8 Å²	74.8	18%	0.176	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	115.7	167	-179.9	0	0	0	0	108.5	I848 V851 T915 L916 L931 I935	I848-V933 HydrophobicContact CD1-CG2 3.63Å; I848-V933 HydrophobicContact CG2-CG2 4.38Å; V851-V933 HydrophobicContact CG1-CG1 4.17Å; V851-V933 HydrophobicContact CG2-CG1 4Å; V851-V933 HydrophobicContact CG2-CG2 4.44Å; T915-V933 CarbonylContact C-O 3.48Å; T915-V933 WeakPolarHBondContact CA-O 3.2Å; L916-V933 HydrophobicContact CB-CB 4.19Å; L916-V933 HydrophobicContact CD1-CB 4.41Å; L916-V933 HydrophobicContact CD1-CG1 4.39Å; L916-V933 HydrophobicContact CG-CB 4.47Å; L916-V933 PolarHBondContact N-O 2.8Å; L916-V933 PolarHBondContact O-N 3.14Å; L931-V933 PolarHBondContact O-N 2.91Å; V933-I935 HydrophobicContact CG1-CG2 4.04Å
934	Y	88.6	Confident	71.5	Confident	167 Å²	167	79.7 Å²	79.7	66%	0.655	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.8	174.5	-56.7	-82.7	0	0	0	110.1	Y914 T915 P932	Y914-Y934 WeakPolarHBondContact O-CA 3.35Å; T915-Y934 HydrophobicContact CG2-CD1 3.92Å; T915-Y934 HydrophobicContact CG2-CE1 3.7Å; P932-Y934 HydrophobicContact CB-CE1 4.41Å; P932-Y934 HydrophobicContact CB-CE2 3.87Å; P932-Y934 HydrophobicContact CG-CE2 3.73Å; P932-Y934 WeakPolarHBondContact CG-OH 3.37Å
935	I	85.5	Confident	69.7	Low	20 Å²	20	83.8 Å²	83.8	10%	0.103	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	150.1	176.8	64.4	176.7	0	0	0	111.4	V851 L860 L908 Y914 L916 V933	V851-I935 HydrophobicContact CG1-CG2 4.43Å; L860-I935 HydrophobicContact CD2-CD1 3.76Å; L860-I935 HydrophobicContact CD2-CG2 4.22Å; L908-I935 HydrophobicContact CD1-CD1 3.87Å; Y914-I935 HydrophobicContact CD2-CD1 4.43Å; Y914-I935 HydrophobicContact CD2-CG1 4.33Å; Y914-I935 HydrophobicContact CG-CG1 4.5Å; Y914-I935 PolarHBondContact N-O 2.7Å; Y914-I935 PolarHBondContact O-N 2.91Å; L916-I935 HydrophobicContact CD1-CD1 4.29Å; L916-I935 HydrophobicContact CD2-CD1 4.29Å; L916-I935 HydrophobicContact CG-CD1 4.46Å; V933-I935 HydrophobicContact CG1-CG2 4.04Å
936	F	82.7	Confident	67.6	Low	63 Å²	63	91 Å²	91	28%	0.276	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	125.7	171.2	-166.7	-82.2	0	0	0	109.1	W853 W911 N913 Y938	W853-F936 WeakPolarHBondContact CZ2-O 3.34Å; W911-F936 AromaticContact CE3-CE1 3.69Å; W911-F936 HydrophobicContact CE3-CE1 3.69Å; W911-F936 AromaticContact CE3-CZ 3.81Å; W911-F936 HydrophobicContact CE3-CZ 3.81Å; W911-F936 HydrophobicContact CZ3-CE1 4.28Å; N913-F936 WeakPolarHBondContact OD1-CD2 3.37Å; N913-F936 WeakPolarHBondContact OD1-CE2 3.09Å; F936-Y938 HydrophobicContact CB-CE2 4.08Å; F936-Y938 AromaticContact CD1-CD1 3.61Å; F936-Y938 HydrophobicContact CD1-CD1 3.61Å; F936-Y938 HydrophobicContact CD1-CD2 4.06Å; F936-Y938 AromaticContact CD1-CE1 3.42Å; F936-Y938 HydrophobicContact CD1-CE1 3.42Å; F936-Y938 VanDerWaalsContact CD1-CE1 3.42Å; F936-Y938 AromaticContact CD1-CE2 3.89Å; F936-Y938 HydrophobicContact CD1-CE2 3.89Å; F936-Y938 AromaticContact CD1-CG 3.93Å; F936-Y938 HydrophobicContact CD1-CG 3.93Å; F936-Y938 AromaticContact CD1-CZ 3.57Å; F936-Y938 AromaticContact CE1-CD1 3.8Å; F936-Y938 HydrophobicContact CE1-CD1 3.8Å; F936-Y938 AromaticContact CE1-CE1 3.79Å; F936-Y938 HydrophobicContact CE1-CE1 3.79Å; F936-Y938 HydrophobicContact CE1-CG 4.41Å; F936-Y938 HydrophobicContact CG-CE1 4.29Å; F936-Y938 HydrophobicContact CG-CE2 4.39Å; F936-Y938 PolarHBondContact O-N 3Å
937	A	76.4	Confident	65.2	Low	0 Å²	0	96.4 Å²	96.4	0%	0	49%	0.491	C	S	.	.			trans	-85.6	108.3	177.1	0	0	0	0	0	110.6	W853 L908 D909 W911 S912 Y914	W853-A937 HydrophobicContact CH2-CB 4.19Å; L908-A937 HydrophobicContact CB-CB 4.43Å; D909-A937 VanDerWaalsContact O-CB 3.3Å; D909-A937 WeakPolarHBondContact O-CB 3.31Å; W911-A937 WeakPolarHBondContact CA-O 3.46Å; W911-A937 PolarHBondContact N-O 3.03Å; S912-A937 PolarHBondContact O-N 3.27Å; S912-A937 VanDerWaalsContact O-N 3.16Å; Y914-A937 HydrophobicContact CE2-CB 4.39Å
938	Y	64.8	Low	62.5	Low	140 Å²	140	99 Å²	99	55%	0.549	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-89	139.7	176.8	-61.6	-82.1	0	0	0	111.3	G857 F936	G857-Y938 WeakPolarHBondContact CA-O 3.24Å; F936-Y938 HydrophobicContact CB-CE2 4.08Å; F936-Y938 AromaticContact CD1-CD1 3.61Å; F936-Y938 HydrophobicContact CD1-CD1 3.61Å; F936-Y938 HydrophobicContact CD1-CD2 4.06Å; F936-Y938 AromaticContact CD1-CE1 3.42Å; F936-Y938 HydrophobicContact CD1-CE1 3.42Å; F936-Y938 VanDerWaalsContact CD1-CE1 3.42Å; F936-Y938 AromaticContact CD1-CE2 3.89Å; F936-Y938 HydrophobicContact CD1-CE2 3.89Å; F936-Y938 AromaticContact CD1-CG 3.93Å; F936-Y938 HydrophobicContact CD1-CG 3.93Å; F936-Y938 AromaticContact CD1-CZ 3.57Å; F936-Y938 AromaticContact CE1-CD1 3.8Å; F936-Y938 HydrophobicContact CE1-CD1 3.8Å; F936-Y938 AromaticContact CE1-CE1 3.79Å; F936-Y938 HydrophobicContact CE1-CE1 3.79Å; F936-Y938 HydrophobicContact CE1-CG 4.41Å; F936-Y938 HydrophobicContact CG-CE1 4.29Å; F936-Y938 HydrophobicContact CG-CE2 4.39Å; F936-Y938 PolarHBondContact O-N 3Å
939	P	56.7	Low	59.9	Low	55 Å²	55	102.6 Å²	102.6	36%	0.357	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-67.4	158.4	173.9	32.6	-39.1	0	0	0	111.9	P910 W911 R941	P910-P939 HydrophobicContact CB-CB 4.43Å; W911-P939 HydrophobicContact CD2-CG 4.31Å; W911-P939 HydrophobicContact CH2-CG 4.08Å; W911-P939 HydrophobicContact CZ2-CG 3.42Å; W911-P939 VanDerWaalsContact CZ2-CG 3.42Å; P939-R941 PolarHBondContact O-N 3.24Å
940	T	53.3	Low	57	Low	80 Å²	80	101 Å²	101	49%	0.491	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-73	119.1	178.1	60.4	0	0	0	0	110.8	N856 T858 G942	N856-T940 HydrophobicContact CB-CG2 3.5Å; N856-T940 VanDerWaalsContact CB-CG2 3.5Å; N856-T940 WeakPolarHBondContact O-CG2 3.14Å; T858-T940 HydrophobicContact CG2-CG2 4.43Å; T940-G942 PolarHBondContact O-N 3.11Å; T940-G942 VanDerWaalsContact O-N 3.14Å
941	R	44.9	Very low	54.2	Low	211 Å²	211	106.6 Å²	106.6	80%	0.796	59%	0.587	S	S	*	*			trans	-58	115.9	-176.1	-157.2	179.4	-155.7	167.3	8.2	111.1	P939 F944	P939-R941 PolarHBondContact O-N 3.24Å; R941-F944 HydrophobicContact CG-CE2 4.21Å; R941-F944 VanDerWaalsContact NE-CE2 3.25Å; R941-F944 VanDerWaalsContact NE-CZ 3.29Å
942	G	35.7	Very low	51.5	Low	61 Å²	61	104.6 Å²	104.6	63%	0.629	59%	0.586	S	S	*	*			trans	-165.6	29	-169.7	0	0	0	0	0	114.8	T940	T940-G942 PolarHBondContact O-N 3.11Å; T940-G942 VanDerWaalsContact O-N 3.14Å
943	D	35.7	Very low	48.5	Very low	165 Å²	165	111 Å²	111	88%	0.882	61%	0.609	S	S	*	*			trans	-166.5	154.7	151.6	-95.1	-29.9	0	0	0	109.4
944	F	32.2	Very low	45.6	Very low	134 Å²	134	118.5 Å²	118.5	59%	0.588	64%	0.64	S	S	*	*			trans	-151.8	153.5	-168.4	-106.4	-73	0	0	0	109.6	R941	R941-F944 HydrophobicContact CG-CE2 4.21Å; R941-F944 VanDerWaalsContact NE-CE2 3.25Å; R941-F944 VanDerWaalsContact NE-CZ 3.29Å
945	P	33.9	Very low	42.8	Very low	129 Å²	129	115.4 Å²	115.4	84%	0.838	64%	0.64	S	S	*	*				-140	-178	98.6	31.6	-13.6	0	0	0	114.2
946	E	30.3	Very low	39.9	Very low	178 Å²	178	121.3 Å²	121.3	83%	0.832	68%	0.677	S	S	*	*			trans	-91.2	151	-163.1	-57	169.7	109.9	0	0	114.9
947	L	33.2	Very low	37.1	Very low	183 Å²	183	124.5 Å²	124.5	96%	0.958	69%	0.694	S	S	*	*			trans	-151.7	85.8	159.2	-110.8	171.4	0	0	0	111.5
948	G	29.2	Very low	34.7	Very low	67 Å²	67	131.1 Å²	131.1	69%	0.691	73%	0.73	S	S	*	*			trans	76.7	117.8	152.1	0	0	0	0	0	120.9
949	V	31.7	Very low	32.9	Very low	149 Å²	149	133.4 Å²	133.4	90%	0.903	74%	0.737	S	S	*	*				35.7	125	128	-171.6	0	0	0	0	118.3
950	A	29.5	Very low	31.4	Very low	83 Å²	83	137 Å²	137	69%	0.686	75%	0.754	S	S	*	*			cis	-163.8	165.1	-6.2	0	0	0	0	0	109
951	P	32	Very low	30.1	Very low	130 Å²	130	141.9 Å²	141.9	84%	0.844	77%	0.771	S	S	*	*			trans	-93.7	125.5	-162.9	33.8	-34	0	0	0	115.9
952	S	28.3	Very low	29.3	Very low	111 Å²	111	142.2 Å²	142.2	78%	0.776	77%	0.773	S	S	*	*			trans	-157.2	120.9	160.4	60.8	0	0	0	0	115.5
953	K	26	Very low	28.9	Very low	177 Å²	177	147.8 Å²	147.8	77%	0.77	78%	0.783	S	S	*	*			trans	47.2	136.4	145.1	-75.7	178.6	170.6	178.8	0	123.2
954	F	27.9	Very low	28.5	Very low	185 Å²	185	146 Å²	146	81%	0.811	78%	0.783	S	S	*	*			trans	73.4	162.5	153.2	-62.5	-51.6	0	0	0	119.1
955	P	28.6	Very low	28.3	Very low	102 Å²	102	143.2 Å²	143.2	66%	0.662	79%	0.793	S	S	*	*			cis	-124.3	176.6	-12.5	25.7	-4.2	0	0	0	114.6
956	V	24.5	Very low	27.9	Very low	144 Å²	144	144.7 Å²	144.7	87%	0.873	79%	0.794	S	S	*	*			trans	-67.5	129.8	156.2	174.9	0	0	0	0	108.4
957	M	25.1	Very low	27.7	Very low	130 Å²	130	143 Å²	143	64%	0.64	79%	0.789	S	S	*	*			trans	-102.6	110.3	-178.8	-165.2	168.5	-79.6	0	0	111.2	W959	M957-W959 HydrophobicContact SD-CZ2 3.79Å; M957-W959 PolarHBondContact SD-NE1 3.33Å
958	N	24.8	Very low	27.4	Very low	139 Å²	139	144 Å²	144	74%	0.743	79%	0.786	S	S	*	*			trans	-85.2	115.6	177.4	-175	14.7	0	0	0	109.8	N960	N958-N960 PolarHBondContact O-N 2.76Å
959	W	26.5	Very low	27.1	Very low	189 Å²	189	151.7 Å²	151.7	72%	0.716	79%	0.794	S	S	*	*			trans	-98.7	68	-174.7	-80	86.9	0	0	0	112.7	M957	M957-W959 HydrophobicContact SD-CZ2 3.79Å; M957-W959 PolarHBondContact SD-NE1 3.33Å
960	N	25.4	Very low	26.7	Very low	130 Å²	130	154.1 Å²	154.1	70%	0.695	79%	0.793	S	S	*	*			trans	-100	152.3	152.4	-77.8	-17	0	0	0	108.4	N958	N958-N960 PolarHBondContact O-N 2.76Å
961	Q	26.6	Very low	26.6	Very low	182 Å²	182	156.3 Å²	156.3	85%	0.85	80%	0.797	S	S	*	*			trans	67.7	82.2	-177.9	-57	-180	-26.6	0	0	115.9
962	Y	28.3	Very low	26.3	Very low	218 Å²	218	157.3 Å²	157.3	86%	0.855	80%	0.795	S	S	*	*			trans	-146.6	112.9	130.3	-119.2	-76.4	0	0	0	109.4
963	E	27.4	Very low	26.2	Very low	178 Å²	178	162.4 Å²	162.4	83%	0.832	80%	0.798	S	S	*	*			trans	-93.6	164.3	-175.6	-67.3	-176.3	108.3	0	0	112.9
964	S	26.6	Very low	26.1	Very low	127 Å²	127	162 Å²	162	89%	0.888	81%	0.805	S	S	*	*			trans	66.1	114.6	157.5	72.7	0	0	0	0	117.8
965	G	27.7	Very low	26	Very low	77 Å²	77	155.6 Å²	155.6	79%	0.794	79%	0.792	S	S	*	*			trans	177.5	102	173	0	0	0	0	0	110.8
966	N	26.7	Very low	25.9	Very low	160 Å²	160	162.9 Å²	162.9	86%	0.856	81%	0.806	S	S	*	*			trans	-72.8	171.4	-173.5	-79.6	-52.4	0	0	0	113.9
967	I	25.8	Very low	25.9	Very low	142 Å²	142	160.3 Å²	160.3	73%	0.728	79%	0.794	S	S	*	*			trans	84.5	90.6	165.2	-44.1	167.2	0	0	0	115.6
968	F	26	Very low	25.9	Very low	205 Å²	205	159.9 Å²	159.9	90%	0.899	79%	0.794	S	S	*	*				-168.2	119.8	104.5	-107.2	-71.8	0	0	0	111.3
969	R	23.4	Very low	26.1	Very low	227 Å²	227	162.2 Å²	162.2	86%	0.857	79%	0.793	S	S	*	*			trans	-141.4	159.2	172.6	-157.2	-178.8	-166.1	-173.3	7.8	108
970	K	24.5	Very low	26.2	Very low	200 Å²	200	156.8 Å²	156.8	87%	0.87	78%	0.783	S	S	*	*			trans	81.7	167.8	173.7	-145.6	173.3	-173.1	177.4	0	114.9
971	V	26.4	Very low	26.3	Very low	130 Å²	130	151.5 Å²	151.5	79%	0.788	76%	0.759	S	S	*	*			trans	75.9	117.3	-170.1	-171.6	0	0	0	0	113.7
972	L	25.9	Very low	26.5	Very low	151 Å²	151	144.6 Å²	144.6	79%	0.791	73%	0.73	S	S	*	*			cis	-163.2	165.6	-25.1	-123.4	159.9	0	0	0	109
973	Y	25.7	Very low	26.5	Very low	217 Å²	217	140.2 Å²	140.2	85%	0.851	72%	0.721	S	S	*	*			trans	-65.9	141.9	160.9	-89.7	-119.1	0	0	0	109.9
974	D	25.1	Very low	26.6	Very low	168 Å²	168	136.3 Å²	136.3	90%	0.898	71%	0.714	S	S	*	*				-165.3	158.6	122.8	-142.9	-25.5	0	0	0	112.7
975	G	25.4	Very low	27.1	Very low	52 Å²	52	135.8 Å²	135.8	54%	0.536	71%	0.707	S	S	.	*			trans	97.1	82.4	142	0	0	0	0	0	121.6
976	R	25.4	Very low	27.3	Very low	255 Å²	255	141.3 Å²	141.3	96%	0.962	71%	0.712	S	S	*	*			trans	71.8	155.3	141.3	-61.4	173.3	-176.6	-175.6	0.3	118.6
977	S	25	Very low	27.6	Very low	89 Å²	89	137 Å²	137	62%	0.622	71%	0.706	S	S	*	*			cis	-172.5	154.8	-22.9	-173.7	0	0	0	0	110.7
978	L	25.6	Very low	27.6	Very low	121 Å²	121	138.1 Å²	138.1	63%	0.634	71%	0.712	S	S	*	*			trans	71.8	141.9	173.3	-53.1	125.1	0	0	0	115.9	Q257	Q257-L978 VanDerWaalsContact CD-O 3.23Å; Q257-L978 WeakPolarHBondContact CG-O 3.21Å
979	Y	28.2	Very low	27.7	Very low	188 Å²	188	133.1 Å²	133.1	74%	0.737	70%	0.703	S	S	*	*			cis	88.9	129.5	19.4	-69.5	-56.1	0	0	0	117.9	Q257	Q257-Y979 VanDerWaalsContact CD-N 3.29Å; Q257-Y979 PolarHBondContact NE2-O 3.35Å; Q257-Y979 PolarHBondContact OE1-O 3.31Å; Q257-Y979 VanDerWaalsContact OE1-O 3.09Å
980	P	28.9	Very low	27.8	Very low	76 Å²	76	129.9 Å²	129.9	49%	0.494	70%	0.698	S	S	.	*				-138.4	-149.8	-60	36.3	-14.8	0	0	0	109
981	G	28	Very low	27.8	Very low	19 Å²	19	126.7 Å²	126.7	20%	0.196	69%	0.686	C	S	.	*				86.2	98.3	121	0	0	0	0	0	120.3	S274	S274-G981 WeakPolarHBondContact OG-CA 3.38Å; S274-G981 PolarHBondContact OG-N 2.93Å
982	S	30.2	Very low	27.7	Very low	36 Å²	36	127.3 Å²	127.3	25%	0.252	68%	0.682	S	S	.	*				143.9	139.2	81.5	61.6	0	0	0	0	117.4	K254 S274	K254-S982 WeakPolarHBondContact CD-O 3.4Å; K254-S982 WeakPolarHBondContact CE-O 3.3Å; K254-S982 PolarHBondContact NZ-O 3.34Å; S274-S982 VanDerWaalsContact CB-N 3.34Å; S274-S982 CarbonylContact O-C 3.49Å; S274-S982 WeakPolarHBondContact O-CA 3.35Å; S274-S982 PolarHBondContact O-N 2.96Å; S274-S982 PolarHBondContact OG-N 2.81Å
983	L	28.7	Very low	27.7	Very low	127 Å²	127	126.4 Å²	126.4	67%	0.665	68%	0.678	S	S	*	*			trans	61.4	135.3	146.8	-64.6	156.6	0	0	0	120.1	K254 S274	K254-L983 PolarHBondContact NZ-O 2.99Å; S274-L983 PolarHBondContact O-N 2.81Å
984	S	29.8	Very low	27.6	Very low	96 Å²	96	119.2 Å²	119.2	67%	0.671	66%	0.659	S	S	*	*			trans	-101.5	168.7	155.9	62.8	0	0	0	0	111.5
985	P	37.5	Very low	27.6	Very low	116 Å²	116	116.4 Å²	116.4	75%	0.753	64%	0.639	S	S	*	*			trans	-125.4	-173.8	-166.6	44.4	-31.5	0	0	0	114.3
986	Q	32.1	Very low	27.5	Very low	193 Å²	193	116 Å²	116	90%	0.902	63%	0.626	S	S	*	*			trans	-149.8	155.1	143.7	-97.5	160.5	30.8	0	0	106
987	G	31	Very low	27.5	Very low	70 Å²	70	108 Å²	108	72%	0.722	61%	0.605	S	S	*	*			cis	126	150	50	0	0	0	0	0	105.8
988	L	26.8	Very low	27.5	Very low	164 Å²	164	109.9 Å²	109.9	86%	0.859	61%	0.608	S	S	*	*			cis	-156.7	-168.4	7.9	-113.6	158	0	0	0	110.2
989	S	27.3	Very low	27.6	Very low	100 Å²	100	109.5 Å²	109.5	70%	0.699	61%	0.606	S	S	*	*			trans	-77.9	178.8	-179.3	57.1	0	0	0	0	114.2
990	E	25.8	Very low	27.7	Very low	160 Å²	160	108 Å²	108	75%	0.748	61%	0.605	S	S	*	*			cis	-149.8	-144.1	-2.1	-141.9	-162.6	146.4	0	0	109.1
991	Q	24.9	Very low	27.7	Very low	133 Å²	133	110.3 Å²	110.3	62%	0.621	61%	0.609	S	S	*	*			cis	-161.4	-178.8	1.7	-152.1	163.3	84.3	0	0	111.7
992	M	24.5	Very low	27.8	Very low	143 Å²	143	117.4 Å²	117.4	70%	0.704	64%	0.638	S	S	*	*			trans	77.9	99.4	149.8	-72.5	-162.5	-176.9	0	0	124
993	N	25.4	Very low	27.7	Very low	132 Å²	132	123.5 Å²	123.5	71%	0.706	66%	0.659	S	S	*	*				57.1	110.8	122.1	-72.5	-17	0	0	0	125	L1116	N993-L1116 WeakPolarHBondContact O-CD1 3.36Å
994	S	23.7	Very low	27.8	Very low	65 Å²	65	120.8 Å²	120.8	46%	0.455	66%	0.663	S	S	.	*			trans	87.3	174.4	139.7	71.2	0	0	0	0	119.9	K1115 L1116	S994-K1115 PolarHBondContact OG-O 2.91Å; S994-K1115 VanDerWaalsContact OG-O 3.09Å; S994-L1116 WeakPolarHBondContact O-CB 3.5Å; S994-L1116 WeakPolarHBondContact O-CD1 3.45Å; S994-L1116 WeakPolarHBondContact OG-CA 3.35Å; S994-L1116 VanDerWaalsContact OG-CB 3.3Å; S994-L1116 WeakPolarHBondContact OG-CB 3.4Å; S994-L1116 PolarHBondContact OG-N 3.16Å
995	K	25.1	Very low	27.8	Very low	110 Å²	110	121.7 Å²	121.7	48%	0.478	67%	0.669	S	S	.	*			trans	146.9	77.3	-150.9	-72.3	169.8	-161.1	151.7	0	119.6	P1114 K1115 L1116	K995-P1114 VanDerWaalsContact O-CG 3.29Å; K995-P1114 WeakPolarHBondContact O-CG 3.4Å; K995-K1115 HydrophobicContact CG-CG 3.69Å; K995-L1116 HydrophobicContact CB-CB 4.01Å; K995-L1116 HydrophobicContact CD-CB 4.08Å; K995-L1116 HydrophobicContact CD-CD2 3.87Å; K995-L1116 WeakPolarHBondContact CE-O 3.3Å; K995-L1116 HydrophobicContact CG-CB 3.86Å; K995-L1116 PolarHBondContact NZ-O 2.97Å
996	T	24.2	Very low	27.6	Very low	43 Å²	43	123.8 Å²	123.8	26%	0.264	67%	0.673	S	S	.	*			trans	-110.4	174.5	170.2	-20.2	0	0	0	0	112.7	P1114 K1115	T996-P1114 VanDerWaalsContact OG1-CA 3.24Å; T996-P1114 WeakPolarHBondContact OG1-CA 3.42Å; T996-P1114 VanDerWaalsContact OG1-CD 3.32Å; T996-P1114 WeakPolarHBondContact OG1-CD 3.14Å; T996-P1114 PolarHBondContact OG1-O 3.48Å; T996-K1115 PolarHBondContact O-NZ 3.11Å; T996-K1115 VanDerWaalsContact OG1-CB 3.3Å; T996-K1115 WeakPolarHBondContact OG1-CB 3.44Å; T996-K1115 PolarHBondContact OG1-N 2.82Å
997	T	25.3	Very low	27.6	Very low	86 Å²	86	119.7 Å²	119.7	53%	0.528	66%	0.661	S	S	.	*			trans	70.7	133.1	145.7	46.7	0	0	0	0	117.8	K1115	T997-K1115 WeakPolarHBondContact OG1-CD 3.41Å; T997-K1115 WeakPolarHBondContact OG1-CE 3.33Å; T997-K1115 PolarHBondContact OG1-NZ 2.73Å
998	D	25.5	Very low	27.6	Very low	129 Å²	129	125 Å²	125	69%	0.69	67%	0.665	S	S	*	*			cis	-172.4	-177.9	-14.9	-138.2	-36.1	0	0	0	112.4
999	I	27.3	Very low	28.3	Very low	114 Å²	114	125 Å²	125	59%	0.585	66%	0.66	S	S	*	*			trans	44.2	116.3	160	-23.7	112.6	0	0	0	119.6
1000	H	29	Very low	29.2	Very low	155 Å²	155	124.3 Å²	124.3	72%	0.718	65%	0.653	S	S	*	*				166.9	121	108.1	-85.7	-68.5	0	0	0	109
1001	E	28.7	Very low	29.8	Very low	125 Å²	125	126 Å²	126	58%	0.584	65%	0.653	S	S	*	*			cis	86.4	104.9	37.7	-170.2	-149.1	-176.6	0	0	113.8
1002	E	30.3	Very low	30.4	Very low	169 Å²	169	127.2 Å²	127.2	79%	0.79	66%	0.656	S	S	*	*			trans	-149.4	101.2	147.2	-161.2	150.9	-134.7	0	0	115.1
1003	K	28.4	Very low	31	Very low	163 Å²	163	127.8 Å²	127.8	71%	0.709	66%	0.661	S	S	*	*			trans	31.6	138.4	134.5	-59.9	160.4	-168.5	150.2	0	122.9
1004	G	32.2	Very low	31.5	Very low	71 Å²	71	127.4 Å²	127.4	73%	0.732	66%	0.663	S	S	*	*			trans	146.1	90.4	157.8	0	0	0	0	0	112.4
1005	S	29.7	Very low	32.1	Very low	114 Å²	114	129.7 Å²	129.7	80%	0.797	68%	0.679	S	S	*	*				56.5	122.8	74.2	-156.1	0	0	0	0	112.4
1006	L	31.6	Very low	32.9	Very low	160 Å²	160	128.4 Å²	128.4	84%	0.838	69%	0.689	S	S	*	*				-150.2	171.8	53.3	-166	61.7	0	0	0	114.4
1007	T	32.5	Very low	34	Very low	108 Å²	108	131 Å²	131	66%	0.663	70%	0.704	S	S	*	*			trans	-95.9	170.5	-158.7	50.6	0	0	0	0	118.2
1008	K	32.4	Very low	35.2	Very low	182 Å²	182	135.2 Å²	135.2	79%	0.791	72%	0.72	S	S	*	*			trans	115	144.7	147.3	-65.1	-173.9	176.7	-176	0	118.6
1009	E	41.5	Very low	36.5	Very low	162 Å²	162	137.9 Å²	137.9	76%	0.757	73%	0.726	S	S	*	*			cis	-162.7	176	-29.3	-111.7	-150.2	138.3	0	0	110
1010	P	45.3	Very low	37.8	Very low	86 Å²	86	135.2 Å²	135.2	56%	0.558	72%	0.717	S	S	*	*			trans	-116.9	-159.5	-149	44.9	-37.1	0	0	0	116.3
1011	W	38.9	Very low	39.2	Very low	195 Å²	195	131.8 Å²	131.8	74%	0.739	71%	0.707	S	S	*	*				173.8	116.5	111.3	-92.1	91.6	0	0	0	113.8
1012	F	36.6	Very low	40.8	Very low	159 Å²	159	131.3 Å²	131.3	70%	0.697	71%	0.708	S	S	*	*			trans	47.5	139.7	142.7	-75.3	-114.7	0	0	0	124.3
1013	I	38.4	Very low	42.5	Very low	156 Å²	156	132.3 Å²	132.3	80%	0.8	71%	0.705	S	S	*	*				-170.9	121.3	104.6	-95	166.7	0	0	0	114
1014	V	34.9	Very low	44.5	Very low	123 Å²	123	128.4 Å²	128.4	75%	0.745	69%	0.694	S	S	*	*			trans	41	136.7	142.9	-168	0	0	0	0	123.3
1015	S	35.4	Very low	46.4	Very low	113 Å²	113	129 Å²	129	79%	0.79	68%	0.683	S	S	*	*			trans	-76.9	131.8	170.5	53.6	0	0	0	0	115.7
1016	A	42.9	Very low	48.4	Very low	83 Å²	83	127.9 Å²	127.9	69%	0.686	67%	0.667	S	S	*	*			trans	-144.8	7.4	167.7	0	0	0	0	0	115.1	S1020	A1016-S1020 PolarHBondContact O-OG 3.32Å
1017	V	46.7	Very low	50.3	Low	98 Å²	98	122.7 Å²	122.7	59%	0.594	64%	0.644	S	S	*	*	H	α-helix	trans	-88.6	-26.6	-158.5	-175	0	0	0	0	114.4	F1019 S1020 V1021	V1017-F1019 PolarHBondContact O-N 2.79Å; V1017-S1020 WeakPolarHBondContact CA-OG 3.49Å; V1017-S1020 PolarHBondContact O-OG 3.44Å; V1017-V1021 HydrophobicContact CG1-CG2 4.14Å; V1017-V1021 WeakPolarHBondContact O-CG2 3.13Å
1018	M	51.9	Low	52.2	Low	175 Å²	175	121.7 Å²	121.7	86%	0.862	63%	0.634	S	S	*	*	H	α-helix	trans	-77.9	-17.6	-169.7	-67.7	-60.4	-69.7	0	0	115.8
1019	F	51.4	Low	54	Low	185 Å²	185	115.9 Å²	115.9	81%	0.811	62%	0.62	S	S	*	*	H	α-helix	trans	-103.9	-26.5	174.7	-94.6	-87.8	0	0	0	113.7	V1017	V1017-F1019 PolarHBondContact O-N 2.79Å
1020	S	55.3	Low	55.2	Low	57 Å²	57	113.8 Å²	113.8	40%	0.399	61%	0.614	S	S	.	*	H	α-helix	trans	-68.7	-36.6	178.4	42	0	0	0	0	112.3	A1016 V1017 L1022 W1023 V1024	A1016-S1020 PolarHBondContact O-OG 3.32Å; V1017-S1020 WeakPolarHBondContact CA-OG 3.49Å; V1017-S1020 PolarHBondContact O-OG 3.44Å; S1020-L1022 VanDerWaalsContact C-N 3.35Å; S1020-L1022 PolarHBondContact O-N 2.85Å; S1020-W1023 PolarHBondContact O-N 2.77Å; S1020-V1024 WeakPolarHBondContact O-CG2 3.29Å; S1020-V1024 PolarHBondContact O-N 3.47Å
1021	V	58.2	Low	56.2	Low	83 Å²	83	114.3 Å²	114.3	50%	0.503	61%	0.61	S	S	.	*	H	α-helix	trans	-59.4	-40.2	179.2	170.4	0	0	0	0	112.7	V1017 V1024 V1025	V1017-V1021 HydrophobicContact CG1-CG2 4.14Å; V1017-V1021 WeakPolarHBondContact O-CG2 3.13Å; V1021-V1024 PolarHBondContact O-N 2.59Å; V1021-V1025 WeakPolarHBondContact O-CG2 3.16Å; V1021-V1025 PolarHBondContact O-N 3.21Å
1022	L	61.6	Low	57.3	Low	116 Å²	116	110.5 Å²	110.5	61%	0.607	60%	0.604	S	S	*	*	H	α-helix	trans	-68	-39.9	-178.3	-165.8	69.2	0	0	0	112	S1020 V1025 I1026	S1020-L1022 VanDerWaalsContact C-N 3.35Å; S1020-L1022 PolarHBondContact O-N 2.85Å; L1022-V1025 PolarHBondContact O-N 2.9Å; L1022-I1026 WeakPolarHBondContact O-CG1 2.93Å; L1022-I1026 PolarHBondContact O-N 2.83Å
1023	W	65.9	Low	58.4	Low	190 Å²	190	112.6 Å²	112.6	72%	0.72	61%	0.608	S	S	*	*	H	α-helix	trans	-69.8	-37.2	175.8	-157.3	-82.7	0	0	0	111.9	S1020 V1025 I1026 C1027	S1020-W1023 PolarHBondContact O-N 2.77Å; W1023-V1025 PolarHBondContact O-N 2.85Å; W1023-I1026 PolarHBondContact O-N 3.11Å; W1023-C1027 WeakPolarHBondContact O-CB 3.41Å; W1023-C1027 PolarHBondContact O-N 3.5Å; W1023-C1027 PolarHBondContact O-SG 2.69Å
1024	V	71.1	Confident	59.2	Low	80 Å²	80	107.7 Å²	107.7	49%	0.485	60%	0.596	S	S	.	*	H	α-helix	trans	-61.8	-40.8	173.5	167.5	0	0	0	0	111.5	S1020 V1021 C1027 L1028	S1020-V1024 WeakPolarHBondContact O-CG2 3.29Å; S1020-V1024 PolarHBondContact O-N 3.47Å; V1021-V1024 PolarHBondContact O-N 2.59Å; V1024-C1027 PolarHBondContact O-N 2.89Å; V1024-L1028 HydrophobicContact CG1-CD1 3.77Å; V1024-L1028 HydrophobicContact CG1-CG 4.28Å; V1024-L1028 WeakPolarHBondContact O-CB 3.44Å; V1024-L1028 VanDerWaalsContact O-CG 3.26Å; V1024-L1028 WeakPolarHBondContact O-CG 3.33Å; V1024-L1028 PolarHBondContact O-N 2.8Å
1025	V	72	Confident	59.9	Low	83 Å²	83	109.9 Å²	109.9	50%	0.503	59%	0.591	S	S	.	*	H	α-helix	trans	-63	-41.7	175.6	169.1	0	0	0	0	111.8	V1021 L1022 W1023 L1028 A1029	V1021-V1025 WeakPolarHBondContact O-CG2 3.16Å; V1021-V1025 PolarHBondContact O-N 3.21Å; L1022-V1025 PolarHBondContact O-N 2.9Å; W1023-V1025 PolarHBondContact O-N 2.85Å; V1025-L1028 PolarHBondContact O-N 2.87Å; V1025-A1029 WeakPolarHBondContact O-CB 3.44Å; V1025-A1029 PolarHBondContact O-N 3.07Å
1026	I	72.6	Confident	60.5	Low	91 Å²	91	112.6 Å²	112.6	47%	0.467	59%	0.59	S	S	.	*	H	α-helix	trans	-67.4	-43.8	177.4	-65.8	168.9	0	0	0	111.2	L1022 W1023 L1028 A1029 L1030	L1022-I1026 WeakPolarHBondContact O-CG1 2.93Å; L1022-I1026 PolarHBondContact O-N 2.83Å; W1023-I1026 PolarHBondContact O-N 3.11Å; I1026-L1028 PolarHBondContact O-N 2.9Å; I1026-A1029 PolarHBondContact O-N 2.8Å; I1026-L1030 HydrophobicContact CG2-CD1 4.43Å; I1026-L1030 PolarHBondContact O-N 3.49Å; I1026-L1030 VanDerWaalsContact O-N 3.08Å
1027	C	71.5	Confident	60.6	Low	52 Å²	52	119.6 Å²	119.6	35%	0.351	60%	0.599	S	S	.	*	H	α-helix	trans	-62.3	-41.4	174.5	-74.8	0	0	0	0	112.3	W1023 V1024 L1030 I1031	W1023-C1027 WeakPolarHBondContact O-CB 3.41Å; W1023-C1027 PolarHBondContact O-N 3.5Å; W1023-C1027 PolarHBondContact O-SG 2.69Å; V1024-C1027 PolarHBondContact O-N 2.89Å; C1027-L1030 PolarHBondContact O-N 3.05Å; C1027-I1031 WeakPolarHBondContact O-CB 3.35Å; C1027-I1031 WeakPolarHBondContact O-CD1 3.2Å; C1027-I1031 VanDerWaalsContact O-CG1 3.24Å; C1027-I1031 WeakPolarHBondContact O-CG1 3.44Å; C1027-I1031 PolarHBondContact O-N 3.22Å
1028	L	71.3	Confident	60.5	Low	87 Å²	87	119 Å²	119	46%	0.455	60%	0.6	S	S	.	*	H	α-helix	trans	-64.3	-40.7	175.5	-75.6	170.6	0	0	0	111.9	V1024 V1025 I1026 L1030 I1031 I1032	V1024-L1028 HydrophobicContact CG1-CD1 3.77Å; V1024-L1028 HydrophobicContact CG1-CG 4.28Å; V1024-L1028 WeakPolarHBondContact O-CB 3.44Å; V1024-L1028 VanDerWaalsContact O-CG 3.26Å; V1024-L1028 WeakPolarHBondContact O-CG 3.33Å; V1024-L1028 PolarHBondContact O-N 2.8Å; V1025-L1028 PolarHBondContact O-N 2.87Å; I1026-L1028 PolarHBondContact O-N 2.9Å; L1028-L1030 VanDerWaalsContact C-N 3.35Å; L1028-L1030 PolarHBondContact O-N 2.92Å; L1028-I1031 PolarHBondContact O-N 2.93Å; L1028-I1032 WeakPolarHBondContact O-CB 3.27Å; L1028-I1032 WeakPolarHBondContact O-CD1 3.43Å; L1028-I1032 VanDerWaalsContact O-CG1 3.22Å; L1028-I1032 WeakPolarHBondContact O-CG1 3.29Å; L1028-I1032 PolarHBondContact O-N 2.93Å
1029	A	69.8	Low	60	Low	59 Å²	59	118 Å²	118	49%	0.488	59%	0.593	S	S	.	*	H	α-helix	trans	-59.3	-44.5	174.7	0	0	0	0	0	111.8	V1025 I1026 I1032 Y1033	V1025-A1029 WeakPolarHBondContact O-CB 3.44Å; V1025-A1029 PolarHBondContact O-N 3.07Å; I1026-A1029 PolarHBondContact O-N 2.8Å; A1029-I1032 PolarHBondContact O-N 3.14Å; A1029-Y1033 WeakPolarHBondContact O-CB 3.36Å; A1029-Y1033 PolarHBondContact O-N 3.3Å
1030	L	66.7	Low	59.5	Low	119 Å²	119	121 Å²	121	62%	0.623	60%	0.598	S	S	*	*	H	α-helix	trans	-68.8	-37.9	177	-69.2	173.1	0	0	0	112.9	I1026 C1027 L1028 Y1033 G1034	I1026-L1030 HydrophobicContact CG2-CD1 4.43Å; I1026-L1030 PolarHBondContact O-N 3.49Å; I1026-L1030 VanDerWaalsContact O-N 3.08Å; C1027-L1030 PolarHBondContact O-N 3.05Å; L1028-L1030 VanDerWaalsContact C-N 3.35Å; L1028-L1030 PolarHBondContact O-N 2.92Å; L1030-Y1033 PolarHBondContact O-N 3.27Å; L1030-G1034 PolarHBondContact O-N 3.11Å
1031	I	66.9	Low	58.6	Low	96 Å²	96	124.6 Å²	124.6	49%	0.492	61%	0.609	S	S	.	*	H	α-helix	trans	-65.2	-42.7	175	-71.5	164.8	0	0	0	110.8	C1027 L1028 G1034 R1035	C1027-I1031 WeakPolarHBondContact O-CB 3.35Å; C1027-I1031 WeakPolarHBondContact O-CD1 3.2Å; C1027-I1031 VanDerWaalsContact O-CG1 3.24Å; C1027-I1031 WeakPolarHBondContact O-CG1 3.44Å; C1027-I1031 PolarHBondContact O-N 3.22Å; L1028-I1031 PolarHBondContact O-N 2.93Å; I1031-G1034 PolarHBondContact O-N 3.16Å; I1031-R1035 VanDerWaalsContact O-CB 3.28Å; I1031-R1035 WeakPolarHBondContact O-CB 3.49Å; I1031-R1035 PolarHBondContact O-N 2.89Å
1032	I	62.7	Low	57.7	Low	116 Å²	116	132.1 Å²	132.1	60%	0.595	63%	0.628	S	S	*	*	H	α-helix	trans	-65.4	-42	177	-69.4	165	0	0	0	110.6	L1028 A1029 H1036	L1028-I1032 WeakPolarHBondContact O-CB 3.27Å; L1028-I1032 WeakPolarHBondContact O-CD1 3.43Å; L1028-I1032 VanDerWaalsContact O-CG1 3.22Å; L1028-I1032 WeakPolarHBondContact O-CG1 3.29Å; L1028-I1032 PolarHBondContact O-N 2.93Å; A1029-I1032 PolarHBondContact O-N 3.14Å; I1032-H1036 PolarHBondContact O-N 2.91Å
1033	Y	59.8	Low	56.5	Low	203 Å²	203	135.2 Å²	135.2	80%	0.796	63%	0.632	S	S	*	*	H	α-helix	trans	-65	-41	176.3	-160.1	-98.7	0	0	0	112.4	A1029 L1030	A1029-Y1033 WeakPolarHBondContact O-CB 3.36Å; A1029-Y1033 PolarHBondContact O-N 3.3Å; L1030-Y1033 PolarHBondContact O-N 3.27Å
1034	G	54.7	Low	54.9	Low	52 Å²	52	136.7 Å²	136.7	54%	0.536	64%	0.637	S	S	.	*	H	α-helix	trans	-70.8	-37.9	178.5	0	0	0	0	0	114.2	L1030 I1031 H1036	L1030-G1034 PolarHBondContact O-N 3.11Å; I1031-G1034 PolarHBondContact O-N 3.16Å; G1034-H1036 VanDerWaalsContact C-N 3.3Å; G1034-H1036 PolarHBondContact O-N 2.71Å
1035	R	50.2	Low	53.1	Low	170 Å²	170	141.3 Å²	141.3	64%	0.642	65%	0.653	S	S	*	*	H	α-helix	trans	-75.2	-17.2	-176.5	-154	167.2	-172.2	156.3	1.7	113.3	I1031 R1037	I1031-R1035 VanDerWaalsContact O-CB 3.28Å; I1031-R1035 WeakPolarHBondContact O-CB 3.49Å; I1031-R1035 PolarHBondContact O-N 2.89Å; R1035-R1037 PolarHBondContact O-N 3.36Å
1036	H	46.8	Very low	51.3	Low	169 Å²	169	142.3 Å²	142.3	78%	0.782	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	8.9	-178.1	-152.4	-67	0	0	0	115.1	I1032 G1034	I1032-H1036 PolarHBondContact O-N 2.91Å; G1034-H1036 VanDerWaalsContact C-N 3.3Å; G1034-H1036 PolarHBondContact O-N 2.71Å
1037	R	45.7	Very low	49.3	Very low	231 Å²	231	143.4 Å²	143.4	87%	0.872	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	-10.6	-173.3	-158.1	166.5	179.8	165.2	-1	116.4	R1035	R1035-R1037 PolarHBondContact O-N 3.36Å
1038	S	43.5	Very low	47.3	Very low	86 Å²	86	148 Å²	148	60%	0.601	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	-20	-168.1	57.1	0	0	0	0	117.5
1039	E	42.1	Very low	45.5	Very low	153 Å²	153	150.1 Å²	150.1	72%	0.715	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-88.8	-6.6	-177.4	-77.8	174.1	164.1	0	0	114.6	Q1041	E1039-Q1041 PolarHBondContact O-N 3.45Å; E1039-Q1041 VanDerWaalsContact O-N 3.09Å
1040	R	40.8	Very low	43.8	Very low	247 Å²	247	152.2 Å²	152.2	93%	0.932	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-74.4	3	-177.5	-141.4	175.7	-168.5	177.9	3.8	115
1041	Q	36.6	Very low	42.3	Very low	133 Å²	133	153.5 Å²	153.5	62%	0.621	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-143.4	15.6	-172.2	-102.6	-172.5	-8.4	0	0	118.5	E1039 R1043	E1039-Q1041 PolarHBondContact O-N 3.45Å; E1039-Q1041 VanDerWaalsContact O-N 3.09Å; Q1041-R1043 WeakPolarHBondContact O-CB 3.33Å; Q1041-R1043 VanDerWaalsContact O-CD 3.23Å; Q1041-R1043 WeakPolarHBondContact O-CD 3.15Å; Q1041-R1043 WeakPolarHBondContact O-CG 3.23Å
1042	R	40.6	Very low	40.9	Very low	242 Å²	242	156.3 Å²	156.3	91%	0.913	74%	0.74	S	S	*	*			trans	-95.2	77.1	151.8	-71.8	-177.2	177.5	178.6	-1	107.4
1043	R	35.1	Very low	39.6	Very low	180 Å²	180	154.9 Å²	154.9	68%	0.679	75%	0.745	S	S	*	*				43.9	102.8	76.9	-68.5	176.9	-165.9	-147.1	6.6	110.4	Q1041	Q1041-R1043 WeakPolarHBondContact O-CB 3.33Å; Q1041-R1043 VanDerWaalsContact O-CD 3.23Å; Q1041-R1043 WeakPolarHBondContact O-CD 3.15Å; Q1041-R1043 WeakPolarHBondContact O-CG 3.23Å
1044	R	33.4	Very low	38.5	Very low	222 Å²	222	152.2 Å²	152.2	84%	0.838	74%	0.74	S	S	*	*				73.3	127.2	76.4	-74.6	-177.7	178.4	-177.3	-1.5	112.5
1045	H	31.9	Very low	37.6	Very low	177 Å²	177	156.4 Å²	156.4	82%	0.819	75%	0.749	S	S	*	*			trans	87.2	79	174.5	-46	109.3	0	0	0	117.9
1046	A	34.3	Very low	36.9	Very low	103 Å²	103	154.6 Å²	154.6	85%	0.851	75%	0.75	S	S	*	*			trans	-158.9	150	143.9	0	0	0	0	0	108.9
1047	V	31.3	Very low	36.4	Very low	114 Å²	114	150.2 Å²	150.2	69%	0.691	74%	0.744	S	S	*	*				-164.9	132.7	-94.6	149.5	0	0	0	0	108.8
1048	L	28.3	Very low	36	Very low	148 Å²	148	148.9 Å²	148.9	78%	0.775	74%	0.744	S	S	*	*			trans	62.2	140.1	175.6	-63.6	160.3	0	0	0	114.8
1049	D	34.2	Very low	35.6	Very low	133 Å²	133	152.8 Å²	152.8	71%	0.711	76%	0.759	S	S	*	*			cis	-152.9	-162.7	-4.6	-137	-5	0	0	0	108
1050	V	35.2	Very low	35.3	Very low	102 Å²	102	149.2 Å²	149.2	62%	0.618	76%	0.763	S	S	*	*			cis	-157.2	164.3	12.3	84	0	0	0	0	111.5
1051	M	34.9	Very low	35	Very low	146 Å²	146	149.4 Å²	149.4	72%	0.719	76%	0.763	S	S	*	*			trans	11.8	127.1	152.2	-69.5	159.3	-157.6	0	0	121
1052	D	36.2	Very low	34.7	Very low	155 Å²	155	151 Å²	151	83%	0.829	78%	0.775	S	S	*	*				90	140.2	57.2	-77.6	-45.3	0	0	0	113.4
1053	A	36.7	Very low	34.3	Very low	86 Å²	86	143 Å²	143	71%	0.711	77%	0.768	S	S	*	*			cis	-157.4	-172.6	-5.7	0	0	0	0	0	108.6
1054	E	35.9	Very low	34.1	Very low	148 Å²	148	140.5 Å²	140.5	69%	0.692	77%	0.773	S	S	*	*			cis	-138.7	-127	2.9	-151.7	-145.5	120.8	0	0	110.2	I1056	E1054-I1056 WeakPolarHBondContact OE1-CG1 3.03Å; E1054-I1056 PolarHBondContact OE1-N 3.36Å
1055	I	35.3	Very low	34.2	Very low	139 Å²	139	136.9 Å²	136.9	71%	0.713	78%	0.775	S	S	*	*			cis	-147	146.5	4.8	-155.8	172.9	0	0	0	114.3
1056	I	35.7	Very low	34.1	Very low	132 Å²	132	135.1 Å²	135.1	68%	0.677	77%	0.771	S	S	*	*			trans	-6.2	125.1	155.9	-52.6	-174.3	0	0	0	115.4	E1054	E1054-I1056 WeakPolarHBondContact OE1-CG1 3.03Å; E1054-I1056 PolarHBondContact OE1-N 3.36Å
1057	A	37.3	Very low	33.9	Very low	78 Å²	78	135.2 Å²	135.2	65%	0.645	77%	0.766	S	S	*	*			cis	-155.8	-168.7	14.1	0	0	0	0	0	111.1
1058	K	36	Very low	33.9	Very low	203 Å²	203	135.1 Å²	135.1	88%	0.883	77%	0.766	S	S	*	*			cis	-155	-173.3	3.2	-140.7	161.4	-167.1	176.4	0	109.7
1059	N	36	Very low	33.9	Very low	168 Å²	168	137.1 Å²	137.1	90%	0.898	77%	0.771	S	S	*	*			trans	-127.6	153.1	-167.8	-74.9	-38.9	0	0	0	116.6
1060	G	36	Very low	33.8	Very low	78 Å²	78	133.9 Å²	133.9	80%	0.804	77%	0.769	S	S	*	*			trans	128.8	138.6	149.6	0	0	0	0	0	115.9
1061	R	34.7	Very low	33.6	Very low	250 Å²	250	138.7 Å²	138.7	94%	0.943	79%	0.785	S	S	*	*			cis	-162	156.3	-7.7	-160.3	174.4	-170.6	163.8	1.7	110.1
1062	L	29.1	Very low	33.4	Very low	166 Å²	166	135.2 Å²	135.2	87%	0.869	79%	0.786	S	S	*	*			trans	-75.8	158.3	175	-77	79.9	0	0	0	113.2
1063	G	33.7	Very low	33.3	Very low	74 Å²	74	134.6 Å²	134.6	76%	0.763	79%	0.789	S	S	*	*			trans	-158.8	127.8	158.1	0	0	0	0	0	111.4
1064	V	30.4	Very low	33.1	Very low	129 Å²	129	134.6 Å²	134.6	78%	0.782	79%	0.788	S	S	*	*			trans	-136.7	122.9	178.1	174.7	0	0	0	0	109
1065	V	35.5	Very low	32.9	Very low	145 Å²	145	133 Å²	133	88%	0.879	79%	0.794	S	S	*	*			trans	-144.8	150.7	168	-175.6	0	0	0	0	108.7
1066	N	30.2	Very low	32.9	Very low	140 Å²	140	131.1 Å²	131.1	75%	0.749	79%	0.79	S	S	*	*			trans	-90	165	-174.7	-78.3	-32.5	0	0	0	114.6
1067	S	29.2	Very low	32.8	Very low	106 Å²	106	131.1 Å²	131.1	74%	0.741	80%	0.799	S	S	*	*			trans	89.5	152.2	137.8	68.5	0	0	0	0	122.4
1068	T	30.9	Very low	32.7	Very low	111 Å²	111	134.6 Å²	134.6	68%	0.681	81%	0.805	S	S	*	*			trans	68.7	104.9	162.4	51	0	0	0	0	122.1
1069	Q	29.4	Very low	32.3	Very low	191 Å²	191	135.2 Å²	135.2	89%	0.893	80%	0.803	S	S	*	*				72.4	156.3	129.4	-65.5	170.9	-62.6	0	0	120.9
1070	G	31.3	Very low	31.9	Very low	64 Å²	64	136 Å²	136	66%	0.66	80%	0.804	S	S	*	*			trans	94.3	84.3	-170.1	0	0	0	0	0	111.7
1071	E	31.1	Very low	31.6	Very low	203 Å²	203	135.9 Å²	135.9	95%	0.949	80%	0.803	S	S	*	*				66.4	118.5	74.8	-60.9	-167.4	133	0	0	114.1
1072	G	31.8	Very low	31.3	Very low	73 Å²	73	131.1 Å²	131.1	75%	0.753	80%	0.796	S	S	*	*			trans	155.6	73.7	-178.2	0	0	0	0	0	115.7
1073	T	32.6	Very low	31.4	Very low	143 Å²	143	133 Å²	133	88%	0.877	80%	0.798	S	S	*	*			trans	-16.7	151.4	159.7	52.7	0	0	0	0	118.8
1074	A	33.6	Very low	31	Very low	85 Å²	85	133.2 Å²	133.2	70%	0.702	79%	0.787	S	S	*	*			cis	-167	144.8	-9.5	0	0	0	0	0	106.5
1075	S	30.8	Very low	30.8	Very low	116 Å²	116	133 Å²	133	81%	0.811	79%	0.786	S	S	*	*				84.3	153.3	53.3	-44.8	0	0	0	0	113.3
1076	P	35.1	Very low	30.4	Very low	98 Å²	98	130.9 Å²	130.9	64%	0.636	78%	0.778	S	S	*	*				-132.5	179	-99	28.5	-4.9	0	0	0	115.2
1077	P	34.5	Very low	30.3	Very low	132 Å²	132	129.9 Å²	129.9	86%	0.857	78%	0.777	S	S	*	*			trans	-72.6	133	171.8	29.7	-35.7	0	0	0	112.8
1078	I	34	Very low	30.2	Very low	151 Å²	151	132 Å²	132	77%	0.774	78%	0.775	S	S	*	*			trans	-137.3	153.8	177.8	-64	-175	0	0	0	111.2
1079	Y	28	Very low	30.2	Very low	217 Å²	217	133 Å²	133	85%	0.851	77%	0.77	S	S	*	*			trans	-92.1	176.3	-171.6	-119.8	-108.8	0	0	0	114.2
1080	M	27	Very low	30.3	Very low	184 Å²	184	131.8 Å²	131.8	91%	0.906	77%	0.765	S	S	*	*			trans	86.7	139.8	163.9	-55.9	-167.6	-86.3	0	0	118.6
1081	G	30.2	Very low	30.3	Very low	76 Å²	76	132.4 Å²	132.4	78%	0.784	76%	0.764	S	S	*	*			trans	161.5	53.8	177.3	0	0	0	0	0	115.3
1082	N	28.6	Very low	30.2	Very low	150 Å²	150	129.3 Å²	129.3	80%	0.802	76%	0.758	S	S	*	*			trans	-78.4	128.6	176.6	-81.9	-11.5	0	0	0	112.4
1083	F	30.6	Very low	30.2	Very low	206 Å²	206	130.5 Å²	130.5	90%	0.904	76%	0.756	S	S	*	*			trans	-151.7	104	144.1	-88.5	-76.5	0	0	0	106.1
1084	S	26.9	Very low	30	Very low	77 Å²	77	131.1 Å²	131.1	54%	0.538	75%	0.753	S	S	.	*			cis	74.7	89.9	36.4	92.8	0	0	0	0	115.4
1085	T	26.5	Very low	30	Very low	125 Å²	125	133.9 Å²	133.9	77%	0.767	75%	0.754	S	S	*	*			trans	74.7	144.2	135	57.8	0	0	0	0	122
1086	S	26.9	Very low	29.8	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	75%	0.75	S	S	*	*			trans	82.4	142	146.1	86.6	0	0	0	0	117.3
1087	T	27	Very low	29.6	Very low	119 Å²	119	137.4 Å²	137.4	73%	0.73	76%	0.763	S	S	*	*			cis	-166.5	173	-14.5	11.2	0	0	0	0	109.1
1088	E	28.4	Very low	29.4	Very low	149 Å²	149	139.8 Å²	139.8	70%	0.696	76%	0.762	S	S	*	*			trans	70	152.2	158.5	-72.5	-179.3	169.8	0	0	116.5
1089	K	30.8	Very low	29.4	Very low	133 Å²	133	138.5 Å²	138.5	58%	0.578	76%	0.764	S	S	*	*			cis	-151.4	149.1	2.7	-127.9	160.8	-173.5	143	0	112.5
1090	E	30.7	Very low	29.5	Very low	166 Å²	166	136.9 Å²	136.9	78%	0.776	77%	0.769	S	S	*	*			trans	36.7	143.9	134.1	-71.6	164.5	-177.5	0	0	121.7
1091	A	30.2	Very low	29.5	Very low	77 Å²	77	133.2 Å²	133.2	64%	0.636	76%	0.761	S	S	*	*			cis	-168	-179.2	-5.1	0	0	0	0	0	112
1092	T	30.7	Very low	29.5	Very low	137 Å²	137	136.4 Å²	136.4	84%	0.84	77%	0.765	S	S	*	*			trans	71.8	144.3	164.5	64.4	0	0	0	0	119.2
1093	S	30.2	Very low	29.4	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	77%	0.769	S	S	*	*			cis	177.4	139.7	-42.2	43.8	0	0	0	0	110
1094	L	30.4	Very low	29.5	Very low	156 Å²	156	132.3 Å²	132.3	82%	0.817	77%	0.768	S	S	*	*			trans	179.3	115.7	141.3	-99.4	162.4	0	0	0	111.8
1095	I	33.4	Very low	29.4	Very low	142 Å²	142	133.7 Å²	133.7	73%	0.728	78%	0.777	S	S	*	*			trans	32.2	120.2	147.4	-54	168.5	0	0	0	118.7
1096	S	26.1	Very low	29.4	Very low	103 Å²	103	136.4 Å²	136.4	72%	0.72	78%	0.784	S	S	*	*			cis	101.3	108.9	14	86	0	0	0	0	118.2
1097	M	31.5	Very low	29.5	Very low	186 Å²	186	139.9 Å²	139.9	92%	0.916	79%	0.792	S	S	*	*			trans	-164.3	93.5	147.9	-102.1	177.4	-179.2	0	0	106.6
1098	E	30.3	Very low	29.5	Very low	181 Å²	181	138.7 Å²	138.7	85%	0.846	79%	0.789	S	S	*	*				88.8	105.2	77.9	-161	171.4	-118.1	0	0	113.3
1099	P	32.3	Very low	29.4	Very low	125 Å²	125	137 Å²	137	81%	0.812	78%	0.784	S	S	*	*			trans	-104.7	159.5	176.7	38.7	-32.1	0	0	0	113
1100	L	30.9	Very low	29.3	Very low	182 Å²	182	140.5 Å²	140.5	95%	0.953	79%	0.794	S	S	*	*			trans	-124.6	138	173.6	-88.6	169.8	0	0	0	113.5
1101	S	26.3	Very low	29.2	Very low	107 Å²	107	138.7 Å²	138.7	75%	0.748	79%	0.79	S	S	*	*			trans	-116.8	145.9	-178.7	59.9	0	0	0	0	111.8
1102	V	30.6	Very low	29.2	Very low	143 Å²	143	143 Å²	143	87%	0.867	80%	0.796	S	S	*	*			trans	-135.1	128.2	163.3	-176.8	0	0	0	0	110.2
1103	N	27.6	Very low	29.1	Very low	166 Å²	166	140.5 Å²	140.5	89%	0.888	79%	0.789	S	S	*	*			trans	-95	145.4	169.6	-82.5	-37.7	0	0	0	110.5
1104	A	31.4	Very low	29.5	Very low	105 Å²	105	139.3 Å²	139.3	87%	0.868	78%	0.78	S	S	*	*			trans	-153.7	158.8	160.2	0	0	0	0	0	110.8
1105	S	26.3	Very low	29.6	Very low	106 Å²	106	137.2 Å²	137.2	74%	0.741	76%	0.764	S	S	*	*			trans	-147.4	144.3	-164.9	60.5	0	0	0	0	115
1106	M	25.2	Very low	29.6	Very low	182 Å²	182	133.4 Å²	133.4	90%	0.897	75%	0.745	S	S	*	*			trans	65.8	169.4	154.6	-70.4	-171.7	166.4	0	0	119.8
1107	I	29.3	Very low	30.1	Very low	174 Å²	174	134.3 Å²	134.3	89%	0.892	75%	0.749	S	S	*	*			trans	85.3	159.7	170.6	-52	-177	0	0	0	114.6
1108	S	26.7	Very low	30.3	Very low	93 Å²	93	131.1 Å²	131.1	65%	0.65	74%	0.736	S	S	*	*			trans	-121.3	-177.4	-148.1	62.2	0	0	0	0	115.7
1109	D	27.4	Very low	30.6	Very low	113 Å²	113	128.3 Å²	128.3	60%	0.604	73%	0.733	S	S	*	*			trans	85.2	117.2	159.3	-75.2	-88.9	0	0	0	121.1
1110	R	28.8	Very low	30.6	Very low	207 Å²	207	127.2 Å²	127.2	78%	0.781	73%	0.725	S	S	*	*			trans	67.7	122.3	131.4	-64.2	173.1	-169	-138.7	-5.3	121.9
1111	N	28	Very low	30.8	Very low	128 Å²	128	128.2 Å²	128.2	68%	0.684	72%	0.722	S	S	*	*			trans	88.9	116.4	132.3	-68.2	-14	0	0	0	122.7
1112	H	29.4	Very low	31	Very low	168 Å²	168	126.4 Å²	126.4	78%	0.778	72%	0.72	S	S	*	*				71.6	98.3	129.6	-67.8	72.2	0	0	0	123.4
1113	A	29.7	Very low	31	Very low	84 Å²	84	126.6 Å²	126.6	69%	0.694	71%	0.712	S	S	*	*				79	165.6	119.1	0	0	0	0	0	122.2
1114	P	38.2	Very low	31	Very low	75 Å²	75	126.8 Å²	126.8	49%	0.487	70%	0.704	S	S	.	*				-100.9	-126.7	-126.6	-7.2	32.3	0	0	0	122.3	K995 T996	K995-P1114 VanDerWaalsContact O-CG 3.29Å; K995-P1114 WeakPolarHBondContact O-CG 3.4Å; T996-P1114 VanDerWaalsContact OG1-CA 3.24Å; T996-P1114 WeakPolarHBondContact OG1-CA 3.42Å; T996-P1114 VanDerWaalsContact OG1-CD 3.32Å; T996-P1114 WeakPolarHBondContact OG1-CD 3.14Å; T996-P1114 PolarHBondContact OG1-O 3.48Å
1115	K	33.1	Very low	30.9	Very low	112 Å²	112	126.2 Å²	126.2	49%	0.487	69%	0.694	S	S	.	*			trans	144	64.1	-172.8	-87.3	-175.3	169.1	86.9	0	124.4	S994 K995 T996 T997	S994-K1115 PolarHBondContact OG-O 2.91Å; S994-K1115 VanDerWaalsContact OG-O 3.09Å; K995-K1115 HydrophobicContact CG-CG 3.69Å; T996-K1115 PolarHBondContact O-NZ 3.11Å; T996-K1115 VanDerWaalsContact OG1-CB 3.3Å; T996-K1115 WeakPolarHBondContact OG1-CB 3.44Å; T996-K1115 PolarHBondContact OG1-N 2.82Å; T997-K1115 WeakPolarHBondContact OG1-CD 3.41Å; T997-K1115 WeakPolarHBondContact OG1-CE 3.33Å; T997-K1115 PolarHBondContact OG1-NZ 2.73Å
1116	L	33.4	Very low	31.1	Very low	62 Å²	62	132 Å²	132	33%	0.325	70%	0.701	S	S	.	*			trans	-90.3	152.6	-177.5	169	159.5	0	0	0	118.7	N993 S994 K995	N993-L1116 WeakPolarHBondContact O-CD1 3.36Å; S994-L1116 WeakPolarHBondContact O-CB 3.5Å; S994-L1116 WeakPolarHBondContact O-CD1 3.45Å; S994-L1116 WeakPolarHBondContact OG-CA 3.35Å; S994-L1116 VanDerWaalsContact OG-CB 3.3Å; S994-L1116 WeakPolarHBondContact OG-CB 3.4Å; S994-L1116 PolarHBondContact OG-N 3.16Å; K995-L1116 HydrophobicContact CB-CB 4.01Å; K995-L1116 HydrophobicContact CD-CB 4.08Å; K995-L1116 HydrophobicContact CD-CD2 3.87Å; K995-L1116 WeakPolarHBondContact CE-O 3.3Å; K995-L1116 HydrophobicContact CG-CB 3.86Å; K995-L1116 PolarHBondContact NZ-O 2.97Å
1117	C	36.3	Very low	31.4	Very low	121 Å²	121	126.1 Å²	126.1	82%	0.818	69%	0.687	S	S	*	*			trans	-106.4	164.9	173.7	-76.2	0	0	0	0	115.3
1118	D	34.4	Very low	31.7	Very low	120 Å²	120	125.2 Å²	125.2	64%	0.642	68%	0.684	S	S	*	*			trans	-126.5	164	-166.4	-175.1	50.3	0	0	0	110.9
1119	P	36.9	Very low	31.8	Very low	121 Å²	121	124 Å²	124	79%	0.786	69%	0.686	S	S	*	*				-149.1	165.8	110.8	38.7	-22.1	0	0	0	117.5
1120	T	33.7	Very low	32	Very low	103 Å²	103	127 Å²	127	63%	0.632	69%	0.694	S	S	*	*			trans	-83.4	149.7	-171.3	51.4	0	0	0	0	116.6
1121	F	34.6	Very low	31.8	Very low	202 Å²	202	122.6 Å²	122.6	89%	0.886	69%	0.69	S	S	*	*				179.4	121.7	105	-115.8	-86	0	0	0	115.1
1122	G	30.6	Very low	31.6	Very low	69 Å²	69	121.6 Å²	121.6	71%	0.711	69%	0.692	S	S	*	*			trans	61.8	147.7	143.3	0	0	0	0	0	122.7
1123	E	30.5	Very low	31.4	Very low	148 Å²	148	118.8 Å²	118.8	69%	0.692	69%	0.691	S	S	*	*			cis	-164.1	136.6	-17.7	-132.1	-159.1	-178.6	0	0	111.4
1124	K	28.2	Very low	31.2	Very low	170 Å²	170	122.2 Å²	122.2	74%	0.739	70%	0.695	S	S	*	*			trans	64.4	156.9	156.5	-69.7	165.9	-169.4	150.3	0	117.4
1125	S	29	Very low	30.6	Very low	92 Å²	92	125.8 Å²	125.8	64%	0.643	71%	0.71	S	S	*	*			cis	-160.1	137.1	2.5	130.3	0	0	0	0	111.9
1126	Y	30.6	Very low	30.9	Very low	228 Å²	228	125.9 Å²	125.9	89%	0.894	72%	0.722	S	S	*	*			trans	46.5	143.1	150.5	-66.4	-101.5	0	0	0	121.6
1127	G	31.3	Very low	30.5	Very low	59 Å²	59	128.7 Å²	128.7	61%	0.608	75%	0.747	S	S	*	*			cis	165.8	174.8	-3.5	0	0	0	0	0	114
1128	N	35.2	Very low	30	Very low	154 Å²	154	133.6 Å²	133.6	82%	0.824	75%	0.75	S	S	*	*			trans	70	141.5	175.7	-48.6	-26.7	0	0	0	115.5
1129	G	29.6	Very low	29.5	Very low	67 Å²	67	133 Å²	133	69%	0.691	76%	0.755	S	S	*	*			cis	111.2	132.2	15.2	0	0	0	0	0	109.5
1130	F	30.4	Very low	28.9	Very low	178 Å²	178	133.2 Å²	133.2	78%	0.781	75%	0.754	S	S	*	*			cis	-168	143.7	41.4	-100.9	-98	0	0	0	112.9
1131	T	25.7	Very low	28.5	Very low	113 Å²	113	132.8 Å²	132.8	69%	0.693	76%	0.755	S	S	*	*			trans	35.8	160.8	134	65.2	0	0	0	0	124.2
1132	C	23.7	Very low	28	Very low	107 Å²	107	131.4 Å²	131.4	72%	0.723	75%	0.753	S	S	*	*			cis	-177.8	166.9	-20.4	-94.8	0	0	0	0	110.6
1133	S	24.9	Very low	27.9	Very low	109 Å²	109	131.5 Å²	131.5	76%	0.762	75%	0.748	S	S	*	*			trans	76.6	157.8	150.8	96.9	0	0	0	0	117.9
1134	M	25.4	Very low	27.7	Very low	156 Å²	156	131.9 Å²	131.9	77%	0.768	75%	0.754	S	S	*	*			cis	-151.1	156.9	-9.5	-78.3	-154.3	-176.9	0	0	112.1
1135	N	26	Very low	27.6	Very low	151 Å²	151	127 Å²	127	81%	0.807	75%	0.752	S	S	*	*			trans	60.3	164.4	142.7	-76.9	-14.5	0	0	0	124
1136	P	37.9	Very low	27.6	Very low	114 Å²	114	132.8 Å²	132.8	74%	0.74	77%	0.766	S	S	*	*			trans	-121.7	148.4	-168.5	40.2	-26.4	0	0	0	116.8
1137	S	25.5	Very low	27.3	Very low	120 Å²	120	126.3 Å²	126.3	84%	0.839	75%	0.754	S	S	*	*			trans	-171.7	167.9	155.8	50.7	0	0	0	0	114.4
1138	Y	26.2	Very low	27	Very low	224 Å²	224	130.9 Å²	130.9	88%	0.878	76%	0.764	S	S	*	*			trans	-60	160.3	173	-57.1	-107	0	0	0	111.8
1139	S	24.9	Very low	26.5	Very low	108 Å²	108	128.6 Å²	128.6	76%	0.755	76%	0.756	S	S	*	*				178.1	156.3	56.3	51.5	0	0	0	0	115.6
1140	V	23.6	Very low	26.3	Very low	125 Å²	125	131.7 Å²	131.7	76%	0.758	76%	0.756	S	S	*	*			trans	34.9	108	136.6	-171	0	0	0	0	123.1
1141	S	24.8	Very low	26.1	Very low	95 Å²	95	130.6 Å²	130.6	66%	0.664	76%	0.758	S	S	*	*			trans	67.1	168	144.6	85.4	0	0	0	0	119.3
1142	M	25	Very low	26.2	Very low	172 Å²	172	129.2 Å²	129.2	85%	0.847	77%	0.767	S	S	*	*			cis	-151	-179.5	-1.1	-144.2	177.9	-64.4	0	0	111.6
1143	A	27.7	Very low	26.3	Very low	72 Å²	72	129 Å²	129	60%	0.595	77%	0.766	S	S	*	*			trans	-65.6	168	-177.2	0	0	0	0	0	114.9
1144	N	27.2	Very low	26.3	Very low	155 Å²	155	130.6 Å²	130.6	83%	0.829	77%	0.766	S	S	*	*				-176.2	159.2	68.8	-83.9	-66.5	0	0	0	114.2
1145	G	26.1	Very low	26.3	Very low	67 Å²	67	131 Å²	131	69%	0.691	77%	0.766	S	S	*	*			trans	78.8	153	154.5	0	0	0	0	0	116.8
1146	F	27.1	Very low	26.2	Very low	215 Å²	215	128.5 Å²	128.5	94%	0.943	76%	0.76	S	S	*	*			cis	-133.9	169.9	4.9	-104	-96.8	0	0	0	112.2
1147	S	25.6	Very low	25.7	Very low	91 Å²	91	129.3 Å²	129.3	64%	0.636	76%	0.762	S	S	*	*			trans	-128.8	168.5	178.3	63	0	0	0	0	110.5
1148	L	24.3	Very low	25.8	Very low	155 Å²	155	128.5 Å²	128.5	81%	0.812	76%	0.755	S	S	*	*			trans	71.5	152.1	173.1	-50.9	164.3	0	0	0	113
1149	T	25.4	Very low	25.8	Very low	107 Å²	107	123.4 Å²	123.4	66%	0.656	75%	0.747	S	S	*	*			cis	-159.1	160.1	-1.3	-0.2	0	0	0	0	111.4
1150	N	24.7	Very low	25.9	Very low	132 Å²	132	128.9 Å²	128.9	71%	0.706	75%	0.753	S	S	*	*			trans	40.5	132.8	144.1	-66	-3.6	0	0	0	123.2
1151	N	26.8	Very low	26	Very low	154 Å²	154	129.5 Å²	129.5	82%	0.824	75%	0.751	S	S	*	*			trans	61.6	104.8	136.1	-57.8	-6.6	0	0	0	119.7
1152	G	26.7	Very low	26.2	Very low	84 Å²	84	130.9 Å²	130.9	87%	0.866	76%	0.758	S	S	*	*			trans	-141.9	90.6	158	0	0	0	0	0	109.6
1153	S	27.2	Very low	26.3	Very low	102 Å²	102	130.6 Å²	130.6	71%	0.713	75%	0.754	S	S	*	*			trans	-90.4	-176.7	-176.7	53.1	0	0	0	0	112.4
1154	L	25	Very low	26.5	Very low	143 Å²	143	137 Å²	137	75%	0.749	77%	0.765	S	S	*	*			trans	81.7	141.6	174.5	-46.5	165.5	0	0	0	113.6
1155	Q	24	Very low	26.8	Very low	166 Å²	166	135.6 Å²	135.6	78%	0.776	76%	0.763	S	S	*	*			cis	-151	164.1	-1.4	-132	158.1	-10.1	0	0	113.6
1156	S	24.4	Very low	27.4	Very low	98 Å²	98	138 Å²	138	69%	0.685	77%	0.767	S	S	*	*			trans	-66.4	-174.6	175.6	48.8	0	0	0	0	115.3
1157	V	27	Very low	27.6	Very low	130 Å²	130	131.1 Å²	131.1	79%	0.788	76%	0.757	S	S	*	*			trans	103.4	129.5	160.4	179.2	0	0	0	0	115.1
1158	P	28.3	Very low	27.8	Very low	104 Å²	104	134.6 Å²	134.6	68%	0.675	77%	0.768	S	S	*	*			cis	-141	179.4	-26	38.9	-19.6	0	0	0	115.8
1159	T	25.3	Very low	28.5	Very low	117 Å²	117	132.4 Å²	132.4	72%	0.718	76%	0.764	S	S	*	*			trans	-38	144	152.4	-35.4	0	0	0	0	115
1160	Y	27.3	Very low	28.6	Very low	223 Å²	223	133 Å²	133	88%	0.875	77%	0.767	S	S	*	*			trans	-159.9	119.3	132.7	-101.4	-65.3	0	0	0	112.3
1161	L	26.9	Very low	28.7	Very low	138 Å²	138	134.4 Å²	134.4	72%	0.723	77%	0.773	S	S	*	*			trans	-99.2	143.8	166.7	-89.2	161.6	0	0	0	109.6
1162	P	29.1	Very low	28.8	Very low	124 Å²	124	131.7 Å²	131.7	81%	0.805	77%	0.767	S	S	*	*			trans	-91.1	141.3	146	-12.2	30.3	0	0	0	110.4
1163	Q	25.9	Very low	29	Very low	166 Å²	166	133.8 Å²	133.8	78%	0.776	76%	0.762	S	S	*	*			trans	-105.9	158	179.9	-70	175	-30	0	0	111.4
1164	Y	31.5	Very low	29.1	Very low	207 Å²	207	135 Å²	135	81%	0.812	76%	0.761	S	S	*	*			trans	26.2	141.7	138.4	-74.3	-75.8	0	0	0	120.7
1165	P	35	Very low	29.1	Very low	124 Å²	124	135.1 Å²	135.1	81%	0.805	76%	0.762	S	S	*	*				-141.6	167.1	67.1	28.3	-5.6	0	0	0	118
1166	P	38.2	Very low	29.4	Very low	117 Å²	117	135.5 Å²	135.5	76%	0.76	77%	0.769	S	S	*	*			trans	-94	173	-175.9	38.8	-36.9	0	0	0	114.6
1167	G	30.5	Very low	29.5	Very low	71 Å²	71	139.1 Å²	139.1	73%	0.732	77%	0.772	S	S	*	*			trans	-149.5	20.7	-168.4	0	0	0	0	0	120.1
1168	N	30.5	Very low	29.5	Very low	164 Å²	164	139.4 Å²	139.4	88%	0.877	77%	0.769	S	S	*	*			trans	63.7	166	166.3	-84.1	-5.2	0	0	0	120.3
1169	P	38.6	Very low	29.7	Very low	110 Å²	110	142.3 Å²	142.3	71%	0.714	77%	0.773	S	S	*	*			trans	-114.1	-167.8	-171.3	38.6	-23.6	0	0	0	112.9
1170	V	28.5	Very low	29.8	Very low	120 Å²	120	140.7 Å²	140.7	73%	0.727	77%	0.767	S	S	*	*				161.3	140.1	127.1	157.4	0	0	0	0	113.8
1171	L	26.4	Very low	29.9	Very low	160 Å²	160	140 Å²	140	84%	0.838	76%	0.764	S	S	*	*			trans	72	149.4	160.3	-86.4	163.7	0	0	0	123.1
1172	S	28.9	Very low	30.2	Very low	98 Å²	98	139.6 Å²	139.6	69%	0.685	76%	0.762	S	S	*	*			trans	-101.1	175.1	170.3	52.1	0	0	0	0	111.3
1173	V	29.8	Very low	30.2	Very low	128 Å²	128	141.1 Å²	141.1	78%	0.776	76%	0.764	S	S	*	*			trans	-172.2	161.2	131.2	140.1	0	0	0	0	110.3
1174	D	29.1	Very low	30.7	Very low	128 Å²	128	139.1 Å²	139.1	68%	0.684	77%	0.766	S	S	*	*			trans	-76.3	175	-161.5	-44.9	-93.9	0	0	0	118.1
1175	N	25.6	Very low	30.6	Very low	144 Å²	144	133 Å²	133	77%	0.77	77%	0.765	S	S	*	*			trans	65.2	123	145.8	-71.7	-49.3	0	0	0	120.4
1176	L	30.4	Very low	30.2	Very low	175 Å²	175	133.7 Å²	133.7	92%	0.916	77%	0.767	S	S	*	*				-165	168	109	-104.4	164.5	0	0	0	112.9
1177	K	26.6	Very low	29.8	Very low	174 Å²	174	135.6 Å²	135.6	76%	0.757	77%	0.769	S	S	*	*			trans	-107.4	164.3	-171.1	-62.2	179.1	175.6	179.2	0	113.1
1178	N	27	Very low	29.7	Very low	135 Å²	135	137.5 Å²	137.5	72%	0.722	77%	0.766	S	S	*	*			trans	69.2	146.1	164	-51.9	-14.3	0	0	0	114.9
1179	H	32.1	Very low	29.9	Very low	166 Å²	166	134.8 Å²	134.8	77%	0.769	76%	0.757	S	S	*	*			cis	-146.7	124.7	34.6	-106.9	-79.7	0	0	0	115.4
1180	S	28.1	Very low	29.4	Very low	83 Å²	83	136.9 Å²	136.9	58%	0.58	76%	0.763	S	S	*	*			trans	26.9	138.3	133	66	0	0	0	0	124.5
1181	Y	29.3	Very low	29.6	Very low	207 Å²	207	138.6 Å²	138.6	81%	0.812	77%	0.766	S	S	*	*			trans	104.2	130.2	137.2	-83.7	-60.1	0	0	0	123.1
1182	N	32.7	Very low	29.8	Very low	130 Å²	130	136.8 Å²	136.8	70%	0.695	76%	0.764	S	S	*	*			trans	88.7	93.5	143.4	-70.1	-22.4	0	0	0	123.2
1183	N	29.8	Very low	29.8	Very low	156 Å²	156	139.7 Å²	139.7	83%	0.834	78%	0.777	S	S	*	*				76.7	158.8	124.9	-94.3	2.4	0	0	0	121.1
1184	P	36.3	Very low	29.9	Very low	125 Å²	125	137.1 Å²	137.1	81%	0.812	78%	0.777	S	S	*	*			trans	-106.7	161.1	-146.7	40	-36.7	0	0	0	115.4
1185	G	28.4	Very low	29.7	Very low	78 Å²	78	134.6 Å²	134.6	80%	0.804	78%	0.781	S	S	*	*			trans	-151.2	133.9	169.9	0	0	0	0	0	112.2
1186	V	27.6	Very low	29.8	Very low	138 Å²	138	132.2 Å²	132.2	84%	0.836	78%	0.782	S	S	*	*			trans	-83.4	126	177	174.4	0	0	0	0	110.1
1187	I	29.8	Very low	29.6	Very low	157 Å²	157	132 Å²	132	81%	0.805	78%	0.776	S	S	*	*			trans	-138.3	122.7	156.8	-58.9	-176.7	0	0	0	109.3
1188	V	29	Very low	29.6	Very low	111 Å²	111	130.7 Å²	130.7	67%	0.673	78%	0.776	S	S	*	*			trans	-105	127.5	165.1	175.2	0	0	0	0	108.2
1189	P	33.3	Very low	29.6	Very low	107 Å²	107	131.3 Å²	131.3	70%	0.695	78%	0.779	S	S	*	*			trans	-93.7	104.9	167.1	32.7	-27.4	0	0	0	110.9
1190	N	28.3	Very low	29.2	Very low	155 Å²	155	128.8 Å²	128.8	83%	0.829	78%	0.78	S	S	*	*			trans	-67.2	134.7	162.7	-77.1	-28.6	0	0	0	109.7
1191	I	33.3	Very low	29.1	Very low	155 Å²	155	128.7 Å²	128.7	80%	0.795	79%	0.792	S	S	*	*			trans	-131.8	131.8	166.1	-61	-175.1	0	0	0	108.1
1192	P	30.2	Very low	29.1	Very low	123 Å²	123	121.9 Å²	121.9	80%	0.799	79%	0.785	S	S	*	*			trans	-96.6	177.9	-159.1	38.7	-38.9	0	0	0	115.6
1193	V	29.2	Very low	29	Very low	158 Å²	158	121.6 Å²	121.6	96%	0.958	79%	0.788	S	S	*	*			trans	-79.6	134.1	-178.2	177.6	0	0	0	0	113
1194	G	31.5	Very low	29.1	Very low	75 Å²	75	121.7 Å²	121.7	77%	0.773	78%	0.783	S	S	*	*			trans	152.7	150.1	170.1	0	0	0	0	0	110.4
1195	G	26.3	Very low	29	Very low	75 Å²	75	120.8 Å²	120.8	77%	0.773	78%	0.779	S	S	*	*			cis	167.1	137.2	-6.1	0	0	0	0	0	110.4
1196	A	27.4	Very low	29.4	Very low	94 Å²	94	122.6 Å²	122.6	78%	0.777	78%	0.776	S	S	*	*			trans	72.8	128.7	172.2	0	0	0	0	0	120.6
1197	Q	26.2	Very low	29.6	Very low	171 Å²	171	121.3 Å²	121.3	80%	0.799	77%	0.773	S	S	*	*			trans	69.3	108.1	133.6	-69.3	-178.7	-10.7	0	0	123.5
1198	L	25.9	Very low	29.5	Very low	146 Å²	146	122.5 Å²	122.5	76%	0.764	78%	0.775	S	S	*	*				74	142.9	119.1	-75.8	165.4	0	0	0	122.9
1199	L	26.7	Very low	29.4	Very low	148 Å²	148	124.2 Å²	124.2	78%	0.775	78%	0.78	S	S	*	*			trans	74.2	84.1	153.7	-66.5	162.8	0	0	0	120.4
1200	S	24.6	Very low	29.1	Very low	112 Å²	112	126.6 Å²	126.6	78%	0.783	78%	0.784	S	S	*	*				40.9	124	120.1	62	0	0	0	0	122
1201	G	26.3	Very low	29.1	Very low	81 Å²	81	127.6 Å²	127.6	84%	0.835	78%	0.783	S	S	*	*			trans	148.2	117.3	137.6	0	0	0	0	0	118.6
1202	G	28.9	Very low	28.7	Very low	65 Å²	65	125.3 Å²	125.3	67%	0.67	78%	0.781	S	S	*	*			trans	84.7	121.6	154.9	0	0	0	0	0	117.6
1203	T	30.6	Very low	28.4	Very low	123 Å²	123	122.8 Å²	122.8	76%	0.755	78%	0.777	S	S	*	*				75.7	138.4	66.2	58.6	0	0	0	0	114.1
1204	H	31.6	Very low	28.2	Very low	158 Å²	158	121.2 Å²	121.2	73%	0.731	77%	0.768	S	S	*	*			cis	-155	142.2	14.1	-112.9	-40.2	0	0	0	109.6
1205	C	33.8	Very low	27.9	Very low	107 Å²	107	122.8 Å²	122.8	72%	0.723	76%	0.763	S	S	*	*				73.7	178.1	89	-86.4	0	0	0	0	115
1206	P	36.2	Very low	27.9	Very low	115 Å²	115	127.1 Å²	127.1	75%	0.747	76%	0.762	S	S	*	*			cis	-128	-166.8	10.8	36.5	-12.5	0	0	0	113.5
1207	S	31.8	Very low	28.1	Very low	112 Å²	112	130 Å²	130	78%	0.783	76%	0.764	S	S	*	*			cis	-151	174.7	19.2	-53	0	0	0	0	113.8
1208	E	27.8	Very low	28.1	Very low	181 Å²	181	129.3 Å²	129.3	85%	0.846	77%	0.765	S	S	*	*			trans	-116.5	165.5	-174.4	-57.4	176.2	98.4	0	0	115.3
1209	L	28.2	Very low	28.4	Very low	147 Å²	147	127.4 Å²	127.4	77%	0.77	76%	0.761	S	S	*	*			trans	14.9	149.4	142.9	-77.4	158.8	0	0	0	124.3
1210	M	26	Very low	28.6	Very low	157 Å²	157	128 Å²	128	77%	0.773	77%	0.765	S	S	*	*			trans	77.2	95.8	146.7	-68.1	-86	-169.5	0	0	121.2
1211	H	29.4	Very low	28.8	Very low	177 Å²	177	125.9 Å²	125.9	82%	0.819	76%	0.761	S	S	*	*				177.7	118.4	125.1	-89.5	-22.8	0	0	0	108.2
1212	S	24.2	Very low	28.9	Very low	107 Å²	107	128.2 Å²	128.2	75%	0.748	76%	0.763	S	S	*	*				58.9	105.7	76.5	74.2	0	0	0	0	114.7
1213	G	24.1	Very low	28.9	Very low	69 Å²	69	133.1 Å²	133.1	71%	0.711	77%	0.773	S	S	*	*			trans	145.1	95.8	169.3	0	0	0	0	0	115.4
1214	T	24.1	Very low	28.8	Very low	126 Å²	126	132.4 Å²	132.4	77%	0.773	77%	0.771	S	S	*	*			trans	40.3	117.5	140	51.2	0	0	0	0	121.6
1215	T	25	Very low	28.5	Very low	107 Å²	107	132.6 Å²	132.6	66%	0.656	78%	0.776	S	S	*	*				75.1	133.3	128.4	59.3	0	0	0	0	122.8
1216	H	27	Very low	28.3	Very low	166 Å²	166	130.1 Å²	130.1	77%	0.769	76%	0.759	S	S	*	*			trans	67.7	135.4	146.7	-64.8	-43.4	0	0	0	118.1
1217	L	30.8	Very low	28.1	Very low	155 Å²	155	127.9 Å²	127.9	81%	0.812	74%	0.744	S	S	*	*			cis	-151	151	2.9	-106.7	153.6	0	0	0	110.5
1218	L	28.1	Very low	27.9	Very low	157 Å²	157	125.8 Å²	125.8	82%	0.822	73%	0.727	S	S	*	*			trans	-77.5	162.9	161.7	-79.3	146.9	0	0	0	110
1219	P	31.4	Very low	28	Very low	105 Å²	105	123.6 Å²	123.6	68%	0.682	72%	0.716	S	S	*	*				-144.4	130	115.7	33.1	-16.9	0	0	0	115.8
1220	N	30.7	Very low	27.9	Very low	161 Å²	161	122.9 Å²	122.9	86%	0.861	71%	0.714	S	S	*	*			trans	67.3	147.6	137.7	-50.7	-15.8	0	0	0	119.8
1221	G	29.5	Very low	28.1	Very low	68 Å²	68	120.5 Å²	120.5	70%	0.701	71%	0.712	S	S	*	*			cis	-143.3	125.7	7	0	0	0	0	0	114.3
1222	C	27.7	Very low	28.2	Very low	130 Å²	130	120.6 Å²	120.6	88%	0.878	71%	0.713	S	S	*	*			trans	-86.6	154.6	140.5	-64.1	0	0	0	0	108
1223	L	28.7	Very low	28.5	Very low	168 Å²	168	122.7 Å²	122.7	88%	0.88	72%	0.716	S	S	*	*			trans	-128.9	158.4	167.4	-83.7	172.1	0	0	0	109.3
1224	P	28.4	Very low	29.1	Very low	108 Å²	108	124.9 Å²	124.9	70%	0.701	72%	0.717	S	S	*	*				-112.2	173.4	-122.9	40.6	-38.4	0	0	0	115.3
1225	L	26.6	Very low	29.5	Very low	161 Å²	161	124.4 Å²	124.4	84%	0.843	72%	0.719	S	S	*	*			trans	-58.7	146.5	156.7	-74.1	166.3	0	0	0	111.5
1226	P	29.8	Very low	30	Very low	55 Å²	55	124.5 Å²	124.5	36%	0.357	72%	0.724	S	S	.	*				-109.3	152.3	126.1	34.4	-31.4	0	0	0	110.9	E1356 N1358	P1226-E1356 WeakPolarHBondContact CG-OE1 3.48Å; P1226-N1358 WeakPolarHBondContact CB-OD1 2.96Å
1227	P	30.6	Very low	30.1	Very low	68 Å²	68	125.1 Å²	125.1	44%	0.442	73%	0.727	S	S	.	*			trans	-94.7	158	-168.6	36.2	-36.5	0	0	0	114.4	N1358	P1227-N1358 VanDerWaalsContact O-CA 3.3Å; P1227-N1358 WeakPolarHBondContact O-CA 3.39Å; P1227-N1358 PolarHBondContact O-OD1 3.47Å
1228	T	28.7	Very low	29.9	Very low	69 Å²	69	123.6 Å²	123.6	42%	0.423	72%	0.72	S	S	.	*			trans	56.1	121.7	148.1	47.8	0	0	0	0	120.4	N1358 S1359	T1228-N1358 CarbonylContact O-C 3.47Å; T1228-N1358 WeakPolarHBondContact O-CA 3.34Å; T1228-N1358 PolarHBondContact O-N 2.92Å; T1228-S1359 PolarHBondContact O-N 2.84Å; T1228-S1359 WeakPolarHBondContact OG1-CA 3.06Å; T1228-S1359 PolarHBondContact OG1-N 3.42Å
1229	H	29.4	Very low	30	Very low	134 Å²	134	123.8 Å²	123.8	62%	0.62	72%	0.716	S	S	*	*				-164.7	158.8	103.6	-137.8	-101.3	0	0	0	113.1	S1359	H1229-S1359 PolarHBondContact CD2-O 2.97Å; H1229-S1359 VanDerWaalsContact CD2-O 3.3Å; H1229-S1359 PolarHBondContact NE2-O 3.33Å
1230	N	26.9	Very low	29.8	Very low	133 Å²	133	123.4 Å²	123.4	71%	0.711	72%	0.723	S	S	*	*			trans	-76.9	146.3	-163.8	-52.5	-48.2	0	0	0	115.6
1231	S	28.8	Very low	29.7	Very low	106 Å²	106	122 Å²	122	74%	0.741	72%	0.72	S	S	*	*				-173.5	125.4	109.9	35.8	0	0	0	0	114.3
1232	Q	31.7	Very low	30.1	Very low	180 Å²	180	123.8 Å²	123.8	84%	0.841	72%	0.719	S	S	*	*			trans	52.4	130.2	150.5	-55.6	172.6	3	0	0	119.6
1233	N	30.8	Very low	30.1	Very low	151 Å²	151	128.2 Å²	128.2	81%	0.807	72%	0.719	S	S	*	*			cis	-156.8	161	-10.9	-114	0.1	0	0	0	108.5
1234	P	35.9	Very low	30.1	Very low	114 Å²	114	124.6 Å²	124.6	74%	0.74	71%	0.713	S	S	*	*			trans	-125.4	160.4	-132.8	41.3	-32.2	0	0	0	118.6
1235	S	34.1	Very low	30.1	Very low	116 Å²	116	123.9 Å²	123.9	81%	0.811	71%	0.711	S	S	*	*			trans	-163.9	105.4	141.9	45.2	0	0	0	0	115.3
1236	S	33.5	Very low	30.3	Very low	110 Å²	110	123.1 Å²	123.1	77%	0.769	71%	0.712	S	S	*	*			trans	43.6	97	146.5	60.1	0	0	0	0	123.3
1237	E	29.1	Very low	30.1	Very low	178 Å²	178	126.2 Å²	126.2	83%	0.832	74%	0.735	S	S	*	*				-4.6	144.3	126	-65.3	162.6	147	0	0	122.8
1238	D	28.2	Very low	30	Very low	123 Å²	123	129.2 Å²	129.2	66%	0.658	75%	0.752	S	S	*	*				111.2	133.4	118.9	-90.3	-10	0	0	0	127.9
1239	H	28.8	Very low	29.9	Very low	161 Å²	161	133.3 Å²	133.3	75%	0.745	77%	0.77	S	S	*	*			trans	57.4	108.7	143.7	-68.7	-29.9	0	0	0	125.5
1240	A	27.2	Very low	29.7	Very low	98 Å²	98	135 Å²	135	81%	0.81	78%	0.778	S	S	*	*				77.5	154.8	119.5	0	0	0	0	0	123.2
1241	T	29.2	Very low	29.7	Very low	131 Å²	131	133.9 Å²	133.9	80%	0.804	78%	0.78	S	S	*	*			trans	-81.4	178.5	-175.9	56.8	0	0	0	0	113.4
1242	P	37.4	Very low	29.7	Very low	105 Å²	105	132.3 Å²	132.3	68%	0.682	77%	0.774	S	S	*	*			cis	-136.1	-173.6	-2.9	25.4	0.5	0	0	0	116.1
1243	Y	27.7	Very low	29.5	Very low	224 Å²	224	131.4 Å²	131.4	88%	0.878	77%	0.772	S	S	*	*			trans	71.1	103	157.4	-80.8	-74	0	0	0	122.1
1244	A	30.3	Very low	29.6	Very low	91 Å²	91	132.8 Å²	132.8	75%	0.752	77%	0.771	S	S	*	*			trans	76.4	157.9	131.8	0	0	0	0	0	123.1
1245	S	28	Very low	29.3	Very low	94 Å²	94	132.9 Å²	132.9	66%	0.657	77%	0.765	S	S	*	*			trans	81	87.3	167.8	56.3	0	0	0	0	121.2
1246	V	29.5	Very low	29.3	Very low	145 Å²	145	135.2 Å²	135.2	88%	0.879	76%	0.763	S	S	*	*				28.8	114.9	126.7	-174.1	0	0	0	0	119.3
1247	S	26.2	Very low	29.3	Very low	119 Å²	119	134.6 Å²	134.6	83%	0.832	76%	0.764	S	S	*	*			trans	-162.8	178.5	132.7	51.4	0	0	0	0	110.6
1248	V	27.8	Very low	29.3	Very low	131 Å²	131	131.9 Å²	131.9	79%	0.794	76%	0.762	S	S	*	*			trans	-113.7	139.6	-167.9	176.5	0	0	0	0	110.7
1249	I	28.2	Very low	29.5	Very low	156 Å²	156	135.6 Å²	135.6	80%	0.8	78%	0.778	S	S	*	*			trans	-178.8	116.8	135.3	-94	153.3	0	0	0	112.4
1250	Q	24.4	Very low	29.5	Very low	168 Å²	168	134.3 Å²	134.3	79%	0.785	78%	0.777	S	S	*	*			trans	28.1	140	139.1	-106.5	165.4	-50.5	0	0	124.6
1251	S	26.1	Very low	29.8	Very low	110 Å²	110	140.4 Å²	140.4	77%	0.769	78%	0.78	S	S	*	*			trans	78.1	143.9	146.2	-63.6	0	0	0	0	119.6
1252	A	28.8	Very low	29.7	Very low	73 Å²	73	137.2 Å²	137.2	60%	0.603	77%	0.774	S	S	*	*			cis	-167.1	161.8	-13.5	0	0	0	0	0	113.1
1253	M	28	Very low	29.4	Very low	161 Å²	161	138.5 Å²	138.5	79%	0.793	78%	0.779	S	S	*	*			trans	65.6	162.1	160	-68.6	157.3	167.8	0	0	116.2
1254	F	32.7	Very low	29.3	Very low	180 Å²	180	134.3 Å²	134.3	79%	0.789	77%	0.771	S	S	*	*			cis	-143.9	158.4	26.5	-88.5	-90.6	0	0	0	110.2
1255	D	29.5	Very low	29.3	Very low	116 Å²	116	138.8 Å²	138.8	62%	0.62	78%	0.775	S	S	*	*			cis	-160.9	-173.6	-7.2	-160.6	6.4	0	0	0	111.4
1256	H	35.6	Very low	29.3	Very low	166 Å²	166	142.3 Å²	142.3	77%	0.769	78%	0.782	S	S	*	*			trans	82.9	85.5	160.2	-58.1	-19.9	0	0	0	118.4
1257	A	31.9	Very low	29.3	Very low	97 Å²	97	140.1 Å²	140.1	80%	0.802	78%	0.778	S	S	*	*				179.7	125.5	99.8	0	0	0	0	0	111.3
1258	P	29.1	Very low	29.4	Very low	120 Å²	120	140.7 Å²	140.7	78%	0.779	78%	0.777	S	S	*	*			trans	-87	152.6	175	34.6	-33.8	0	0	0	112.5
1259	M	33.5	Very low	29.4	Very low	202 Å²	202	140.9 Å²	140.9	100%	0.995	78%	0.783	S	S	*	*			trans	-114.5	111.7	147.3	-84.4	-163.4	171.3	0	0	108.2
1260	D	28.3	Very low	29.4	Very low	134 Å²	134	137.2 Å²	137.2	72%	0.717	78%	0.783	S	S	*	*			trans	-102.2	137.6	173.9	-176.8	10.2	0	0	0	109.3	G1262	D1260-G1262 PolarHBondContact OD1-N 3.02Å
1261	Y	33.7	Very low	29.6	Very low	225 Å²	225	141 Å²	141	88%	0.882	79%	0.791	S	S	*	*			trans	-163.1	70	164	-112.3	-66.7	0	0	0	110.3
1262	G	27.4	Very low	29.7	Very low	65 Å²	65	144.7 Å²	144.7	67%	0.67	80%	0.796	S	S	*	*			trans	-76.4	124.9	161.9	0	0	0	0	0	111.9	D1260	D1260-G1262 PolarHBondContact OD1-N 3.02Å
1263	V	30.3	Very low	29.8	Very low	131 Å²	131	149.4 Å²	149.4	79%	0.794	81%	0.81	S	S	*	*			trans	-134.7	123.4	152.8	179.5	0	0	0	0	110.7
1264	I	26.9	Very low	29.7	Very low	137 Å²	137	146 Å²	146	70%	0.703	80%	0.802	S	S	*	*			trans	-48.7	136.5	171.6	-64.3	147.4	0	0	0	112.5
1265	H	30.3	Very low	29.5	Very low	184 Å²	184	145.5 Å²	145.5	85%	0.852	81%	0.807	S	S	*	*			trans	-150.3	117.1	132.2	-119.9	-70.2	0	0	0	113.3
1266	Q	26.3	Very low	29.5	Very low	169 Å²	169	143.8 Å²	143.8	79%	0.79	81%	0.809	S	S	*	*			trans	-76.8	140.2	161.2	-65	169.1	-59.3	0	0	109.1
1267	A	30.3	Very low	29.3	Very low	98 Å²	98	144 Å²	144	81%	0.81	81%	0.81	S	S	*	*			trans	-152	73.3	165.8	0	0	0	0	0	110	C1269	A1267-C1269 PolarHBondContact O-N 3.31Å
1268	T	27.7	Very low	29.2	Very low	131 Å²	131	146.5 Å²	146.5	80%	0.804	81%	0.808	S	S	*	*			trans	-75.6	115.2	175.8	47.4	0	0	0	0	111.6
1269	C	29.1	Very low	29.4	Very low	135 Å²	135	148 Å²	148	91%	0.912	81%	0.808	S	S	*	*			trans	-157.2	114.5	145.2	-102.6	0	0	0	0	109.6	A1267	A1267-C1269 PolarHBondContact O-N 3.31Å
1270	G	26.8	Very low	29.5	Very low	79 Å²	79	144 Å²	144	81%	0.814	80%	0.798	S	S	*	*			trans	-93.5	167.1	171.2	0	0	0	0	0	111.4
1271	R	29.5	Very low	30.1	Very low	249 Å²	249	143 Å²	143	94%	0.94	80%	0.798	S	S	*	*			trans	-142.2	123.4	144.9	-133.5	173.7	-172.9	171.6	2.1	110.1
1272	Q	27.3	Very low	30.3	Very low	186 Å²	186	138 Å²	138	87%	0.869	79%	0.793	S	S	*	*			trans	-64.2	139.4	161.3	-61.9	163.9	-73.9	0	0	108.1
1273	L	30.7	Very low	31	Very low	173 Å²	173	139.9 Å²	139.9	91%	0.906	79%	0.794	S	S	*	*			trans	-145.7	155.8	134	-109.4	165.9	0	0	0	107.8
1274	S	27.8	Very low	31.2	Very low	90 Å²	90	140.8 Å²	140.8	63%	0.629	79%	0.794	S	S	*	*			trans	-139.2	162.7	-146.1	57.1	0	0	0	0	113.8
1275	L	27.8	Very low	31.6	Very low	169 Å²	169	145.3 Å²	145.3	89%	0.885	80%	0.804	S	S	*	*			trans	77.2	170.1	154.9	-112.2	74.9	0	0	0	118
1276	A	30.4	Very low	32.2	Very low	80 Å²	80	141.6 Å²	141.6	66%	0.661	80%	0.796	S	S	*	*			trans	82	89	166.8	0	0	0	0	0	118.6
1277	E	29.9	Very low	32.9	Very low	170 Å²	170	139 Å²	139	79%	0.794	79%	0.794	S	S	*	*				65.5	111.8	120.5	-66.9	175.5	122.3	0	0	121.8
1278	I	29.9	Very low	33.6	Very low	149 Å²	149	140.6 Å²	140.6	76%	0.764	80%	0.796	S	S	*	*				37.9	100.8	111.5	-51.2	166	0	0	0	116.1
1279	I	32.9	Very low	34	Very low	151 Å²	151	139.8 Å²	139.8	77%	0.774	80%	0.796	S	S	*	*				-170.3	137	129.3	-97.4	150	0	0	0	108.3
1280	P	37.2	Very low	34.3	Very low	120 Å²	120	140.9 Å²	140.9	78%	0.779	79%	0.792	S	S	*	*			trans	-90.3	130.9	179.6	33.6	-32.5	0	0	0	113.2
1281	P	40.8	Very low	34.7	Very low	112 Å²	112	142.4 Å²	142.4	73%	0.727	79%	0.787	S	S	*	*			trans	-117.5	-176.9	170.7	46.3	-34.5	0	0	0	110.7
1282	P	37.9	Very low	34.8	Very low	120 Å²	120	135.7 Å²	135.7	78%	0.779	78%	0.779	S	S	*	*				-129	-169.9	-105.6	30.4	-4.2	0	0	0	112.6
1283	P	40.6	Very low	35.2	Very low	105 Å²	105	136.3 Å²	136.3	68%	0.682	78%	0.778	S	S	*	*			trans	-89.4	173.3	-167.2	36.6	-35.4	0	0	0	115.5
1284	D	34.9	Very low	35.3	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	77%	0.766	S	S	*	*			trans	53	102.5	159.3	-59	-28.2	0	0	0	119.5
1285	Y	36.2	Very low	35.5	Very low	232 Å²	232	134.1 Å²	134.1	91%	0.91	78%	0.775	S	S	*	*			trans	-131.4	153.2	154.8	-101.4	-99.6	0	0	0	111.3
1286	P	42.2	Very low	35.9	Very low	106 Å²	106	132.1 Å²	132.1	69%	0.688	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-85.5	170.2	-155.4	-11.8	30.4	0	0	0	115.5
1287	P	40.2	Very low	36	Very low	115 Å²	115	132.9 Å²	132.9	75%	0.747	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-70.6	147.5	-178.5	29.8	-35.7	0	0	0	113
1288	P	45	Very low	36.2	Very low	131 Å²	131	133.5 Å²	133.5	85%	0.851	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-68.5	134.4	175.7	28.7	-34.2	0	0	0	111.5
1289	S	35.9	Very low	36.2	Very low	114 Å²	114	133.7 Å²	133.7	80%	0.797	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-76.2	151.5	-177.3	47.6	0	0	0	0	113.7
1290	L	36	Very low	36.1	Very low	158 Å²	158	136.9 Å²	136.9	83%	0.827	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-60.4	135.2	172.6	-76	154.6	0	0	0	112.1	S1292	L1290-S1292 PolarHBondContact O-N 3.45Å
1291	P	36.5	Very low	35.8	Very low	111 Å²	111	135.8 Å²	135.8	72%	0.721	77%	0.768	S	S	*	*			trans	-79.6	87.2	154.4	32.7	-30.4	0	0	0	109.1	F1293	P1291-F1293 PolarHBondContact O-N 2.89Å; P1291-F1293 VanDerWaalsContact O-N 3.16Å
1292	S	31.4	Very low	35.1	Very low	108 Å²	108	135.2 Å²	135.2	76%	0.755	77%	0.766	S	S	*	*			trans	-73.2	100.8	168.8	57.3	0	0	0	0	109.9	L1290	L1290-S1292 PolarHBondContact O-N 3.45Å
1293	F	35.2	Very low	34.7	Very low	198 Å²	198	140.7 Å²	140.7	87%	0.868	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-90.1	135.1	161.7	-92	-83.3	0	0	0	110.6	P1291	P1291-F1293 PolarHBondContact O-N 2.89Å; P1291-F1293 VanDerWaalsContact O-N 3.16Å
1294	S	31.9	Very low	34.2	Very low	92 Å²	92	140.7 Å²	140.7	64%	0.643	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-80.1	150.1	-165.6	41.4	0	0	0	0	113.5
1295	P	33.5	Very low	34.1	Very low	126 Å²	126	141.4 Å²	141.4	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-71.5	131	164.9	31.1	-32.5	0	0	0	109.5
1296	V	35.6	Very low	33.9	Very low	126 Å²	126	133.1 Å²	133.1	76%	0.764	76%	0.762	S	S	*	*			trans	-125.7	107	170.2	-179.3	0	0	0	0	108.3
1297	P	32.3	Very low	33.5	Very low	97 Å²	97	135.9 Å²	135.9	63%	0.63	77%	0.771	S	S	*	*			trans	-76.4	149.2	162.7	33.8	-32.4	0	0	0	109.2
1298	H	33.6	Very low	33.1	Very low	182 Å²	182	134.7 Å²	134.7	84%	0.843	77%	0.771	S	S	*	*			trans	-178.5	154.7	131.5	-99.6	-68.1	0	0	0	110.7
1299	H	30.4	Very low	32.7	Very low	154 Å²	154	134 Å²	134	71%	0.713	77%	0.766	S	S	*	*			trans	-62.8	145.8	178.1	-67.3	-117.7	0	0	0	112.2
1300	F	30.7	Very low	32.5	Very low	217 Å²	217	133.8 Å²	133.8	95%	0.952	76%	0.763	S	S	*	*			trans	-129	135.6	134.9	-107.3	-86.2	0	0	0	109.3
1301	T	30.8	Very low	32.1	Very low	98 Å²	98	132 Å²	132	60%	0.601	76%	0.764	S	S	*	*			trans	-121.6	146.1	-170.3	43.3	0	0	0	0	110.7
1302	S	26.4	Very low	31.9	Very low	99 Å²	99	130 Å²	130	69%	0.692	76%	0.763	S	S	*	*			trans	63.9	165.5	173.9	77	0	0	0	0	113.3
1303	W	30.4	Very low	31.8	Very low	236 Å²	236	131 Å²	131	89%	0.894	77%	0.771	S	S	*	*			cis	-110.2	163.8	27.1	-81.7	36.6	0	0	0	115.5
1304	S	28.2	Very low	31.6	Very low	105 Å²	105	124.8 Å²	124.8	73%	0.734	76%	0.763	S	S	*	*			trans	-131.7	134.7	-178.6	55	0	0	0	0	111.7
1305	L	33.6	Very low	31.5	Very low	164 Å²	164	129.2 Å²	129.2	86%	0.859	77%	0.773	S	S	*	*			trans	-165.5	139.1	161.2	-86.8	127	0	0	0	103.5
1306	G	32.5	Very low	31.4	Very low	59 Å²	59	130 Å²	130	61%	0.608	77%	0.77	S	S	*	*			cis	149.1	141.1	16.4	0	0	0	0	0	104.4
1307	D	34.2	Very low	31	Very low	164 Å²	164	129 Å²	129	88%	0.877	77%	0.769	S	S	*	*			cis	-146.1	-177.4	8.1	-69	-53.4	0	0	0	111.1
1308	A	30.8	Very low	30.8	Very low	90 Å²	90	128.2 Å²	128.2	74%	0.744	77%	0.771	S	S	*	*			trans	-126.5	-160.8	173	0	0	0	0	0	108.4
1309	P	37.5	Very low	30.5	Very low	116 Å²	116	130.1 Å²	130.1	75%	0.753	77%	0.772	S	S	*	*			cis	-137.2	-141.8	-9.3	32	-6	0	0	0	112.2
1310	C	31.2	Very low	30.6	Very low	109 Å²	109	127.5 Å²	127.5	74%	0.736	77%	0.771	S	S	*	*			trans	93.1	84.3	155.6	-66.3	0	0	0	0	121.9
1311	S	28.5	Very low	30.4	Very low	121 Å²	121	123.6 Å²	123.6	85%	0.846	76%	0.76	S	S	*	*				11.8	133.3	125.1	58.4	0	0	0	0	122.9
1312	G	32.3	Very low	30.2	Very low	68 Å²	68	125.8 Å²	125.8	70%	0.701	76%	0.762	S	S	*	*			trans	161.3	120	153	0	0	0	0	0	110.1
1313	S	28.8	Very low	30.3	Very low	131 Å²	131	129.7 Å²	129.7	92%	0.916	76%	0.761	S	S	*	*				83.9	119.3	50.3	73.3	0	0	0	0	113.9
1314	G	31.5	Very low	30.1	Very low	67 Å²	67	126.7 Å²	126.7	69%	0.691	76%	0.757	S	S	*	*			trans	121.3	96.7	-173.8	0	0	0	0	0	110
1315	E	29.8	Very low	30	Very low	185 Å²	185	127.1 Å²	127.1	86%	0.864	76%	0.76	S	S	*	*				89.2	126.8	57.5	-69.1	-177.3	151.4	0	0	114.4
1316	D	30.4	Very low	29.6	Very low	141 Å²	141	124.2 Å²	124.2	75%	0.754	75%	0.754	S	S	*	*			trans	60	94.5	143.1	-66.9	8.6	0	0	0	123.5
1317	S	27.3	Very low	29.5	Very low	106 Å²	106	127 Å²	127	74%	0.741	76%	0.764	S	S	*	*				95.6	144.4	104.6	80.7	0	0	0	0	121.9
1318	A	28.4	Very low	29.2	Very low	81 Å²	81	127.1 Å²	127.1	67%	0.669	76%	0.759	S	S	*	*			trans	64.3	141.4	143.3	0	0	0	0	0	121.6
1319	Y	27.3	Very low	29.3	Very low	222 Å²	222	131.6 Å²	131.6	87%	0.871	76%	0.764	S	S	*	*			trans	41.8	132.6	148.7	-84.5	-102	0	0	0	119.5
1320	S	31.4	Very low	28.7	Very low	98 Å²	98	134.6 Å²	134.6	69%	0.685	77%	0.768	S	S	*	*			cis	-165	144.4	31.4	57	0	0	0	0	113.6
1321	D	27	Very low	28.7	Very low	135 Å²	135	133.2 Å²	133.2	72%	0.722	77%	0.773	S	S	*	*				35.4	155	123.4	-121.9	-24.6	0	0	0	124.2
1322	F	27.6	Very low	28.7	Very low	145 Å²	145	130.8 Å²	130.8	64%	0.636	77%	0.766	S	S	*	*			trans	78.9	104.2	161	-89.6	-127.9	0	0	0	122.7
1323	R	26.8	Very low	28.7	Very low	180 Å²	180	133.3 Å²	133.3	68%	0.679	77%	0.772	S	S	*	*				67.3	127	123.8	-70.2	-170.4	-177.6	-178.6	1.3	123
1324	Q	26.1	Very low	28.7	Very low	174 Å²	174	133.9 Å²	133.9	81%	0.813	77%	0.765	S	S	*	*			trans	68.4	156.1	136.9	-62.8	171.9	-41.1	0	0	116
1325	S	27.4	Very low	28.9	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	77%	0.774	S	S	*	*			cis	-147	168.5	12.4	60.8	0	0	0	0	113.6
1326	S	25.6	Very low	28.9	Very low	104 Å²	104	135.4 Å²	135.4	73%	0.727	77%	0.768	S	S	*	*			trans	-51.2	142.5	178.6	49.7	0	0	0	0	119.8
1327	S	30.5	Very low	29	Very low	117 Å²	117	134.7 Å²	134.7	82%	0.818	77%	0.774	S	S	*	*			trans	-163.9	131.1	137.9	52.4	0	0	0	0	107.8
1328	Q	26.4	Very low	29.2	Very low	167 Å²	167	132.6 Å²	132.6	78%	0.78	77%	0.769	S	S	*	*			cis	89.5	75.6	12.5	-147.4	-178.6	30.8	0	0	117.4
1329	H	33	Very low	29.4	Very low	183 Å²	183	135.3 Å²	135.3	85%	0.847	78%	0.783	S	S	*	*			trans	-155.8	129.2	149.5	-83.8	-66.9	0	0	0	106
1330	Q	26.1	Very low	29.6	Very low	179 Å²	179	127.9 Å²	127.9	84%	0.836	77%	0.774	S	S	*	*			cis	96.1	119	15	-155	-178.1	30.9	0	0	115.3
1331	G	29.7	Very low	29.8	Very low	81 Å²	81	129.3 Å²	129.3	84%	0.835	78%	0.781	S	S	*	*			trans	98.9	143.7	-178.9	0	0	0	0	0	113.8
1332	G	28.4	Very low	30.2	Very low	69 Å²	69	128.3 Å²	128.3	71%	0.711	78%	0.782	S	S	*	*			cis	167.6	170.1	-4.5	0	0	0	0	0	112.2
1333	C	32.6	Very low	30.4	Very low	122 Å²	122	127 Å²	127	82%	0.824	79%	0.786	S	S	*	*			trans	76.8	114.6	-173.1	-49	0	0	0	0	114.4
1334	D	29.6	Very low	30.5	Very low	143 Å²	143	123.4 Å²	123.4	77%	0.765	79%	0.788	S	S	*	*			cis	78.5	123.5	37.7	-61	-61.7	0	0	0	115.9
1335	V	34.8	Very low	30.6	Very low	145 Å²	145	119.6 Å²	119.6	88%	0.879	78%	0.78	S	S	*	*				-164.1	153.3	108	148.9	0	0	0	0	109.8
1336	N	30	Very low	30.6	Very low	139 Å²	139	118.1 Å²	118.1	74%	0.743	77%	0.77	S	S	*	*			trans	-94.1	176.3	-162.3	-85.3	-67.1	0	0	0	117
1337	S	32.5	Very low	30.8	Very low	126 Å²	126	120.3 Å²	120.3	88%	0.881	77%	0.769	S	S	*	*			trans	92.6	142.2	149.2	76.7	0	0	0	0	119.4
1338	G	31.4	Very low	30.7	Very low	62 Å²	62	121.3 Å²	121.3	64%	0.639	76%	0.76	S	S	*	*			cis	167.4	146.2	-12.6	0	0	0	0	0	115.6
1339	S	32.7	Very low	30.8	Very low	137 Å²	137	118.4 Å²	118.4	96%	0.958	75%	0.75	S	S	*	*			trans	61.7	147.1	176.6	66.1	0	0	0	0	117.2
1340	G	31.5	Very low	30.4	Very low	67 Å²	67	120.1 Å²	120.1	69%	0.691	75%	0.749	S	S	*	*			cis	152.5	174.2	-5	0	0	0	0	0	110.7
1341	P	37.2	Very low	30.3	Very low	128 Å²	128	117.5 Å²	117.5	83%	0.831	74%	0.74	S	S	*	*			cis	-130.5	-133	-16.4	44.2	-23.4	0	0	0	111.4
1342	P	35.3	Very low	30.1	Very low	113 Å²	113	119.1 Å²	119.1	73%	0.734	73%	0.734	S	S	*	*			trans	-134.2	-140	-139	39.5	-12.8	0	0	0	115.5
1343	V	31.3	Very low	29.9	Very low	119 Å²	119	120.3 Å²	120.3	72%	0.721	73%	0.732	S	S	*	*			trans	80	108.2	172.8	-177.7	0	0	0	0	112.8
1344	S	28.3	Very low	29.7	Very low	104 Å²	104	122.5 Å²	122.5	73%	0.727	73%	0.73	S	S	*	*				64.6	156.3	63.2	85.2	0	0	0	0	113.1
1345	S	28.5	Very low	29.7	Very low	93 Å²	93	122.6 Å²	122.6	65%	0.65	73%	0.725	S	S	*	*			cis	-162.9	133.6	16.1	53.6	0	0	0	0	108.5
1346	S	27.7	Very low	29.5	Very low	83 Å²	83	121.8 Å²	121.8	58%	0.58	71%	0.712	S	S	*	*				86	149	95.2	75.1	0	0	0	0	117.6
1347	H	29.5	Very low	29.7	Very low	149 Å²	149	119.8 Å²	119.8	69%	0.69	71%	0.709	S	S	*	*			trans	65.9	156.6	157.6	-60.9	-61.5	0	0	0	117.4
1348	H	29.5	Very low	29.7	Very low	138 Å²	138	117.2 Å²	117.2	64%	0.639	69%	0.685	S	S	*	*			cis	-153.1	138.3	-17.2	-117	-30.8	0	0	0	109.5
1349	N	27.3	Very low	29.7	Very low	107 Å²	107	117.9 Å²	117.9	57%	0.572	68%	0.68	S	S	*	*				60.9	130.4	106.8	-82.5	16.4	0	0	0	119.8
1350	W	25.5	Very low	29.8	Very low	218 Å²	218	114.3 Å²	114.3	83%	0.826	66%	0.659	S	S	*	*			trans	75.8	154	138.7	-67	22.7	0	0	0	118.5
1351	L	24.3	Very low	29.9	Very low	124 Å²	124	119 Å²	119	65%	0.649	67%	0.667	S	S	*	*			cis	-163.9	160.8	-24.8	-112.6	174.6	0	0	0	109.7
1352	T	25	Very low	29.9	Very low	116 Å²	116	118.2 Å²	118.2	71%	0.712	66%	0.662	S	S	*	*			trans	54.6	113.8	153.6	40.9	0	0	0	0	124.3
1353	S	24.5	Very low	29.8	Very low	93 Å²	93	117 Å²	117	65%	0.65	66%	0.662	S	S	*	*				65.7	123	122.4	69.6	0	0	0	0	125.8
1354	Q	27	Very low	30	Very low	168 Å²	168	116.6 Å²	116.6	79%	0.785	66%	0.664	S	S	*	*			trans	64.7	160.2	139.7	-64.6	-178	-53.3	0	0	119.3
1355	H	31.1	Very low	30.1	Very low	146 Å²	146	116.7 Å²	116.7	68%	0.676	67%	0.665	S	S	*	*			cis	-140.6	-171.1	16.5	-120.1	-78.2	0	0	0	112.9
1356	E	30.7	Very low	30.4	Very low	128 Å²	128	120.4 Å²	120.4	60%	0.598	67%	0.671	S	S	*	*			trans	-76.9	-172.1	-172.2	-49.7	129.8	120	0	0	115	P1226	P1226-E1356 WeakPolarHBondContact CG-OE1 3.48Å
1357	S	32.6	Very low	30.4	Very low	97 Å²	97	120.6 Å²	120.6	68%	0.678	67%	0.673	S	S	*	*			cis	-176.6	157.1	29.9	42.2	0	0	0	0	116.6
1358	N	33.3	Very low	30.3	Very low	72 Å²	72	121 Å²	121	39%	0.385	68%	0.678	S	S	.	*			trans	73.7	117.7	134.7	-60.2	11.4	0	0	0	129.2	P1226 P1227 T1228	P1226-N1358 WeakPolarHBondContact CB-OD1 2.96Å; P1227-N1358 VanDerWaalsContact O-CA 3.3Å; P1227-N1358 WeakPolarHBondContact O-CA 3.39Å; P1227-N1358 PolarHBondContact O-OD1 3.47Å; T1228-N1358 CarbonylContact O-C 3.47Å; T1228-N1358 WeakPolarHBondContact O-CA 3.34Å; T1228-N1358 PolarHBondContact O-N 2.92Å
1359	S	32.3	Very low	30.2	Very low	76 Å²	76	118.3 Å²	118.3	53%	0.531	68%	0.675	S	S	.	*				92	141	128.8	70.4	0	0	0	0	123.6	T1228 H1229	T1228-S1359 PolarHBondContact O-N 2.84Å; T1228-S1359 WeakPolarHBondContact OG1-CA 3.06Å; T1228-S1359 PolarHBondContact OG1-N 3.42Å; H1229-S1359 PolarHBondContact CD2-O 2.97Å; H1229-S1359 VanDerWaalsContact CD2-O 3.3Å; H1229-S1359 PolarHBondContact NE2-O 3.33Å
1360	A	34.1	Very low	30.2	Very low	61 Å²	61	122 Å²	122	50%	0.504	69%	0.686	S	S	.	*			cis	-176.3	148.1	-22.5	0	0	0	0	0	113.9
1361	L	33.1	Very low	30.4	Very low	166 Å²	166	116.9 Å²	116.9	87%	0.869	68%	0.679	S	S	*	*			trans	42.3	175.5	148.6	-77	168.9	0	0	0	122.5
1362	P	37.9	Very low	30.6	Very low	111 Å²	111	116.8 Å²	116.8	72%	0.721	69%	0.689	S	S	*	*			cis	-134.6	162.7	-6	40.2	-21.9	0	0	0	118.9
1363	A	33.6	Very low	30.7	Very low	88 Å²	88	114.3 Å²	114.3	73%	0.727	69%	0.687	S	S	*	*			trans	55	124.1	135.8	0	0	0	0	0	126.7
1364	S	33.8	Very low	30.9	Very low	111 Å²	111	118.2 Å²	118.2	78%	0.776	70%	0.699	S	S	*	*				120.8	123.2	116.1	74.2	0	0	0	0	122.9
1365	S	32	Very low	30.9	Very low	106 Å²	106	114.8 Å²	114.8	74%	0.741	69%	0.694	S	S	*	*			trans	99	137.6	134.5	83.7	0	0	0	0	123.5
1366	H	33.7	Very low	30.6	Very low	170 Å²	170	113 Å²	113	79%	0.787	70%	0.698	S	S	*	*			trans	57.4	95.6	150.8	-71.5	-62.7	0	0	0	124.5
1367	S	27.3	Very low	30.3	Very low	88 Å²	88	114.3 Å²	114.3	62%	0.615	70%	0.704	S	S	*	*				89.2	147.8	105.4	80.2	0	0	0	0	122
1368	I	27.9	Very low	29.9	Very low	157 Å²	157	119.3 Å²	119.3	81%	0.805	71%	0.708	S	S	*	*			trans	66.2	138.2	150.7	-69.2	162.1	0	0	0	116.9
1369	S	27.4	Very low	29.4	Very low	82 Å²	82	122.5 Å²	122.5	57%	0.573	72%	0.724	S	S	*	*			cis	-173.6	170.3	-25.9	68.6	0	0	0	0	107.4
1370	K	27.1	Very low	29.1	Very low	185 Å²	185	125.3 Å²	125.3	80%	0.804	73%	0.733	S	S	*	*			trans	67.6	156.2	154.7	-76.9	177.4	178.2	179.8	0	118
1371	T	29	Very low	28.7	Very low	109 Å²	109	129.4 Å²	129.4	67%	0.669	74%	0.742	S	S	*	*			cis	-169	157.8	-36.8	20.3	0	0	0	0	107.4
1372	S	28.6	Very low	28.4	Very low	122 Å²	122	128.8 Å²	128.8	85%	0.853	74%	0.735	S	S	*	*			trans	65.4	159.2	147.4	64.1	0	0	0	0	119.8
1373	G	28.8	Very low	27.8	Very low	65 Å²	65	127.6 Å²	127.6	67%	0.67	73%	0.729	S	S	*	*			trans	112.2	62.6	177.4	0	0	0	0	0	112.1
1374	L	27.2	Very low	27.5	Very low	174 Å²	174	131 Å²	131	91%	0.911	73%	0.734	S	S	*	*				91.5	156.8	80	-83.9	166.6	0	0	0	113.3
1375	S	26.7	Very low	27.2	Very low	96 Å²	96	129.7 Å²	129.7	67%	0.671	72%	0.724	S	S	*	*			trans	-87.8	167.8	-167.2	54.2	0	0	0	0	114.1
1376	S	25.3	Very low	27.1	Very low	109 Å²	109	131 Å²	131	76%	0.762	73%	0.728	S	S	*	*			trans	65.6	146.6	174.7	60.3	0	0	0	0	113
1377	E	25.2	Very low	27.3	Very low	156 Å²	156	127.4 Å²	127.4	73%	0.729	72%	0.72	S	S	*	*			cis	-150.4	162.5	48.8	-83.9	-163.3	116.3	0	0	114.4
1378	W	23.8	Very low	27.7	Very low	202 Å²	202	131.5 Å²	131.5	77%	0.765	73%	0.729	S	S	*	*			trans	35.5	130.4	141.1	-63.7	66.8	0	0	0	120.4
1379	L	23.6	Very low	28	Very low	138 Å²	138	128 Å²	128	72%	0.723	72%	0.718	S	S	*	*				46.2	91.9	83.9	-96.9	169.6	0	0	0	113.2
1380	N	25.1	Very low	28.2	Very low	135 Å²	135	129.9 Å²	129.9	72%	0.722	73%	0.727	S	S	*	*			trans	-178.4	155.2	134.7	-93.9	-19.5	0	0	0	113.3
1381	H	26.4	Very low	28.3	Very low	147 Å²	147	127.3 Å²	127.3	68%	0.681	72%	0.722	S	S	*	*			trans	19	142.1	131.6	-64.1	-116.7	0	0	0	118.4
1382	E	26	Very low	28.4	Very low	154 Å²	154	128.9 Å²	128.9	72%	0.72	72%	0.722	S	S	*	*			cis	-162.6	135.9	14.9	-113.1	152.2	-162.1	0	0	107.4
1383	S	25.9	Very low	28.5	Very low	86 Å²	86	130.7 Å²	130.7	60%	0.601	72%	0.716	S	S	*	*				81.7	150.2	81	96.6	0	0	0	0	116
1384	L	26.4	Very low	28.5	Very low	160 Å²	160	133 Å²	133	84%	0.838	71%	0.712	S	S	*	*			trans	70	142.2	167.4	-57.9	159.1	0	0	0	117.3
1385	S	28.4	Very low	28.5	Very low	82 Å²	82	133 Å²	133	57%	0.573	71%	0.705	S	S	*	*			cis	-171.9	122	-16.6	49.3	0	0	0	0	113.4
1386	T	30.1	Very low	28.4	Very low	133 Å²	133	132.1 Å²	132.1	82%	0.816	70%	0.703	S	S	*	*			trans	55.4	176.9	141.6	60.9	0	0	0	0	120.6
1387	P	36.6	Very low	28.6	Very low	95 Å²	95	134.9 Å²	134.9	62%	0.617	70%	0.704	S	S	*	*			cis	-116	156.8	-34.5	21.9	-0.7	0	0	0	111
1388	H	36.8	Very low	28.9	Very low	174 Å²	174	135.8 Å²	135.8	81%	0.806	71%	0.708	S	S	*	*				163.6	157.5	91.7	-92.4	-74.3	0	0	0	105.8
1389	S	33.7	Very low	29.2	Very low	83 Å²	83	131.6 Å²	131.6	58%	0.58	71%	0.707	S	S	*	*			cis	-163.3	117.2	-9	48.7	0	0	0	0	106.2
1390	T	31.2	Very low	29.4	Very low	123 Å²	123	129.4 Å²	129.4	76%	0.755	70%	0.703	S	S	*	*				54	131.8	109.4	65	0	0	0	0	115.3
1391	D	29.3	Very low	29.5	Very low	131 Å²	131	129.3 Å²	129.3	70%	0.701	71%	0.708	S	S	*	*			cis	-169.3	-179.9	15.3	-136.1	-37.6	0	0	0	114.7
1392	Q	30.9	Very low	29.5	Very low	141 Å²	141	126.6 Å²	126.6	66%	0.659	71%	0.705	S	S	*	*			trans	70.9	151.2	156.1	-70	165.5	25.4	0	0	118.1
1393	H	32.1	Very low	29.6	Very low	160 Å²	160	126.9 Å²	126.9	74%	0.741	71%	0.711	S	S	*	*			cis	-156.6	165.8	-4.7	-108.2	-40.1	0	0	0	109
1394	I	27.5	Very low	29.8	Very low	113 Å²	113	127 Å²	127	58%	0.579	71%	0.711	S	S	*	*				-166.4	150.3	-55.1	-129.5	-177.2	0	0	0	110.8
1395	F	27.4	Very low	29.9	Very low	175 Å²	175	125.8 Å²	125.8	77%	0.768	71%	0.711	S	S	*	*			trans	64.2	163.8	167.1	-75.5	-138.3	0	0	0	116.6
1396	A	25.6	Very low	30.1	Very low	77 Å²	77	129.4 Å²	129.4	64%	0.636	72%	0.722	S	S	*	*			cis	141	157.4	-21.5	0	0	0	0	0	111.8
1397	H	28.6	Very low	30.2	Very low	168 Å²	168	131.2 Å²	131.2	78%	0.778	72%	0.721	S	S	*	*			trans	89.9	139.4	167.9	-64.3	-82.5	0	0	0	122.3
1398	H	31.5	Very low	30.3	Very low	174 Å²	174	132.4 Å²	132.4	81%	0.806	73%	0.729	S	S	*	*			trans	-57.2	159	165.5	-56.3	-85.7	0	0	0	113
1399	P	31.1	Very low	30.3	Very low	114 Å²	114	127.8 Å²	127.8	74%	0.74	72%	0.716	S	S	*	*				-115.7	164.1	60.3	3.7	20.4	0	0	0	112.1
1400	S	25.9	Very low	30.3	Very low	92 Å²	92	132.3 Å²	132.3	64%	0.643	73%	0.728	S	S	*	*			cis	72.7	133.8	34.7	88	0	0	0	0	116.1
1401	T	27.3	Very low	30.4	Very low	134 Å²	134	132.8 Å²	132.8	82%	0.822	73%	0.73	S	S	*	*			trans	66.9	150.3	178.9	72.5	0	0	0	0	117.9
1402	S	27.5	Very low	30.3	Very low	90 Å²	90	131 Å²	131	63%	0.629	73%	0.733	S	S	*	*			cis	-175.9	163.8	-30	56.2	0	0	0	0	110.5
1403	L	28.6	Very low	30.1	Very low	160 Å²	160	133.8 Å²	133.8	84%	0.838	77%	0.767	S	S	*	*			trans	73	142.9	161.1	-63.4	157.6	0	0	0	116.5
1404	S	29.7	Very low	30	Very low	87 Å²	87	132.5 Å²	132.5	61%	0.608	77%	0.768	S	S	*	*			cis	-167.8	125.9	-6	48.5	0	0	0	0	114.6
1405	T	28.6	Very low	30.2	Very low	135 Å²	135	133.5 Å²	133.5	83%	0.828	78%	0.778	S	S	*	*			trans	61.7	154.3	146.7	2.8	0	0	0	0	118.1
1406	I	32.9	Very low	30.3	Very low	158 Å²	158	131.2 Å²	131.2	81%	0.81	78%	0.778	S	S	*	*			cis	-137.7	147.9	16.7	-61.5	177.2	0	0	0	111.1
1407	Q	31.2	Very low	30.6	Very low	171 Å²	171	134.4 Å²	134.4	80%	0.799	79%	0.787	S	S	*	*			trans	-93.3	155.8	169.2	-60.1	177	-85.6	0	0	112
1408	P	39.5	Very low	30.7	Very low	121 Å²	121	132.3 Å²	132.3	79%	0.786	79%	0.787	S	S	*	*				-134.9	175.6	94.3	12.1	9.9	0	0	0	112.7
1409	S	35.9	Very low	30.7	Very low	76 Å²	76	129.5 Å²	129.5	53%	0.531	79%	0.786	S	S	.	*			cis	167	140.4	-37.4	59.9	0	0	0	0	107.2
1410	H	34.8	Very low	30.6	Very low	179 Å²	179	130.6 Å²	130.6	83%	0.829	79%	0.789	S	S	*	*			trans	65.9	144.9	170.3	-60.7	-72.7	0	0	0	118
1411	V	32.5	Very low	31	Very low	132 Å²	132	133.6 Å²	133.6	80%	0.8	80%	0.801	S	S	*	*			cis	-153.6	154.8	-30.9	101.3	0	0	0	0	107.9
1412	A	27	Very low	31.3	Very low	93 Å²	93	133.6 Å²	133.6	77%	0.769	80%	0.799	S	S	*	*			trans	-79.6	148.6	-176.7	0	0	0	0	0	113.5
1413	C	27.7	Very low	31.7	Very low	201 Å²	201	137.5 Å²	137.5	100%	1.358	81%	0.814	S	S	*	*				-152.3	0	111.3	-160	0	0	0	0	110.6

Retrieved 1,413 of 1,413 residues in 1538.5 ms (Link to these results)

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