A0A061IEG6_CRIGR Loading...

Desmocollin 3

A component of desmosome cell-cell junctions which are required for positive regulation of cellular adhesion. Involved in the interaction of plaque proteins and intermediate filaments mediating cell-cell adhesion.

AlphaFold DB , UniProt , Accession A0A061IEG6, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC100771819, Length 896 aa.

						>A0A061IEG6_CRIGR|A0A061IEG6|LOC100771819
MMFSGLRSPRGRAMGTQLMLMLWVFSFVGEACKKVTLNVPSTLEVDQIIGRVNLKECLSSAEGIRTSDPDFRVLDDGSVYPARALVLSGEKRSFVIQLSDSKTQTQKEIPVILEHQKKVLKKRHTKNTVLRRAKRRWAPIPCSMQENSLGPFPLFLQQVQSDAAQNYTIIYSIKGRGADQEPRDLFTIDKHTGNLYCHKAVDREKYDVFDLTAYAYTVDGYSADSPLPLPIKIEDENDNYPLFTETIYNFEVPESSRIGTVVGVVCATDMDEPDTMHTRLKYSILEQNPRSPGLFSVHPDTGIITTVSHYMDREVVDKYTLIMKVQDMNGQFFGLISTSTCIITVQDSNDNAPTFRQNGYETSVEENTYNVEILRIPVDDKDLIKSANWKANFTILKGNENGRFKITTDPETNEGVLCVVKPLDYEENHQVTLEIGVNNEAPLIRDVASRVPTMNRALVTVHVRDQDEGPECKPPEQYVRIKENSAVGSKINGYKAYDPETKNSNGLRYKKLQDPKEWVSIEEVSGLLTISKALDREAMAPRNDLYNITVMAIDQDGKSCTGTLAVNIEDVNDNAPEIIQDYLVICKPKMGYADISAMDLDEPVHGPPFQFNLASSSPEVNRIWTLNQVNDTAARLSYRKNAEVQEYSIPVTVKDRAGQSATKILRVNLCDCTHPSQCAARSRSAGITLGKWAILAILLGIALLFSVLLTLVCGVVTARKGKHFPEDLAQQNLIISNTEAPGDDRVCSANGFTMQTANNSSQGFCGTMGSGMRNGGQETIEMMKGHQTLDSCRVAGHHHTLDSCRGGHMETDNCRYTYSEWHSFTQPRLGEKLHACNQNEDHTPSQDYVLTYHYEGRGSPAGSVGCCSEKQEEEGLDFLNNLEPKFLTLAETCTKR
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.1	Very low	30.3	Very low	235 Å²	235	155 Å²	155	100%	1.158	84%	0.835	S	S	*	*				0	124.5	0	-65.3	152.5	-179.7	0	0	105.9
2	M	27.6	Very low	30.3	Very low	165 Å²	165	162.1 Å²	162.1	81%	0.813	84%	0.841	S	S	*	*				58.9	126.4	67.1	-73.5	-176.6	170.2	0	0	111.5
3	F	27.8	Very low	30.2	Very low	171 Å²	171	156.4 Å²	156.4	75%	0.75	83%	0.832	S	S	*	*			cis	-157.9	155	8.2	-129.8	-66.5	0	0	0	111.6
4	S	29.5	Very low	29.9	Very low	114 Å²	114	158.8 Å²	158.8	80%	0.797	84%	0.84	S	S	*	*			trans	59.2	154	155.2	55.4	0	0	0	0	121.2
5	G	29.3	Very low	29.6	Very low	61 Å²	61	152.3 Å²	152.3	63%	0.629	83%	0.826	S	S	*	*			cis	139.9	117.9	-16.3	0	0	0	0	0	116.8
6	L	28.8	Very low	29.7	Very low	176 Å²	176	151.8 Å²	151.8	92%	0.921	83%	0.829	S	S	*	*			trans	64.5	143.3	164.3	-57.7	118.4	0	0	0	116.7
7	R	28.8	Very low	29.7	Very low	240 Å²	240	153.5 Å²	153.5	91%	0.906	83%	0.83	S	S	*	*			cis	-151.4	161.8	43.9	-83.9	-179.5	162.5	159.4	-4.3	114.4
8	S	28.6	Very low	29.8	Very low	90 Å²	90	154.6 Å²	154.6	63%	0.629	83%	0.834	S	S	*	*			trans	-108.2	165	159.1	166.2	0	0	0	0	109.5
9	P	40.8	Very low	30	Very low	129 Å²	129	155.1 Å²	155.1	84%	0.838	83%	0.833	S	S	*	*				-129.6	170.3	120	32.5	-21.5	0	0	0	114.1
10	R	29.8	Very low	30.1	Very low	244 Å²	244	155.2 Å²	155.2	92%	0.921	83%	0.832	S	S	*	*			trans	-114.1	155.7	-176.4	-73.9	170.7	159.3	172.1	-6.8	111.8
11	G	27.2	Very low	30.2	Very low	80 Å²	80	156.5 Å²	156.5	83%	0.825	84%	0.836	S	S	*	*			trans	158.4	103.4	163.3	0	0	0	0	0	111.9
12	R	29.8	Very low	30.1	Very low	240 Å²	240	152.6 Å²	152.6	91%	0.906	82%	0.819	S	S	*	*			cis	113.9	76.5	11.9	-163.7	-160.7	-170.7	-168.3	3.7	113.7
13	A	29.3	Very low	30.1	Very low	88 Å²	88	156.2 Å²	156.2	73%	0.727	82%	0.824	S	S	*	*			trans	-156.6	128.9	148.9	0	0	0	0	0	105.7
14	M	26.5	Very low	30.1	Very low	190 Å²	190	152.5 Å²	152.5	94%	0.936	82%	0.815	S	S	*	*				57.9	119.3	62.4	-62.6	-171.5	97.8	0	0	112.4
15	G	25.4	Very low	30.4	Very low	61 Å²	61	157.6 Å²	157.6	63%	0.629	82%	0.823	S	S	*	*			cis	-173.6	-163.2	0.3	0	0	0	0	0	113.1
16	T	30.2	Very low	30.4	Very low	144 Å²	144	159.3 Å²	159.3	88%	0.883	83%	0.825	S	S	*	*			trans	70.9	142.5	-157	75.8	0	0	0	0	112.4
17	Q	30.2	Very low	30.9	Very low	181 Å²	181	160.3 Å²	160.3	85%	0.846	82%	0.823	S	S	*	*			cis	-135.5	121.1	7.9	-166.8	166.9	-4.6	0	0	110.1
18	L	31.3	Very low	31.2	Very low	173 Å²	173	155.6 Å²	155.6	91%	0.906	82%	0.82	S	S	*	*			trans	-100.7	92	-175.3	-168.9	141.6	0	0	0	110.3
19	M	34.1	Very low	31.8	Very low	165 Å²	165	154 Å²	154	81%	0.813	82%	0.818	S	S	*	*			trans	-149.5	160.2	169.4	-92.4	-62.8	173.9	0	0	109
20	L	31.3	Very low	32.4	Very low	156 Å²	156	156 Å²	156	82%	0.817	82%	0.816	S	S	*	*			trans	64.5	51.4	177.2	-69.8	149.7	0	0	0	116
21	M	32.5	Very low	33.9	Very low	183 Å²	183	148.9 Å²	148.9	90%	0.901	81%	0.81	S	S	*	*			trans	-99.9	72.5	146.8	-93	-67.1	-70	0	0	109.5
22	L	33.3	Very low	36.2	Very low	154 Å²	154	146 Å²	146	81%	0.806	78%	0.777	S	S	*	*			trans	171.2	94.4	158	-100.1	162.3	0	0	0	110.1
23	W	27.3	Very low	38.6	Very low	240 Å²	240	141.6 Å²	141.6	91%	0.909	76%	0.764	S	S	*	*			trans	-165	139.7	142.8	-121.9	51.4	0	0	0	111.1
24	V	29.1	Very low	41.2	Very low	94 Å²	94	143.8 Å²	143.8	57%	0.57	76%	0.757	S	S	*	*			trans	59.8	104.1	163.4	-172.2	0	0	0	0	118.4	S26	V24-S26 VanDerWaalsContact CG1-OG 3.29Å; V24-S26 WeakPolarHBondContact CG1-OG 3.41Å
25	F	34.8	Very low	44.1	Very low	221 Å²	221	136.5 Å²	136.5	97%	0.969	72%	0.724	S	S	*	*			trans	-71.4	122	140.3	-105.7	-93.8	0	0	0	108.5
26	S	30.1	Very low	46.9	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	71%	0.711	S	S	*	*			trans	-157.4	133.3	161.6	60.9	0	0	0	0	111.5	V24	V24-S26 VanDerWaalsContact CG1-OG 3.29Å; V24-S26 WeakPolarHBondContact CG1-OG 3.41Å
27	F	39.4	Very low	49.5	Very low	198 Å²	198	130.4 Å²	130.4	87%	0.868	67%	0.673	S	S	*	*			trans	-65.4	157.4	167.5	-85.3	-110.2	0	0	0	111.8
28	V	34.3	Very low	52.1	Low	140 Å²	140	126.8 Å²	126.8	85%	0.848	66%	0.66	S	S	*	*			trans	171.2	125.7	138.2	149.1	0	0	0	0	105.1
29	G	42.3	Very low	54.4	Low	58 Å²	58	118.6 Å²	118.6	60%	0.598	62%	0.617	S	S	*	*			cis	109.4	91	13.2	0	0	0	0	0	109.2	A31	G29-A31 PolarHBondContact O-N 3.18Å
30	E	52.4	Low	56.5	Low	169 Å²	169	113.8 Å²	113.8	79%	0.79	60%	0.598	S	S	*	*			trans	-56.2	109.9	-175.6	-68.6	-178.2	125.7	0	0	111.4	K107	E30-K107 PolarHBondContact O-NZ 3.04Å
31	A	60.6	Low	58.6	Low	95 Å²	95	109 Å²	109	79%	0.785	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-74	135.1	178.2	0	0	0	0	0	109.9	G29	G29-A31 PolarHBondContact O-N 3.18Å
32	C	75.4	Confident	60.8	Low	19 Å²	19	104 Å²	104	13%	0.128	56%	0.557	C	S	.	*	P	Polyproline II helix	trans	-67.6	151.3	-179.5	-64.4	0	0	0	0	111.6	K34 C57 E108 I109	C32-K34 PolarHBondContact O-N 3.06Å; C32-C57 HydrophobicContact CB-CB 3.64Å; C32-C57 WeakPolarHBondContact CB-SG 3.41Å; C32-C57 WeakPolarHBondContact SG-CA 3.45Å; C32-C57 WeakPolarHBondContact SG-CB 3.01Å; C32-C57 CovalentContact SG-SG 2.03Å; C32-C57 PolarHBondContact SG-SG 2.87Å; C32-E108 WeakPolarHBondContact CB-O 3.08Å; C32-I109 HydrophobicContact CB-CG1 4.05Å
33	K	80.1	Confident	63.2	Low	149 Å²	149	96.9 Å²	96.9	65%	0.648	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-59.8	130.5	-178.3	-68.2	178.9	-170.9	165	0	110.6	E56	K33-E56 WeakPolarHBondContact CD-OE1 3.46Å; K33-E56 WeakPolarHBondContact CE-OE1 3.46Å; K33-E56 IonicContact NZ-OE1 3.39Å; K33-E56 PolarHBondContact NZ-OE1 2.96Å
34	K	83.9	Confident	65.7	Low	133 Å²	133	91.4 Å²	91.4	58%	0.578	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-65.1	131.5	173.1	-179.3	176.4	-179.3	174.1	0	110.6	C32 P110 I112	C32-K34 PolarHBondContact O-N 3.06Å; K34-P110 WeakPolarHBondContact CA-O 3.49Å; K34-P110 HydrophobicContact CB-CG 3.99Å; K34-P110 HydrophobicContact CG-CG 4.14Å; K34-I112 VanDerWaalsContact NZ-CD1 3.27Å
35	V	87.4	Confident	68.4	Low	38 Å²	38	90.7 Å²	90.7	23%	0.23	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	143.3	179.8	-179.4	0	0	0	0	110.2	L37 V52 I109 P110 V111 I112	V35-L37 HydrophobicContact CG1-CD2 4.06Å; V35-V52 HydrophobicContact CG1-CG2 4.31Å; V35-V52 HydrophobicContact CG2-CG1 4.23Å; V35-I109 HydrophobicContact CG2-CG2 4.08Å; V35-P110 PolarHBondContact N-O 2.86Å; V35-V111 WeakPolarHBondContact O-CA 3.32Å; V35-I112 PolarHBondContact O-N 3.18Å
36	T	85.8	Confident	70.5	Confident	61 Å²	61	84 Å²	84	37%	0.374	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.4	177.2	-53.5	0	0	0	0	109.4	I112 E114	T36-I112 CarbonylContact C-O 3.08Å; T36-I112 WeakPolarHBondContact CA-O 3.3Å; T36-E114 HydrophobicContact CG2-CB 4.01Å; T36-E114 HydrophobicContact CG2-CG 3.67Å
37	L	84.9	Confident	73	Confident	16 Å²	16	83.7 Å²	83.7	8%	0.084	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.3	178.4	-57.7	-179	0	0	0	109.6	V35 V39 V79 V111 I112 L113 E114	V35-L37 HydrophobicContact CG1-CD2 4.06Å; L37-V39 HydrophobicContact CB-CG1 4.43Å; L37-V79 HydrophobicContact CD1-CG2 4.37Å; L37-V111 HydrophobicContact CD1-CG1 4.06Å; L37-V111 HydrophobicContact CG-CG1 4.2Å; L37-I112 PolarHBondContact N-O 2.8Å; L37-L113 HydrophobicContact CB-CD2 3.99Å; L37-L113 HydrophobicContact CD1-CD2 4.27Å; L37-E114 PolarHBondContact O-N 2.78Å
38	N	83.5	Confident	75.2	Confident	104 Å²	104	78.5 Å²	78.5	56%	0.556	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	95.4	-174.4	-76	-59.9	0	0	0	110.9	E114 Q116	N38-E114 CarbonylContact C-O 3.58Å; N38-E114 WeakPolarHBondContact CA-O 2.93Å; N38-Q116 HydrophobicContact CB-CG 3.99Å; N38-Q116 PolarHBondContact O-NE2 3.03Å
39	V	80.9	Confident	77.7	Confident	2 Å²	2	72.9 Å²	72.9	1%	0.012	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	156.1	-165.7	-69.7	0	0	0	0	114.1	L37 L43 I49 L87 L113 E114 H115 Q116	L37-V39 HydrophobicContact CB-CG1 4.43Å; V39-L43 HydrophobicContact CB-CD2 4.13Å; V39-L43 HydrophobicContact CG1-CD2 4.4Å; V39-I49 HydrophobicContact CG1-CB 4.05Å; V39-L87 HydrophobicContact CG2-CD1 3.58Å; V39-L113 HydrophobicContact CG1-CD2 4.36Å; V39-L113 HydrophobicContact CG2-CB 3.92Å; V39-E114 PolarHBondContact N-O 2.97Å; V39-H115 WeakPolarHBondContact O-CA 3.35Å; V39-Q116 PolarHBondContact O-N 2.81Å
40	P	78.2	Confident	79.7	Confident	64 Å²	64	71 Å²	71	42%	0.416	39%	0.389	S	S	.	.			trans	-66.4	170.6	167.8	28.3	-33.8	0	0	0	112.2	T42 L43	P40-T42 VanDerWaalsContact C-N 3.27Å; P40-T42 WeakPolarHBondContact CG-O 3.37Å; P40-T42 PolarHBondContact O-N 3.39Å; P40-L43 HydrophobicContact CG-CD2 4.1Å
41	S	74.6	Confident	81.3	Confident	55 Å²	55	70.5 Å²	70.5	39%	0.385	38%	0.38	S	S	.	.	S	Bend	trans	-72.3	-17.3	177.6	40.7	0	0	0	0	114.3	L87 H115	S41-L87 PolarHBondContact O-N 3.25Å; S41-H115 PolarHBondContact N-ND1 2.83Å
42	T	79.3	Confident	82.6	Confident	78 Å²	78	66.1 Å²	66.1	48%	0.479	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	127.3	-178.8	46.1	0	0	0	0	108.3	P40 L85 V86	P40-T42 VanDerWaalsContact C-N 3.27Å; P40-T42 WeakPolarHBondContact CG-O 3.37Å; P40-T42 PolarHBondContact O-N 3.39Å; T42-L85 CarbonylContact C-O 3.59Å; T42-L85 WeakPolarHBondContact CA-O 3.48Å; T42-V86 HydrophobicContact CG2-CG2 4.39Å
43	L	83.3	Confident	83.1	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.021	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.6	178	-59.7	-179.2	0	0	0	109.2	V39 P40 I49 F71 P81 A84 L85 L87	V39-L43 HydrophobicContact CB-CD2 4.13Å; V39-L43 HydrophobicContact CG1-CD2 4.4Å; P40-L43 HydrophobicContact CG-CD2 4.1Å; L43-I49 HydrophobicContact CD1-CD1 4.4Å; L43-I49 HydrophobicContact CD1-CG2 4.24Å; L43-I49 HydrophobicContact CD2-CG2 3.68Å; L43-I49 HydrophobicContact CG-CG2 4.43Å; L43-F71 HydrophobicContact CD1-CE1 3.97Å; L43-F71 HydrophobicContact CD1-CZ 4.39Å; L43-P81 HydrophobicContact CB-CB 4.38Å; L43-P81 HydrophobicContact CB-CG 4.2Å; L43-A84 WeakPolarHBondContact O-CA 3.4Å; L43-L85 HydrophobicContact CB-CB 4.3Å; L43-L85 HydrophobicContact CD1-CD1 4.49Å; L43-L85 PolarHBondContact N-O 2.98Å; L43-L85 PolarHBondContact O-N 3.12Å; L43-L87 HydrophobicContact CD1-CD1 4.31Å
44	E	80.7	Confident	83.3	Confident	125 Å²	125	63.3 Å²	63.3	58%	0.584	33%	0.334	S	S	*	.			trans	-89.7	148.1	176.9	-67.9	176.8	-179.6	0	0	110.7	Q47 P81	E44-Q47 HydrophobicContact CB-CB 4.4Å; E44-Q47 WeakPolarHBondContact O-CB 3.48Å; E44-Q47 PolarHBondContact O-N 2.98Å; E44-P81 WeakPolarHBondContact O-CG 3.23Å
45	V	85.3	Confident	83.1	Confident	80 Å²	80	64.7 Å²	64.7	49%	0.485	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	138	-178.8	-169.7	0	0	0	0	110	Q47 A84	V45-Q47 PolarHBondContact O-N 3.37Å; V45-A84 HydrophobicContact CG2-CB 4.15Å
46	D	78.3	Confident	82.9	Confident	79 Å²	79	68 Å²	68	42%	0.422	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	8.5	174.6	-73.9	27.5	0	0	0	115.9	R72 Y80 P81	D46-R72 VanDerWaalsContact CG-CZ 3.43Å; D46-R72 IonicContact OD1-CZ 2.72Å; D46-R72 VanDerWaalsContact OD1-CZ 3.27Å; D46-R72 IonicContact OD1-NH1 2.63Å; D46-R72 PolarHBondContact OD1-NH1 3.25Å; D46-R72 IonicContact OD1-NH2 2.81Å; D46-R72 PolarHBondContact OD1-NH2 3.37Å; D46-R72 IonicContact OD2-CZ 3.85Å; D46-R72 IonicContact OD2-NH1 3.32Å; D46-R72 PolarHBondContact OD2-NH1 2.98Å; D46-R72 IonicContact OD2-NH2 2.78Å; D46-R72 PolarHBondContact OD2-NH2 3.46Å; D46-Y80 VanDerWaalsContact O-CD1 3.25Å; D46-Y80 WeakPolarHBondContact O-CD1 3.39Å; D46-P81 PolarHBondContact N-O 2.82Å
47	Q	82.6	Confident	82.6	Confident	90 Å²	90	66 Å²	66	42%	0.421	34%	0.341	S	S	.	.			trans	-77.8	132.2	168.2	-170.9	176	67.5	0	0	110.4	E44 V45 I49 P81	E44-Q47 HydrophobicContact CB-CB 4.4Å; E44-Q47 WeakPolarHBondContact O-CB 3.48Å; E44-Q47 PolarHBondContact O-N 2.98Å; V45-Q47 PolarHBondContact O-N 3.37Å; Q47-I49 PolarHBondContact O-N 3Å; Q47-P81 WeakPolarHBondContact O-CD 3.43Å
48	I	86.1	Confident	82.5	Confident	90 Å²	90	66.3 Å²	66.3	46%	0.462	34%	0.343	S	S	.	.			trans	-69	122.5	176.6	-172.1	173.8	0	0	0	110.6	S78 Y80	I48-S78 WeakPolarHBondContact CD1-OG 3.46Å; I48-Y80 HydrophobicContact CB-CD1 4.17Å; I48-Y80 HydrophobicContact CB-CE1 3.72Å; I48-Y80 HydrophobicContact CG1-CE1 4.35Å
49	I	86.1	Confident	82	Confident	22 Å²	22	66.6 Å²	66.6	11%	0.113	35%	0.353	C	S	.	.			trans	-99.6	-7.9	-178.9	61.9	164	0	0	0	113.5	V39 L43 Q47 F71 V79 P81 L113	V39-I49 HydrophobicContact CG1-CB 4.05Å; L43-I49 HydrophobicContact CD1-CD1 4.4Å; L43-I49 HydrophobicContact CD1-CG2 4.24Å; L43-I49 HydrophobicContact CD2-CG2 3.68Å; L43-I49 HydrophobicContact CG-CG2 4.43Å; Q47-I49 PolarHBondContact O-N 3Å; I49-F71 HydrophobicContact CD1-CD1 3.78Å; I49-F71 HydrophobicContact CD1-CE1 3.69Å; I49-V79 HydrophobicContact CD1-CG1 3.88Å; I49-V79 HydrophobicContact CG1-CB 4.03Å; I49-V79 HydrophobicContact CG1-CG1 3.83Å; I49-V79 WeakPolarHBondContact CG1-O 3.26Å; I49-V79 PolarHBondContact N-O 3.39Å; I49-P81 HydrophobicContact CG2-CG 4.46Å; I49-L113 HydrophobicContact CD1-CD2 4.04Å
50	G	85.2	Confident	81.6	Confident	19 Å²	19	69.3 Å²	69.3	20%	0.196	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.7	178.9	177	0	0	0	0	0	111.9	V79	G50-V79 PolarHBondContact O-N 3.45Å
51	R	86.4	Confident	81.4	Confident	157 Å²	157	68 Å²	68	59%	0.592	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	137.3	-179.7	-167.7	169.8	-179.3	171	2.1	110.3	D76 G77	R51-D76 VanDerWaalsContact CZ-O 3.28Å; R51-D76 IonicContact CZ-OD2 3.65Å; R51-D76 PolarHBondContact NE-O 2.9Å; R51-D76 IonicContact NE-OD2 2.69Å; R51-D76 PolarHBondContact NE-OD2 3.03Å; R51-D76 IonicContact NH1-OD2 2.81Å; R51-D76 PolarHBondContact NH1-OD2 2.85Å; R51-D76 PolarHBondContact NH2-O 2.68Å; R51-D76 IonicContact NH2-OD2 2.68Å; R51-D76 PolarHBondContact NH2-OD2 3.04Å; R51-G77 CarbonylContact C-O 3.55Å; R51-G77 WeakPolarHBondContact CA-O 3.37Å
52	V	87.5	Confident	81.4	Confident	3 Å²	3	70.7 Å²	70.7	2%	0.018	37%	0.373	C	S	.	.			trans	-114.4	128.9	-176.9	179.3	0	0	0	0	108.7	V35 L54 G77 V79 I96 I109 V111	V35-V52 HydrophobicContact CG1-CG2 4.31Å; V35-V52 HydrophobicContact CG2-CG1 4.23Å; V52-L54 VanDerWaalsContact C-N 3.35Å; V52-L54 HydrophobicContact CB-CD2 4.17Å; V52-L54 HydrophobicContact CG1-CD2 3.92Å; V52-L54 PolarHBondContact O-N 3.36Å; V52-G77 PolarHBondContact N-O 3.38Å; V52-G77 VanDerWaalsContact O-CA 3.3Å; V52-G77 WeakPolarHBondContact O-CA 3.48Å; V52-V79 HydrophobicContact CG2-CG2 3.86Å; V52-I96 HydrophobicContact CB-CD1 4.23Å; V52-I96 HydrophobicContact CG1-CD1 4.21Å; V52-I96 HydrophobicContact CG2-CD1 3.96Å; V52-I109 HydrophobicContact CG1-CD1 3.79Å; V52-I109 HydrophobicContact CG1-CG2 4.02Å; V52-V111 HydrophobicContact CG2-CG2 4.27Å
53	N	84.6	Confident	81.4	Confident	97 Å²	97	68 Å²	68	52%	0.519	36%	0.36	S	S	.	.			trans	-77	83.9	178.4	-172	3.7	0	0	0	111.2	K55 E56	N53-K55 PolarHBondContact O-N 3.28Å; N53-K55 PolarHBondContact OD1-N 2.77Å; N53-E56 HydrophobicContact CB-CB 4.2Å; N53-E56 WeakPolarHBondContact O-CB 3.41Å; N53-E56 PolarHBondContact O-N 2.93Å; N53-E56 VanDerWaalsContact O-N 3.16Å
54	L	85.3	Confident	81.5	Confident	13 Å²	13	69.6 Å²	69.6	7%	0.068	37%	0.369	C	S	.	.	H	α-helix	trans	-57.5	-37.4	-178.4	-52.1	-175.7	0	0	0	111.9	V52 E56 C57 L58 I64 I96 L98 I109	V52-L54 VanDerWaalsContact C-N 3.35Å; V52-L54 HydrophobicContact CB-CD2 4.17Å; V52-L54 HydrophobicContact CG1-CD2 3.92Å; V52-L54 PolarHBondContact O-N 3.36Å; L54-E56 PolarHBondContact O-N 3.32Å; L54-C57 WeakPolarHBondContact O-CB 3.32Å; L54-C57 PolarHBondContact O-N 3.32Å; L54-L58 PolarHBondContact O-N 2.85Å; L54-I64 HydrophobicContact CD1-CD1 3.56Å; L54-I64 HydrophobicContact CD1-CG1 4.4Å; L54-I96 HydrophobicContact CD2-CG2 4.38Å; L54-L98 HydrophobicContact CB-CD1 4.14Å; L54-L98 HydrophobicContact CD1-CD2 4.35Å; L54-L98 HydrophobicContact CD2-CD1 4.48Å; L54-L98 HydrophobicContact CD2-CD2 4.31Å; L54-I109 HydrophobicContact CD2-CD1 3.92Å
55	K	80.1	Confident	81.6	Confident	161 Å²	161	72.3 Å²	72.3	70%	0.7	37%	0.374	S	S	*	.	H	α-helix	trans	-67.3	-19	-178.6	-63.1	-174.3	-178.8	-178.7	0	114.1	N53 C57 L58	N53-K55 PolarHBondContact O-N 3.28Å; N53-K55 PolarHBondContact OD1-N 2.77Å; K55-C57 VanDerWaalsContact C-N 3.33Å; K55-L58 WeakPolarHBondContact CA-O 3.29Å
56	E	81.5	Confident	81.7	Confident	109 Å²	109	70.5 Å²	70.5	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-76.8	-21.6	171.9	-173.7	174.8	178.8	0	0	112.5	K33 N53 L54	K33-E56 WeakPolarHBondContact CD-OE1 3.46Å; K33-E56 WeakPolarHBondContact CE-OE1 3.46Å; K33-E56 IonicContact NZ-OE1 3.39Å; K33-E56 PolarHBondContact NZ-OE1 2.96Å; N53-E56 HydrophobicContact CB-CB 4.2Å; N53-E56 WeakPolarHBondContact O-CB 3.41Å; N53-E56 PolarHBondContact O-N 2.93Å; N53-E56 VanDerWaalsContact O-N 3.16Å; L54-E56 PolarHBondContact O-N 3.32Å
57	C	80.8	Confident	82.1	Confident	19 Å²	19	70.1 Å²	70.1	13%	0.128	37%	0.366	C	S	.	.	H	α-helix	trans	-96.2	-42.6	178.2	175.2	0	0	0	0	112.6	C32 L54 K55 L98 K107 I109	C32-C57 HydrophobicContact CB-CB 3.64Å; C32-C57 WeakPolarHBondContact CB-SG 3.41Å; C32-C57 WeakPolarHBondContact SG-CA 3.45Å; C32-C57 WeakPolarHBondContact SG-CB 3.01Å; C32-C57 CovalentContact SG-SG 2.03Å; C32-C57 PolarHBondContact SG-SG 2.87Å; L54-C57 WeakPolarHBondContact O-CB 3.32Å; L54-C57 PolarHBondContact O-N 3.32Å; K55-C57 VanDerWaalsContact C-N 3.33Å; C57-L98 HydrophobicContact CB-CD1 4.15Å; C57-K107 VanDerWaalsContact SG-CB 3.57Å; C57-I109 HydrophobicContact CB-CD1 3.64Å; C57-I109 HydrophobicContact CB-CG1 3.76Å; C57-I109 WeakPolarHBondContact SG-CG1 3.42Å
58	L	81.8	Confident	82.1	Confident	22 Å²	22	66.9 Å²	66.9	12%	0.115	35%	0.352	C	S	.	.			trans	-148.8	118	177.3	-167.1	66	0	0	0	108.9	L54 K55 S60 A61 L98 D100 K107	L54-L58 PolarHBondContact O-N 2.85Å; K55-L58 WeakPolarHBondContact CA-O 3.29Å; L58-S60 WeakPolarHBondContact CD2-O 3.34Å; L58-S60 WeakPolarHBondContact CG-O 3.43Å; L58-S60 PolarHBondContact O-N 3.32Å; L58-A61 HydrophobicContact CD2-CB 4.17Å; L58-L98 HydrophobicContact CB-CB 4.45Å; L58-L98 HydrophobicContact CB-CD1 4.04Å; L58-L98 HydrophobicContact CD2-CB 4.04Å; L58-D100 HydrophobicContact CD2-CB 4.09Å; L58-K107 HydrophobicContact CB-CG 4.45Å; L58-K107 HydrophobicContact CD1-CG 4.14Å
59	S	74.3	Confident	81.9	Confident	109 Å²	109	67.7 Å²	67.7	76%	0.762	36%	0.363	S	S	*	.	S	Bend	trans	-67.6	-19.9	-170.9	52.3	0	0	0	0	114.5
60	S	72.3	Confident	81.9	Confident	59 Å²	59	67.2 Å²	67.2	41%	0.413	36%	0.361	S	S	.	.	S	Bend	trans	-141.2	117.7	172.1	-180	0	0	0	0	107.5	L58	L58-S60 WeakPolarHBondContact CD2-O 3.34Å; L58-S60 WeakPolarHBondContact CG-O 3.43Å; L58-S60 PolarHBondContact O-N 3.32Å
61	A	73.9	Confident	82	Confident	36 Å²	36	66.4 Å²	66.4	30%	0.298	35%	0.352	S	S	.	.			trans	-124.1	135.3	172.8	0	0	0	0	0	107.8	L58 L98	L58-A61 HydrophobicContact CD2-CB 4.17Å; A61-L98 HydrophobicContact CB-CB 4.14Å; A61-L98 HydrophobicContact CB-CD2 4.09Å; A61-L98 HydrophobicContact CB-CG 4.49Å
62	E	74.8	Confident	82.1	Confident	112 Å²	112	63.5 Å²	63.5	52%	0.523	34%	0.341	S	S	.	.	S	Bend	trans	-116.6	-17.1	-176.8	-163.6	170.8	-110.9	0	0	111.5	S99 S101 K102	E62-S99 PolarHBondContact N-O 3.34Å; E62-S101 WeakPolarHBondContact OE2-CB 3.46Å; E62-S101 PolarHBondContact OE2-OG 3.2Å; E62-K102 WeakPolarHBondContact OE1-CE 2.95Å; E62-K102 IonicContact OE1-NZ 3.05Å; E62-K102 PolarHBondContact OE1-NZ 2.99Å
63	G	78	Confident	82.2	Confident	21 Å²	21	64.3 Å²	64.3	22%	0.216	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.9	165.2	0	0	0	0	0	111	S99	G63-S99 WeakPolarHBondContact CA-OG 3.36Å; G63-S99 PolarHBondContact N-O 3.32Å; G63-S99 PolarHBondContact O-N 3.28Å; G63-S99 PolarHBondContact O-OG 3.44Å
64	I	86.3	Confident	82.3	Confident	39 Å²	39	63.4 Å²	63.4	20%	0.2	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.2	170.5	-55.4	173.8	0	0	0	107.5	L54 V73 D75 I96 L98	L54-I64 HydrophobicContact CD1-CD1 3.56Å; L54-I64 HydrophobicContact CD1-CG1 4.4Å; I64-V73 HydrophobicContact CG2-CB 4.2Å; I64-V73 HydrophobicContact CG2-CG1 4.26Å; I64-D75 HydrophobicContact CD1-CB 4.48Å; I64-D75 WeakPolarHBondContact CD1-OD1 3Å; I64-I96 HydrophobicContact CG2-CG2 3.88Å; I64-L98 HydrophobicContact CB-CD2 4.38Å; I64-L98 HydrophobicContact CG1-CD2 3.86Å; I64-L98 HydrophobicContact CG2-CD2 4.2Å
65	R	83.1	Confident	82.1	Confident	182 Å²	182	69.4 Å²	69.4	69%	0.687	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.2	144.2	174.2	-65.1	-173.6	177.3	-167.5	-1.7	111.1	I96 Q97	R65-I96 CarbonylContact O-C 3.6Å; R65-I96 WeakPolarHBondContact O-CA 3.38Å; R65-Q97 HydrophobicContact CB-CB 4.47Å; R65-Q97 PolarHBondContact N-O 3.09Å; R65-Q97 PolarHBondContact O-N 3.1Å
66	T	87.5	Confident	82.2	Confident	41 Å²	41	64.9 Å²	64.9	25%	0.252	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	143.4	172.3	46.7	0	0	0	0	110.6	D68 F71 V73 F94 V95	T66-D68 PolarHBondContact O-N 3.36Å; T66-D68 PolarHBondContact OG1-O 2.83Å; T66-F71 WeakPolarHBondContact CB-O 3.46Å; T66-F71 WeakPolarHBondContact CG2-O 3.4Å; T66-F71 PolarHBondContact OG1-O 2.9Å; T66-V73 HydrophobicContact CG2-CB 4.48Å; T66-V73 HydrophobicContact CG2-CG2 3.67Å; T66-F94 HydrophobicContact CG2-CD2 4.43Å; T66-F94 HydrophobicContact CG2-CE2 4.34Å; T66-V95 WeakPolarHBondContact CA-O 3.39Å
67	S	85.1	Confident	82.2	Confident	72 Å²	72	59.7 Å²	59.7	50%	0.503	33%	0.332	S	S	.	.	S	Bend	trans	-78.9	-4.3	173.2	78	0	0	0	0	113.6	V95	S67-V95 PolarHBondContact N-O 2.92Å; S67-V95 PolarHBondContact OG-N 3.09Å
68	D	83.6	Confident	82.5	Confident	21 Å²	21	59 Å²	59	11%	0.112	33%	0.327	C	S	.	.	S	Bend	trans	-132.5	110.4	-176.3	-173.9	-13	0	0	0	107.6	T66 D70 F71 R92 F94	T66-D68 PolarHBondContact O-N 3.36Å; T66-D68 PolarHBondContact OG1-O 2.83Å; D68-D70 PolarHBondContact O-N 2.89Å; D68-D70 VanDerWaalsContact O-N 3.12Å; D68-D70 WeakPolarHBondContact OD1-CB 3.43Å; D68-D70 PolarHBondContact OD1-N 3.46Å; D68-F71 HydrophobicContact CB-CD2 4.2Å; D68-F71 PolarHBondContact O-N 3.39Å; D68-F71 VanDerWaalsContact O-N 3.16Å; D68-R92 IonicContact OD1-CZ 2.72Å; D68-R92 IonicContact OD1-NH2 2.63Å; D68-R92 PolarHBondContact OD1-NH2 3.24Å; D68-R92 IonicContact OD2-CZ 2.71Å; D68-R92 IonicContact OD2-NE 3.94Å; D68-R92 PolarHBondContact OD2-NE 3.46Å; D68-R92 IonicContact OD2-NH2 2.76Å; D68-R92 PolarHBondContact OD2-NH2 3.3Å; D68-F94 HydrophobicContact CB-CB 3.47Å; D68-F94 VanDerWaalsContact CB-CB 3.47Å; D68-F94 HydrophobicContact CB-CG 4.18Å
69	P	82.4	Confident	82.8	Confident	108 Å²	108	58 Å²	58	70%	0.701	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-8.9	-173.6	30.6	-36.9	0	0	0	113.1	F71	P69-F71 PolarHBondContact O-N 2.91Å
70	D	85.3	Confident	83.6	Confident	12 Å²	12	54.9 Å²	54.9	6%	0.064	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-7.5	173.4	-72.5	-2.6	0	0	0	112.9	D68 P81 A82 R83 L85 R92	D68-D70 PolarHBondContact O-N 2.89Å; D68-D70 VanDerWaalsContact O-N 3.12Å; D68-D70 WeakPolarHBondContact OD1-CB 3.43Å; D68-D70 PolarHBondContact OD1-N 3.46Å; D70-P81 CarbonylContact O-C 3.54Å; D70-P81 VanDerWaalsContact O-CA 3.31Å; D70-P81 WeakPolarHBondContact O-CA 3.35Å; D70-A82 PolarHBondContact O-N 2.86Å; D70-R83 IonicContact OD1-CZ 3.06Å; D70-R83 IonicContact OD1-NE 2.65Å; D70-R83 PolarHBondContact OD1-NE 3.38Å; D70-R83 IonicContact OD1-NH2 3.95Å; D70-R83 PolarHBondContact OD1-NH2 2.88Å; D70-R83 IonicContact OD2-NE 3.15Å; D70-R83 IonicContact OD2-NH2 3.97Å; D70-L85 HydrophobicContact CB-CD1 3.91Å; D70-L85 HydrophobicContact CB-CD2 4.24Å; D70-L85 WeakPolarHBondContact OD2-CD2 3.25Å; D70-R92 VanDerWaalsContact CG-NH2 3.28Å; D70-R92 IonicContact OD2-CZ 2.71Å; D70-R92 VanDerWaalsContact OD2-CZ 3.22Å; D70-R92 IonicContact OD2-NH1 3.36Å; D70-R92 PolarHBondContact OD2-NH1 2.92Å; D70-R92 IonicContact OD2-NH2 2.7Å; D70-R92 PolarHBondContact OD2-NH2 2.99Å
71	F	87.9	Confident	84.3	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	135.1	178.9	-57.5	-77.9	0	0	0	112.4	L43 I49 T66 D68 P69 Y80 P81 L85 F94 L113	L43-F71 HydrophobicContact CD1-CE1 3.97Å; L43-F71 HydrophobicContact CD1-CZ 4.39Å; I49-F71 HydrophobicContact CD1-CD1 3.78Å; I49-F71 HydrophobicContact CD1-CE1 3.69Å; T66-F71 WeakPolarHBondContact CB-O 3.46Å; T66-F71 WeakPolarHBondContact CG2-O 3.4Å; T66-F71 PolarHBondContact OG1-O 2.9Å; D68-F71 HydrophobicContact CB-CD2 4.2Å; D68-F71 PolarHBondContact O-N 3.39Å; D68-F71 VanDerWaalsContact O-N 3.16Å; P69-F71 PolarHBondContact O-N 2.91Å; F71-Y80 CarbonylContact C-O 3.47Å; F71-Y80 WeakPolarHBondContact CA-O 3.27Å; F71-P81 HydrophobicContact CD1-CB 4.23Å; F71-P81 HydrophobicContact CE1-CB 4.13Å; F71-L85 HydrophobicContact CE1-CD1 3.83Å; F71-L85 HydrophobicContact CE2-CD1 4.36Å; F71-L85 HydrophobicContact CZ-CD1 3.63Å; F71-F94 HydrophobicContact CB-CE1 4.31Å; F71-F94 HydrophobicContact CB-CE2 4.45Å; F71-F94 HydrophobicContact CB-CZ 4.16Å; F71-F94 HydrophobicContact CD1-CE1 4.35Å; F71-F94 AromaticContact CD2-CD1 3.67Å; F71-F94 HydrophobicContact CD2-CD1 3.67Å; F71-F94 AromaticContact CD2-CE1 3.72Å; F71-F94 HydrophobicContact CD2-CE1 3.72Å; F71-F94 HydrophobicContact CD2-CG 4.32Å; F71-F94 HydrophobicContact CD2-CZ 4.41Å; F71-F94 HydrophobicContact CE2-CD1 4.02Å; F71-F94 HydrophobicContact CE2-CE1 4.15Å; F71-F94 HydrophobicContact CG-CD1 4.24Å; F71-F94 AromaticContact CG-CE1 3.84Å; F71-F94 HydrophobicContact CG-CE1 3.84Å; F71-F94 HydrophobicContact CG-CZ 4.17Å; F71-L113 HydrophobicContact CE1-CD1 3.89Å; F71-L113 HydrophobicContact CE2-CD1 4.12Å; F71-L113 HydrophobicContact CZ-CD1 3.45Å; F71-L113 VanDerWaalsContact CZ-CD1 3.45Å
72	R	88.7	Confident	84.7	Confident	95 Å²	95	52.8 Å²	52.8	36%	0.358	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	149.6	169.8	69.8	179.5	-162.2	-149	3.1	110.3	D46 Y80	D46-R72 VanDerWaalsContact CG-CZ 3.43Å; D46-R72 IonicContact OD1-CZ 2.72Å; D46-R72 VanDerWaalsContact OD1-CZ 3.27Å; D46-R72 IonicContact OD1-NH1 2.63Å; D46-R72 PolarHBondContact OD1-NH1 3.25Å; D46-R72 IonicContact OD1-NH2 2.81Å; D46-R72 PolarHBondContact OD1-NH2 3.37Å; D46-R72 IonicContact OD2-CZ 3.85Å; D46-R72 IonicContact OD2-NH1 3.32Å; D46-R72 PolarHBondContact OD2-NH1 2.98Å; D46-R72 IonicContact OD2-NH2 2.78Å; D46-R72 PolarHBondContact OD2-NH2 3.46Å; R72-Y80 HydrophobicContact CG-CD2 4.46Å; R72-Y80 PolarHBondContact N-O 3.35Å; R72-Y80 PolarHBondContact O-N 2.68Å
73	V	88.8	Confident	85.1	Confident	21 Å²	21	54.5 Å²	54.5	13%	0.127	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.9	179.2	-178.6	0	0	0	0	108.5	I64 T66 S78 V79 I96	I64-V73 HydrophobicContact CG2-CB 4.2Å; I64-V73 HydrophobicContact CG2-CG1 4.26Å; T66-V73 HydrophobicContact CG2-CB 4.48Å; T66-V73 HydrophobicContact CG2-CG2 3.67Å; V73-S78 WeakPolarHBondContact CA-O 3.2Å; V73-V79 HydrophobicContact CG2-CG1 4.25Å; V73-V79 HydrophobicContact CG2-CG2 4.14Å; V73-I96 HydrophobicContact CG1-CD1 4.31Å; V73-I96 HydrophobicContact CG2-CD1 3.91Å; V73-I96 HydrophobicContact CG2-CG1 4.15Å
74	L	86.8	Confident	85.2	Confident	77 Å²	77	57 Å²	57	40%	0.403	30%	0.3	S	S	.	.			trans	-95.1	164.3	177.4	-56.8	-177.6	0	0	0	111.4	D76 G77 S78 Y80	L74-D76 WeakPolarHBondContact CB-OD1 3.03Å; L74-D76 PolarHBondContact O-N 3.38Å; L74-D76 VanDerWaalsContact O-N 3.14Å; L74-G77 WeakPolarHBondContact O-CA 3.26Å; L74-G77 PolarHBondContact O-N 2.96Å; L74-S78 PolarHBondContact N-O 3.01Å; L74-Y80 HydrophobicContact CD1-CD2 4.41Å; L74-Y80 HydrophobicContact CD1-CE2 3.58Å; L74-Y80 HydrophobicContact CG-CD2 4.32Å; L74-Y80 HydrophobicContact CG-CE2 3.86Å
75	D	82.2	Confident	84.9	Confident	139 Å²	139	56 Å²	56	74%	0.743	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-22.6	-177.8	-54.5	-50.5	0	0	0	113.9	I64 G77	I64-D75 HydrophobicContact CD1-CB 4.48Å; I64-D75 WeakPolarHBondContact CD1-OD1 3Å; D75-G77 PolarHBondContact O-N 3.38Å
76	D	80.6	Confident	84.7	Confident	67 Å²	67	53 Å²	53	36%	0.358	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-9.9	174.4	91.7	-52.4	0	0	0	112.9	R51 L74 S78	R51-D76 VanDerWaalsContact CZ-O 3.28Å; R51-D76 IonicContact CZ-OD2 3.65Å; R51-D76 PolarHBondContact NE-O 2.9Å; R51-D76 IonicContact NE-OD2 2.69Å; R51-D76 PolarHBondContact NE-OD2 3.03Å; R51-D76 IonicContact NH1-OD2 2.81Å; R51-D76 PolarHBondContact NH1-OD2 2.85Å; R51-D76 PolarHBondContact NH2-O 2.68Å; R51-D76 IonicContact NH2-OD2 2.68Å; R51-D76 PolarHBondContact NH2-OD2 3.04Å; L74-D76 WeakPolarHBondContact CB-OD1 3.03Å; L74-D76 PolarHBondContact O-N 3.38Å; L74-D76 VanDerWaalsContact O-N 3.14Å; D76-S78 VanDerWaalsContact CG-OG 3.3Å; D76-S78 WeakPolarHBondContact OD1-CB 3.48Å; D76-S78 PolarHBondContact OD1-N 3.45Å; D76-S78 PolarHBondContact OD1-OG 3.37Å; D76-S78 PolarHBondContact OD2-OG 2.98Å
77	G	81.3	Confident	84.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.291	C	S	.	.			trans	93.7	0.8	-176.6	0	0	0	0	0	115.6	R51 V52 L74 D75	R51-G77 CarbonylContact C-O 3.55Å; R51-G77 WeakPolarHBondContact CA-O 3.37Å; V52-G77 PolarHBondContact N-O 3.38Å; V52-G77 VanDerWaalsContact O-CA 3.3Å; V52-G77 WeakPolarHBondContact O-CA 3.48Å; L74-G77 WeakPolarHBondContact O-CA 3.26Å; L74-G77 PolarHBondContact O-N 2.96Å; D75-G77 PolarHBondContact O-N 3.38Å
78	S	88.3	Confident	82.8	Confident	4 Å²	4	53 Å²	53	3%	0.028	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	136.2	-176.5	-66.7	0	0	0	0	112.1	I48 V73 L74 D76	I48-S78 WeakPolarHBondContact CD1-OG 3.46Å; V73-S78 WeakPolarHBondContact CA-O 3.2Å; L74-S78 PolarHBondContact N-O 3.01Å; D76-S78 VanDerWaalsContact CG-OG 3.3Å; D76-S78 WeakPolarHBondContact OD1-CB 3.48Å; D76-S78 PolarHBondContact OD1-N 3.45Å; D76-S78 PolarHBondContact OD1-OG 3.37Å; D76-S78 PolarHBondContact OD2-OG 2.98Å
79	V	88.9	Confident	81.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.2	-171.7	-172.1	0	0	0	0	110.4	L37 I49 G50 V52 V73 F94	L37-V79 HydrophobicContact CD1-CG2 4.37Å; I49-V79 HydrophobicContact CD1-CG1 3.88Å; I49-V79 HydrophobicContact CG1-CB 4.03Å; I49-V79 HydrophobicContact CG1-CG1 3.83Å; I49-V79 WeakPolarHBondContact CG1-O 3.26Å; I49-V79 PolarHBondContact N-O 3.39Å; G50-V79 PolarHBondContact O-N 3.45Å; V52-V79 HydrophobicContact CG2-CG2 3.86Å; V73-V79 HydrophobicContact CG2-CG1 4.25Å; V73-V79 HydrophobicContact CG2-CG2 4.14Å; V79-F94 HydrophobicContact CG1-CZ 3.96Å
80	Y	89.6	Confident	80.5	Confident	45 Å²	45	59.2 Å²	59.2	18%	0.176	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	147.4	-178.3	-54.8	-98.3	0	0	0	110.9	D46 I48 F71 R72 L74	D46-Y80 VanDerWaalsContact O-CD1 3.25Å; D46-Y80 WeakPolarHBondContact O-CD1 3.39Å; I48-Y80 HydrophobicContact CB-CD1 4.17Å; I48-Y80 HydrophobicContact CB-CE1 3.72Å; I48-Y80 HydrophobicContact CG1-CE1 4.35Å; F71-Y80 CarbonylContact C-O 3.47Å; F71-Y80 WeakPolarHBondContact CA-O 3.27Å; R72-Y80 HydrophobicContact CG-CD2 4.46Å; R72-Y80 PolarHBondContact N-O 3.35Å; R72-Y80 PolarHBondContact O-N 2.68Å; L74-Y80 HydrophobicContact CD1-CD2 4.41Å; L74-Y80 HydrophobicContact CD1-CE2 3.58Å; L74-Y80 HydrophobicContact CG-CD2 4.32Å; L74-Y80 HydrophobicContact CG-CE2 3.86Å
81	P	87.4	Confident	79.5	Confident	0 Å²	0	65 Å²	65	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	132.9	170.5	36.4	-34.2	0	0	0	110.1	L43 E44 D46 Q47 I49 D70 F71 R83 L85	L43-P81 HydrophobicContact CB-CB 4.38Å; L43-P81 HydrophobicContact CB-CG 4.2Å; E44-P81 WeakPolarHBondContact O-CG 3.23Å; D46-P81 PolarHBondContact N-O 2.82Å; Q47-P81 WeakPolarHBondContact O-CD 3.43Å; I49-P81 HydrophobicContact CG2-CG 4.46Å; D70-P81 CarbonylContact O-C 3.54Å; D70-P81 VanDerWaalsContact O-CA 3.31Å; D70-P81 WeakPolarHBondContact O-CA 3.35Å; F71-P81 HydrophobicContact CD1-CB 4.23Å; F71-P81 HydrophobicContact CE1-CB 4.13Å; P81-R83 VanDerWaalsContact C-N 3.28Å; P81-R83 PolarHBondContact O-N 2.94Å; P81-L85 HydrophobicContact CB-CD1 4Å
82	A	83.1	Confident	79.2	Confident	50 Å²	50	68.4 Å²	68.4	41%	0.413	38%	0.377	S	S	.	.	S	Bend	trans	-79.8	-9	-179.2	0	0	0	0	0	113.6	D70	D70-A82 PolarHBondContact O-N 2.86Å
83	R	81.5	Confident	79.1	Confident	149 Å²	149	67.3 Å²	67.3	56%	0.562	38%	0.384	S	S	*	.	S	Bend	trans	-152.9	167.6	172.4	54	177	166.5	177.5	-3.7	110	D70 P81 L85	D70-R83 IonicContact OD1-CZ 3.06Å; D70-R83 IonicContact OD1-NE 2.65Å; D70-R83 PolarHBondContact OD1-NE 3.38Å; D70-R83 IonicContact OD1-NH2 3.95Å; D70-R83 PolarHBondContact OD1-NH2 2.88Å; D70-R83 IonicContact OD2-NE 3.15Å; D70-R83 IonicContact OD2-NH2 3.97Å; P81-R83 VanDerWaalsContact C-N 3.28Å; P81-R83 PolarHBondContact O-N 2.94Å; R83-L85 HydrophobicContact CG-CD2 4.11Å; R83-L85 WeakPolarHBondContact O-CG 3.48Å
84	A	80.6	Confident	79.1	Confident	73 Å²	73	66.4 Å²	66.4	60%	0.603	38%	0.378	S	S	*	.			trans	-69.2	133.5	176.3	0	0	0	0	0	110.2	L43 V45	L43-A84 WeakPolarHBondContact O-CA 3.4Å; V45-A84 HydrophobicContact CG2-CB 4.15Å
85	L	79.8	Confident	79.2	Confident	18 Å²	18	64.4 Å²	64.4	9%	0.094	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	134	-172.2	-62.5	165	0	0	0	111.5	T42 L43 D70 F71 P81 R83	T42-L85 CarbonylContact C-O 3.59Å; T42-L85 WeakPolarHBondContact CA-O 3.48Å; L43-L85 HydrophobicContact CB-CB 4.3Å; L43-L85 HydrophobicContact CD1-CD1 4.49Å; L43-L85 PolarHBondContact N-O 2.98Å; L43-L85 PolarHBondContact O-N 3.12Å; D70-L85 HydrophobicContact CB-CD1 3.91Å; D70-L85 HydrophobicContact CB-CD2 4.24Å; D70-L85 WeakPolarHBondContact OD2-CD2 3.25Å; F71-L85 HydrophobicContact CE1-CD1 3.83Å; F71-L85 HydrophobicContact CE2-CD1 4.36Å; F71-L85 HydrophobicContact CZ-CD1 3.63Å; P81-L85 HydrophobicContact CB-CD1 4Å; R83-L85 HydrophobicContact CG-CD2 4.11Å; R83-L85 WeakPolarHBondContact O-CG 3.48Å
86	V	80.1	Confident	79.5	Confident	119 Å²	119	57.8 Å²	57.8	72%	0.721	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	116.7	166.9	-172.5	0	0	0	0	108	T42 S88	T42-V86 HydrophobicContact CG2-CG2 4.39Å; V86-S88 PolarHBondContact O-N 2.02Å
87	L	74.1	Confident	79.9	Confident	25 Å²	25	57.5 Å²	57.5	13%	0.131	33%	0.33	C	S	.	.			trans	-80.7	102.8	174.7	-65.1	176	0	0	0	108.9	V39 S41 L43 R92 L113	V39-L87 HydrophobicContact CG2-CD1 3.58Å; S41-L87 PolarHBondContact O-N 3.25Å; L43-L87 HydrophobicContact CD1-CD1 4.31Å; L87-R92 HydrophobicContact CD2-CB 4.05Å; L87-L113 HydrophobicContact CD1-CB 4.49Å; L87-L113 HydrophobicContact CD1-CD1 4.41Å; L87-L113 HydrophobicContact CD2-CD1 4.49Å
88	S	58.3	Low	80.2	Confident	89 Å²	89	57.5 Å²	57.5	62%	0.622	33%	0.33	S	S	*	.			trans	-57.8	159	160.8	57.5	0	0	0	0	109.9	V86 E90	V86-S88 PolarHBondContact O-N 2.02Å; S88-E90 PolarHBondContact O-N 3.38Å
89	G	58.1	Low	80	Confident	91 Å²	91	59.7 Å²	59.7	94%	0.938	35%	0.346	S	S	*	.	S	Bend	trans	-66.6	11.2	-164.8	0	0	0	0	0	117.9
90	E	60.1	Low	79.7	Confident	168 Å²	168	60.3 Å²	60.3	79%	0.785	35%	0.349	S	S	*	.	S	Bend	trans	-91.8	157.1	175.8	-59.2	-169.6	152.7	0	0	111.2	S88 R92	S88-E90 PolarHBondContact O-N 3.38Å; E90-R92 PolarHBondContact O-N 3.5Å; E90-R92 VanDerWaalsContact O-N 3.15Å
91	K	64.4	Low	79.2	Confident	134 Å²	134	61.7 Å²	61.7	58%	0.583	37%	0.365	S	S	*	.			trans	-81	96.4	-179.3	-67.1	-168.2	178.7	-168.6	0	110.5	I112 E114	K91-I112 HydrophobicContact CB-CG2 4.32Å; K91-I112 HydrophobicContact CD-CG2 4.44Å; K91-E114 HydrophobicContact CD-CG 4.33Å; K91-E114 WeakPolarHBondContact CE-OE1 3.46Å; K91-E114 VanDerWaalsContact NZ-CD 3.32Å; K91-E114 IonicContact NZ-OE1 3.7Å; K91-E114 PolarHBondContact NZ-OE1 3.15Å; K91-E114 IonicContact NZ-OE2 2.72Å
92	R	81.1	Confident	78.6	Confident	73 Å²	73	68.8 Å²	68.8	28%	0.275	40%	0.396	S	S	.	.			trans	-66.7	132.7	170.1	-166.4	171	-174.1	160.4	6.4	109.9	D68 D70 L87 E90 L113	D68-R92 IonicContact OD1-CZ 2.72Å; D68-R92 IonicContact OD1-NH2 2.63Å; D68-R92 PolarHBondContact OD1-NH2 3.24Å; D68-R92 IonicContact OD2-CZ 2.71Å; D68-R92 IonicContact OD2-NE 3.94Å; D68-R92 PolarHBondContact OD2-NE 3.46Å; D68-R92 IonicContact OD2-NH2 2.76Å; D68-R92 PolarHBondContact OD2-NH2 3.3Å; D70-R92 VanDerWaalsContact CG-NH2 3.28Å; D70-R92 IonicContact OD2-CZ 2.71Å; D70-R92 VanDerWaalsContact OD2-CZ 3.22Å; D70-R92 IonicContact OD2-NH1 3.36Å; D70-R92 PolarHBondContact OD2-NH1 2.92Å; D70-R92 IonicContact OD2-NH2 2.7Å; D70-R92 PolarHBondContact OD2-NH2 2.99Å; L87-R92 HydrophobicContact CD2-CB 4.05Å; E90-R92 PolarHBondContact O-N 3.5Å; E90-R92 VanDerWaalsContact O-N 3.15Å; R92-L113 PolarHBondContact O-N 3.06Å
93	S	85.6	Confident	78	Confident	71 Å²	71	70.3 Å²	70.3	50%	0.497	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	140.5	179.9	59.9	0	0	0	0	111	V111	S93-V111 CarbonylContact C-O 3.57Å; S93-V111 VanDerWaalsContact CA-O 3.22Å; S93-V111 WeakPolarHBondContact CA-O 3.44Å; S93-V111 WeakPolarHBondContact CB-O 3.37Å
94	F	89	Confident	77.6	Confident	3 Å²	3	71.9 Å²	71.9	1%	0.013	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	167.9	179	64	-91.8	0	0	0	110.3	T66 D68 F71 V79 I96 V111 L113	T66-F94 HydrophobicContact CG2-CD2 4.43Å; T66-F94 HydrophobicContact CG2-CE2 4.34Å; D68-F94 HydrophobicContact CB-CB 3.47Å; D68-F94 VanDerWaalsContact CB-CB 3.47Å; D68-F94 HydrophobicContact CB-CG 4.18Å; F71-F94 HydrophobicContact CB-CE1 4.31Å; F71-F94 HydrophobicContact CB-CE2 4.45Å; F71-F94 HydrophobicContact CB-CZ 4.16Å; F71-F94 HydrophobicContact CD1-CE1 4.35Å; F71-F94 AromaticContact CD2-CD1 3.67Å; F71-F94 HydrophobicContact CD2-CD1 3.67Å; F71-F94 AromaticContact CD2-CE1 3.72Å; F71-F94 HydrophobicContact CD2-CE1 3.72Å; F71-F94 HydrophobicContact CD2-CG 4.32Å; F71-F94 HydrophobicContact CD2-CZ 4.41Å; F71-F94 HydrophobicContact CE2-CD1 4.02Å; F71-F94 HydrophobicContact CE2-CE1 4.15Å; F71-F94 HydrophobicContact CG-CD1 4.24Å; F71-F94 AromaticContact CG-CE1 3.84Å; F71-F94 HydrophobicContact CG-CE1 3.84Å; F71-F94 HydrophobicContact CG-CZ 4.17Å; V79-F94 HydrophobicContact CG1-CZ 3.96Å; F94-I96 HydrophobicContact CD2-CG1 4.35Å; F94-I96 HydrophobicContact CE2-CD1 4.36Å; F94-I96 HydrophobicContact CE2-CG1 3.88Å; F94-V111 HydrophobicContact CD2-CB 4.33Å; F94-V111 HydrophobicContact CE1-CB 4.25Å; F94-V111 HydrophobicContact CE1-CG1 4Å; F94-V111 HydrophobicContact CE2-CB 3.99Å; F94-V111 HydrophobicContact CE2-CG1 4.33Å; F94-V111 HydrophobicContact CE2-CG2 4.13Å; F94-V111 HydrophobicContact CZ-CB 3.94Å; F94-V111 HydrophobicContact CZ-CG1 3.78Å; F94-V111 HydrophobicContact CZ-CG2 4.38Å; F94-V111 PolarHBondContact N-O 3.46Å; F94-V111 PolarHBondContact O-N 2.87Å; F94-V111 VanDerWaalsContact O-O 3.1Å; F94-L113 HydrophobicContact CE1-CD1 4.47Å; F94-L113 HydrophobicContact CE1-CD2 4.27Å; F94-L113 HydrophobicContact CE1-CG 4.35Å
95	V	89.3	Confident	77.4	Confident	34 Å²	34	71 Å²	71	21%	0.206	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135.1	178.7	178.4	0	0	0	0	109.2	T66 S67 Q97 E108 I109	T66-V95 WeakPolarHBondContact CA-O 3.39Å; S67-V95 PolarHBondContact N-O 2.92Å; S67-V95 PolarHBondContact OG-N 3.09Å; V95-Q97 HydrophobicContact CG1-CG 4.15Å; V95-E108 HydrophobicContact CG1-CB 3.65Å; V95-E108 HydrophobicContact CG1-CG 3.97Å; V95-I109 WeakPolarHBondContact CA-O 3.25Å
96	I	89.3	Confident	77.5	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	113.8	163.7	-55.5	170.9	0	0	0	106.7	V52 L54 I64 R65 V73 F94 L98 E108 I109 V111	V52-I96 HydrophobicContact CB-CD1 4.23Å; V52-I96 HydrophobicContact CG1-CD1 4.21Å; V52-I96 HydrophobicContact CG2-CD1 3.96Å; L54-I96 HydrophobicContact CD2-CG2 4.38Å; I64-I96 HydrophobicContact CG2-CG2 3.88Å; R65-I96 CarbonylContact O-C 3.6Å; R65-I96 WeakPolarHBondContact O-CA 3.38Å; V73-I96 HydrophobicContact CG1-CD1 4.31Å; V73-I96 HydrophobicContact CG2-CD1 3.91Å; V73-I96 HydrophobicContact CG2-CG1 4.15Å; F94-I96 HydrophobicContact CD2-CG1 4.35Å; F94-I96 HydrophobicContact CE2-CD1 4.36Å; F94-I96 HydrophobicContact CE2-CG1 3.88Å; I96-L98 HydrophobicContact CG2-CD2 4.02Å; I96-E108 WeakPolarHBondContact O-CA 3.46Å; I96-I109 HydrophobicContact CB-CB 4.32Å; I96-I109 PolarHBondContact N-O 2.97Å; I96-I109 PolarHBondContact O-N 3.01Å; I96-V111 HydrophobicContact CD1-CG2 3.74Å; I96-V111 HydrophobicContact CG1-CG2 4.01Å
97	Q	88.1	Confident	77.7	Confident	62 Å²	62	72.8 Å²	72.8	29%	0.29	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.8	172.4	-62.4	-172.8	-35.6	0	0	108.8	R65 V95 E108	R65-Q97 HydrophobicContact CB-CB 4.47Å; R65-Q97 PolarHBondContact N-O 3.09Å; R65-Q97 PolarHBondContact O-N 3.1Å; V95-Q97 HydrophobicContact CG1-CG 4.15Å; Q97-E108 HydrophobicContact CG-CG 4.25Å; Q97-E108 PolarHBondContact NE2-OE1 3.35Å
98	L	88.3	Confident	78.3	Confident	0 Å²	0	76 Å²	76	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	131.4	173.3	-60.1	-178.2	0	0	0	108.9	L54 C57 L58 A61 I64 I96 Q106 K107 I109	L54-L98 HydrophobicContact CB-CD1 4.14Å; L54-L98 HydrophobicContact CD1-CD2 4.35Å; L54-L98 HydrophobicContact CD2-CD1 4.48Å; L54-L98 HydrophobicContact CD2-CD2 4.31Å; C57-L98 HydrophobicContact CB-CD1 4.15Å; L58-L98 HydrophobicContact CB-CB 4.45Å; L58-L98 HydrophobicContact CB-CD1 4.04Å; L58-L98 HydrophobicContact CD2-CB 4.04Å; A61-L98 HydrophobicContact CB-CB 4.14Å; A61-L98 HydrophobicContact CB-CD2 4.09Å; A61-L98 HydrophobicContact CB-CG 4.49Å; I64-L98 HydrophobicContact CB-CD2 4.38Å; I64-L98 HydrophobicContact CG1-CD2 3.86Å; I64-L98 HydrophobicContact CG2-CD2 4.2Å; I96-L98 HydrophobicContact CG2-CD2 4.02Å; L98-Q106 CarbonylContact O-C 3.57Å; L98-Q106 WeakPolarHBondContact O-CA 3.45Å; L98-K107 PolarHBondContact N-O 3.09Å; L98-K107 PolarHBondContact O-N 2.89Å; L98-I109 HydrophobicContact CD1-CD1 3.98Å
99	S	84.3	Confident	79.7	Confident	50 Å²	50	72 Å²	72	35%	0.35	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	136.2	175.3	58.8	0	0	0	0	111.4	E62 G63	E62-S99 PolarHBondContact N-O 3.34Å; G63-S99 WeakPolarHBondContact CA-OG 3.36Å; G63-S99 PolarHBondContact N-O 3.32Å; G63-S99 PolarHBondContact O-N 3.28Å; G63-S99 PolarHBondContact O-OG 3.44Å
100	D	82.8	Confident	81.1	Confident	12 Å²	12	69.9 Å²	69.9	6%	0.064	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.9	169.1	172.1	24.3	0	0	0	110.2	L58 K102 T103 Q104 T105	L58-D100 HydrophobicContact CD2-CB 4.09Å; D100-K102 VanDerWaalsContact C-N 3.26Å; D100-K102 PolarHBondContact O-N 2.91Å; D100-K102 WeakPolarHBondContact OD1-CB 3.4Å; D100-K102 PolarHBondContact OD1-N 2.72Å; D100-T103 VanDerWaalsContact OD2-CB 3.26Å; D100-T103 WeakPolarHBondContact OD2-CB 3.23Å; D100-T103 WeakPolarHBondContact OD2-CG2 3.32Å; D100-T103 PolarHBondContact OD2-N 2.95Å; D100-T103 VanDerWaalsContact OD2-N 3.1Å; D100-T103 PolarHBondContact OD2-OG1 2.96Å; D100-Q104 WeakPolarHBondContact O-CA 3.44Å; D100-Q104 PolarHBondContact O-N 3.2Å; D100-Q104 VanDerWaalsContact O-N 3.1Å; D100-T105 PolarHBondContact N-O 3.1Å
101	S	77.8	Confident	82.5	Confident	75 Å²	75	61.9 Å²	61.9	52%	0.524	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-29.1	179.2	71.4	0	0	0	0	112.6	E62	E62-S101 WeakPolarHBondContact OE2-CB 3.46Å; E62-S101 PolarHBondContact OE2-OG 3.2Å
102	K	74.7	Confident	83.6	Confident	148 Å²	148	56.5 Å²	56.5	64%	0.643	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-34.7	-169.7	-65.1	158.3	-165.8	152.1	0	112.1	E62 D100	E62-K102 WeakPolarHBondContact OE1-CE 2.95Å; E62-K102 IonicContact OE1-NZ 3.05Å; E62-K102 PolarHBondContact OE1-NZ 2.99Å; D100-K102 VanDerWaalsContact C-N 3.26Å; D100-K102 PolarHBondContact O-N 2.91Å; D100-K102 WeakPolarHBondContact OD1-CB 3.4Å; D100-K102 PolarHBondContact OD1-N 2.72Å
103	T	71.6	Confident	83.8	Confident	83 Å²	83	53.2 Å²	53.2	51%	0.509	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-6.7	174.6	60.5	0	0	0	0	114.1	D100 T105	D100-T103 VanDerWaalsContact OD2-CB 3.26Å; D100-T103 WeakPolarHBondContact OD2-CB 3.23Å; D100-T103 WeakPolarHBondContact OD2-CG2 3.32Å; D100-T103 PolarHBondContact OD2-N 2.95Å; D100-T103 VanDerWaalsContact OD2-N 3.1Å; D100-T103 PolarHBondContact OD2-OG1 2.96Å; T103-T105 PolarHBondContact O-N 2.03Å; T103-T105 PolarHBondContact OG1-N 3.5Å; T103-T105 PolarHBondContact OG1-OG1 3.09Å
104	Q	72.1	Confident	83.5	Confident	182 Å²	182	53 Å²	53	85%	0.85	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	24.9	-169.3	-60.2	-172.5	-21.9	0	0	113.5	D100	D100-Q104 WeakPolarHBondContact O-CA 3.44Å; D100-Q104 PolarHBondContact O-N 3.2Å; D100-Q104 VanDerWaalsContact O-N 3.1Å
105	T	76.8	Confident	82.4	Confident	54 Å²	54	57.2 Å²	57.2	33%	0.331	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	137.5	178.1	61.5	0	0	0	0	111.2	D100 T103	D100-T105 PolarHBondContact N-O 3.1Å; T103-T105 PolarHBondContact O-N 2.03Å; T103-T105 PolarHBondContact OG1-N 3.5Å; T103-T105 PolarHBondContact OG1-OG1 3.09Å
106	Q	81.4	Confident	81	Confident	121 Å²	121	61 Å²	61	57%	0.565	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.4	169.4	-171.3	175.2	-3.5	0	0	108.8	L98	L98-Q106 CarbonylContact O-C 3.57Å; L98-Q106 WeakPolarHBondContact O-CA 3.45Å
107	K	84.5	Confident	79.2	Confident	54 Å²	54	69.3 Å²	69.3	24%	0.235	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.5	177.9	-70.4	-67.9	-159.5	175.1	0	110.1	E30 C57 L58 L98	E30-K107 PolarHBondContact O-NZ 3.04Å; C57-K107 VanDerWaalsContact SG-CB 3.57Å; L58-K107 HydrophobicContact CB-CG 4.45Å; L58-K107 HydrophobicContact CD1-CG 4.14Å; L98-K107 PolarHBondContact N-O 3.09Å; L98-K107 PolarHBondContact O-N 2.89Å
108	E	87.6	Confident	77	Confident	93 Å²	93	75.8 Å²	75.8	44%	0.435	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	126.5	-177.8	-65.4	-158.4	140.8	0	0	110.8	C32 V95 I96 Q97	C32-E108 WeakPolarHBondContact CB-O 3.08Å; V95-E108 HydrophobicContact CG1-CB 3.65Å; V95-E108 HydrophobicContact CG1-CG 3.97Å; I96-E108 WeakPolarHBondContact O-CA 3.46Å; Q97-E108 HydrophobicContact CG-CG 4.25Å; Q97-E108 PolarHBondContact NE2-OE1 3.35Å
109	I	87.3	Confident	74.5	Confident	3 Å²	3	81.6 Å²	81.6	2%	0.015	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	109.1	172	-51.8	176.3	0	0	0	108.3	C32 V35 V52 L54 C57 V95 I96 L98 V111	C32-I109 HydrophobicContact CB-CG1 4.05Å; V35-I109 HydrophobicContact CG2-CG2 4.08Å; V52-I109 HydrophobicContact CG1-CD1 3.79Å; V52-I109 HydrophobicContact CG1-CG2 4.02Å; L54-I109 HydrophobicContact CD2-CD1 3.92Å; C57-I109 HydrophobicContact CB-CD1 3.64Å; C57-I109 HydrophobicContact CB-CG1 3.76Å; C57-I109 WeakPolarHBondContact SG-CG1 3.42Å; V95-I109 WeakPolarHBondContact CA-O 3.25Å; I96-I109 HydrophobicContact CB-CB 4.32Å; I96-I109 PolarHBondContact N-O 2.97Å; I96-I109 PolarHBondContact O-N 3.01Å; L98-I109 HydrophobicContact CD1-CD1 3.98Å; I109-V111 HydrophobicContact CG2-CG2 4.35Å; I109-V111 PolarHBondContact O-N 2.81Å
110	P	88	Confident	72.3	Confident	48 Å²	48	86.6 Å²	86.6	31%	0.312	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	120	172.9	27.9	-29.4	0	0	0	110.2	K34 V35	K34-P110 WeakPolarHBondContact CA-O 3.49Å; K34-P110 HydrophobicContact CB-CG 3.99Å; K34-P110 HydrophobicContact CG-CG 4.14Å; V35-P110 PolarHBondContact N-O 2.86Å
111	V	88.8	Confident	69.7	Low	0 Å²	0	95.2 Å²	95.2	0%	0	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.5	177.9	-176.9	0	0	0	0	109.4	V35 L37 V52 S93 F94 I96 I109	V35-V111 WeakPolarHBondContact O-CA 3.32Å; L37-V111 HydrophobicContact CD1-CG1 4.06Å; L37-V111 HydrophobicContact CG-CG1 4.2Å; V52-V111 HydrophobicContact CG2-CG2 4.27Å; S93-V111 CarbonylContact C-O 3.57Å; S93-V111 VanDerWaalsContact CA-O 3.22Å; S93-V111 WeakPolarHBondContact CA-O 3.44Å; S93-V111 WeakPolarHBondContact CB-O 3.37Å; F94-V111 HydrophobicContact CD2-CB 4.33Å; F94-V111 HydrophobicContact CE1-CB 4.25Å; F94-V111 HydrophobicContact CE1-CG1 4Å; F94-V111 HydrophobicContact CE2-CB 3.99Å; F94-V111 HydrophobicContact CE2-CG1 4.33Å; F94-V111 HydrophobicContact CE2-CG2 4.13Å; F94-V111 HydrophobicContact CZ-CB 3.94Å; F94-V111 HydrophobicContact CZ-CG1 3.78Å; F94-V111 HydrophobicContact CZ-CG2 4.38Å; F94-V111 PolarHBondContact N-O 3.46Å; F94-V111 PolarHBondContact O-N 2.87Å; F94-V111 VanDerWaalsContact O-O 3.1Å; I96-V111 HydrophobicContact CD1-CG2 3.74Å; I96-V111 HydrophobicContact CG1-CG2 4.01Å; I109-V111 HydrophobicContact CG2-CG2 4.35Å; I109-V111 PolarHBondContact O-N 2.81Å
112	I	87.3	Confident	67.5	Low	21 Å²	21	100.6 Å²	100.6	11%	0.108	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	133.5	171.6	-57.7	-153	0	0	0	110.2	K34 V35 T36 L37 K91 E114	K34-I112 VanDerWaalsContact NZ-CD1 3.27Å; V35-I112 PolarHBondContact O-N 3.18Å; T36-I112 CarbonylContact C-O 3.08Å; T36-I112 WeakPolarHBondContact CA-O 3.3Å; L37-I112 PolarHBondContact N-O 2.8Å; K91-I112 HydrophobicContact CB-CG2 4.32Å; K91-I112 HydrophobicContact CD-CG2 4.44Å; I112-E114 HydrophobicContact CG2-CG 3.95Å
113	L	86	Confident	65.4	Low	4 Å²	4	104.8 Å²	104.8	2%	0.021	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	114.1	167.9	-55.8	-174.9	0	0	0	108.3	L37 V39 I49 F71 L87 R92 F94	L37-L113 HydrophobicContact CB-CD2 3.99Å; L37-L113 HydrophobicContact CD1-CD2 4.27Å; V39-L113 HydrophobicContact CG1-CD2 4.36Å; V39-L113 HydrophobicContact CG2-CB 3.92Å; I49-L113 HydrophobicContact CD1-CD2 4.04Å; F71-L113 HydrophobicContact CE1-CD1 3.89Å; F71-L113 HydrophobicContact CE2-CD1 4.12Å; F71-L113 HydrophobicContact CZ-CD1 3.45Å; F71-L113 VanDerWaalsContact CZ-CD1 3.45Å; L87-L113 HydrophobicContact CD1-CB 4.49Å; L87-L113 HydrophobicContact CD1-CD1 4.41Å; L87-L113 HydrophobicContact CD2-CD1 4.49Å; R92-L113 PolarHBondContact O-N 3.06Å; F94-L113 HydrophobicContact CE1-CD1 4.47Å; F94-L113 HydrophobicContact CE1-CD2 4.27Å; F94-L113 HydrophobicContact CE1-CG 4.35Å
114	E	78.2	Confident	63.6	Low	65 Å²	65	109.2 Å²	109.2	30%	0.304	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.9	170.7	-71.2	-161.6	-174.4	0	0	110.1	T36 L37 N38 V39 K91 I112 Q116	T36-E114 HydrophobicContact CG2-CB 4.01Å; T36-E114 HydrophobicContact CG2-CG 3.67Å; L37-E114 PolarHBondContact O-N 2.78Å; N38-E114 CarbonylContact C-O 3.58Å; N38-E114 WeakPolarHBondContact CA-O 2.93Å; V39-E114 PolarHBondContact N-O 2.97Å; K91-E114 HydrophobicContact CD-CG 4.33Å; K91-E114 WeakPolarHBondContact CE-OE1 3.46Å; K91-E114 VanDerWaalsContact NZ-CD 3.32Å; K91-E114 IonicContact NZ-OE1 3.7Å; K91-E114 PolarHBondContact NZ-OE1 3.15Å; K91-E114 IonicContact NZ-OE2 2.72Å; I112-E114 HydrophobicContact CG2-CG 3.95Å; E114-Q116 PolarHBondContact O-N 3.06Å
115	H	65.4	Low	62.1	Low	92 Å²	92	106.9 Å²	106.9	43%	0.426	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	129.4	177.5	172.4	68.9	0	0	0	110.9	V39 S41 K117	V39-H115 WeakPolarHBondContact O-CA 3.35Å; S41-H115 PolarHBondContact N-ND1 2.83Å; H115-K117 VanDerWaalsContact C-N 3.33Å; H115-K117 PolarHBondContact O-N 3.1Å
116	Q	60.5	Low	60.2	Low	113 Å²	113	112.1 Å²	112.1	53%	0.528	52%	0.524	S	S	.	.			trans	-64.8	85.9	176.5	-74.3	-159.7	20	0	0	112.9	N38 V39 E114 K118	N38-Q116 HydrophobicContact CB-CG 3.99Å; N38-Q116 PolarHBondContact O-NE2 3.03Å; V39-Q116 PolarHBondContact O-N 2.81Å; E114-Q116 PolarHBondContact O-N 3.06Å; Q116-K118 PolarHBondContact O-N 3.16Å
117	K	51.2	Low	58.4	Low	176 Å²	176	114.6 Å²	114.6	77%	0.765	54%	0.542	S	S	*	.			trans	-60.3	111.4	157.7	-73	-177.4	178.3	175.1	0	108	H115 V119	H115-K117 VanDerWaalsContact C-N 3.33Å; H115-K117 PolarHBondContact O-N 3.1Å; K117-V119 VanDerWaalsContact C-N 3.33Å; K117-V119 WeakPolarHBondContact O-CG2 3.24Å; K117-V119 PolarHBondContact O-N 3.49Å
118	K	43.1	Very low	56.2	Low	198 Å²	198	116.8 Å²	116.8	86%	0.861	56%	0.559	S	S	*	*			trans	-57.2	95.1	168.7	-81.7	-176.5	175.4	175.2	0	109.4	Q116 L120	Q116-K118 PolarHBondContact O-N 3.16Å; K118-L120 PolarHBondContact O-N 3.08Å
119	V	34.8	Very low	53.9	Low	121 Å²	121	119.2 Å²	119.2	73%	0.733	58%	0.581	S	S	*	*			trans	-73.7	78.4	174	-174.8	0	0	0	0	108.7	K117 K121	K117-V119 VanDerWaalsContact C-N 3.33Å; K117-V119 WeakPolarHBondContact O-CG2 3.24Å; K117-V119 PolarHBondContact O-N 3.49Å; V119-K121 PolarHBondContact O-N 3.43Å
120	L	38.3	Very low	51.5	Low	155 Å²	155	126.4 Å²	126.4	81%	0.812	62%	0.618	S	S	*	*			trans	-48.8	107.1	150.1	-94.8	161.8	0	0	0	106.9	K118 K122	K118-L120 PolarHBondContact O-N 3.08Å; L120-K122 PolarHBondContact O-N 3.27Å
121	K	29.3	Very low	49.3	Very low	194 Å²	194	135.5 Å²	135.5	84%	0.843	65%	0.646	S	S	*	*			trans	-64	82.9	177.4	-74.7	-177.9	177.7	174.2	0	109.1	V119 R123	V119-K121 PolarHBondContact O-N 3.43Å; K121-R123 PolarHBondContact O-N 3.38Å
122	K	31.4	Very low	46.7	Very low	187 Å²	187	147 Å²	147	81%	0.813	69%	0.69	S	S	*	*			trans	-53.7	114	169.7	-79.6	-171.9	174.9	-178.2	0	107.1	L120 H124	L120-K122 PolarHBondContact O-N 3.27Å; K122-H124 PolarHBondContact O-N 2.85Å
123	R	30.6	Very low	44.5	Very low	236 Å²	236	150.3 Å²	150.3	89%	0.891	72%	0.72	S	S	*	*			trans	-58.6	108.5	170.8	-78.7	179.6	170	172.2	-2.7	107.6	K121 T125	K121-R123 PolarHBondContact O-N 3.38Å; R123-T125 PolarHBondContact O-N 3.21Å
124	H	33.9	Very low	42.4	Very low	176 Å²	176	159.7 Å²	159.7	82%	0.815	76%	0.76	S	S	*	*			trans	-65.5	106.4	163.3	-88.4	-74.9	0	0	0	108.1	K122 K126	K122-H124 PolarHBondContact O-N 2.85Å; H124-K126 PolarHBondContact O-N 2.83Å
125	T	39.8	Very low	40.9	Very low	133 Å²	133	167.9 Å²	167.9	82%	0.816	79%	0.789	S	S	*	*			trans	-71.3	64.5	166.9	38.9	0	0	0	0	110.3	R123	R123-T125 PolarHBondContact O-N 3.21Å
126	K	37.7	Very low	40.5	Very low	164 Å²	164	174.6 Å²	174.6	71%	0.713	81%	0.81	S	S	*	*			trans	-72.5	129.8	155.2	-77.6	-169.9	173.4	-175.6	0	107.3	H124 T128	H124-K126 PolarHBondContact O-N 2.83Å; K126-T128 PolarHBondContact O-N 2.74Å
127	N	43.3	Very low	40.5	Very low	174 Å²	174	180.9 Å²	180.9	93%	0.93	83%	0.829	S	S	*	*			trans	-72.3	72.5	168.7	-81.6	-24.4	0	0	0	110
128	T	37.7	Very low	40.9	Very low	99 Å²	99	176.6 Å²	176.6	61%	0.607	83%	0.827	S	S	*	*			trans	-88.3	132.4	155.2	45.4	0	0	0	0	108	K126 L130	K126-T128 PolarHBondContact O-N 2.74Å; T128-L130 PolarHBondContact O-N 2.81Å
129	V	40.2	Very low	41.9	Very low	145 Å²	145	169.9 Å²	169.9	88%	0.879	80%	0.804	S	S	*	*			trans	-63.8	106.4	174	176.9	0	0	0	0	107.9	R131	V129-R131 VanDerWaalsContact C-N 3.33Å; V129-R131 PolarHBondContact O-N 2.82Å
130	L	35.7	Very low	43.8	Very low	153 Å²	153	170.3 Å²	170.3	80%	0.801	80%	0.8	S	S	*	*			trans	-69.1	87.4	-178.9	-75.3	171	0	0	0	110.3	T128 R132	T128-L130 PolarHBondContact O-N 2.81Å; L130-R132 PolarHBondContact O-N 2.88Å
131	R	42.3	Very low	45.4	Very low	240 Å²	240	167.8 Å²	167.8	91%	0.906	79%	0.793	S	S	*	*			trans	-56.4	115	159.8	-95.3	-170.6	168.4	-166.9	-3.2	107.8	V129 A133	V129-R131 VanDerWaalsContact C-N 3.33Å; V129-R131 PolarHBondContact O-N 2.82Å; R131-A133 PolarHBondContact O-N 2.89Å
132	R	34.4	Very low	48.1	Very low	242 Å²	242	159 Å²	159	91%	0.913	76%	0.756	S	S	*	*			trans	-69.4	86	-173.3	-167.9	-173.2	-161.5	-175.7	6.2	110.3	L130 K134	L130-R132 PolarHBondContact O-N 2.88Å; R132-K134 PolarHBondContact O-N 2.84Å
133	A	39.9	Very low	51	Low	90 Å²	90	152.5 Å²	152.5	74%	0.744	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-55.9	125.3	166.3	0	0	0	0	0	108.6	R131 R135	R131-A133 PolarHBondContact O-N 2.89Å; A133-R135 PolarHBondContact O-N 3.43Å
134	K	42.5	Very low	53.9	Low	200 Å²	200	141.6 Å²	141.6	87%	0.87	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-56.9	131.9	172.6	-76.1	-173.9	177.2	-178.5	0	107.7	R132 R136	R132-K134 PolarHBondContact O-N 2.84Å; K134-R136 PolarHBondContact O-N 2.92Å; K134-R136 VanDerWaalsContact O-N 3.16Å
135	R	47.6	Very low	56.7	Low	238 Å²	238	137.8 Å²	137.8	90%	0.898	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-61.6	116.9	158.5	-68.8	-177.7	179.9	-180	-1	105.8	A133	A133-R135 PolarHBondContact O-N 3.43Å
136	R	56.8	Low	59.3	Low	233 Å²	233	131.6 Å²	131.6	88%	0.879	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-70.7	129.2	159	-77.8	-168	-82.5	-155.9	-0.6	106.4	K134	K134-R136 PolarHBondContact O-N 2.92Å; K134-R136 VanDerWaalsContact O-N 3.16Å
137	W	60.6	Low	61.9	Low	244 Å²	244	126.8 Å²	126.8	92%	0.924	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-65.2	158.6	162.6	-61.9	98.1	0	0	0	108.3
138	A	58.2	Low	64.2	Low	87 Å²	87	119.6 Å²	119.6	72%	0.719	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-60.9	149.9	161.7	0	0	0	0	0	108.6
139	P	65.5	Low	66.7	Low	57 Å²	57	123.2 Å²	123.2	37%	0.37	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-52	145.7	165.8	-23.4	34.3	0	0	0	110.2	P230	P139-P230 HydrophobicContact CB-CG 4.46Å
140	I	74.1	Confident	69	Low	129 Å²	129	117.5 Å²	117.5	66%	0.662	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-65.5	125.4	166.3	-61.2	173.4	0	0	0	105.7	C142	I140-C142 PolarHBondContact O-N 2.86Å
141	P	71.5	Confident	71.7	Confident	103 Å²	103	115.9 Å²	115.9	67%	0.669	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-62.4	127.5	179.4	26	-33.4	0	0	0	109.3
142	C	87.2	Confident	74	Confident	8 Å²	8	108 Å²	108	5%	0.054	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	131.3	161.1	-173.2	0	0	0	0	106.6	I140 I231 K232	I140-C142 PolarHBondContact O-N 2.86Å; C142-I231 HydrophobicContact CB-CG1 4.4Å; C142-I231 WeakPolarHBondContact O-CA 3.29Å; C142-K232 PolarHBondContact O-N 2.9Å
143	S	90.8	Very high	76.8	Confident	52 Å²	52	99.9 Å²	99.9	36%	0.364	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	155.6	173.3	55.4	0	0	0	0	112	K232 E234	S143-K232 VanDerWaalsContact CA-O 3.25Å; S143-K232 WeakPolarHBondContact CA-O 3.21Å; S143-E234 VanDerWaalsContact CB-CD 3.49Å; S143-E234 WeakPolarHBondContact CB-OE1 3.49Å; S143-E234 PolarHBondContact OG-OE1 2.91Å
144	M	91.6	Very high	79.4	Confident	6 Å²	6	97.7 Å²	97.7	3%	0.03	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	121	178.4	170.8	174.9	165	0	0	108.8	E146 L154 L156 F186 C197 V201 I231 K232 I233 E234	M144-E146 PolarHBondContact O-N 3.27Å; M144-L154 HydrophobicContact CE-CD2 3.99Å; M144-L154 HydrophobicContact CG-CD2 4.32Å; M144-L154 HydrophobicContact SD-CD2 4.18Å; M144-L156 HydrophobicContact CB-CD2 4.05Å; M144-L156 HydrophobicContact CG-CD2 4.14Å; M144-L156 HydrophobicContact SD-CD2 3.93Å; M144-F186 HydrophobicContact SD-CE1 4.38Å; M144-C197 HydrophobicContact CE-CB 4.3Å; M144-C197 HydrophobicContact SD-CB 3.75Å; M144-V201 HydrophobicContact CE-CG2 4.31Å; M144-I231 HydrophobicContact CB-CG2 4.31Å; M144-K232 PolarHBondContact N-O 2.96Å; M144-K232 VanDerWaalsContact N-O 3.09Å; M144-I233 HydrophobicContact CB-CD1 4.25Å; M144-I233 CarbonylContact O-C 3.5Å; M144-I233 WeakPolarHBondContact O-CA 3.27Å; M144-E234 PolarHBondContact O-N 2.99Å
145	Q	92.8	Very high	81.8	Confident	97 Å²	97	93 Å²	93	45%	0.453	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	132.4	169.1	-169.2	-177.1	17.3	0	0	110.5	E236	Q145-E236 HydrophobicContact CG-CG 4.07Å; Q145-E236 VanDerWaalsContact NE2-CD 3.34Å; Q145-E236 PolarHBondContact NE2-OE1 2.85Å
146	E	94.9	Very high	83.9	Confident	2 Å²	2	83.2 Å²	83.2	1%	0.009	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	174.2	177.4	80	179.1	113.1	0	0	113.4	M144 S148 V201 R203 I233 E234 D235 E236	M144-E146 PolarHBondContact O-N 3.27Å; E146-S148 PolarHBondContact O-N 2.81Å; E146-V201 WeakPolarHBondContact CB-O 3.31Å; E146-R203 HydrophobicContact CB-CB 4.22Å; E146-R203 VanDerWaalsContact CD-CB 3.42Å; E146-R203 HydrophobicContact CG-CB 4.48Å; E146-R203 VanDerWaalsContact OE1-CB 3.32Å; E146-R203 WeakPolarHBondContact OE1-CB 3.41Å; E146-R203 WeakPolarHBondContact OE2-CB 3.3Å; E146-R203 PolarHBondContact OE2-N 3.44Å; E146-I233 HydrophobicContact CB-CG2 3.56Å; E146-E234 PolarHBondContact N-O 2.73Å; E146-D235 WeakPolarHBondContact OE1-CA 3.48Å; E146-E236 HydrophobicContact CG-CB 3.94Å; E146-E236 HydrophobicContact CG-CG 3.98Å; E146-E236 PolarHBondContact OE1-N 3.28Å
147	N	93.1	Very high	85.6	Confident	63 Å²	63	74.1 Å²	74.1	34%	0.337	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	14.5	176.2	-77.7	-49.9	0	0	0	116	L149 V201 D238	N147-L149 PolarHBondContact O-N 2.73Å; N147-V201 PolarHBondContact N-O 2.81Å; N147-D238 PolarHBondContact ND2-OD2 3.45Å
148	S	91.6	Very high	87.1	Confident	24 Å²	24	66.7 Å²	66.7	17%	0.168	38%	0.382	C	S	.	.			trans	-56.7	127.9	-169.5	-173.6	0	0	0	0	112.3	E146 G150 F152	E146-S148 PolarHBondContact O-N 2.81Å; S148-G150 PolarHBondContact O-N 2.67Å; S148-G150 VanDerWaalsContact O-N 3.15Å; S148-F152 VanDerWaalsContact O-CE2 3.31Å; S148-F152 WeakPolarHBondContact O-CE2 3.43Å; S148-F152 WeakPolarHBondContact O-CZ 3.49Å
149	L	89.7	Confident	88.6	Confident	175 Å²	175	63.4 Å²	63.4	92%	0.916	35%	0.353	S	S	*	.			trans	-74.4	0.5	-179.5	-56.4	179.8	0	0	0	113.4	N147	N147-L149 PolarHBondContact O-N 2.73Å
150	G	88.4	Confident	89.8	Confident	25 Å²	25	67.4 Å²	67.4	26%	0.258	37%	0.367	S	S	.	.			trans	84.7	-155.3	-179.1	0	0	0	0	0	113.5	S148	S148-G150 PolarHBondContact O-N 2.67Å; S148-G150 VanDerWaalsContact O-N 3.15Å
151	P	91.8	Very high	90.5	Very high	119 Å²	119	61.7 Å²	61.7	77%	0.773	34%	0.338	S	S	*	.	P	Polyproline II helix	cis	-70.1	143.4	9.5	28.8	-36.2	0	0	0	113.5
152	F	91.4	Very high	91.3	Very high	75 Å²	75	62.8 Å²	62.8	33%	0.329	34%	0.339	S	S	.	.	S	Bend	trans	-93.9	145.9	172.4	-65.1	-73.8	0	0	0	111.1	S148 L154 H198 K199 A200	S148-F152 VanDerWaalsContact O-CE2 3.31Å; S148-F152 WeakPolarHBondContact O-CE2 3.43Å; S148-F152 WeakPolarHBondContact O-CZ 3.49Å; F152-L154 HydrophobicContact CD1-CB 3.96Å; F152-L154 HydrophobicContact CE1-CB 4.06Å; F152-H198 VanDerWaalsContact CD1-C 3.48Å; F152-K199 VanDerWaalsContact CE1-O 3.32Å; F152-K199 WeakPolarHBondContact CE1-O 3.2Å; F152-A200 HydrophobicContact CZ-CB 4.28Å
153	P	93.2	Very high	91.2	Very high	70 Å²	70	63.3 Å²	63.3	46%	0.455	34%	0.343	S	S	.	.	S	Bend	cis	-72.8	127.1	0	28.8	-34.3	0	0	0	113.2	Y196 C197	P153-Y196 HydrophobicContact CB-CD1 4.13Å; P153-Y196 HydrophobicContact CB-CG 4.33Å; P153-Y196 HydrophobicContact CG-CD1 4.47Å; P153-C197 CarbonylContact C-O 3.57Å; P153-C197 VanDerWaalsContact CA-O 3.28Å; P153-C197 WeakPolarHBondContact CA-O 3.44Å
154	L	93.4	Very high	91	Very high	45 Å²	45	63.2 Å²	63.2	24%	0.236	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	120.4	-179.4	179.1	66.1	0	0	0	109.3	M144 F152 L156 Y196 C197	M144-L154 HydrophobicContact CE-CD2 3.99Å; M144-L154 HydrophobicContact CG-CD2 4.32Å; M144-L154 HydrophobicContact SD-CD2 4.18Å; F152-L154 HydrophobicContact CD1-CB 3.96Å; F152-L154 HydrophobicContact CE1-CB 4.06Å; L154-L156 HydrophobicContact CD2-CD2 4.17Å; L154-L156 HydrophobicContact CG-CD2 4.23Å; L154-Y196 CarbonylContact O-C 3.46Å; L154-Y196 WeakPolarHBondContact O-CA 3.45Å; L154-C197 HydrophobicContact CB-CB 4.49Å; L154-C197 PolarHBondContact N-O 3.12Å; L154-C197 PolarHBondContact O-N 3.28Å
155	F	94	Very high	90.7	Very high	100 Å²	100	71 Å²	71	44%	0.439	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	131.8	174.8	173.3	-98.6	0	0	0	110.7	Q158 N194 Y196	F155-Q158 HydrophobicContact CE2-CB 4.33Å; F155-Q158 HydrophobicContact CZ-CB 4.1Å; F155-N194 HydrophobicContact CD2-CB 4.11Å; F155-N194 HydrophobicContact CE2-CB 3.82Å; F155-Y196 HydrophobicContact CB-CD1 3.98Å; F155-Y196 HydrophobicContact CB-CE1 3.82Å; F155-Y196 HydrophobicContact CD2-CD1 4.43Å; F155-Y196 AromaticContact CD2-CE1 3.97Å; F155-Y196 HydrophobicContact CD2-CE1 3.97Å; F155-Y196 HydrophobicContact CG-CE1 4.39Å
156	L	92	Very high	90.3	Very high	33 Å²	33	72.4 Å²	72.4	17%	0.173	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-60.7	-179.5	-57.7	-175.7	0	0	0	112.1	M144 L154 F186 L195 C197 I231	M144-L156 HydrophobicContact CB-CD2 4.05Å; M144-L156 HydrophobicContact CG-CD2 4.14Å; M144-L156 HydrophobicContact SD-CD2 3.93Å; L154-L156 HydrophobicContact CD2-CD2 4.17Å; L154-L156 HydrophobicContact CG-CD2 4.23Å; L156-F186 HydrophobicContact CD1-CD1 3.82Å; L156-F186 HydrophobicContact CD1-CE1 3.82Å; L156-L195 PolarHBondContact N-O 3.14Å; L156-C197 HydrophobicContact CD1-CB 4.18Å; L156-C197 HydrophobicContact CD2-CB 4.41Å; L156-C197 HydrophobicContact CG-CB 4.39Å; L156-I231 HydrophobicContact CD1-CD1 3.82Å
157	Q	91.6	Very high	89.9	Confident	43 Å²	43	79.3 Å²	79.3	20%	0.201	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	154.6	-173.6	-165.4	175.9	36.1	0	0	110	L195	Q157-L195 VanDerWaalsContact O-CB 3.3Å; Q157-L195 WeakPolarHBondContact O-CB 3.15Å; Q157-L195 PolarHBondContact O-N 2.76Å
158	Q	91.9	Very high	89.6	Confident	87 Å²	87	81.1 Å²	81.1	41%	0.407	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.2	167.4	-174.3	175.3	28.7	0	0	109.8	F155 Q160 T192 N194	F155-Q158 HydrophobicContact CE2-CB 4.33Å; F155-Q158 HydrophobicContact CZ-CB 4.1Å; Q158-Q160 VanDerWaalsContact CD-NE2 3.28Å; Q158-Q160 HydrophobicContact CG-CG 4.16Å; Q158-T192 PolarHBondContact NE2-O 3.24Å; Q158-N194 VanDerWaalsContact CG-OD1 3.22Å; Q158-N194 WeakPolarHBondContact CG-OD1 3.34Å; Q158-N194 PolarHBondContact NE2-OD1 3.38Å
159	V	90.9	Very high	89.6	Confident	19 Å²	19	80.4 Å²	80.4	12%	0.115	43%	0.427	C	S	.	.			trans	-115.3	138.2	170.9	-65.2	0	0	0	0	110.4	I188 G193 A213 L227 L229	V159-I188 HydrophobicContact CG2-CD1 3.52Å; V159-G193 PolarHBondContact N-O 3.35Å; V159-G193 WeakPolarHBondContact O-CA 3.23Å; V159-A213 HydrophobicContact CG2-CB 4.43Å; V159-L227 HydrophobicContact CG1-CD2 4.36Å; V159-L229 HydrophobicContact CG1-CD1 3.9Å; V159-L229 HydrophobicContact CG1-CD2 4.08Å; V159-L229 HydrophobicContact CG2-CD1 4.42Å
160	Q	90.3	Very high	89.7	Confident	141 Å²	141	74.8 Å²	74.8	66%	0.659	40%	0.398	S	S	*	.			trans	-136.2	144	-177.4	-64.7	-177	-5.2	0	0	110.7	Q158 Y171	Q158-Q160 VanDerWaalsContact CD-NE2 3.28Å; Q158-Q160 HydrophobicContact CG-CG 4.16Å; Q160-Y171 WeakPolarHBondContact CA-OH 3.36Å
161	S	89.3	Confident	90	Very high	9 Å²	9	74.4 Å²	74.4	6%	0.063	39%	0.388	C	S	.	.			trans	-92.2	136.5	170.5	176.1	0	0	0	0	110	A163 A164 Y171 D224	S161-A163 PolarHBondContact O-N 2.82Å; S161-A163 WeakPolarHBondContact OG-CB 3.49Å; S161-A163 PolarHBondContact OG-N 2.89Å; S161-A164 WeakPolarHBondContact O-CB 3.33Å; S161-A164 PolarHBondContact O-N 2.81Å; S161-Y171 PolarHBondContact N-OH 2.72Å; S161-D224 VanDerWaalsContact CB-OD2 3.26Å; S161-D224 WeakPolarHBondContact CB-OD2 3.3Å; S161-D224 PolarHBondContact OG-OD2 2.66Å
162	D	88	Confident	90.1	Very high	126 Å²	126	70.4 Å²	70.4	67%	0.674	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-70.5	-22.7	174.1	64.9	-2.1	0	0	0	112.2	A164 Q165	D162-A164 PolarHBondContact O-N 2.73Å; D162-A164 VanDerWaalsContact O-N 3.16Å; D162-Q165 WeakPolarHBondContact O-CG 3.16Å; D162-Q165 PolarHBondContact O-N 3.07Å
163	A	85.6	Confident	90.2	Very high	19 Å²	19	67.9 Å²	67.9	16%	0.157	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-62	-16.9	170	0	0	0	0	0	113.6	S161 Q165 N166 Y167 A223	S161-A163 PolarHBondContact O-N 2.82Å; S161-A163 WeakPolarHBondContact OG-CB 3.49Å; S161-A163 PolarHBondContact OG-N 2.89Å; A163-Q165 PolarHBondContact O-N 2.84Å; A163-Q165 VanDerWaalsContact O-N 3.12Å; A163-N166 PolarHBondContact O-N 2.89Å; A163-Y167 PolarHBondContact O-N 3.32Å; A163-Y167 VanDerWaalsContact O-N 3.07Å; A163-A223 HydrophobicContact CB-CB 4.31Å
164	A	86.1	Confident	90.2	Very high	49 Å²	49	69 Å²	69	41%	0.405	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-63.2	-12.9	174.3	0	0	0	0	0	114.1	S161 D162 N166 Y167 I169	S161-A164 WeakPolarHBondContact O-CB 3.33Å; S161-A164 PolarHBondContact O-N 2.81Å; D162-A164 PolarHBondContact O-N 2.73Å; D162-A164 VanDerWaalsContact O-N 3.16Å; A164-N166 VanDerWaalsContact C-N 3.28Å; A164-Y167 WeakPolarHBondContact CA-O 3.44Å; A164-I169 HydrophobicContact CB-CB 4.42Å; A164-I169 HydrophobicContact CB-CG1 3.84Å
165	Q	84.5	Confident	90.2	Very high	170 Å²	170	67.2 Å²	67.2	79%	0.794	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-70.3	-23.6	169.4	-62.9	179.4	14.2	0	0	113.1	D162 A163	D162-Q165 WeakPolarHBondContact O-CG 3.16Å; D162-Q165 PolarHBondContact O-N 3.07Å; A163-Q165 PolarHBondContact O-N 2.84Å; A163-Q165 VanDerWaalsContact O-N 3.12Å
166	N	85.2	Confident	90.1	Very high	126 Å²	126	66.8 Å²	66.8	67%	0.674	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	-22.5	-173	-62.8	-70.1	0	0	0	113.5	A163 A164	A163-N166 PolarHBondContact O-N 2.89Å; A164-N166 VanDerWaalsContact C-N 3.28Å
167	Y	85.6	Confident	90	Very high	147 Å²	147	65.2 Å²	65.2	58%	0.576	33%	0.331	S	S	*	.	S	Bend	trans	-138.2	148.8	-175.4	-56.2	-78.4	0	0	0	111.4	A163 A164 I169 T217	A163-Y167 PolarHBondContact O-N 3.32Å; A163-Y167 VanDerWaalsContact O-N 3.07Å; A164-Y167 WeakPolarHBondContact CA-O 3.44Å; Y167-I169 PolarHBondContact O-N 2.91Å; Y167-T217 HydrophobicContact CG-CG2 4.33Å
168	T	87.8	Confident	90	Very high	101 Å²	101	63.7 Å²	63.7	62%	0.62	33%	0.325	S	S	*	.			trans	-71.2	112.5	167.7	-53.8	0	0	0	0	109.4	V218	T168-V218 HydrophobicContact CG2-CG2 3.93Å
169	I	91	Very high	90.1	Very high	10 Å²	10	63.2 Å²	63.2	5%	0.051	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	142.7	-179.2	-58.4	-53.3	0	0	0	111	A164 Y167 Y171 A215 Y216 T217 A223	A164-I169 HydrophobicContact CB-CB 4.42Å; A164-I169 HydrophobicContact CB-CG1 3.84Å; Y167-I169 PolarHBondContact O-N 2.91Å; I169-Y171 HydrophobicContact CG2-CD1 4.14Å; I169-Y171 HydrophobicContact CG2-CD2 4.46Å; I169-Y171 HydrophobicContact CG2-CE1 3.73Å; I169-Y171 HydrophobicContact CG2-CE2 4.09Å; I169-Y171 HydrophobicContact CG2-CG 4.48Å; I169-A215 HydrophobicContact CG2-CB 3.73Å; I169-Y216 CarbonylContact C-O 3.59Å; I169-Y216 WeakPolarHBondContact CA-O 3.39Å; I169-T217 HydrophobicContact CD1-CG2 4.27Å; I169-A223 HydrophobicContact CD1-CB 3.48Å; I169-A223 VanDerWaalsContact CD1-CB 3.48Å
170	I	92.2	Very high	90.1	Very high	57 Å²	57	67.7 Å²	67.7	29%	0.292	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	119.8	171.8	-58.8	178.1	0	0	0	107.9	K190 Y216 V218	I170-K190 WeakPolarHBondContact CA-O 3.16Å; I170-K190 HydrophobicContact CG2-CB 4.3Å; I170-Y216 PolarHBondContact N-O 3.3Å; I170-Y216 PolarHBondContact O-N 2.93Å; I170-V218 HydrophobicContact CD1-CG2 4.29Å
171	Y	93.8	Very high	90	Very high	16 Å²	16	67.4 Å²	67.4	6%	0.063	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	146.6	178.2	-59.8	-77	0	0	0	112	Q160 S161 I169 K190 A215	Q160-Y171 WeakPolarHBondContact CA-OH 3.36Å; S161-Y171 PolarHBondContact N-OH 2.72Å; I169-Y171 HydrophobicContact CG2-CD1 4.14Å; I169-Y171 HydrophobicContact CG2-CD2 4.46Å; I169-Y171 HydrophobicContact CG2-CE1 3.73Å; I169-Y171 HydrophobicContact CG2-CE2 4.09Å; I169-Y171 HydrophobicContact CG2-CG 4.48Å; Y171-K190 PolarHBondContact N-O 2.89Å; Y171-A215 HydrophobicContact CD1-CB 4.15Å; Y171-A215 HydrophobicContact CE1-CB 4.1Å
172	S	93.6	Very high	90.1	Very high	35 Å²	35	68.5 Å²	68.5	25%	0.245	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	157	172.8	58.4	0	0	0	0	111.2	I188 A213 Y214 Y216	S172-I188 VanDerWaalsContact CA-CG2 3.45Å; S172-A213 CarbonylContact O-C 3.59Å; S172-A213 WeakPolarHBondContact O-CA 3.48Å; S172-Y214 PolarHBondContact N-O 3.02Å; S172-Y214 PolarHBondContact O-N 3.05Å; S172-Y216 WeakPolarHBondContact OG-CE2 3.02Å
173	I	94.5	Very high	90.3	Very high	22 Å²	22	69.2 Å²	69.2	11%	0.113	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	155.3	175.9	53.9	171.5	0	0	0	111	A178 F186 I188 L195 L211 T212 A213	I173-A178 HydrophobicContact CD1-CB 3.99Å; I173-A178 HydrophobicContact CG1-CB 4.1Å; I173-F186 HydrophobicContact CD1-CB 4.11Å; I173-I188 HydrophobicContact CB-CG2 4.39Å; I173-I188 HydrophobicContact CG1-CB 4.36Å; I173-I188 HydrophobicContact CG1-CG2 4.06Å; I173-I188 HydrophobicContact CG2-CB 4Å; I173-I188 HydrophobicContact CG2-CD1 4.24Å; I173-I188 HydrophobicContact CG2-CG2 3.94Å; I173-L195 HydrophobicContact CD1-CD1 3.79Å; I173-L195 HydrophobicContact CG2-CD1 4.43Å; I173-L211 HydrophobicContact CD1-CD1 4.19Å; I173-T212 WeakPolarHBondContact CA-O 3.48Å; I173-A213 HydrophobicContact CG2-CB 4.09Å
174	K	93.9	Very high	90.5	Very high	94 Å²	94	73.7 Å²	73.7	41%	0.409	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	154.6	170	-58.4	-173.2	-179.3	-176.7	0	110	D179 L211 T212 Y214	K174-D179 WeakPolarHBondContact CA-OD1 3.44Å; K174-D179 WeakPolarHBondContact CG-OD2 3.21Å; K174-L211 CarbonylContact O-C 3.54Å; K174-T212 PolarHBondContact N-O 2.75Å; K174-T212 PolarHBondContact O-N 2.96Å; K174-Y214 HydrophobicContact CB-CE2 4.02Å; K174-Y214 HydrophobicContact CD-CE2 4.15Å; K174-Y214 HydrophobicContact CG-CD2 4.44Å; K174-Y214 HydrophobicContact CG-CE2 3.99Å
175	G	92.5	Very high	90.9	Very high	8 Å²	8	71.9 Å²	71.9	8%	0.082	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137	179.9	-179.4	0	0	0	0	0	113.1	G177 A178 D179 Q180	G175-G177 PolarHBondContact O-N 2.92Å; G175-A178 PolarHBondContact O-N 2.78Å; G175-D179 PolarHBondContact N-OD1 3.1Å; G175-D179 PolarHBondContact O-N 3.47Å; G175-Q180 PolarHBondContact O-N 3.25Å
176	R	91.9	Very high	91.4	Very high	91 Å²	91	63.9 Å²	63.9	34%	0.343	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-55.4	126.4	168	-168.5	-165.3	-164.4	-166.4	8.7	108	E181 D207 V208 F209 L211	R176-E181 WeakPolarHBondContact CG-O 3.48Å; R176-D207 IonicContact NH1-OD1 3.81Å; R176-V208 PolarHBondContact NH1-O 2.9Å; R176-F209 HydrophobicContact CB-CD1 4.38Å; R176-F209 HydrophobicContact CG-CD1 4.01Å; R176-F209 HydrophobicContact CG-CE1 4.35Å; R176-F209 WeakPolarHBondContact O-CD1 3.3Å; R176-L211 VanDerWaalsContact O-CD2 3.26Å; R176-L211 WeakPolarHBondContact O-CD2 3.27Å
177	G	90.6	Very high	91.8	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.8	-13.6	-174.4	0	0	0	0	0	114.7	G175 Q180 P182 L185 F186	G175-G177 PolarHBondContact O-N 2.92Å; G177-Q180 PolarHBondContact N-O 3.22Å; G177-Q180 VanDerWaalsContact N-O 3.11Å; G177-P182 CarbonylContact C-O 3.59Å; G177-P182 VanDerWaalsContact C-O 3.27Å; G177-P182 WeakPolarHBondContact CA-O 3.17Å; G177-P182 PolarHBondContact N-O 2.88Å; G177-L185 WeakPolarHBondContact O-CB 3.03Å; G177-L185 PolarHBondContact O-N 2.81Å; G177-L185 VanDerWaalsContact O-N 3.07Å; G177-F186 PolarHBondContact O-N 2.86Å
178	A	92.1	Very high	92.3	Very high	11 Å²	11	54 Å²	54	9%	0.091	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-91.4	-179.6	0	0	0	0	0	111.4	I173 G175 R183 D184 L211	I173-A178 HydrophobicContact CD1-CB 3.99Å; I173-A178 HydrophobicContact CG1-CB 4.1Å; G175-A178 PolarHBondContact O-N 2.78Å; A178-R183 WeakPolarHBondContact O-CA 3.49Å; A178-D184 PolarHBondContact O-N 3.49Å; A178-D184 VanDerWaalsContact O-N 3.16Å; A178-L211 HydrophobicContact CB-CD2 3.83Å
179	D	92.1	Very high	92.7	Very high	77 Å²	77	52.1 Å²	52.1	41%	0.412	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-14.5	177.5	63.1	-16	0	0	0	113.2	K174 G175	K174-D179 WeakPolarHBondContact CA-OD1 3.44Å; K174-D179 WeakPolarHBondContact CG-OD2 3.21Å; G175-D179 PolarHBondContact N-OD1 3.1Å; G175-D179 PolarHBondContact O-N 3.47Å
180	Q	91.7	Very high	92.8	Very high	113 Å²	113	57.9 Å²	57.9	53%	0.528	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-113.9	155.7	175.7	-61	168	52.7	0	0	111	G175 G177 P182	G175-Q180 PolarHBondContact O-N 3.25Å; G177-Q180 PolarHBondContact N-O 3.22Å; G177-Q180 VanDerWaalsContact N-O 3.11Å; Q180-P182 CarbonylContact O-C 3.56Å
181	E	88.5	Confident	92.7	Very high	135 Å²	135	61.8 Å²	61.8	63%	0.631	30%	0.298	S	S	*	.	S	Bend	trans	-66.6	138.4	-171.3	-76.5	163.5	-149.9	0	0	113.4	R176 R183	R176-E181 WeakPolarHBondContact CG-O 3.48Å; E181-R183 HydrophobicContact CG-CG 3.88Å; E181-R183 IonicContact OE1-CZ 2.65Å; E181-R183 IonicContact OE1-NE 3.22Å; E181-R183 PolarHBondContact OE1-NE 2.94Å; E181-R183 IonicContact OE1-NH2 3.76Å; E181-R183 PolarHBondContact OE1-NH2 3.08Å
182	P	92.1	Very high	92.5	Very high	32 Å²	32	63.8 Å²	63.8	21%	0.208	31%	0.312	C	S	.	.	S	Bend	cis	-70.1	127.5	-3.8	30	-35.1	0	0	0	112.1	G177 Q180 L185 Y206 F209	G177-P182 CarbonylContact C-O 3.59Å; G177-P182 VanDerWaalsContact C-O 3.27Å; G177-P182 WeakPolarHBondContact CA-O 3.17Å; G177-P182 PolarHBondContact N-O 2.88Å; Q180-P182 CarbonylContact O-C 3.56Å; P182-L185 HydrophobicContact CG-CD2 3.95Å; P182-Y206 HydrophobicContact CG-CE1 4.26Å; P182-Y206 HydrophobicContact CG-CE2 4.15Å; P182-F209 HydrophobicContact CG-CE1 3.79Å; P182-F209 HydrophobicContact CG-CZ 4.34Å
183	R	90.4	Very high	92.4	Very high	140 Å²	140	62.1 Å²	62.1	53%	0.528	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	155.9	-174.1	-57.4	-175.2	-154.2	-160.3	4	112.3	A178 E181 L185	A178-R183 WeakPolarHBondContact O-CA 3.49Å; E181-R183 HydrophobicContact CG-CG 3.88Å; E181-R183 IonicContact OE1-CZ 2.65Å; E181-R183 IonicContact OE1-NE 3.22Å; E181-R183 PolarHBondContact OE1-NE 2.94Å; E181-R183 IonicContact OE1-NH2 3.76Å; E181-R183 PolarHBondContact OE1-NH2 3.08Å; R183-L185 PolarHBondContact O-N 2.92Å
184	D	90.4	Very high	92.4	Very high	114 Å²	114	62.3 Å²	62.3	61%	0.61	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	21.7	175.3	-51.4	-62.4	0	0	0	114	A178	A178-D184 PolarHBondContact O-N 3.49Å; A178-D184 VanDerWaalsContact O-N 3.16Å
185	L	94.1	Very high	92.4	Very high	10 Å²	10	57.9 Å²	57.9	5%	0.052	28%	0.282	C	S	.	.	S	Bend	trans	-74.2	-45.8	175.5	176.6	61.6	0	0	0	110.2	G177 P182 R183 C197 H198 K199 V201 F209	G177-L185 WeakPolarHBondContact O-CB 3.03Å; G177-L185 PolarHBondContact O-N 2.81Å; G177-L185 VanDerWaalsContact O-N 3.07Å; P182-L185 HydrophobicContact CG-CD2 3.95Å; R183-L185 PolarHBondContact O-N 2.92Å; L185-C197 CarbonylContact O-C 3.57Å; L185-C197 WeakPolarHBondContact O-CA 3.34Å; L185-H198 PolarHBondContact O-N 2.86Å; L185-K199 HydrophobicContact CD1-CB 3.92Å; L185-V201 HydrophobicContact CD1-CG2 3.88Å; L185-V201 HydrophobicContact CD2-CG2 3.87Å; L185-V201 HydrophobicContact CG-CG2 4.36Å; L185-F209 HydrophobicContact CD2-CE1 3.76Å; L185-F209 HydrophobicContact CD2-CE2 4.24Å; L185-F209 HydrophobicContact CD2-CZ 3.57Å
186	F	95.1	Very high	92.5	Very high	3 Å²	3	60.4 Å²	60.4	1%	0.013	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	144.4	174.2	-52.1	-76.2	0	0	0	111.6	M144 L156 I173 G177 L195 Y196 C197 F209 L211 I231	M144-F186 HydrophobicContact SD-CE1 4.38Å; L156-F186 HydrophobicContact CD1-CD1 3.82Å; L156-F186 HydrophobicContact CD1-CE1 3.82Å; I173-F186 HydrophobicContact CD1-CB 4.11Å; G177-F186 PolarHBondContact O-N 2.86Å; F186-L195 HydrophobicContact CB-CD1 4.36Å; F186-Y196 CarbonylContact C-O 3.49Å; F186-Y196 VanDerWaalsContact CA-O 3.24Å; F186-Y196 WeakPolarHBondContact CA-O 3.22Å; F186-C197 HydrophobicContact CD1-CB 3.76Å; F186-C197 HydrophobicContact CE1-CB 3.76Å; F186-C197 VanDerWaalsContact CE1-SG 3.54Å; F186-F209 HydrophobicContact CE2-CB 3.86Å; F186-F209 AromaticContact CE2-CD1 3.77Å; F186-F209 HydrophobicContact CE2-CD1 3.77Å; F186-F209 AromaticContact CE2-CD2 3.74Å; F186-F209 HydrophobicContact CE2-CD2 3.74Å; F186-F209 HydrophobicContact CE2-CE1 4.18Å; F186-F209 HydrophobicContact CE2-CE2 4.17Å; F186-F209 AromaticContact CE2-CG 3.51Å; F186-F209 HydrophobicContact CE2-CG 3.51Å; F186-F209 HydrophobicContact CE2-CZ 4.35Å; F186-F209 HydrophobicContact CZ-CB 4.49Å; F186-F209 AromaticContact CZ-CD2 3.85Å; F186-F209 HydrophobicContact CZ-CD2 3.85Å; F186-F209 HydrophobicContact CZ-CE2 4.17Å; F186-F209 HydrophobicContact CZ-CG 4.09Å; F186-L211 HydrophobicContact CB-CD1 3.85Å; F186-L211 HydrophobicContact CD2-CD1 3.94Å; F186-L211 HydrophobicContact CG-CD1 3.96Å; F186-I231 HydrophobicContact CD1-CD1 3.57Å; F186-I231 HydrophobicContact CD2-CD1 4.1Å; F186-I231 HydrophobicContact CE1-CD1 3.48Å; F186-I231 VanDerWaalsContact CE1-CD1 3.48Å; F186-I231 HydrophobicContact CE2-CD1 4.03Å; F186-I231 HydrophobicContact CG-CD1 3.89Å; F186-I231 HydrophobicContact CZ-CD1 3.73Å
187	T	95	Very high	92.6	Very high	49 Å²	49	56 Å²	56	30%	0.301	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	142.6	173.6	57.5	0	0	0	0	111	Y196 H198	T187-Y196 PolarHBondContact N-O 2.97Å; T187-Y196 PolarHBondContact O-N 3.37Å; T187-H198 PolarHBondContact OG1-CE1 3.42Å
188	I	95.3	Very high	92.8	Very high	17 Å²	17	59.8 Å²	59.8	9%	0.087	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	135.2	169.4	-163.7	164.1	0	0	0	110.4	V159 S172 I173 N194 L195	V159-I188 HydrophobicContact CG2-CD1 3.52Å; S172-I188 VanDerWaalsContact CA-CG2 3.45Å; I173-I188 HydrophobicContact CB-CG2 4.39Å; I173-I188 HydrophobicContact CG1-CB 4.36Å; I173-I188 HydrophobicContact CG1-CG2 4.06Å; I173-I188 HydrophobicContact CG2-CB 4Å; I173-I188 HydrophobicContact CG2-CD1 4.24Å; I173-I188 HydrophobicContact CG2-CG2 3.94Å; I188-N194 CarbonylContact C-O 3.35Å; I188-N194 WeakPolarHBondContact CA-O 3.34Å; I188-L195 HydrophobicContact CB-CD1 4.4Å
189	D	95.4	Very high	92.7	Very high	60 Å²	60	65.2 Å²	65.2	32%	0.321	31%	0.312	S	S	.	.			trans	-68.9	130.5	168.8	174.7	-93.4	0	0	0	110.3	H191 T192 G193 N194 Y196	D189-H191 PolarHBondContact O-N 2.8Å; D189-H191 PolarHBondContact OD1-N 2.78Å; D189-T192 WeakPolarHBondContact CB-OG1 3.41Å; D189-T192 VanDerWaalsContact CG-OG1 3.24Å; D189-T192 WeakPolarHBondContact OD1-CB 3.29Å; D189-T192 PolarHBondContact OD1-N 2.92Å; D189-T192 PolarHBondContact OD1-OG1 2.73Å; D189-G193 WeakPolarHBondContact O-CA 3.39Å; D189-G193 PolarHBondContact O-N 2.89Å; D189-G193 VanDerWaalsContact O-N 3.08Å; D189-N194 HydrophobicContact CB-CB 4.37Å; D189-N194 PolarHBondContact N-O 3.44Å; D189-Y196 HydrophobicContact CB-CE2 4.28Å
190	K	92.9	Very high	92.8	Very high	132 Å²	132	64 Å²	64	57%	0.574	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-18.6	-167	-67.5	178.6	-177.6	173.6	0	114	I170 Y171	I170-K190 WeakPolarHBondContact CA-O 3.16Å; I170-K190 HydrophobicContact CG2-CB 4.3Å; Y171-K190 PolarHBondContact N-O 2.89Å
191	H	90	Very high	92.9	Very high	138 Å²	138	59 Å²	59	64%	0.639	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	-34.3	-172.3	-60.1	-57.4	0	0	0	113	D189	D189-H191 PolarHBondContact O-N 2.8Å; D189-H191 PolarHBondContact OD1-N 2.78Å
192	T	91.3	Very high	93.2	Very high	58 Å²	58	55 Å²	55	36%	0.356	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-21.7	179.5	61.8	0	0	0	0	113.3	Q158 D189 N194	Q158-T192 PolarHBondContact NE2-O 3.24Å; D189-T192 WeakPolarHBondContact CB-OG1 3.41Å; D189-T192 VanDerWaalsContact CG-OG1 3.24Å; D189-T192 WeakPolarHBondContact OD1-CB 3.29Å; D189-T192 PolarHBondContact OD1-N 2.92Å; D189-T192 PolarHBondContact OD1-OG1 2.73Å; T192-N194 PolarHBondContact O-N 2.87Å; T192-N194 PolarHBondContact OG1-N 2.92Å
193	G	90.9	Very high	93.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.268	C	S	.	.			trans	72.6	14.3	-174.7	0	0	0	0	0	114	V159 D189 L195	V159-G193 PolarHBondContact N-O 3.35Å; V159-G193 WeakPolarHBondContact O-CA 3.23Å; D189-G193 WeakPolarHBondContact O-CA 3.39Å; D189-G193 PolarHBondContact O-N 2.89Å; D189-G193 VanDerWaalsContact O-N 3.08Å; G193-L195 PolarHBondContact O-N 2.73Å
194	N	94.4	Very high	93.6	Very high	27 Å²	27	50.8 Å²	50.8	14%	0.144	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	123.2	175.3	-69.7	-3.3	0	0	0	110.6	F155 Q158 I188 D189 T192 Y196	F155-N194 HydrophobicContact CD2-CB 4.11Å; F155-N194 HydrophobicContact CE2-CB 3.82Å; Q158-N194 VanDerWaalsContact CG-OD1 3.22Å; Q158-N194 WeakPolarHBondContact CG-OD1 3.34Å; Q158-N194 PolarHBondContact NE2-OD1 3.38Å; I188-N194 CarbonylContact C-O 3.35Å; I188-N194 WeakPolarHBondContact CA-O 3.34Å; D189-N194 HydrophobicContact CB-CB 4.37Å; D189-N194 PolarHBondContact N-O 3.44Å; T192-N194 PolarHBondContact O-N 2.87Å; T192-N194 PolarHBondContact OG1-N 2.92Å; N194-Y196 HydrophobicContact CB-CD2 4.26Å; N194-Y196 HydrophobicContact CB-CE2 3.39Å; N194-Y196 PolarHBondContact ND2-OH 3.24Å; N194-Y196 VanDerWaalsContact ND2-OH 3.11Å; N194-Y196 WeakPolarHBondContact O-CD2 3.5Å; N194-Y196 WeakPolarHBondContact O-CE2 3.45Å
195	L	94.1	Very high	93.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	130.7	175.2	-176.3	63.2	0	0	0	110.1	L156 Q157 I173 F186 I188 G193 L211 I231	L156-L195 PolarHBondContact N-O 3.14Å; Q157-L195 VanDerWaalsContact O-CB 3.3Å; Q157-L195 WeakPolarHBondContact O-CB 3.15Å; Q157-L195 PolarHBondContact O-N 2.76Å; I173-L195 HydrophobicContact CD1-CD1 3.79Å; I173-L195 HydrophobicContact CG2-CD1 4.43Å; F186-L195 HydrophobicContact CB-CD1 4.36Å; I188-L195 HydrophobicContact CB-CD1 4.4Å; G193-L195 PolarHBondContact O-N 2.73Å; L195-L211 HydrophobicContact CD1-CD1 4.43Å; L195-I231 HydrophobicContact CD2-CD1 4.21Å
196	Y	94.4	Very high	93.6	Very high	61 Å²	61	53.5 Å²	53.5	24%	0.239	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147.9	-178.8	-61.5	-89.5	0	0	0	111.9	P153 L154 F155 F186 T187 D189 N194	P153-Y196 HydrophobicContact CB-CD1 4.13Å; P153-Y196 HydrophobicContact CB-CG 4.33Å; P153-Y196 HydrophobicContact CG-CD1 4.47Å; L154-Y196 CarbonylContact O-C 3.46Å; L154-Y196 WeakPolarHBondContact O-CA 3.45Å; F155-Y196 HydrophobicContact CB-CD1 3.98Å; F155-Y196 HydrophobicContact CB-CE1 3.82Å; F155-Y196 HydrophobicContact CD2-CD1 4.43Å; F155-Y196 AromaticContact CD2-CE1 3.97Å; F155-Y196 HydrophobicContact CD2-CE1 3.97Å; F155-Y196 HydrophobicContact CG-CE1 4.39Å; F186-Y196 CarbonylContact C-O 3.49Å; F186-Y196 VanDerWaalsContact CA-O 3.24Å; F186-Y196 WeakPolarHBondContact CA-O 3.22Å; T187-Y196 PolarHBondContact N-O 2.97Å; T187-Y196 PolarHBondContact O-N 3.37Å; D189-Y196 HydrophobicContact CB-CE2 4.28Å; N194-Y196 HydrophobicContact CB-CD2 4.26Å; N194-Y196 HydrophobicContact CB-CE2 3.39Å; N194-Y196 PolarHBondContact ND2-OH 3.24Å; N194-Y196 VanDerWaalsContact ND2-OH 3.11Å; N194-Y196 WeakPolarHBondContact O-CD2 3.5Å; N194-Y196 WeakPolarHBondContact O-CE2 3.45Å
197	C	94.7	Very high	93.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	142.8	164.6	-169.1	0	0	0	0	110.7	M144 P153 L154 L156 L185 F186 K199	M144-C197 HydrophobicContact CE-CB 4.3Å; M144-C197 HydrophobicContact SD-CB 3.75Å; P153-C197 CarbonylContact C-O 3.57Å; P153-C197 VanDerWaalsContact CA-O 3.28Å; P153-C197 WeakPolarHBondContact CA-O 3.44Å; L154-C197 HydrophobicContact CB-CB 4.49Å; L154-C197 PolarHBondContact N-O 3.12Å; L154-C197 PolarHBondContact O-N 3.28Å; L156-C197 HydrophobicContact CD1-CB 4.18Å; L156-C197 HydrophobicContact CD2-CB 4.41Å; L156-C197 HydrophobicContact CG-CB 4.39Å; L185-C197 CarbonylContact O-C 3.57Å; L185-C197 WeakPolarHBondContact O-CA 3.34Å; F186-C197 HydrophobicContact CD1-CB 3.76Å; F186-C197 HydrophobicContact CE1-CB 3.76Å; F186-C197 VanDerWaalsContact CE1-SG 3.54Å; C197-K199 PolarHBondContact SG-O 3.32Å
198	H	93.1	Very high	93.4	Very high	78 Å²	78	57.5 Å²	57.5	36%	0.361	28%	0.281	S	S	.	.			trans	-102.4	-13	-175.6	-83.4	113.8	0	0	0	115.6	F152 L185 T187	F152-H198 VanDerWaalsContact CD1-C 3.48Å; L185-H198 PolarHBondContact O-N 2.86Å; T187-H198 PolarHBondContact OG1-CE1 3.42Å
199	K	91.6	Very high	93.3	Very high	125 Å²	125	56.7 Å²	56.7	54%	0.543	28%	0.277	S	S	.	.	S	Bend	trans	-147	160.1	-173.3	-62.8	174.5	-175.4	161.2	0	110.5	F152 L185 C197	F152-K199 VanDerWaalsContact CE1-O 3.32Å; F152-K199 WeakPolarHBondContact CE1-O 3.2Å; L185-K199 HydrophobicContact CD1-CB 3.92Å; C197-K199 PolarHBondContact SG-O 3.32Å
200	A	92.8	Very high	93	Very high	51 Å²	51	59.4 Å²	59.4	42%	0.421	29%	0.291	S	S	.	.			trans	-60.5	153.6	161.6	0	0	0	0	0	110.2	F152	F152-A200 HydrophobicContact CZ-CB 4.28Å
201	V	93.8	Very high	93	Very high	8 Å²	8	53.2 Å²	53.2	5%	0.048	26%	0.264	C	S	.	.			trans	-131	139.6	178.8	-179.7	0	0	0	0	106.1	M144 E146 N147 L185 Y206 F209 I233	M144-V201 HydrophobicContact CE-CG2 4.31Å; E146-V201 WeakPolarHBondContact CB-O 3.31Å; N147-V201 PolarHBondContact N-O 2.81Å; L185-V201 HydrophobicContact CD1-CG2 3.88Å; L185-V201 HydrophobicContact CD2-CG2 3.87Å; L185-V201 HydrophobicContact CG-CG2 4.36Å; V201-Y206 HydrophobicContact CG1-CD2 4.34Å; V201-F209 HydrophobicContact CG1-CE2 3.92Å; V201-F209 HydrophobicContact CG1-CZ 4.17Å; V201-I233 HydrophobicContact CB-CD1 4.48Å; V201-I233 HydrophobicContact CG1-CD1 4.16Å; V201-I233 HydrophobicContact CG1-CG1 4.04Å
202	D	94.9	Very high	93.1	Very high	53 Å²	53	48.4 Å²	48.4	28%	0.283	25%	0.245	S	C	.	.			trans	-100.3	139.4	165.1	77.8	78.7	0	0	0	108.9	K205 Y206	D202-K205 WeakPolarHBondContact OD1-CB 3.2Å; D202-K205 PolarHBondContact OD1-N 3.36Å; D202-K205 VanDerWaalsContact OD1-N 3.17Å; D202-K205 VanDerWaalsContact OD2-CD 3.28Å; D202-K205 WeakPolarHBondContact OD2-CD 3.48Å; D202-K205 IonicContact OD2-NZ 3.19Å; D202-Y206 PolarHBondContact O-N 2.83Å
203	R	95.4	Very high	93.2	Very high	27 Å²	27	46 Å²	46	10%	0.102	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-29	-167.2	-178.4	-124	58.3	133.4	5.7	112.2	E146 K205 Y206 D207 I233 D235 M270 E272	E146-R203 HydrophobicContact CB-CB 4.22Å; E146-R203 VanDerWaalsContact CD-CB 3.42Å; E146-R203 HydrophobicContact CG-CB 4.48Å; E146-R203 VanDerWaalsContact OE1-CB 3.32Å; E146-R203 WeakPolarHBondContact OE1-CB 3.41Å; E146-R203 WeakPolarHBondContact OE2-CB 3.3Å; E146-R203 PolarHBondContact OE2-N 3.44Å; R203-K205 PolarHBondContact O-N 3.22Å; R203-K205 VanDerWaalsContact O-N 3.11Å; R203-Y206 CarbonylContact O-C 3.53Å; R203-Y206 VanDerWaalsContact O-C 3.25Å; R203-Y206 PolarHBondContact O-N 3.46Å; R203-D207 PolarHBondContact O-N 2.75Å; R203-I233 HydrophobicContact CB-CB 4.28Å; R203-I233 HydrophobicContact CB-CG2 3.7Å; R203-I233 HydrophobicContact CG-CB 4.03Å; R203-I233 HydrophobicContact CG-CG2 3.91Å; R203-D235 WeakPolarHBondContact CD-OD1 3.13Å; R203-D235 IonicContact CZ-OD1 2.87Å; R203-D235 IonicContact NE-OD1 2.99Å; R203-D235 PolarHBondContact NE-OD1 2.63Å; R203-D235 IonicContact NH1-OD1 3.63Å; R203-D235 PolarHBondContact NH1-OD1 2.7Å; R203-D235 IonicContact NH2-OD1 3.81Å; R203-M270 PolarHBondContact NH2-O 2.85Å; R203-E272 VanDerWaalsContact NH1-N 3.13Å
204	E	94.9	Very high	93.3	Very high	55 Å²	55	48.6 Å²	48.6	26%	0.257	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-29.2	175.5	-66.4	54.6	-103.5	0	0	110.7	N239 M270	E204-N239 VanDerWaalsContact CD-ND2 3.27Å; E204-N239 WeakPolarHBondContact CG-ND2 3.21Å; E204-M270 HydrophobicContact CG-CB 4.07Å
205	K	93.4	Very high	93.2	Very high	127 Å²	127	47.8 Å²	47.8	55%	0.552	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-28.5	175.9	-170.3	-177.7	-166.1	165.2	0	113.8	D202 R203	D202-K205 WeakPolarHBondContact OD1-CB 3.2Å; D202-K205 PolarHBondContact OD1-N 3.36Å; D202-K205 VanDerWaalsContact OD1-N 3.17Å; D202-K205 VanDerWaalsContact OD2-CD 3.28Å; D202-K205 WeakPolarHBondContact OD2-CD 3.48Å; D202-K205 IonicContact OD2-NZ 3.19Å; R203-K205 PolarHBondContact O-N 3.22Å; R203-K205 VanDerWaalsContact O-N 3.11Å
206	Y	92.6	Very high	93.1	Very high	54 Å²	54	50.9 Å²	50.9	21%	0.212	25%	0.25	C	S	.	.			trans	-145.4	83.3	-174.6	-59.7	-63.4	0	0	0	113.3	P182 V201 D202 R203 F209 I233	P182-Y206 HydrophobicContact CG-CE1 4.26Å; P182-Y206 HydrophobicContact CG-CE2 4.15Å; V201-Y206 HydrophobicContact CG1-CD2 4.34Å; D202-Y206 PolarHBondContact O-N 2.83Å; R203-Y206 CarbonylContact O-C 3.53Å; R203-Y206 VanDerWaalsContact O-C 3.25Å; R203-Y206 PolarHBondContact O-N 3.46Å; Y206-F209 HydrophobicContact CD1-CE1 4.13Å; Y206-F209 AromaticContact CD1-CZ 3.95Å; Y206-F209 HydrophobicContact CD1-CZ 3.95Å; Y206-F209 HydrophobicContact CD2-CZ 4.01Å; Y206-F209 HydrophobicContact CG-CE1 4.18Å; Y206-F209 HydrophobicContact CG-CE2 4.27Å; Y206-F209 AromaticContact CG-CZ 3.54Å; Y206-F209 HydrophobicContact CG-CZ 3.54Å; Y206-I233 WeakPolarHBondContact O-CG1 3.18Å
207	D	92.1	Very high	92.8	Very high	95 Å²	95	48.7 Å²	48.7	51%	0.508	24%	0.244	S	C	.	.	S	Bend	trans	-61.8	-46.5	174.2	64.6	-34.1	0	0	0	114.2	R176 R203 I233	R176-D207 IonicContact NH1-OD1 3.81Å; R203-D207 PolarHBondContact O-N 2.75Å; D207-I233 PolarHBondContact O-N 2.97Å
208	V	92.8	Very high	92.4	Very high	42 Å²	42	53.3 Å²	53.3	26%	0.255	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	141.4	-173.5	-175.7	0	0	0	0	112	R176 P230 I231 K232	R176-V208 PolarHBondContact NH1-O 2.9Å; V208-P230 HydrophobicContact CG1-CB 4.3Å; V208-I231 WeakPolarHBondContact CA-O 3.21Å; V208-K232 HydrophobicContact CG2-CG 4.32Å
209	F	92.9	Very high	91.9	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	105.5	169.9	-64.8	-90.5	0	0	0	111.5	R176 P182 L185 F186 V201 Y206 L211 P230 I231 I233	R176-F209 HydrophobicContact CB-CD1 4.38Å; R176-F209 HydrophobicContact CG-CD1 4.01Å; R176-F209 HydrophobicContact CG-CE1 4.35Å; R176-F209 WeakPolarHBondContact O-CD1 3.3Å; P182-F209 HydrophobicContact CG-CE1 3.79Å; P182-F209 HydrophobicContact CG-CZ 4.34Å; L185-F209 HydrophobicContact CD2-CE1 3.76Å; L185-F209 HydrophobicContact CD2-CE2 4.24Å; L185-F209 HydrophobicContact CD2-CZ 3.57Å; F186-F209 HydrophobicContact CE2-CB 3.86Å; F186-F209 AromaticContact CE2-CD1 3.77Å; F186-F209 HydrophobicContact CE2-CD1 3.77Å; F186-F209 AromaticContact CE2-CD2 3.74Å; F186-F209 HydrophobicContact CE2-CD2 3.74Å; F186-F209 HydrophobicContact CE2-CE1 4.18Å; F186-F209 HydrophobicContact CE2-CE2 4.17Å; F186-F209 AromaticContact CE2-CG 3.51Å; F186-F209 HydrophobicContact CE2-CG 3.51Å; F186-F209 HydrophobicContact CE2-CZ 4.35Å; F186-F209 HydrophobicContact CZ-CB 4.49Å; F186-F209 AromaticContact CZ-CD2 3.85Å; F186-F209 HydrophobicContact CZ-CD2 3.85Å; F186-F209 HydrophobicContact CZ-CE2 4.17Å; F186-F209 HydrophobicContact CZ-CG 4.09Å; V201-F209 HydrophobicContact CG1-CE2 3.92Å; V201-F209 HydrophobicContact CG1-CZ 4.17Å; Y206-F209 HydrophobicContact CD1-CE1 4.13Å; Y206-F209 AromaticContact CD1-CZ 3.95Å; Y206-F209 HydrophobicContact CD1-CZ 3.95Å; Y206-F209 HydrophobicContact CD2-CZ 4.01Å; Y206-F209 HydrophobicContact CG-CE1 4.18Å; Y206-F209 HydrophobicContact CG-CE2 4.27Å; Y206-F209 AromaticContact CG-CZ 3.54Å; Y206-F209 HydrophobicContact CG-CZ 3.54Å; F209-L211 PolarHBondContact O-N 2.81Å; F209-P230 WeakPolarHBondContact O-CA 3.24Å; F209-I231 HydrophobicContact CB-CB 4.41Å; F209-I231 PolarHBondContact N-O 2.91Å; F209-I231 PolarHBondContact O-N 2.87Å; F209-I233 HydrophobicContact CD2-CD1 4.11Å; F209-I233 HydrophobicContact CD2-CG1 4.19Å; F209-I233 HydrophobicContact CE2-CD1 4.01Å; F209-I233 HydrophobicContact CE2-CG1 3.95Å
210	D	90.8	Very high	91.4	Very high	116 Å²	116	52.6 Å²	52.6	62%	0.62	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	83.7	172.1	-73.9	-51.9	0	0	0	111.4
211	L	92.2	Very high	91.1	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	156.5	168.1	-62.7	177.7	0	0	0	111.2	I173 K174 R176 A178 F186 L195 F209 L229 I231	I173-L211 HydrophobicContact CD1-CD1 4.19Å; K174-L211 CarbonylContact O-C 3.54Å; R176-L211 VanDerWaalsContact O-CD2 3.26Å; R176-L211 WeakPolarHBondContact O-CD2 3.27Å; A178-L211 HydrophobicContact CB-CD2 3.83Å; F186-L211 HydrophobicContact CB-CD1 3.85Å; F186-L211 HydrophobicContact CD2-CD1 3.94Å; F186-L211 HydrophobicContact CG-CD1 3.96Å; L195-L211 HydrophobicContact CD1-CD1 4.43Å; F209-L211 PolarHBondContact O-N 2.81Å; L211-L229 HydrophobicContact CB-CB 4.45Å; L211-L229 WeakPolarHBondContact CB-O 3.3Å; L211-L229 PolarHBondContact N-O 3.44Å; L211-L229 CarbonylContact O-C 3.56Å; L211-L229 PolarHBondContact O-N 3.3Å; L211-I231 HydrophobicContact CD1-CD1 3.62Å; L211-I231 HydrophobicContact CD1-CG1 4.36Å
212	T	92.9	Very high	90.8	Very high	37 Å²	37	61 Å²	61	23%	0.227	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	123.3	167.8	-60.3	0	0	0	0	109.2	I173 K174 Y214 P226 L227	I173-T212 WeakPolarHBondContact CA-O 3.48Å; K174-T212 PolarHBondContact N-O 2.75Å; K174-T212 PolarHBondContact O-N 2.96Å; T212-Y214 HydrophobicContact CG2-CD2 4.3Å; T212-Y214 HydrophobicContact CG2-CE1 4.49Å; T212-Y214 HydrophobicContact CG2-CE2 3.62Å; T212-Y214 WeakPolarHBondContact O-CD2 3.44Å; T212-Y214 VanDerWaalsContact O-CE2 3.27Å; T212-Y214 WeakPolarHBondContact O-CE2 3.25Å; T212-P226 HydrophobicContact CG2-CB 3.57Å; T212-L227 CarbonylContact C-O 3.37Å; T212-L227 WeakPolarHBondContact CA-O 3.47Å
213	A	92.3	Very high	90.3	Very high	8 Å²	8	60.2 Å²	60.2	7%	0.066	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	146.3	172.5	0	0	0	0	0	111.9	V159 S172 I173 P226 L227 L229	V159-A213 HydrophobicContact CG2-CB 4.43Å; S172-A213 CarbonylContact O-C 3.59Å; S172-A213 WeakPolarHBondContact O-CA 3.48Å; I173-A213 HydrophobicContact CG2-CB 4.09Å; A213-P226 WeakPolarHBondContact O-CA 3.34Å; A213-L227 HydrophobicContact CB-CB 4.49Å; A213-L227 PolarHBondContact N-O 2.8Å; A213-L227 PolarHBondContact O-N 3.44Å; A213-L229 HydrophobicContact CB-CD1 3.58Å; A213-L229 HydrophobicContact CB-CG 4.3Å
214	Y	92.8	Very high	89.9	Confident	54 Å²	54	62.1 Å²	62.1	21%	0.212	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	135.7	179.4	-59.3	-103.9	0	0	0	109.1	S172 K174 T212 Y216 P226	S172-Y214 PolarHBondContact N-O 3.02Å; S172-Y214 PolarHBondContact O-N 3.05Å; K174-Y214 HydrophobicContact CB-CE2 4.02Å; K174-Y214 HydrophobicContact CD-CE2 4.15Å; K174-Y214 HydrophobicContact CG-CD2 4.44Å; K174-Y214 HydrophobicContact CG-CE2 3.99Å; T212-Y214 HydrophobicContact CG2-CD2 4.3Å; T212-Y214 HydrophobicContact CG2-CE1 4.49Å; T212-Y214 HydrophobicContact CG2-CE2 3.62Å; T212-Y214 WeakPolarHBondContact O-CD2 3.44Å; T212-Y214 VanDerWaalsContact O-CE2 3.27Å; T212-Y214 WeakPolarHBondContact O-CE2 3.25Å; Y214-Y216 VanDerWaalsContact CB-CE2 3.41Å; Y214-Y216 WeakPolarHBondContact CD1-OH 3.07Å; Y214-Y216 HydrophobicContact CG-CE2 4.2Å; Y214-P226 HydrophobicContact CD1-CB 3.91Å; Y214-P226 HydrophobicContact CD1-CG 3.71Å; Y214-P226 HydrophobicContact CE1-CB 3.69Å; Y214-P226 HydrophobicContact CE1-CG 3.51Å
215	A	93.1	Very high	89.5	Confident	10 Å²	10	64.2 Å²	64.2	8%	0.083	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	117.8	175.2	0	0	0	0	0	109.2	I169 Y171 A223 D224	I169-A215 HydrophobicContact CG2-CB 3.73Å; Y171-A215 HydrophobicContact CD1-CB 4.15Å; Y171-A215 HydrophobicContact CE1-CB 4.1Å; A215-A223 PolarHBondContact O-N 2.73Å; A215-D224 HydrophobicContact CB-CB 4.35Å
216	Y	91.6	Very high	89.4	Confident	65 Å²	65	61.2 Å²	61.2	26%	0.255	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	151.5	180	-60.5	-77.6	0	0	0	111	I169 I170 S172 Y214 Y221	I169-Y216 CarbonylContact C-O 3.59Å; I169-Y216 WeakPolarHBondContact CA-O 3.39Å; I170-Y216 PolarHBondContact N-O 3.3Å; I170-Y216 PolarHBondContact O-N 2.93Å; S172-Y216 WeakPolarHBondContact OG-CE2 3.02Å; Y214-Y216 VanDerWaalsContact CB-CE2 3.41Å; Y214-Y216 WeakPolarHBondContact CD1-OH 3.07Å; Y214-Y216 HydrophobicContact CG-CE2 4.2Å; Y216-Y221 CarbonylContact C-O 3.56Å; Y216-Y221 VanDerWaalsContact CA-O 3.24Å; Y216-Y221 WeakPolarHBondContact CA-O 3.03Å
217	T	88.8	Confident	89.2	Confident	16 Å²	16	62.5 Å²	62.5	10%	0.098	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	165.7	162.5	68.9	0	0	0	0	110.4	Y167 I169 D219 G220 Y221 A223	Y167-T217 HydrophobicContact CG-CG2 4.33Å; I169-T217 HydrophobicContact CD1-CG2 4.27Å; T217-D219 PolarHBondContact O-N 3.44Å; T217-D219 PolarHBondContact OG1-N 2.95Å; T217-G220 PolarHBondContact O-N 2.89Å; T217-Y221 PolarHBondContact N-O 3.18Å; T217-Y221 PolarHBondContact OG1-N 3.47Å; T217-A223 HydrophobicContact CG2-CB 4.29Å
218	V	84.7	Confident	89.1	Confident	97 Å²	97	61.1 Å²	61.1	59%	0.588	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-32.4	173.1	-177.9	0	0	0	0	112	T168 I170 G220	T168-V218 HydrophobicContact CG2-CG2 3.93Å; I170-V218 HydrophobicContact CD1-CG2 4.29Å; V218-G220 PolarHBondContact O-N 2.86Å
219	D	84.5	Confident	89	Confident	134 Å²	134	59.5 Å²	59.5	72%	0.717	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	2.6	177.4	-45	-70	0	0	0	114	T217 Y221	T217-D219 PolarHBondContact O-N 3.44Å; T217-D219 PolarHBondContact OG1-N 2.95Å; D219-Y221 HydrophobicContact CB-CD2 4Å; D219-Y221 HydrophobicContact CB-CE2 4.25Å
220	G	80.6	Confident	88.9	Confident	53 Å²	53	61.3 Å²	61.3	55%	0.546	36%	0.355	S	S	.	.	S	Bend	trans	85.2	4.7	175.3	0	0	0	0	0	116.1	T217 V218	T217-G220 PolarHBondContact O-N 2.89Å; V218-G220 PolarHBondContact O-N 2.86Å
221	Y	85.6	Confident	89	Confident	173 Å²	173	55.8 Å²	55.8	68%	0.678	33%	0.325	S	S	*	.			trans	-75.4	136.3	174	-70	-90	0	0	0	110.7	Y216 T217 D219 A223	Y216-Y221 CarbonylContact C-O 3.56Å; Y216-Y221 VanDerWaalsContact CA-O 3.24Å; Y216-Y221 WeakPolarHBondContact CA-O 3.03Å; T217-Y221 PolarHBondContact N-O 3.18Å; T217-Y221 PolarHBondContact OG1-N 3.47Å; D219-Y221 HydrophobicContact CB-CD2 4Å; D219-Y221 HydrophobicContact CB-CE2 4.25Å; Y221-A223 PolarHBondContact O-N 2.71Å; Y221-A223 VanDerWaalsContact O-N 3.13Å
222	S	87.4	Confident	89	Confident	64 Å²	64	59 Å²	59	45%	0.448	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-67.1	110.4	170.3	-156.3	0	0	0	0	108.5	D224	S222-D224 PolarHBondContact OG-O 3.49Å
223	A	84.4	Confident	89.1	Confident	35 Å²	35	57.3 Å²	57.3	29%	0.289	33%	0.328	S	S	.	.	S	Bend	trans	-72.2	-36.5	-179.5	0	0	0	0	0	111.1	A163 I169 A215 T217 Y221	A163-A223 HydrophobicContact CB-CB 4.31Å; I169-A223 HydrophobicContact CD1-CB 3.48Å; I169-A223 VanDerWaalsContact CD1-CB 3.48Å; A215-A223 PolarHBondContact O-N 2.73Å; T217-A223 HydrophobicContact CG2-CB 4.29Å; Y221-A223 PolarHBondContact O-N 2.71Å; Y221-A223 VanDerWaalsContact O-N 3.13Å
224	D	87.1	Confident	89.2	Confident	67 Å²	67	61.1 Å²	61.1	36%	0.358	35%	0.345	S	S	.	.	S	Bend	trans	-120.6	169.9	176.3	-101	-55.3	0	0	0	112.3	S161 A215 S222	S161-D224 VanDerWaalsContact CB-OD2 3.26Å; S161-D224 WeakPolarHBondContact CB-OD2 3.3Å; S161-D224 PolarHBondContact OG-OD2 2.66Å; A215-D224 HydrophobicContact CB-CB 4.35Å; S222-D224 PolarHBondContact OG-O 3.49Å
225	S	87.8	Confident	89.3	Confident	100 Å²	100	59.3 Å²	59.3	70%	0.699	34%	0.339	S	S	*	.			trans	-74.3	144.7	163.8	-62.4	0	0	0	0	110.4	L227	S225-L227 PolarHBondContact O-N 3.39Å
226	P	90.6	Very high	89.4	Confident	64 Å²	64	62.6 Å²	62.6	42%	0.416	35%	0.353	S	S	.	.			trans	-56.6	135.8	178.2	-24.1	33.5	0	0	0	112.5	T212 A213 Y214	T212-P226 HydrophobicContact CG2-CB 3.57Å; A213-P226 WeakPolarHBondContact O-CA 3.34Å; Y214-P226 HydrophobicContact CD1-CB 3.91Å; Y214-P226 HydrophobicContact CD1-CG 3.71Å; Y214-P226 HydrophobicContact CE1-CB 3.69Å; Y214-P226 HydrophobicContact CE1-CG 3.51Å
227	L	89	Confident	89.6	Confident	80 Å²	80	61.3 Å²	61.3	42%	0.419	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	112.7	-175.1	176.8	61.6	0	0	0	109.9	V159 T212 A213 S225 L229	V159-L227 HydrophobicContact CG1-CD2 4.36Å; T212-L227 CarbonylContact C-O 3.37Å; T212-L227 WeakPolarHBondContact CA-O 3.47Å; A213-L227 HydrophobicContact CB-CB 4.49Å; A213-L227 PolarHBondContact N-O 2.8Å; A213-L227 PolarHBondContact O-N 3.44Å; S225-L227 PolarHBondContact O-N 3.39Å; L227-L229 HydrophobicContact CD2-CD2 3.84Å; L227-L229 HydrophobicContact CD2-CG 4.42Å; L227-L229 HydrophobicContact CG-CD2 3.89Å; L227-L229 HydrophobicContact CG-CG 4.22Å; L227-L229 PolarHBondContact O-N 3.45Å
228	P	90.1	Very high	89.8	Confident	67 Å²	67	63.9 Å²	63.9	44%	0.435	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	128.8	170	-20.1	33.3	0	0	0	110.4
229	L	89.7	Confident	90.4	Very high	8 Å²	8	61.2 Å²	61.2	4%	0.042	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	78.2	178.4	-65.4	179.5	0	0	0	108.5	V159 L211 A213 L227 I231	V159-L229 HydrophobicContact CG1-CD1 3.9Å; V159-L229 HydrophobicContact CG1-CD2 4.08Å; V159-L229 HydrophobicContact CG2-CD1 4.42Å; L211-L229 HydrophobicContact CB-CB 4.45Å; L211-L229 WeakPolarHBondContact CB-O 3.3Å; L211-L229 PolarHBondContact N-O 3.44Å; L211-L229 CarbonylContact O-C 3.56Å; L211-L229 PolarHBondContact O-N 3.3Å; A213-L229 HydrophobicContact CB-CD1 3.58Å; A213-L229 HydrophobicContact CB-CG 4.3Å; L227-L229 HydrophobicContact CD2-CD2 3.84Å; L227-L229 HydrophobicContact CD2-CG 4.42Å; L227-L229 HydrophobicContact CG-CD2 3.89Å; L227-L229 HydrophobicContact CG-CG 4.22Å; L227-L229 PolarHBondContact O-N 3.45Å; L229-I231 PolarHBondContact O-N 2.92Å
230	P	91.3	Very high	90.9	Very high	37 Å²	37	61.1 Å²	61.1	24%	0.24	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	122.3	170.3	28.7	-32.7	0	0	0	108.9	P139 V208 F209	P139-P230 HydrophobicContact CB-CG 4.46Å; V208-P230 HydrophobicContact CG1-CB 4.3Å; F209-P230 WeakPolarHBondContact O-CA 3.24Å
231	I	92.7	Very high	91.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	115.8	166.1	-53.9	172.3	0	0	0	106.6	C142 M144 L156 F186 L195 V208 F209 L211 L229 I233	C142-I231 HydrophobicContact CB-CG1 4.4Å; C142-I231 WeakPolarHBondContact O-CA 3.29Å; M144-I231 HydrophobicContact CB-CG2 4.31Å; L156-I231 HydrophobicContact CD1-CD1 3.82Å; F186-I231 HydrophobicContact CD1-CD1 3.57Å; F186-I231 HydrophobicContact CD2-CD1 4.1Å; F186-I231 HydrophobicContact CE1-CD1 3.48Å; F186-I231 VanDerWaalsContact CE1-CD1 3.48Å; F186-I231 HydrophobicContact CE2-CD1 4.03Å; F186-I231 HydrophobicContact CG-CD1 3.89Å; F186-I231 HydrophobicContact CZ-CD1 3.73Å; L195-I231 HydrophobicContact CD2-CD1 4.21Å; V208-I231 WeakPolarHBondContact CA-O 3.21Å; F209-I231 HydrophobicContact CB-CB 4.41Å; F209-I231 PolarHBondContact N-O 2.91Å; F209-I231 PolarHBondContact O-N 2.87Å; L211-I231 HydrophobicContact CD1-CD1 3.62Å; L211-I231 HydrophobicContact CD1-CG1 4.36Å; L229-I231 PolarHBondContact O-N 2.92Å; I231-I233 HydrophobicContact CG2-CD1 4.3Å
232	K	93.1	Very high	92.2	Very high	71 Å²	71	55.3 Å²	55.3	31%	0.309	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	136.3	165.6	-161.1	-143.6	171	-171.3	0	108.3	C142 S143 M144 V208 E272	C142-K232 PolarHBondContact O-N 2.9Å; S143-K232 VanDerWaalsContact CA-O 3.25Å; S143-K232 WeakPolarHBondContact CA-O 3.21Å; M144-K232 PolarHBondContact N-O 2.96Å; M144-K232 VanDerWaalsContact N-O 3.09Å; V208-K232 HydrophobicContact CG2-CG 4.32Å; K232-E272 WeakPolarHBondContact CE-OE1 3.45Å; K232-E272 IonicContact NZ-OE1 2.74Å; K232-E272 PolarHBondContact NZ-OE1 2.82Å; K232-E272 IonicContact NZ-OE2 2.7Å; K232-E272 PolarHBondContact NZ-OE2 2.82Å
233	I	94.8	Very high	92.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	135.6	164	-54.2	-53	0	0	0	108.3	M144 E146 V201 R203 Y206 D207 F209 I231	M144-I233 HydrophobicContact CB-CD1 4.25Å; M144-I233 CarbonylContact O-C 3.5Å; M144-I233 WeakPolarHBondContact O-CA 3.27Å; E146-I233 HydrophobicContact CB-CG2 3.56Å; V201-I233 HydrophobicContact CB-CD1 4.48Å; V201-I233 HydrophobicContact CG1-CD1 4.16Å; V201-I233 HydrophobicContact CG1-CG1 4.04Å; R203-I233 HydrophobicContact CB-CB 4.28Å; R203-I233 HydrophobicContact CB-CG2 3.7Å; R203-I233 HydrophobicContact CG-CB 4.03Å; R203-I233 HydrophobicContact CG-CG2 3.91Å; Y206-I233 WeakPolarHBondContact O-CG1 3.18Å; D207-I233 PolarHBondContact O-N 2.97Å; F209-I233 HydrophobicContact CD2-CD1 4.11Å; F209-I233 HydrophobicContact CD2-CG1 4.19Å; F209-I233 HydrophobicContact CE2-CD1 4.01Å; F209-I233 HydrophobicContact CE2-CG1 3.95Å; I231-I233 HydrophobicContact CG2-CD1 4.3Å
234	E	94.2	Very high	93.3	Very high	89 Å²	89	55.2 Å²	55.2	42%	0.416	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	135.9	174.6	-82.4	171.7	-174.8	0	0	109.8	S143 M144 E146	S143-E234 VanDerWaalsContact CB-CD 3.49Å; S143-E234 WeakPolarHBondContact CB-OE1 3.49Å; S143-E234 PolarHBondContact OG-OE1 2.91Å; M144-E234 PolarHBondContact O-N 2.99Å; E146-E234 PolarHBondContact N-O 2.73Å
235	D	95.4	Very high	93.7	Very high	16 Å²	16	57.2 Å²	57.2	9%	0.086	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-81	132	-166.8	-167.2	86	0	0	0	111.8	E146 R203 E272 H277	E146-D235 WeakPolarHBondContact OE1-CA 3.48Å; R203-D235 WeakPolarHBondContact CD-OD1 3.13Å; R203-D235 IonicContact CZ-OD1 2.87Å; R203-D235 IonicContact NE-OD1 2.99Å; R203-D235 PolarHBondContact NE-OD1 2.63Å; R203-D235 IonicContact NH1-OD1 3.63Å; R203-D235 PolarHBondContact NH1-OD1 2.7Å; R203-D235 IonicContact NH2-OD1 3.81Å; D235-E272 HydrophobicContact CB-CB 3.8Å; D235-E272 WeakPolarHBondContact OD1-CA 3.49Å; D235-E272 WeakPolarHBondContact OD1-CB 3.05Å; D235-E272 PolarHBondContact OD1-N 3.42Å; D235-E272 WeakPolarHBondContact OD2-CB 3.37Å; D235-E272 PolarHBondContact OD2-N 2.78Å; D235-H277 PolarHBondContact O-CE1 2.63Å; D235-H277 IonicContact OD2-CE1 3.59Å; D235-H277 IonicContact OD2-CG 3.74Å; D235-H277 IonicContact OD2-ND1 2.73Å; D235-H277 PolarHBondContact OD2-ND1 3.25Å
236	E	94.3	Very high	94.1	Very high	79 Å²	79	58 Å²	58	37%	0.369	30%	0.303	S	S	.	.			trans	-109.5	153.6	168.9	-72.9	-72.2	130.1	0	0	110.3	Q145 E146 D238	Q145-E236 HydrophobicContact CG-CG 4.07Å; Q145-E236 VanDerWaalsContact NE2-CD 3.34Å; Q145-E236 PolarHBondContact NE2-OE1 2.85Å; E146-E236 HydrophobicContact CG-CB 3.94Å; E146-E236 HydrophobicContact CG-CG 3.98Å; E146-E236 PolarHBondContact OE1-N 3.28Å; E236-D238 PolarHBondContact O-N 3.05Å
237	N	95.3	Very high	94.4	Very high	37 Å²	37	59.1 Å²	59.1	20%	0.198	30%	0.304	C	S	.	.	S	Bend	trans	-79.8	66.3	179.4	-163.9	124.3	0	0	0	110.7	D271 H277 D327 M328	N237-D271 WeakPolarHBondContact CA-OD2 3.44Å; N237-H277 HydrophobicContact CB-CB 4.26Å; N237-H277 WeakPolarHBondContact OD1-CA 3.09Å; N237-H277 WeakPolarHBondContact OD1-CB 3.04Å; N237-H277 PolarHBondContact OD1-CD2 2.72Å; N237-D327 PolarHBondContact ND2-OD2 2.54Å; N237-M328 WeakPolarHBondContact OD1-CG 3.34Å
238	D	94.3	Very high	94.8	Very high	70 Å²	70	56.2 Å²	56.2	37%	0.374	29%	0.288	S	S	.	.			trans	-103.1	-20.8	-171.1	114	-38.8	0	0	0	114.3	N147 E236	N147-D238 PolarHBondContact ND2-OD2 3.45Å; E236-D238 PolarHBondContact O-N 3.05Å
239	N	95.6	Very high	95.1	Very high	41 Å²	41	58 Å²	58	22%	0.219	29%	0.294	C	S	.	.	S	Bend	trans	-87.6	151.7	173.5	-62.6	-89.6	0	0	0	111.6	E204 M270 D271 L335	E204-N239 VanDerWaalsContact CD-ND2 3.27Å; E204-N239 WeakPolarHBondContact CG-ND2 3.21Å; N239-M270 HydrophobicContact CB-CB 3.99Å; N239-D271 WeakPolarHBondContact CB-OD1 3.38Å; N239-D271 PolarHBondContact N-OD1 3.44Å; N239-D271 PolarHBondContact ND2-OD1 2.86Å; N239-L335 WeakPolarHBondContact O-CD1 3.25Å
240	Y	96.4	Very high	95.5	Very high	133 Å²	133	59.4 Å²	59.4	52%	0.522	30%	0.3	S	S	.	.			trans	-97.9	138.1	176.8	-72.9	-110.7	0	0	0	109	L242 L335	Y240-L242 WeakPolarHBondContact O-CG 3.17Å; Y240-L242 PolarHBondContact O-N 3.31Å; Y240-L242 VanDerWaalsContact O-N 3.11Å; Y240-L335 HydrophobicContact CD1-CB 3.78Å; Y240-L335 HydrophobicContact CD1-CD1 4.36Å; Y240-L335 HydrophobicContact CD1-CG 4.49Å; Y240-L335 HydrophobicContact CD2-CD1 3.99Å; Y240-L335 HydrophobicContact CE1-CB 3.97Å; Y240-L335 HydrophobicContact CE1-CD1 4.31Å; Y240-L335 HydrophobicContact CE1-CD2 4.02Å; Y240-L335 HydrophobicContact CE1-CG 4.33Å; Y240-L335 HydrophobicContact CE2-CD1 3.95Å; Y240-L335 HydrophobicContact CG-CB 4.22Å; Y240-L335 HydrophobicContact CG-CD1 4.2Å
241	P	97.1	Very high	95.8	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.316	C	S	.	.			trans	-65.9	114.6	174.9	24.1	-33.4	0	0	0	110.2	D269 L280 V325 D327 S337	P241-D269 VanDerWaalsContact CA-OD2 3.31Å; P241-D269 WeakPolarHBondContact CA-OD2 3.42Å; P241-D269 VanDerWaalsContact CB-OD2 3.29Å; P241-D269 WeakPolarHBondContact CB-OD2 3.47Å; P241-D269 WeakPolarHBondContact CD-OD2 3.2Å; P241-L280 HydrophobicContact CB-CD1 4.16Å; P241-L280 HydrophobicContact CB-CD2 3.58Å; P241-L280 HydrophobicContact CG-CD2 4.33Å; P241-V325 HydrophobicContact CB-CG1 3.97Å; P241-V325 HydrophobicContact CB-CG2 4.23Å; P241-V325 HydrophobicContact CG-CG1 4.16Å; P241-V325 WeakPolarHBondContact O-CG1 3.24Å; P241-D327 HydrophobicContact CG-CB 4.2Å; P241-S337 WeakPolarHBondContact O-CB 3.43Å; P241-S337 PolarHBondContact O-OG 2.81Å
242	L	96.6	Very high	95.9	Very high	103 Å²	103	63.7 Å²	63.7	54%	0.539	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130	-176.8	-63.4	-177.3	0	0	0	111.3	Y240 A267 T268	Y240-L242 WeakPolarHBondContact O-CG 3.17Å; Y240-L242 PolarHBondContact O-N 3.31Å; Y240-L242 VanDerWaalsContact O-N 3.11Å; L242-A267 CarbonylContact O-C 3.54Å; L242-A267 WeakPolarHBondContact O-CA 3.46Å; L242-A267 WeakPolarHBondContact O-CB 3.4Å; L242-T268 PolarHBondContact N-O 2.8Å; L242-T268 PolarHBondContact O-N 2.71Å
243	F	97.8	Very high	95.9	Very high	24 Å²	24	62.6 Å²	62.6	11%	0.105	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	140.7	168.2	-76.5	-82.4	0	0	0	110.8	E245 Y248 V265 C266 A267 Y282 M323 V325 S339	F243-E245 WeakPolarHBondContact CB-O 3.41Å; F243-E245 PolarHBondContact O-N 3.45Å; F243-Y248 HydrophobicContact CB-CE2 4.45Å; F243-Y248 HydrophobicContact CD1-CE2 4.01Å; F243-V265 HydrophobicContact CD1-CB 4.39Å; F243-V265 HydrophobicContact CE1-CB 4.07Å; F243-V265 HydrophobicContact CE1-CG2 3.96Å; F243-C266 WeakPolarHBondContact CA-O 3.29Å; F243-C266 WeakPolarHBondContact CD1-O 3.12Å; F243-A267 HydrophobicContact CD1-CB 4.24Å; F243-A267 HydrophobicContact CG-CB 4.44Å; F243-Y282 AromaticContact CE1-CD1 3.98Å; F243-Y282 HydrophobicContact CE1-CD1 3.98Å; F243-Y282 AromaticContact CE1-CE1 3.97Å; F243-Y282 HydrophobicContact CE1-CE1 3.97Å; F243-Y282 HydrophobicContact CZ-CD1 4.36Å; F243-M323 HydrophobicContact CE1-CB 4.21Å; F243-M323 HydrophobicContact CE2-CB 4.43Å; F243-M323 HydrophobicContact CZ-CB 3.74Å; F243-V325 HydrophobicContact CD2-CG1 3.82Å; F243-V325 HydrophobicContact CE1-CB 4.29Å; F243-V325 HydrophobicContact CE2-CB 3.83Å; F243-V325 HydrophobicContact CE2-CG1 3.52Å; F243-V325 HydrophobicContact CG-CG1 4.48Å; F243-V325 HydrophobicContact CZ-CB 3.7Å; F243-V325 HydrophobicContact CZ-CG1 3.92Å; F243-S339 VanDerWaalsContact CG-CB 3.42Å
244	T	96.8	Very high	95.7	Very high	73 Å²	73	63.2 Å²	63.2	45%	0.448	32%	0.32	S	S	.	.	S	Bend	trans	-67.7	-24.2	178.6	59.5	0	0	0	0	113	Y248 C266 T268	T244-Y248 PolarHBondContact OG1-OH 2.69Å; T244-C266 HydrophobicContact CG2-CB 4.02Å; T244-C266 PolarHBondContact N-O 2.81Å; T244-C266 PolarHBondContact OG1-O 2.66Å; T244-T268 HydrophobicContact CG2-CG2 4.22Å
245	E	95.9	Very high	95.4	Very high	110 Å²	110	62 Å²	62	51%	0.514	32%	0.321	S	S	.	.			trans	-129.3	143.7	175.5	-63.5	-64.6	168.3	0	0	110.9	F243 Y248 S339	F243-E245 WeakPolarHBondContact CB-O 3.41Å; F243-E245 PolarHBondContact O-N 3.45Å; E245-Y248 HydrophobicContact CB-CD1 4.37Å; E245-Y248 HydrophobicContact CB-CD2 4.24Å; E245-Y248 HydrophobicContact CB-CE1 4.04Å; E245-Y248 HydrophobicContact CB-CE2 3.9Å; E245-Y248 HydrophobicContact CB-CG 4.47Å; E245-Y248 HydrophobicContact CG-CE1 4.23Å; E245-Y248 WeakPolarHBondContact O-CE2 3.29Å; E245-S339 PolarHBondContact O-OG 3.05Å
246	T	94.3	Very high	95.1	Very high	116 Å²	116	62.2 Å²	62.2	71%	0.712	32%	0.324	S	S	*	.	S	Bend	trans	-82.6	-26.6	177.4	55.8	0	0	0	0	113.1	S339 T340	T246-S339 PolarHBondContact O-OG 2.89Å; T246-S339 VanDerWaalsContact O-OG 3.12Å; T246-T340 PolarHBondContact O-N 2.72Å
247	I	97.1	Very high	95	Very high	87 Å²	87	68 Å²	68	45%	0.446	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	108.3	173.8	-52.2	179.8	0	0	0	109.2	T340 I342	I247-T340 CarbonylContact C-O 3.57Å; I247-T340 VanDerWaalsContact CA-O 3.31Å; I247-T340 WeakPolarHBondContact CA-O 3.28Å; I247-I342 HydrophobicContact CG2-CD1 3.96Å; I247-I342 HydrophobicContact CG2-CG1 4.41Å
248	Y	97.6	Very high	94.8	Very high	19 Å²	19	70.2 Å²	70.2	8%	0.075	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	143.6	166.2	-68.6	-91.2	0	0	0	110.2	F243 T244 E245 F250 V265 C266 T340 I342	F243-Y248 HydrophobicContact CB-CE2 4.45Å; F243-Y248 HydrophobicContact CD1-CE2 4.01Å; T244-Y248 PolarHBondContact OG1-OH 2.69Å; E245-Y248 HydrophobicContact CB-CD1 4.37Å; E245-Y248 HydrophobicContact CB-CD2 4.24Å; E245-Y248 HydrophobicContact CB-CE1 4.04Å; E245-Y248 HydrophobicContact CB-CE2 3.9Å; E245-Y248 HydrophobicContact CB-CG 4.47Å; E245-Y248 HydrophobicContact CG-CE1 4.23Å; E245-Y248 WeakPolarHBondContact O-CE2 3.29Å; Y248-F250 HydrophobicContact CD1-CE2 4.26Å; Y248-F250 AromaticContact CD1-CZ 3.74Å; Y248-F250 HydrophobicContact CD1-CZ 3.74Å; Y248-F250 HydrophobicContact CG-CE2 4.37Å; Y248-F250 HydrophobicContact CG-CZ 4.29Å; Y248-V265 HydrophobicContact CD1-CG1 4.03Å; Y248-V265 HydrophobicContact CD2-CB 4.34Å; Y248-V265 HydrophobicContact CD2-CG1 3.72Å; Y248-V265 HydrophobicContact CE1-CB 4.28Å; Y248-V265 HydrophobicContact CE1-CG1 4.18Å; Y248-V265 HydrophobicContact CE2-CB 3.98Å; Y248-V265 HydrophobicContact CE2-CG1 3.89Å; Y248-V265 HydrophobicContact CG-CG1 3.79Å; Y248-C266 PolarHBondContact OH-N 3.04Å; Y248-C266 PolarHBondContact OH-O 2.87Å; Y248-T340 PolarHBondContact N-O 2.77Å; Y248-I342 PolarHBondContact O-N 2.78Å
249	N	97.8	Very high	94.7	Very high	104 Å²	104	69.1 Å²	69.1	56%	0.556	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	124	171.5	-64	-91.9	0	0	0	108.2	I342	N249-I342 CarbonylContact C-O 3.53Å; N249-I342 WeakPolarHBondContact CA-O 3.04Å
250	F	97.6	Very high	94.7	Very high	39 Å²	39	69.4 Å²	69.4	17%	0.171	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	160.5	176.3	-58.9	-56.1	0	0	0	110.5	Y248 V262 V265 I304 C341 I342 I343 T344	Y248-F250 HydrophobicContact CD1-CE2 4.26Å; Y248-F250 AromaticContact CD1-CZ 3.74Å; Y248-F250 HydrophobicContact CD1-CZ 3.74Å; Y248-F250 HydrophobicContact CG-CE2 4.37Å; Y248-F250 HydrophobicContact CG-CZ 4.29Å; F250-V262 HydrophobicContact CB-CG1 3.81Å; F250-V262 HydrophobicContact CG-CG1 4.48Å; F250-V265 HydrophobicContact CE2-CG1 4.2Å; F250-I304 HydrophobicContact CD2-CD1 4.49Å; F250-I304 HydrophobicContact CE2-CD1 4.18Å; F250-C341 VanDerWaalsContact CD2-SG 3.54Å; F250-I342 PolarHBondContact N-O 2.98Å; F250-I343 WeakPolarHBondContact O-CA 3.41Å; F250-T344 PolarHBondContact O-N 3.31Å
251	E	96.6	Very high	94.7	Very high	123 Å²	123	67.3 Å²	67.3	58%	0.575	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131	140.3	179.9	-59.7	-172.8	-177.1	0	0	109.6	T344 Q346	E251-T344 WeakPolarHBondContact CA-O 3.38Å; E251-Q346 HydrophobicContact CB-CG 4.04Å; E251-Q346 PolarHBondContact OE2-NE2 3.49Å
252	V	95.3	Very high	94.7	Very high	3 Å²	3	68 Å²	68	2%	0.018	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	127.5	-176.7	57.3	0	0	0	0	110.7	S256 T260 V262 F295 T306 M311 I343 T344 V345 Q346	V252-S256 WeakPolarHBondContact CG2-OG 3.43Å; V252-T260 HydrophobicContact CG2-CG2 4.48Å; V252-V262 HydrophobicContact CB-CG1 4.27Å; V252-V262 HydrophobicContact CB-CG2 4.32Å; V252-V262 HydrophobicContact CG1-CG1 4.38Å; V252-V262 HydrophobicContact CG2-CG2 4.19Å; V252-F295 HydrophobicContact CG1-CE1 4.46Å; V252-T306 HydrophobicContact CG2-CG2 4.28Å; V252-M311 HydrophobicContact CG1-CE 4.23Å; V252-M311 HydrophobicContact CG1-SD 3.72Å; V252-M311 HydrophobicContact CG2-SD 4.1Å; V252-I343 HydrophobicContact CG1-CG2 3.5Å; V252-T344 PolarHBondContact N-O 2.87Å; V252-V345 CarbonylContact O-C 3.59Å; V252-V345 WeakPolarHBondContact O-CA 3.4Å; V252-Q346 PolarHBondContact O-N 2.79Å
253	P	92.6	Very high	94.7	Very high	48 Å²	48	63.6 Å²	63.6	31%	0.312	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	138	172.5	-21.9	33	0	0	0	111.6	S255 S256 Q346	P253-S255 VanDerWaalsContact C-N 3.25Å; P253-S255 PolarHBondContact O-N 3.43Å; P253-S256 WeakPolarHBondContact O-CB 3.41Å; P253-S256 PolarHBondContact O-N 3.08Å; P253-S256 PolarHBondContact O-OG 2.8Å; P253-Q346 WeakPolarHBondContact CA-O 3.31Å; P253-Q346 HydrophobicContact CG-CB 4.46Å
254	E	91.8	Very high	94.7	Very high	14 Å²	14	65.5 Å²	65.5	7%	0.065	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-33.9	175.8	64.2	-145.8	121.2	0	0	113.5	S256 M311 R313 V345 Q346 D347 S348	E254-S256 PolarHBondContact O-N 2.85Å; E254-M311 HydrophobicContact CB-CG 4.26Å; E254-R313 WeakPolarHBondContact OE2-CA 3.38Å; E254-R313 WeakPolarHBondContact OE2-CB 3.44Å; E254-R313 PolarHBondContact OE2-N 3.33Å; E254-V345 HydrophobicContact CB-CG1 3.64Å; E254-Q346 PolarHBondContact N-O 2.03Å; E254-D347 WeakPolarHBondContact OE1-CA 3.02Å; E254-S348 PolarHBondContact OE1-N 3.27Å
255	S	86.9	Confident	94.7	Very high	63 Å²	63	62 Å²	62	44%	0.441	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	6	171.5	56.8	0	0	0	0	114.4	P253 S348	P253-S255 VanDerWaalsContact C-N 3.25Å; P253-S255 PolarHBondContact O-N 3.43Å; S255-S348 PolarHBondContact OG-OG 2.97Å
256	S	90.2	Very high	94.7	Very high	20 Å²	20	59.7 Å²	59.7	14%	0.14	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-63.3	134.6	171.8	-72.1	0	0	0	0	112.7	V252 P253 E254	V252-S256 WeakPolarHBondContact CG2-OG 3.43Å; P253-S256 WeakPolarHBondContact O-CB 3.41Å; P253-S256 PolarHBondContact O-N 3.08Å; P253-S256 PolarHBondContact O-OG 2.8Å; E254-S256 PolarHBondContact O-N 2.85Å
257	R	90.6	Very high	94.9	Very high	201 Å²	201	54.8 Å²	54.8	76%	0.758	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-73.3	161.6	172.9	-60.6	179.9	-177.8	178.9	0.1	110.6	G259 T260 T306	R257-G259 PolarHBondContact O-N 3.01Å; R257-T260 WeakPolarHBondContact O-CB 3.5Å; R257-T260 PolarHBondContact O-N 2.81Å; R257-T260 PolarHBondContact O-OG1 2.97Å; R257-T260 VanDerWaalsContact O-OG1 3.08Å; R257-T306 PolarHBondContact O-OG1 3.21Å
258	I	92.1	Very high	94.8	Very high	83 Å²	83	54.6 Å²	54.6	43%	0.426	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	136.2	166.3	-69.5	-176.1	0	0	0	109.4	H309	I258-H309 WeakPolarHBondContact CD1-CD2 3.43Å; I258-H309 WeakPolarHBondContact CD1-NE2 3.33Å
259	G	92.8	Very high	94.8	Very high	48 Å²	48	55 Å²	55	50%	0.495	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	-0.7	-176.9	0	0	0	0	0	114.8	R257 V261 T306	R257-G259 PolarHBondContact O-N 3.01Å; G259-V261 PolarHBondContact O-N 2.9Å; G259-T306 PolarHBondContact N-O 3.37Å; G259-T306 PolarHBondContact N-OG1 3.01Å
260	T	94.9	Very high	94.7	Very high	47 Å²	47	55.4 Å²	55.4	29%	0.288	31%	0.311	S	S	.	.			trans	-60.5	130.9	170.4	-69.7	0	0	0	0	109.9	V252 R257 T305 T306	V252-T260 HydrophobicContact CG2-CG2 4.48Å; R257-T260 WeakPolarHBondContact O-CB 3.5Å; R257-T260 PolarHBondContact O-N 2.81Å; R257-T260 PolarHBondContact O-OG1 2.97Å; R257-T260 VanDerWaalsContact O-OG1 3.08Å; T260-T305 CarbonylContact O-C 3.53Å; T260-T305 VanDerWaalsContact O-CA 3.26Å; T260-T305 WeakPolarHBondContact O-CA 3.45Å; T260-T306 PolarHBondContact N-OG1 3.09Å; T260-T306 VanDerWaalsContact N-OG1 3.09Å; T260-T306 PolarHBondContact O-N 2.71Å
261	V	96.8	Very high	94.7	Very high	88 Å²	88	53.7 Å²	53.7	53%	0.533	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125.1	172.5	175.6	0	0	0	0	109.1	G259 I303 T305	G259-V261 PolarHBondContact O-N 2.9Å; V261-I303 HydrophobicContact CB-CG2 4.46Å; V261-I303 HydrophobicContact CG1-CG2 3.74Å; V261-I303 HydrophobicContact CG2-CG2 3.97Å; V261-T305 HydrophobicContact CG2-CG2 4.12Å
262	V	96.9	Very high	94.6	Very high	15 Å²	15	50.7 Å²	50.7	9%	0.091	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-37	179.8	179.8	0	0	0	0	111.2	F250 V252 F295 I304 T306 I343	F250-V262 HydrophobicContact CB-CG1 3.81Å; F250-V262 HydrophobicContact CG-CG1 4.48Å; V252-V262 HydrophobicContact CB-CG1 4.27Å; V252-V262 HydrophobicContact CB-CG2 4.32Å; V252-V262 HydrophobicContact CG1-CG1 4.38Å; V252-V262 HydrophobicContact CG2-CG2 4.19Å; V262-F295 HydrophobicContact CG2-CD1 4.06Å; V262-F295 HydrophobicContact CG2-CE1 3.93Å; V262-I304 HydrophobicContact CB-CB 4.46Å; V262-I304 HydrophobicContact CB-CG2 4.2Å; V262-I304 PolarHBondContact N-O 3.1Å; V262-T306 HydrophobicContact CG2-CG2 3.87Å; V262-I343 HydrophobicContact CG1-CD1 4.03Å; V262-I343 HydrophobicContact CG1-CG1 4.09Å; V262-I343 HydrophobicContact CG1-CG2 3.84Å
263	G	96.2	Very high	94.6	Very high	11 Å²	11	55 Å²	55	11%	0.113	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.9	-176.7	-175.8	0	0	0	0	0	111.9	I304	G263-I304 PolarHBondContact O-N 3.47Å
264	V	97.5	Very high	94.6	Very high	64 Å²	64	59.9 Å²	59.9	39%	0.388	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	124.1	178.2	-169.4	0	0	0	0	108.8	T301 G302 I303	V264-T301 WeakPolarHBondContact CG1-O 3.46Å; V264-G302 WeakPolarHBondContact CA-O 3.49Å; V264-I303 HydrophobicContact CG1-CG1 4.16Å; V264-I303 HydrophobicContact CG2-CG1 4Å
265	V	97.3	Very high	94.8	Very high	0 Å²	0	61 Å²	61	0%	0	35%	0.349	C	S	.	.			trans	-93	137.3	170.5	-61.9	0	0	0	0	110.2	F243 Y248 F250 Y282 G302 I304 M323	F243-V265 HydrophobicContact CD1-CB 4.39Å; F243-V265 HydrophobicContact CE1-CB 4.07Å; F243-V265 HydrophobicContact CE1-CG2 3.96Å; Y248-V265 HydrophobicContact CD1-CG1 4.03Å; Y248-V265 HydrophobicContact CD2-CB 4.34Å; Y248-V265 HydrophobicContact CD2-CG1 3.72Å; Y248-V265 HydrophobicContact CE1-CB 4.28Å; Y248-V265 HydrophobicContact CE1-CG1 4.18Å; Y248-V265 HydrophobicContact CE2-CB 3.98Å; Y248-V265 HydrophobicContact CE2-CG1 3.89Å; Y248-V265 HydrophobicContact CG-CG1 3.79Å; F250-V265 HydrophobicContact CE2-CG1 4.2Å; V265-Y282 HydrophobicContact CG2-CD1 3.9Å; V265-Y282 HydrophobicContact CG2-CE1 4.27Å; V265-G302 WeakPolarHBondContact CG2-O 3.29Å; V265-G302 PolarHBondContact N-O 2.8Å; V265-I304 HydrophobicContact CG1-CD1 4Å; V265-M323 HydrophobicContact CG1-CG 4.37Å; V265-M323 HydrophobicContact CG2-CE 3.92Å
266	C	96.9	Very high	95.1	Very high	60 Å²	60	61.7 Å²	61.7	41%	0.405	35%	0.347	S	S	.	.			trans	-117.5	145.1	-179.5	-65.1	0	0	0	0	111	F243 T244 Y248	F243-C266 WeakPolarHBondContact CA-O 3.29Å; F243-C266 WeakPolarHBondContact CD1-O 3.12Å; T244-C266 HydrophobicContact CG2-CB 4.02Å; T244-C266 PolarHBondContact N-O 2.81Å; T244-C266 PolarHBondContact OG1-O 2.66Å; Y248-C266 PolarHBondContact OH-N 3.04Å; Y248-C266 PolarHBondContact OH-O 2.87Å
267	A	96.8	Very high	95.3	Very high	14 Å²	14	62.5 Å²	62.5	12%	0.116	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	154.4	170.2	0	0	0	0	0	110	L242 F243 L280 Y282 V325	L242-A267 CarbonylContact O-C 3.54Å; L242-A267 WeakPolarHBondContact O-CA 3.46Å; L242-A267 WeakPolarHBondContact O-CB 3.4Å; F243-A267 HydrophobicContact CD1-CB 4.24Å; F243-A267 HydrophobicContact CG-CB 4.44Å; A267-L280 HydrophobicContact CB-CD1 3.95Å; A267-Y282 HydrophobicContact CB-CE1 3.88Å; A267-Y282 PolarHBondContact N-OH 3.22Å; A267-V325 HydrophobicContact CB-CB 4.24Å; A267-V325 HydrophobicContact CB-CG1 4.01Å; A267-V325 HydrophobicContact CB-CG2 3.91Å
268	T	96.3	Very high	95.6	Very high	83 Å²	83	54.4 Å²	54.4	51%	0.509	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.9	179.3	50.1	0	0	0	0	109.3	L242 T244	L242-T268 PolarHBondContact N-O 2.8Å; L242-T268 PolarHBondContact O-N 2.71Å; T244-T268 HydrophobicContact CG2-CG2 4.22Å
269	D	97.4	Very high	95.8	Very high	26 Å²	26	55.5 Å²	55.5	14%	0.139	32%	0.32	C	S	.	.			trans	-119.5	156.7	171.7	-143.9	-40.6	0	0	0	109.5	P241 T278 L280	P241-D269 VanDerWaalsContact CA-OD2 3.31Å; P241-D269 WeakPolarHBondContact CA-OD2 3.42Å; P241-D269 VanDerWaalsContact CB-OD2 3.29Å; P241-D269 WeakPolarHBondContact CB-OD2 3.47Å; P241-D269 WeakPolarHBondContact CD-OD2 3.2Å; D269-T278 HydrophobicContact CB-CG2 4.27Å; D269-L280 HydrophobicContact CB-CD2 4.15Å
270	M	96.3	Very high	96	Very high	113 Å²	113	54.5 Å²	54.5	56%	0.557	30%	0.303	S	S	*	.			trans	-104.9	-19.6	-171.4	-69.8	-58.4	-49.1	0	0	114	R203 E204 N239	R203-M270 PolarHBondContact NH2-O 2.85Å; E204-M270 HydrophobicContact CG-CB 4.07Å; N239-M270 HydrophobicContact CB-CB 3.99Å
271	D	96.6	Very high	96.1	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	30%	0.297	C	S	.	.	S	Bend	trans	-57.7	-177.1	176.5	-62.6	-5.9	0	0	0	113.1	N237 N239 P273 H277 T278	N237-D271 WeakPolarHBondContact CA-OD2 3.44Å; N239-D271 WeakPolarHBondContact CB-OD1 3.38Å; N239-D271 PolarHBondContact N-OD1 3.44Å; N239-D271 PolarHBondContact ND2-OD1 2.86Å; D271-P273 WeakPolarHBondContact O-CD 3.37Å; D271-H277 HydrophobicContact CB-CB 3.78Å; D271-H277 WeakPolarHBondContact OD2-CB 3.34Å; D271-T278 VanDerWaalsContact C-CG2 3.48Å; D271-T278 HydrophobicContact CB-CG2 3.97Å; D271-T278 VanDerWaalsContact O-CG2 3.24Å; D271-T278 WeakPolarHBondContact O-CG2 3.33Å
272	E	94.9	Very high	96.2	Very high	60 Å²	60	51.1 Å²	51.1	28%	0.28	28%	0.276	S	S	.	.			trans	-67.4	123	-174	-175.9	166.6	-145.6	0	0	111.2	R203 K232 D235 T275 T278	R203-E272 VanDerWaalsContact NH1-N 3.13Å; K232-E272 WeakPolarHBondContact CE-OE1 3.45Å; K232-E272 IonicContact NZ-OE1 2.74Å; K232-E272 PolarHBondContact NZ-OE1 2.82Å; K232-E272 IonicContact NZ-OE2 2.7Å; K232-E272 PolarHBondContact NZ-OE2 2.82Å; D235-E272 HydrophobicContact CB-CB 3.8Å; D235-E272 WeakPolarHBondContact OD1-CA 3.49Å; D235-E272 WeakPolarHBondContact OD1-CB 3.05Å; D235-E272 PolarHBondContact OD1-N 3.42Å; D235-E272 WeakPolarHBondContact OD2-CB 3.37Å; D235-E272 PolarHBondContact OD2-N 2.78Å; E272-T275 HydrophobicContact CB-CG2 3.74Å; E272-T275 HydrophobicContact CG-CG2 3.79Å; E272-T275 WeakPolarHBondContact O-CB 3.41Å; E272-T275 WeakPolarHBondContact O-CG2 3.25Å; E272-T275 PolarHBondContact O-OG1 2.68Å; E272-T278 WeakPolarHBondContact O-CG2 3.28Å; E272-T278 PolarHBondContact O-OG1 3.12Å
273	P	94.6	Very high	96.2	Very high	92 Å²	92	52.3 Å²	52.3	60%	0.597	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	155.6	-177.9	25.5	-34.6	0	0	0	112.2	D271 T275 T278	D271-P273 WeakPolarHBondContact O-CD 3.37Å; P273-T275 PolarHBondContact O-N 3.19Å; P273-T275 VanDerWaalsContact O-N 3.17Å; P273-T278 WeakPolarHBondContact CA-OG1 3.34Å
274	D	93.6	Very high	96.3	Very high	152 Å²	152	54 Å²	54	81%	0.813	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	6.3	-176.9	-64.2	-48.8	0	0	0	116	T278	D274-T278 PolarHBondContact N-OG1 2.91Å
275	T	94.8	Very high	96.1	Very high	37 Å²	37	56 Å²	56	23%	0.227	30%	0.299	C	S	.	.	S	Bend	trans	-81.5	-155.4	177.7	67.1	0	0	0	0	112.7	E272 P273 H277 T278 R279	E272-T275 HydrophobicContact CB-CG2 3.74Å; E272-T275 HydrophobicContact CG-CG2 3.79Å; E272-T275 WeakPolarHBondContact O-CB 3.41Å; E272-T275 WeakPolarHBondContact O-CG2 3.25Å; E272-T275 PolarHBondContact O-OG1 2.68Å; P273-T275 PolarHBondContact O-N 3.19Å; P273-T275 VanDerWaalsContact O-N 3.17Å; T275-H277 PolarHBondContact OG1-N 2.88Å; T275-H277 VanDerWaalsContact OG1-N 3.1Å; T275-T278 PolarHBondContact N-OG1 2.92Å; T275-T278 PolarHBondContact OG1-N 2.84Å; T275-T278 PolarHBondContact OG1-OG1 2.83Å; T275-R279 PolarHBondContact O-NE 2.86Å
276	M	94.7	Very high	96	Very high	77 Å²	77	60 Å²	60	38%	0.379	32%	0.318	S	S	.	.	S	Bend	trans	-92	-29.7	163.5	-73.2	-68	-62.8	0	0	111.8	R279 M328 N329	M276-R279 VanDerWaalsContact O-CB 3.23Å; M276-R279 WeakPolarHBondContact O-CB 3.23Å; M276-R279 PolarHBondContact O-N 3.18Å; M276-R279 VanDerWaalsContact O-N 3.14Å; M276-M328 HydrophobicContact CB-CE 4.49Å; M276-M328 HydrophobicContact CB-SD 3.51Å; M276-M328 VanDerWaalsContact CB-SD 3.51Å; M276-M328 WeakPolarHBondContact O-CA 3.2Å; M276-M328 PolarHBondContact O-N 2.92Å; M276-N329 HydrophobicContact CE-CB 3.61Å
277	H	94.3	Very high	95.9	Very high	38 Å²	38	58 Å²	58	18%	0.176	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-54.8	-178.8	-48.7	160.7	0	0	0	108.9	D235 N237 D271 T275 R279 D327	D235-H277 PolarHBondContact O-CE1 2.63Å; D235-H277 IonicContact OD2-CE1 3.59Å; D235-H277 IonicContact OD2-CG 3.74Å; D235-H277 IonicContact OD2-ND1 2.73Å; D235-H277 PolarHBondContact OD2-ND1 3.25Å; N237-H277 HydrophobicContact CB-CB 4.26Å; N237-H277 WeakPolarHBondContact OD1-CA 3.09Å; N237-H277 WeakPolarHBondContact OD1-CB 3.04Å; N237-H277 PolarHBondContact OD1-CD2 2.72Å; D271-H277 HydrophobicContact CB-CB 3.78Å; D271-H277 WeakPolarHBondContact OD2-CB 3.34Å; T275-H277 PolarHBondContact OG1-N 2.88Å; T275-H277 VanDerWaalsContact OG1-N 3.1Å; H277-R279 PolarHBondContact O-N 3.07Å; H277-D327 WeakPolarHBondContact O-CB 3.4Å
278	T	96	Very high	95.8	Very high	30 Å²	30	62.3 Å²	62.3	18%	0.184	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	9.5	174.6	53	0	0	0	0	115.7	D269 D271 E272 P273 D274 T275 L280	D269-T278 HydrophobicContact CB-CG2 4.27Å; D271-T278 VanDerWaalsContact C-CG2 3.48Å; D271-T278 HydrophobicContact CB-CG2 3.97Å; D271-T278 VanDerWaalsContact O-CG2 3.24Å; D271-T278 WeakPolarHBondContact O-CG2 3.33Å; E272-T278 WeakPolarHBondContact O-CG2 3.28Å; E272-T278 PolarHBondContact O-OG1 3.12Å; P273-T278 WeakPolarHBondContact CA-OG1 3.34Å; D274-T278 PolarHBondContact N-OG1 2.91Å; T275-T278 PolarHBondContact N-OG1 2.92Å; T275-T278 PolarHBondContact OG1-N 2.84Å; T275-T278 PolarHBondContact OG1-OG1 2.83Å; T278-L280 PolarHBondContact O-N 2.72Å; T278-L280 VanDerWaalsContact O-N 3.17Å
279	R	96	Very high	95.7	Very high	106 Å²	106	60.5 Å²	60.5	40%	0.4	31%	0.313	S	S	.	.			trans	-89.9	79.4	-175.9	-170	166.5	-67.6	-87.6	-8.2	112.4	T275 M276 H277 N329	T275-R279 PolarHBondContact O-NE 2.86Å; M276-R279 VanDerWaalsContact O-CB 3.23Å; M276-R279 WeakPolarHBondContact O-CB 3.23Å; M276-R279 PolarHBondContact O-N 3.18Å; M276-R279 VanDerWaalsContact O-N 3.14Å; H277-R279 PolarHBondContact O-N 3.07Å; R279-N329 WeakPolarHBondContact CD-OD1 3.37Å; R279-N329 HydrophobicContact CG-CB 3.98Å; R279-N329 WeakPolarHBondContact O-CA 3.47Å; R279-N329 PolarHBondContact O-N 2.6Å
280	L	97.5	Very high	95.2	Very high	27 Å²	27	68.2 Å²	68.2	14%	0.141	34%	0.341	C	S	.	.			trans	-70.9	145.3	-172.7	-51.9	-166.7	0	0	0	114.3	P241 A267 D269 T278 V325 Q326 D327	P241-L280 HydrophobicContact CB-CD1 4.16Å; P241-L280 HydrophobicContact CB-CD2 3.58Å; P241-L280 HydrophobicContact CG-CD2 4.33Å; A267-L280 HydrophobicContact CB-CD1 3.95Å; D269-L280 HydrophobicContact CB-CD2 4.15Å; T278-L280 PolarHBondContact O-N 2.72Å; T278-L280 VanDerWaalsContact O-N 3.17Å; L280-V325 HydrophobicContact CB-CG2 4Å; L280-V325 HydrophobicContact CD1-CG2 4.1Å; L280-V325 HydrophobicContact CG-CG2 4.46Å; L280-Q326 CarbonylContact C-O 3.56Å; L280-Q326 WeakPolarHBondContact CA-O 3.3Å; L280-D327 HydrophobicContact CD2-CB 4.28Å
281	K	97.7	Very high	94.6	Very high	39 Å²	39	67.6 Å²	67.6	17%	0.17	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	128.8	169.2	-69.5	-60.2	-168.9	-173.9	0	111.8	P299 D300 V325 Q326 N329	K281-P299 CarbonylContact C-O 3.59Å; K281-P299 WeakPolarHBondContact CA-O 3.18Å; K281-P299 HydrophobicContact CD-CB 4.31Å; K281-D300 IonicContact NZ-OD1 2.64Å; K281-D300 PolarHBondContact NZ-OD1 3.04Å; K281-D300 IonicContact NZ-OD2 2.74Å; K281-D300 PolarHBondContact NZ-OD2 2.64Å; K281-V325 WeakPolarHBondContact O-CA 3.19Å; K281-Q326 PolarHBondContact N-O 2.93Å; K281-Q326 PolarHBondContact O-N 3.04Å; K281-N329 WeakPolarHBondContact CE-OD1 3.4Å
282	Y	98.1	Very high	93.9	Very high	25 Å²	25	69.8 Å²	69.8	10%	0.098	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	142.8	176.4	-58.3	-88.5	0	0	0	111.5	F243 V265 A267 P299 K324 V325	F243-Y282 AromaticContact CE1-CD1 3.98Å; F243-Y282 HydrophobicContact CE1-CD1 3.98Å; F243-Y282 AromaticContact CE1-CE1 3.97Å; F243-Y282 HydrophobicContact CE1-CE1 3.97Å; F243-Y282 HydrophobicContact CZ-CD1 4.36Å; V265-Y282 HydrophobicContact CG2-CD1 3.9Å; V265-Y282 HydrophobicContact CG2-CE1 4.27Å; A267-Y282 HydrophobicContact CB-CE1 3.88Å; A267-Y282 PolarHBondContact N-OH 3.22Å; Y282-P299 WeakPolarHBondContact CD2-O 3.26Å; Y282-P299 PolarHBondContact N-O 3.2Å; Y282-P299 WeakPolarHBondContact O-CA 3.4Å; Y282-K324 WeakPolarHBondContact CA-O 3.34Å; Y282-V325 HydrophobicContact CD1-CB 4.13Å; Y282-V325 HydrophobicContact CD1-CG2 4.02Å; Y282-V325 HydrophobicContact CE1-CB 4.19Å; Y282-V325 HydrophobicContact CE1-CG2 3.85Å
283	S	97.3	Very high	93.5	Very high	40 Å²	40	69.2 Å²	69.2	28%	0.28	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	149.7	169.5	67.5	0	0	0	0	111.8	K324	S283-K324 PolarHBondContact N-O 2.57Å; S283-K324 PolarHBondContact O-N 2.77Å; S283-K324 VanDerWaalsContact OG-CE 3.3Å; S283-K324 WeakPolarHBondContact OG-CE 3.06Å
284	I	97.1	Very high	93.4	Very high	47 Å²	47	64.9 Å²	64.9	24%	0.241	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125.4	166	-61.4	164.8	0	0	0	107.9	E286 F295 V297 L321 M323	I284-E286 WeakPolarHBondContact CG2-O 3.12Å; I284-F295 HydrophobicContact CD1-CB 4.08Å; I284-F295 WeakPolarHBondContact CD1-O 3.07Å; I284-V297 HydrophobicContact CD1-CB 4.47Å; I284-V297 HydrophobicContact CG1-CB 4.28Å; I284-V297 HydrophobicContact CG1-CG1 3.97Å; I284-L321 HydrophobicContact CD1-CD1 3.96Å; I284-L321 HydrophobicContact CG1-CD1 4.25Å; I284-L321 HydrophobicContact CG2-CD2 4.28Å; I284-M323 HydrophobicContact CG1-CE 3.97Å; I284-M323 HydrophobicContact CG1-SD 3.86Å
285	L	94.9	Very high	93.5	Very high	105 Å²	105	58.3 Å²	58.3	55%	0.55	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-40.5	177.5	-175.1	154	0	0	0	111.1	I322 K324 T338	L285-I322 HydrophobicContact CB-CG2 4.31Å; L285-I322 WeakPolarHBondContact CB-O 3.41Å; L285-I322 HydrophobicContact CD2-CG2 4.34Å; L285-I322 PolarHBondContact N-O 2.88Å; L285-K324 HydrophobicContact CB-CB 4.37Å; L285-K324 HydrophobicContact CD1-CB 4.48Å; L285-T338 HydrophobicContact CD1-CG2 4.41Å
286	E	95.1	Very high	93.6	Very high	85 Å²	85	59.1 Å²	59.1	40%	0.397	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	147.2	174.3	-177.5	151.2	-124.2	0	0	110.8	I284 R290 L321 I322	I284-E286 WeakPolarHBondContact CG2-O 3.12Å; E286-R290 IonicContact OE1-NH1 2.92Å; E286-R290 PolarHBondContact OE1-NH1 3.22Å; E286-L321 CarbonylContact O-C 3.56Å; E286-L321 WeakPolarHBondContact O-CA 3.24Å; E286-I322 HydrophobicContact CB-CB 4.31Å; E286-I322 HydrophobicContact CB-CG1 4.28Å; E286-I322 PolarHBondContact O-N 2.78Å
287	Q	94.8	Very high	93.7	Very high	17 Å²	17	56.1 Å²	56.1	8%	0.079	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	136.4	166.1	-178.5	-167.2	-74.1	0	0	107.5	P289 R290 P292 Y319 T320 L321	Q287-P289 WeakPolarHBondContact CG-O 3.31Å; Q287-P289 PolarHBondContact NE2-O 2.82Å; Q287-P289 CarbonylContact O-C 3.51Å; Q287-R290 VanDerWaalsContact O-CA 3.23Å; Q287-R290 WeakPolarHBondContact O-CA 3.44Å; Q287-R290 PolarHBondContact O-N 3.42Å; Q287-P292 PolarHBondContact NE2-O 3.27Å; Q287-Y319 HydrophobicContact CG-CD1 4.27Å; Q287-T320 CarbonylContact C-O 3.55Å; Q287-L321 HydrophobicContact CB-CD2 3.77Å; Q287-L321 HydrophobicContact CG-CD2 3.57Å
288	N	94.4	Very high	93.9	Very high	106 Å²	106	58.9 Å²	58.9	57%	0.567	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.4	169.4	-176.7	36.6	0	0	0	109.5	Y319 T320	N288-Y319 WeakPolarHBondContact O-CA 3.43Å; N288-T320 PolarHBondContact N-O 2.74Å; N288-T320 PolarHBondContact O-N 2.95Å
289	P	93.8	Very high	93.9	Very high	44 Å²	44	60 Å²	60	29%	0.286	32%	0.323	S	S	.	.	S	Bend	cis	-60.3	147.2	-4.6	-26.2	37.4	0	0	0	114.3	Q287 S291 V316	Q287-P289 WeakPolarHBondContact CG-O 3.31Å; Q287-P289 PolarHBondContact NE2-O 2.82Å; Q287-P289 CarbonylContact O-C 3.51Å; P289-S291 PolarHBondContact O-N 2.03Å; P289-V316 HydrophobicContact CG-CG1 4.01Å; P289-V316 HydrophobicContact CG-CG2 4.11Å
290	R	87.9	Confident	93.9	Very high	188 Å²	188	59.1 Å²	59.1	71%	0.709	33%	0.326	S	S	*	.			trans	-74.7	-19	-170.5	-169.2	175.4	178.9	101.9	3.2	115.3	E286 Q287	E286-R290 IonicContact OE1-NH1 2.92Å; E286-R290 PolarHBondContact OE1-NH1 3.22Å; Q287-R290 VanDerWaalsContact O-CA 3.23Å; Q287-R290 WeakPolarHBondContact O-CA 3.44Å; Q287-R290 PolarHBondContact O-N 3.42Å
291	S	81.7	Confident	93.8	Very high	100 Å²	100	60.8 Å²	60.8	70%	0.699	34%	0.337	S	S	*	.	S	Bend	trans	-148.1	140.2	-179.7	-172.1	0	0	0	0	109.5	P289	P289-S291 PolarHBondContact O-N 2.03Å
292	P	83.6	Confident	93.8	Very high	50 Å²	50	59 Å²	59	33%	0.325	33%	0.329	S	S	.	.	S	Bend	cis	-67	150.4	-7.1	29.6	-36.5	0	0	0	112.4	Q287 L294	Q287-P292 PolarHBondContact NE2-O 3.27Å; P292-L294 HydrophobicContact CB-CD2 4.08Å; P292-L294 HydrophobicContact CG-CD2 3.69Å; P292-L294 HydrophobicContact CG-CG 4.27Å; P292-L294 PolarHBondContact O-N 3.08Å
293	G	86.3	Confident	93.8	Very high	49 Å²	49	60.4 Å²	60.4	51%	0.505	34%	0.338	S	S	.	.			trans	-70.5	112	168.7	0	0	0	0	0	109.8
294	L	91.8	Very high	93.8	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.325	C	S	.	.			trans	-102.1	-23	-174	-66.5	-164.2	0	0	0	113.8	P292 T306 V307 S308 Y310 M311 Y319	P292-L294 HydrophobicContact CB-CD2 4.08Å; P292-L294 HydrophobicContact CG-CD2 3.69Å; P292-L294 HydrophobicContact CG-CG 4.27Å; P292-L294 PolarHBondContact O-N 3.08Å; L294-T306 WeakPolarHBondContact O-CA 3.47Å; L294-V307 WeakPolarHBondContact O-CG2 3.5Å; L294-V307 PolarHBondContact O-N 3.02Å; L294-S308 VanDerWaalsContact CD2-CB 3.43Å; L294-S308 VanDerWaalsContact CD2-OG 3.28Å; L294-S308 WeakPolarHBondContact CD2-OG 3.35Å; L294-Y310 WeakPolarHBondContact CD1-O 3.13Å; L294-Y310 WeakPolarHBondContact CD2-O 3.45Å; L294-M311 HydrophobicContact CB-CE 4.47Å; L294-M311 HydrophobicContact CD1-CB 4.05Å; L294-M311 HydrophobicContact CD1-CE 4.11Å; L294-M311 HydrophobicContact CD1-CG 4.16Å; L294-Y319 HydrophobicContact CD1-CE1 3.85Å; L294-Y319 HydrophobicContact CD1-CE2 3.83Å; L294-Y319 VanDerWaalsContact CD1-OH 3.28Å; L294-Y319 WeakPolarHBondContact CD1-OH 3.47Å; L294-Y319 HydrophobicContact CG-CE1 4.22Å
295	F	95.8	Very high	93.8	Very high	14 Å²	14	58 Å²	58	6%	0.061	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	144.9	-171.3	-55	-77.3	0	0	0	112.2	V252 V262 I284 I304 T305 T306 M311 Y319 L321 I343	V252-F295 HydrophobicContact CG1-CE1 4.46Å; V262-F295 HydrophobicContact CG2-CD1 4.06Å; V262-F295 HydrophobicContact CG2-CE1 3.93Å; I284-F295 HydrophobicContact CD1-CB 4.08Å; I284-F295 WeakPolarHBondContact CD1-O 3.07Å; F295-I304 HydrophobicContact CB-CG2 4.2Å; F295-I304 HydrophobicContact CD1-CG2 4.25Å; F295-T305 WeakPolarHBondContact CA-O 2.95Å; F295-T306 HydrophobicContact CE1-CG2 4.43Å; F295-M311 HydrophobicContact CE1-CE 3.53Å; F295-M311 HydrophobicContact CZ-CE 3.49Å; F295-M311 VanDerWaalsContact CZ-CE 3.49Å; F295-Y319 HydrophobicContact CE2-CD1 4.03Å; F295-Y319 HydrophobicContact CE2-CD2 4.03Å; F295-Y319 AromaticContact CE2-CG 3.65Å; F295-Y319 HydrophobicContact CE2-CG 3.65Å; F295-Y319 HydrophobicContact CZ-CD2 4.37Å; F295-Y319 HydrophobicContact CZ-CG 4.4Å; F295-L321 HydrophobicContact CB-CD1 4.08Å; F295-L321 HydrophobicContact CB-CD2 4.44Å; F295-L321 HydrophobicContact CD2-CD2 4.11Å; F295-L321 HydrophobicContact CG-CD1 4.38Å; F295-I343 HydrophobicContact CD1-CD1 3.68Å; F295-I343 HydrophobicContact CD2-CD1 4.01Å; F295-I343 HydrophobicContact CE1-CD1 3.69Å; F295-I343 HydrophobicContact CE1-CG2 3.94Å; F295-I343 HydrophobicContact CE2-CD1 4.03Å; F295-I343 HydrophobicContact CG-CD1 3.84Å; F295-I343 HydrophobicContact CZ-CB 4.24Å; F295-I343 HydrophobicContact CZ-CD1 3.87Å; F295-I343 HydrophobicContact CZ-CG2 3.72Å
296	S	95.9	Very high	93.9	Very high	55 Å²	55	53 Å²	53	39%	0.385	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	160.6	166.2	-173.2	0	0	0	0	109.5	I304 T305 V307	S296-I304 CarbonylContact O-C 3.57Å; S296-I304 VanDerWaalsContact O-CA 3.31Å; S296-I304 WeakPolarHBondContact O-CA 3.21Å; S296-T305 PolarHBondContact N-O 3.31Å; S296-T305 PolarHBondContact O-N 3.1Å; S296-V307 VanDerWaalsContact CB-CG1 3.49Å
297	V	97.9	Very high	93.7	Very high	14 Å²	14	52.3 Å²	52.3	9%	0.085	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	134	173	67.5	0	0	0	0	109.8	I284 I303 I304 M323	I284-V297 HydrophobicContact CD1-CB 4.47Å; I284-V297 HydrophobicContact CG1-CB 4.28Å; I284-V297 HydrophobicContact CG1-CG1 3.97Å; V297-I303 CarbonylContact C-O 3.55Å; V297-I303 WeakPolarHBondContact CA-O 3.35Å; V297-I304 HydrophobicContact CB-CG1 4.29Å; V297-I304 HydrophobicContact CG2-CG1 4Å; V297-M323 HydrophobicContact CB-CE 3.95Å; V297-M323 HydrophobicContact CG1-CE 4.05Å; V297-M323 HydrophobicContact CG2-CE 3.85Å
298	H	97.6	Very high	93.3	Very high	96 Å²	96	52.3 Å²	52.3	44%	0.444	30%	0.301	S	S	.	.			trans	-72.8	121	176.6	-174.4	-91.9	0	0	0	109.9	D300 T301 G302 I303	H298-D300 VanDerWaalsContact C-N 3.3Å; H298-D300 PolarHBondContact O-N 3.17Å; H298-T301 WeakPolarHBondContact CB-OG1 3.44Å; H298-T301 PolarHBondContact ND1-OG1 3.11Å; H298-T301 PolarHBondContact O-N 2.99Å; H298-G302 PolarHBondContact O-N 2.84Å; H298-I303 HydrophobicContact CB-CB 4.31Å; H298-I303 PolarHBondContact N-O 3.17Å
299	P	97.1	Very high	92.5	Very high	54 Å²	54	53.9 Å²	53.9	35%	0.351	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-24.4	-160.6	25.8	-35.5	0	0	0	114.1	K281 Y282	K281-P299 CarbonylContact C-O 3.59Å; K281-P299 WeakPolarHBondContact CA-O 3.18Å; K281-P299 HydrophobicContact CD-CB 4.31Å; Y282-P299 WeakPolarHBondContact CD2-O 3.26Å; Y282-P299 PolarHBondContact N-O 3.2Å; Y282-P299 WeakPolarHBondContact O-CA 3.4Å
300	D	95.6	Very high	91.8	Very high	87 Å²	87	60.4 Å²	60.4	47%	0.465	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-8.1	-178.9	-70.2	-99.5	0	0	0	114	K281 H298	K281-D300 IonicContact NZ-OD1 2.64Å; K281-D300 PolarHBondContact NZ-OD1 3.04Å; K281-D300 IonicContact NZ-OD2 2.74Å; K281-D300 PolarHBondContact NZ-OD2 2.64Å; H298-D300 VanDerWaalsContact C-N 3.3Å; H298-D300 PolarHBondContact O-N 3.17Å
301	T	96.3	Very high	91.9	Very high	62 Å²	62	52.1 Å²	52.1	38%	0.38	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.9	-6	-169.7	60.9	0	0	0	0	115	V264 H298 I303	V264-T301 WeakPolarHBondContact CG1-O 3.46Å; H298-T301 WeakPolarHBondContact CB-OG1 3.44Å; H298-T301 PolarHBondContact ND1-OG1 3.11Å; H298-T301 PolarHBondContact O-N 2.99Å; T301-I303 PolarHBondContact O-N 2.79Å; T301-I303 VanDerWaalsContact O-N 3.1Å; T301-I303 WeakPolarHBondContact OG1-CD1 3.39Å; T301-I303 WeakPolarHBondContact OG1-CG1 3.34Å
302	G	96.3	Very high	92.4	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.277	C	S	.	.			trans	68.5	6.1	178.9	0	0	0	0	0	114.9	V264 V265 H298 I304	V264-G302 WeakPolarHBondContact CA-O 3.49Å; V265-G302 WeakPolarHBondContact CG2-O 3.29Å; V265-G302 PolarHBondContact N-O 2.8Å; H298-G302 PolarHBondContact O-N 2.84Å; G302-I304 PolarHBondContact O-N 2.95Å
303	I	98.2	Very high	92.9	Very high	56 Å²	56	49.9 Å²	49.9	29%	0.287	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	120.8	178.8	-57.6	171.8	0	0	0	109	V261 V264 V297 H298 T301 T305	V261-I303 HydrophobicContact CB-CG2 4.46Å; V261-I303 HydrophobicContact CG1-CG2 3.74Å; V261-I303 HydrophobicContact CG2-CG2 3.97Å; V264-I303 HydrophobicContact CG1-CG1 4.16Å; V264-I303 HydrophobicContact CG2-CG1 4Å; V297-I303 CarbonylContact C-O 3.55Å; V297-I303 WeakPolarHBondContact CA-O 3.35Å; H298-I303 HydrophobicContact CB-CB 4.31Å; H298-I303 PolarHBondContact N-O 3.17Å; T301-I303 PolarHBondContact O-N 2.79Å; T301-I303 VanDerWaalsContact O-N 3.1Å; T301-I303 WeakPolarHBondContact OG1-CD1 3.39Å; T301-I303 WeakPolarHBondContact OG1-CG1 3.34Å; I303-T305 HydrophobicContact CG2-CG2 4.21Å
304	I	98	Very high	93.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	131.5	176.5	-58.7	176.4	0	0	0	109.2	F250 V262 G263 V265 F295 S296 V297 G302 L321 M323 I343	F250-I304 HydrophobicContact CD2-CD1 4.49Å; F250-I304 HydrophobicContact CE2-CD1 4.18Å; V262-I304 HydrophobicContact CB-CB 4.46Å; V262-I304 HydrophobicContact CB-CG2 4.2Å; V262-I304 PolarHBondContact N-O 3.1Å; G263-I304 PolarHBondContact O-N 3.47Å; V265-I304 HydrophobicContact CG1-CD1 4Å; F295-I304 HydrophobicContact CB-CG2 4.2Å; F295-I304 HydrophobicContact CD1-CG2 4.25Å; S296-I304 CarbonylContact O-C 3.57Å; S296-I304 VanDerWaalsContact O-CA 3.31Å; S296-I304 WeakPolarHBondContact O-CA 3.21Å; V297-I304 HydrophobicContact CB-CG1 4.29Å; V297-I304 HydrophobicContact CG2-CG1 4Å; G302-I304 PolarHBondContact O-N 2.95Å; I304-L321 HydrophobicContact CD1-CD1 4.23Å; I304-L321 HydrophobicContact CG2-CD1 4.37Å; I304-M323 HydrophobicContact CD1-CE 3.94Å; I304-M323 HydrophobicContact CD1-SD 4.16Å; I304-M323 HydrophobicContact CG1-CE 4.21Å; I304-I343 HydrophobicContact CG2-CD1 4.26Å
305	T	96.9	Very high	93.1	Very high	35 Å²	35	55.1 Å²	55.1	22%	0.215	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	153	180	57.5	0	0	0	0	112.8	T260 V261 F295 S296 I303	T260-T305 CarbonylContact O-C 3.53Å; T260-T305 VanDerWaalsContact O-CA 3.26Å; T260-T305 WeakPolarHBondContact O-CA 3.45Å; V261-T305 HydrophobicContact CG2-CG2 4.12Å; F295-T305 WeakPolarHBondContact CA-O 2.95Å; S296-T305 PolarHBondContact N-O 3.31Å; S296-T305 PolarHBondContact O-N 3.1Å; I303-T305 HydrophobicContact CG2-CG2 4.21Å
306	T	95.9	Very high	93	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.012	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	137	169.8	59.4	0	0	0	0	110.9	V252 R257 G259 T260 V262 L294 F295 M311	V252-T306 HydrophobicContact CG2-CG2 4.28Å; R257-T306 PolarHBondContact O-OG1 3.21Å; G259-T306 PolarHBondContact N-O 3.37Å; G259-T306 PolarHBondContact N-OG1 3.01Å; T260-T306 PolarHBondContact N-OG1 3.09Å; T260-T306 VanDerWaalsContact N-OG1 3.09Å; T260-T306 PolarHBondContact O-N 2.71Å; V262-T306 HydrophobicContact CG2-CG2 3.87Å; L294-T306 WeakPolarHBondContact O-CA 3.47Å; F295-T306 HydrophobicContact CE1-CG2 4.43Å; T306-M311 HydrophobicContact CG2-CE 3.71Å
307	V	92.7	Very high	92.9	Very high	70 Å²	70	57.7 Å²	57.7	42%	0.424	30%	0.299	S	S	.	.			trans	-125.8	6.8	179.8	-65	0	0	0	0	114.4	L294 S296	L294-V307 WeakPolarHBondContact O-CG2 3.5Å; L294-V307 PolarHBondContact O-N 3.02Å; S296-V307 VanDerWaalsContact CB-CG1 3.49Å
308	S	85.3	Confident	92.8	Very high	17 Å²	17	61.3 Å²	61.3	12%	0.119	31%	0.313	C	S	.	.			trans	-145	151.1	-176.5	168.9	0	0	0	0	110.7	L294 Y310	L294-S308 VanDerWaalsContact CD2-CB 3.43Å; L294-S308 VanDerWaalsContact CD2-OG 3.28Å; L294-S308 WeakPolarHBondContact CD2-OG 3.35Å; S308-Y310 WeakPolarHBondContact OG-CD2 3.34Å; S308-Y310 PolarHBondContact OG-N 3.16Å
309	H	78.9	Confident	92.7	Very high	139 Å²	139	57 Å²	57	64%	0.644	29%	0.293	S	S	*	.	S	Bend	trans	-85.4	-7.1	172.2	-71.9	-71.7	0	0	0	113.3	I258 M311	I258-H309 WeakPolarHBondContact CD1-CD2 3.43Å; I258-H309 WeakPolarHBondContact CD1-NE2 3.33Å; H309-M311 PolarHBondContact O-N 2.69Å; H309-M311 VanDerWaalsContact O-N 3.09Å
310	Y	79.1	Confident	92.7	Very high	181 Å²	181	56.3 Å²	56.3	71%	0.71	29%	0.288	S	S	*	.			trans	-85.7	46	-178.8	-58.9	-68.6	0	0	0	112.6	L294 S308	L294-Y310 WeakPolarHBondContact CD1-O 3.13Å; L294-Y310 WeakPolarHBondContact CD2-O 3.45Å; S308-Y310 WeakPolarHBondContact OG-CD2 3.34Å; S308-Y310 PolarHBondContact OG-N 3.16Å
311	M	89.7	Confident	92.7	Very high	14 Å²	14	52.2 Å²	52.2	7%	0.069	27%	0.266	C	S	.	.			trans	-98.7	121.5	169.3	-167.6	172.9	-65	0	0	107.4	V252 E254 L294 F295 T306 H309 V345	V252-M311 HydrophobicContact CG1-CE 4.23Å; V252-M311 HydrophobicContact CG1-SD 3.72Å; V252-M311 HydrophobicContact CG2-SD 4.1Å; E254-M311 HydrophobicContact CB-CG 4.26Å; L294-M311 HydrophobicContact CB-CE 4.47Å; L294-M311 HydrophobicContact CD1-CB 4.05Å; L294-M311 HydrophobicContact CD1-CE 4.11Å; L294-M311 HydrophobicContact CD1-CG 4.16Å; F295-M311 HydrophobicContact CE1-CE 3.53Å; F295-M311 HydrophobicContact CZ-CE 3.49Å; F295-M311 VanDerWaalsContact CZ-CE 3.49Å; T306-M311 HydrophobicContact CG2-CE 3.71Å; H309-M311 PolarHBondContact O-N 2.69Å; H309-M311 VanDerWaalsContact O-N 3.09Å; M311-V345 HydrophobicContact CG-CG1 4.04Å; M311-V345 HydrophobicContact CG-CG2 4.23Å; M311-V345 HydrophobicContact SD-CG1 4.35Å; M311-V345 HydrophobicContact SD-CG2 4.47Å
312	D	90.6	Very high	92.8	Very high	64 Å²	64	51.8 Å²	51.8	34%	0.342	26%	0.261	S	S	.	.			trans	-157.5	113.7	-164	169.4	-33.5	0	0	0	106.2	E314 V315 V316	D312-E314 PolarHBondContact OD1-N 3.31Å; D312-V315 HydrophobicContact CB-CB 4.37Å; D312-V315 PolarHBondContact O-N 3.3Å; D312-V315 WeakPolarHBondContact OD1-CB 3.29Å; D312-V315 VanDerWaalsContact OD1-CG2 3.25Å; D312-V315 WeakPolarHBondContact OD1-CG2 3.33Å; D312-V315 PolarHBondContact OD1-N 2.95Å; D312-V315 WeakPolarHBondContact OD2-CG2 2.92Å; D312-V316 PolarHBondContact O-N 2.91Å
313	R	94.1	Very high	92.9	Very high	38 Å²	38	51.8 Å²	51.8	14%	0.143	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-25.5	-173.5	-175.8	-137.6	60.3	79.8	-10.1	111.7	E254 V315 D317 V345 D347 K381	E254-R313 WeakPolarHBondContact OE2-CA 3.38Å; E254-R313 WeakPolarHBondContact OE2-CB 3.44Å; E254-R313 PolarHBondContact OE2-N 3.33Å; R313-V315 PolarHBondContact O-N 3.36Å; R313-D317 HydrophobicContact CG-CB 4.25Å; R313-V345 HydrophobicContact CB-CB 4.28Å; R313-V345 HydrophobicContact CB-CG1 3.89Å; R313-V345 HydrophobicContact CG-CB 4.38Å; R313-V345 HydrophobicContact CG-CG1 4.44Å; R313-D347 IonicContact CZ-OD1 3.2Å; R313-D347 IonicContact NE-OD1 2.77Å; R313-D347 PolarHBondContact NE-OD1 2.95Å; R313-D347 VanDerWaalsContact NE-OD1 3.15Å; R313-D347 IonicContact NH2-OD1 3.7Å; R313-K381 PolarHBondContact NH2-O 3.1Å
314	E	92.8	Very high	92.9	Very high	48 Å²	48	51.1 Å²	51.1	22%	0.224	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-27.3	171.6	-68.3	61.3	-130.5	0	0	111.3	D312 K381	D312-E314 PolarHBondContact OD1-N 3.31Å; E314-K381 HydrophobicContact CG-CB 3.61Å; E314-K381 HydrophobicContact CG-CD 4.18Å
315	V	91.3	Very high	92.9	Very high	112 Å²	112	51.1 Å²	51.1	68%	0.679	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-43.6	176.1	179.7	0	0	0	0	112.5	D312 R313	D312-V315 HydrophobicContact CB-CB 4.37Å; D312-V315 PolarHBondContact O-N 3.3Å; D312-V315 WeakPolarHBondContact OD1-CB 3.29Å; D312-V315 VanDerWaalsContact OD1-CG2 3.25Å; D312-V315 WeakPolarHBondContact OD1-CG2 3.33Å; D312-V315 PolarHBondContact OD1-N 2.95Å; D312-V315 WeakPolarHBondContact OD2-CG2 2.92Å; R313-V315 PolarHBondContact O-N 3.36Å
316	V	92.3	Very high	92.9	Very high	27 Å²	27	49.9 Å²	49.9	16%	0.164	25%	0.248	C	C	.	.			trans	-147	110.6	174.5	-176.3	0	0	0	0	112	P289 D312 K318 Y319	P289-V316 HydrophobicContact CG-CG1 4.01Å; P289-V316 HydrophobicContact CG-CG2 4.11Å; D312-V316 PolarHBondContact O-N 2.91Å; V316-K318 WeakPolarHBondContact CG1-O 3.18Å; V316-Y319 HydrophobicContact CB-CE2 3.8Å; V316-Y319 WeakPolarHBondContact CB-OH 3.39Å; V316-Y319 HydrophobicContact CG1-CD2 4Å; V316-Y319 HydrophobicContact CG1-CE1 4.16Å; V316-Y319 HydrophobicContact CG1-CE2 3.51Å; V316-Y319 HydrophobicContact CG1-CG 4.49Å
317	D	93.9	Very high	92.9	Very high	96 Å²	96	49.8 Å²	49.8	51%	0.513	25%	0.247	S	C	.	.	S	Bend	trans	-74.6	-21.4	177	70.4	-30.2	0	0	0	114.4	R313 V345	R313-D317 HydrophobicContact CG-CB 4.25Å; D317-V345 PolarHBondContact O-N 2.75Å
318	K	95.3	Very high	93.1	Very high	89 Å²	89	47.9 Å²	47.9	39%	0.387	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	128.8	-168.4	179.6	162.4	172.4	146.1	0	114.2	V316 I342	V316-K318 WeakPolarHBondContact CG1-O 3.18Å; K318-I342 HydrophobicContact CD-CG2 4.31Å; K318-I342 VanDerWaalsContact CE-CG2 3.49Å; K318-I342 HydrophobicContact CG-CG2 4.4Å
319	Y	95.6	Very high	93.6	Very high	5 Å²	5	50.3 Å²	50.3	2%	0.02	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.6	174.8	-67.9	-97.4	0	0	0	110.9	Q287 N288 L294 F295 V316 I343 V345	Q287-Y319 HydrophobicContact CG-CD1 4.27Å; N288-Y319 WeakPolarHBondContact O-CA 3.43Å; L294-Y319 HydrophobicContact CD1-CE1 3.85Å; L294-Y319 HydrophobicContact CD1-CE2 3.83Å; L294-Y319 VanDerWaalsContact CD1-OH 3.28Å; L294-Y319 WeakPolarHBondContact CD1-OH 3.47Å; L294-Y319 HydrophobicContact CG-CE1 4.22Å; F295-Y319 HydrophobicContact CE2-CD1 4.03Å; F295-Y319 HydrophobicContact CE2-CD2 4.03Å; F295-Y319 AromaticContact CE2-CG 3.65Å; F295-Y319 HydrophobicContact CE2-CG 3.65Å; F295-Y319 HydrophobicContact CZ-CD2 4.37Å; F295-Y319 HydrophobicContact CZ-CG 4.4Å; V316-Y319 HydrophobicContact CB-CE2 3.8Å; V316-Y319 WeakPolarHBondContact CB-OH 3.39Å; V316-Y319 HydrophobicContact CG1-CD2 4Å; V316-Y319 HydrophobicContact CG1-CE1 4.16Å; V316-Y319 HydrophobicContact CG1-CE2 3.51Å; V316-Y319 HydrophobicContact CG1-CG 4.49Å; Y319-I343 PolarHBondContact N-O 2.71Å; Y319-I343 PolarHBondContact O-N 2.76Å; Y319-V345 HydrophobicContact CD2-CG2 4.02Å; Y319-V345 HydrophobicContact CE2-CG2 3.98Å
320	T	97.1	Very high	94.3	Very high	41 Å²	41	45.3 Å²	45.3	25%	0.252	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	122.1	173.5	-54	0	0	0	0	109.4	Q287 N288 T340	Q287-T320 CarbonylContact C-O 3.55Å; N288-T320 PolarHBondContact N-O 2.74Å; N288-T320 PolarHBondContact O-N 2.95Å; T320-T340 HydrophobicContact CG2-CG2 3.71Å
321	L	97.4	Very high	95	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	135.1	174.4	-51.1	-177.3	0	0	0	109.8	I284 E286 Q287 F295 I304 M323 C341 I343	I284-L321 HydrophobicContact CD1-CD1 3.96Å; I284-L321 HydrophobicContact CG1-CD1 4.25Å; I284-L321 HydrophobicContact CG2-CD2 4.28Å; E286-L321 CarbonylContact O-C 3.56Å; E286-L321 WeakPolarHBondContact O-CA 3.24Å; Q287-L321 HydrophobicContact CB-CD2 3.77Å; Q287-L321 HydrophobicContact CG-CD2 3.57Å; F295-L321 HydrophobicContact CB-CD1 4.08Å; F295-L321 HydrophobicContact CB-CD2 4.44Å; F295-L321 HydrophobicContact CD2-CD2 4.11Å; F295-L321 HydrophobicContact CG-CD1 4.38Å; I304-L321 HydrophobicContact CD1-CD1 4.23Å; I304-L321 HydrophobicContact CG2-CD1 4.37Å; L321-M323 HydrophobicContact CB-SD 3.76Å; L321-M323 HydrophobicContact CD1-SD 3.99Å; L321-C341 HydrophobicContact CB-CB 4.16Å; L321-C341 PolarHBondContact N-O 3.06Å; L321-C341 PolarHBondContact O-N 2.72Å; L321-I343 HydrophobicContact CD1-CD1 3.58Å; L321-I343 HydrophobicContact CG-CD1 4.08Å
322	I	97.7	Very high	95.2	Very high	53 Å²	53	49 Å²	49	27%	0.272	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	107.4	162.1	-55.5	-55.6	0	0	0	107	L285 E286 T338	L285-I322 HydrophobicContact CB-CG2 4.31Å; L285-I322 WeakPolarHBondContact CB-O 3.41Å; L285-I322 HydrophobicContact CD2-CG2 4.34Å; L285-I322 PolarHBondContact N-O 2.88Å; E286-I322 HydrophobicContact CB-CB 4.31Å; E286-I322 HydrophobicContact CB-CG1 4.28Å; E286-I322 PolarHBondContact O-N 2.78Å; I322-T338 HydrophobicContact CG2-CG2 4.41Å
323	M	98	Very high	95.3	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	139.8	177.8	-55.8	-54.5	-66.3	0	0	109.5	F243 V265 I284 V297 I304 L321 T338 S339 C341	F243-M323 HydrophobicContact CE1-CB 4.21Å; F243-M323 HydrophobicContact CE2-CB 4.43Å; F243-M323 HydrophobicContact CZ-CB 3.74Å; V265-M323 HydrophobicContact CG1-CG 4.37Å; V265-M323 HydrophobicContact CG2-CE 3.92Å; I284-M323 HydrophobicContact CG1-CE 3.97Å; I284-M323 HydrophobicContact CG1-SD 3.86Å; V297-M323 HydrophobicContact CB-CE 3.95Å; V297-M323 HydrophobicContact CG1-CE 4.05Å; V297-M323 HydrophobicContact CG2-CE 3.85Å; I304-M323 HydrophobicContact CD1-CE 3.94Å; I304-M323 HydrophobicContact CD1-SD 4.16Å; I304-M323 HydrophobicContact CG1-CE 4.21Å; L321-M323 HydrophobicContact CB-SD 3.76Å; L321-M323 HydrophobicContact CD1-SD 3.99Å; M323-T338 CarbonylContact O-C 3.56Å; M323-T338 WeakPolarHBondContact O-CA 3.34Å; M323-T338 WeakPolarHBondContact O-CB 3.15Å; M323-S339 WeakPolarHBondContact CB-O 3.37Å; M323-S339 PolarHBondContact N-O 3.04Å; M323-S339 PolarHBondContact O-N 2.85Å; M323-C341 HydrophobicContact CG-CB 3.62Å; M323-C341 HydrophobicContact SD-CB 4.14Å
324	K	97.4	Very high	95.3	Very high	42 Å²	42	49.5 Å²	49.5	18%	0.183	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	136.7	169.7	-167.3	-162.2	71.2	167.1	0	109	Y282 S283 L285 I336 S337 T338	Y282-K324 WeakPolarHBondContact CA-O 3.34Å; S283-K324 PolarHBondContact N-O 2.57Å; S283-K324 PolarHBondContact O-N 2.77Å; S283-K324 VanDerWaalsContact OG-CE 3.3Å; S283-K324 WeakPolarHBondContact OG-CE 3.06Å; L285-K324 HydrophobicContact CB-CB 4.37Å; L285-K324 HydrophobicContact CD1-CB 4.48Å; K324-I336 HydrophobicContact CD-CD1 4.34Å; K324-I336 HydrophobicContact CD-CG1 4.48Å; K324-I336 HydrophobicContact CD-CG2 3.78Å; K324-I336 HydrophobicContact CG-CG2 3.48Å; K324-I336 VanDerWaalsContact CG-CG2 3.48Å; K324-S337 WeakPolarHBondContact CA-O 3.33Å; K324-T338 HydrophobicContact CG-CG2 4.43Å
325	V	97.9	Very high	95.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	143.2	159.7	67.2	0	0	0	0	108.5	P241 F243 A267 L280 K281 Y282 I336 S337	P241-V325 HydrophobicContact CB-CG1 3.97Å; P241-V325 HydrophobicContact CB-CG2 4.23Å; P241-V325 HydrophobicContact CG-CG1 4.16Å; P241-V325 WeakPolarHBondContact O-CG1 3.24Å; F243-V325 HydrophobicContact CD2-CG1 3.82Å; F243-V325 HydrophobicContact CE1-CB 4.29Å; F243-V325 HydrophobicContact CE2-CB 3.83Å; F243-V325 HydrophobicContact CE2-CG1 3.52Å; F243-V325 HydrophobicContact CG-CG1 4.48Å; F243-V325 HydrophobicContact CZ-CB 3.7Å; F243-V325 HydrophobicContact CZ-CG1 3.92Å; A267-V325 HydrophobicContact CB-CB 4.24Å; A267-V325 HydrophobicContact CB-CG1 4.01Å; A267-V325 HydrophobicContact CB-CG2 3.91Å; L280-V325 HydrophobicContact CB-CG2 4Å; L280-V325 HydrophobicContact CD1-CG2 4.1Å; L280-V325 HydrophobicContact CG-CG2 4.46Å; K281-V325 WeakPolarHBondContact O-CA 3.19Å; Y282-V325 HydrophobicContact CD1-CB 4.13Å; Y282-V325 HydrophobicContact CD1-CG2 4.02Å; Y282-V325 HydrophobicContact CE1-CB 4.19Å; Y282-V325 HydrophobicContact CE1-CG2 3.85Å; V325-I336 WeakPolarHBondContact O-CA 3.49Å; V325-S337 PolarHBondContact N-O 2.9Å; V325-S337 PolarHBondContact O-N 3.44Å; V325-S337 VanDerWaalsContact O-N 3.1Å
326	Q	97.4	Very high	95.7	Very high	10 Å²	10	47.5 Å²	47.5	5%	0.047	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	139.8	177.7	-175.5	162.6	22.7	0	0	110	L280 K281 Q331 G334 L335 I336	L280-Q326 CarbonylContact C-O 3.56Å; L280-Q326 WeakPolarHBondContact CA-O 3.3Å; K281-Q326 PolarHBondContact N-O 2.93Å; K281-Q326 PolarHBondContact O-N 3.04Å; Q326-Q331 PolarHBondContact NE2-O 2.73Å; Q326-G334 PolarHBondContact NE2-O 2.73Å; Q326-L335 VanDerWaalsContact CA-O 3.32Å; Q326-L335 WeakPolarHBondContact CA-O 3.48Å; Q326-L335 WeakPolarHBondContact CG-O 3.03Å; Q326-I336 HydrophobicContact CB-CG1 4.08Å; Q326-I336 HydrophobicContact CG-CG1 3.74Å
327	D	97.1	Very high	95.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.24	C	C	.	.	S	Bend	trans	-74.4	-163.7	176	69.3	23.1	0	0	0	111.9	N237 P241 H277 L280 N329 G330 G334 L335	N237-D327 PolarHBondContact ND2-OD2 2.54Å; P241-D327 HydrophobicContact CG-CB 4.2Å; H277-D327 WeakPolarHBondContact O-CB 3.4Å; L280-D327 HydrophobicContact CD2-CB 4.28Å; D327-N329 PolarHBondContact O-N 3.21Å; D327-G330 PolarHBondContact O-N 3.29Å; D327-G334 WeakPolarHBondContact OD1-CA 3.46Å; D327-L335 PolarHBondContact N-O 3.4Å; D327-L335 VanDerWaalsContact N-O 3.14Å; D327-L335 PolarHBondContact OD1-N 2.92Å; D327-L335 WeakPolarHBondContact OD2-CA 3.39Å; D327-L335 WeakPolarHBondContact OD2-CB 3Å; D327-L335 WeakPolarHBondContact OD2-CG 3.43Å; D327-L335 PolarHBondContact OD2-N 2.76Å
328	M	96.6	Very high	96.1	Very high	30 Å²	30	46.7 Å²	46.7	15%	0.148	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	51.7	33.7	168.4	-75.5	-61.8	-125.7	0	0	115	N237 M276 G330 Q331 F333	N237-M328 WeakPolarHBondContact OD1-CG 3.34Å; M276-M328 HydrophobicContact CB-CE 4.49Å; M276-M328 HydrophobicContact CB-SD 3.51Å; M276-M328 VanDerWaalsContact CB-SD 3.51Å; M276-M328 WeakPolarHBondContact O-CA 3.2Å; M276-M328 PolarHBondContact O-N 2.92Å; M328-G330 PolarHBondContact O-N 2.7Å; M328-Q331 HydrophobicContact CB-CB 4.35Å; M328-Q331 WeakPolarHBondContact O-CB 3.49Å; M328-Q331 VanDerWaalsContact O-CG 3.24Å; M328-Q331 WeakPolarHBondContact O-CG 3.4Å; M328-Q331 PolarHBondContact O-N 2.63Å; M328-Q331 PolarHBondContact O-NE2 2.54Å; M328-F333 HydrophobicContact CB-CE2 4.21Å; M328-F333 HydrophobicContact CE-CE2 3.8Å; M328-F333 HydrophobicContact CG-CE2 4.04Å
329	N	95.2	Very high	96.2	Very high	68 Å²	68	42.9 Å²	42.9	36%	0.364	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	57.3	28.5	-175.2	-164.6	67.6	0	0	0	113.5	M276 R279 K281 D327	M276-N329 HydrophobicContact CE-CB 3.61Å; R279-N329 WeakPolarHBondContact CD-OD1 3.37Å; R279-N329 HydrophobicContact CG-CB 3.98Å; R279-N329 WeakPolarHBondContact O-CA 3.47Å; R279-N329 PolarHBondContact O-N 2.6Å; K281-N329 WeakPolarHBondContact CE-OD1 3.4Å; D327-N329 PolarHBondContact O-N 3.21Å
330	G	93.6	Very high	96.3	Very high	33 Å²	33	44.7 Å²	44.7	34%	0.34	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	77.1	21.2	-179.4	0	0	0	0	0	114.9	D327 M328	D327-G330 PolarHBondContact O-N 3.29Å; M328-G330 PolarHBondContact O-N 2.7Å
331	Q	94.9	Very high	96.4	Very high	78 Å²	78	42.8 Å²	42.8	36%	0.364	22%	0.224	S	C	.	.			trans	-71.3	151.1	177.4	-72.8	175.2	101.5	0	0	112.1	Q326 M328 F333 G334	Q326-Q331 PolarHBondContact NE2-O 2.73Å; M328-Q331 HydrophobicContact CB-CB 4.35Å; M328-Q331 WeakPolarHBondContact O-CB 3.49Å; M328-Q331 VanDerWaalsContact O-CG 3.24Å; M328-Q331 WeakPolarHBondContact O-CG 3.4Å; M328-Q331 PolarHBondContact O-N 2.63Å; M328-Q331 PolarHBondContact O-NE2 2.54Å; Q331-F333 HydrophobicContact CB-CD1 4.19Å; Q331-F333 HydrophobicContact CB-CE1 3.69Å; Q331-F333 HydrophobicContact CB-CE2 4.37Å; Q331-F333 HydrophobicContact CB-CZ 3.8Å; Q331-F333 HydrophobicContact CG-CE1 4.3Å; Q331-F333 HydrophobicContact CG-CZ 4.31Å; Q331-F333 PolarHBondContact O-N 2.73Å; Q331-G334 PolarHBondContact O-N 2.73Å
332	F	92.7	Very high	96.4	Very high	195 Å²	195	44 Å²	44	86%	0.855	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-20.7	-168.9	70.1	-94	0	0	0	115.8
333	F	92.8	Very high	96.4	Very high	105 Å²	105	41.5 Å²	41.5	46%	0.461	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-5.1	179.6	57	-97.7	0	0	0	113.2	M328 Q331	M328-F333 HydrophobicContact CB-CE2 4.21Å; M328-F333 HydrophobicContact CE-CE2 3.8Å; M328-F333 HydrophobicContact CG-CE2 4.04Å; Q331-F333 HydrophobicContact CB-CD1 4.19Å; Q331-F333 HydrophobicContact CB-CE1 3.69Å; Q331-F333 HydrophobicContact CB-CE2 4.37Å; Q331-F333 HydrophobicContact CB-CZ 3.8Å; Q331-F333 HydrophobicContact CG-CE1 4.3Å; Q331-F333 HydrophobicContact CG-CZ 4.31Å; Q331-F333 PolarHBondContact O-N 2.73Å
334	G	94.6	Very high	96.3	Very high	7 Å²	7	43.7 Å²	43.7	7%	0.072	23%	0.232	C	C	.	.	S	Bend	trans	-72	148.1	179	0	0	0	0	0	113.4	Q326 D327 Q331	Q326-G334 PolarHBondContact NE2-O 2.73Å; D327-G334 WeakPolarHBondContact OD1-CA 3.46Å; Q331-G334 PolarHBondContact O-N 2.73Å
335	L	96	Very high	96.2	Very high	40 Å²	40	42 Å²	42	21%	0.209	23%	0.225	C	C	.	.			trans	-71.7	150	-178.6	-51.1	177.4	0	0	0	111.5	N239 Y240 Q326 D327	N239-L335 WeakPolarHBondContact O-CD1 3.25Å; Y240-L335 HydrophobicContact CD1-CB 3.78Å; Y240-L335 HydrophobicContact CD1-CD1 4.36Å; Y240-L335 HydrophobicContact CD1-CG 4.49Å; Y240-L335 HydrophobicContact CD2-CD1 3.99Å; Y240-L335 HydrophobicContact CE1-CB 3.97Å; Y240-L335 HydrophobicContact CE1-CD1 4.31Å; Y240-L335 HydrophobicContact CE1-CD2 4.02Å; Y240-L335 HydrophobicContact CE1-CG 4.33Å; Y240-L335 HydrophobicContact CE2-CD1 3.95Å; Y240-L335 HydrophobicContact CG-CB 4.22Å; Y240-L335 HydrophobicContact CG-CD1 4.2Å; Q326-L335 VanDerWaalsContact CA-O 3.32Å; Q326-L335 WeakPolarHBondContact CA-O 3.48Å; Q326-L335 WeakPolarHBondContact CG-O 3.03Å; D327-L335 PolarHBondContact N-O 3.4Å; D327-L335 VanDerWaalsContact N-O 3.14Å; D327-L335 PolarHBondContact OD1-N 2.92Å; D327-L335 WeakPolarHBondContact OD2-CA 3.39Å; D327-L335 WeakPolarHBondContact OD2-CB 3Å; D327-L335 WeakPolarHBondContact OD2-CG 3.43Å; D327-L335 PolarHBondContact OD2-N 2.76Å
336	I	96.6	Very high	96.1	Very high	79 Å²	79	45.9 Å²	45.9	41%	0.405	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	136	-165.9	-63.4	171.1	0	0	0	110.2	K324 V325 Q326	K324-I336 HydrophobicContact CD-CD1 4.34Å; K324-I336 HydrophobicContact CD-CG1 4.48Å; K324-I336 HydrophobicContact CD-CG2 3.78Å; K324-I336 HydrophobicContact CG-CG2 3.48Å; K324-I336 VanDerWaalsContact CG-CG2 3.48Å; V325-I336 WeakPolarHBondContact O-CA 3.49Å; Q326-I336 HydrophobicContact CB-CG1 4.08Å; Q326-I336 HydrophobicContact CG-CG1 3.74Å
337	S	97.2	Very high	95.9	Very high	21 Å²	21	46.9 Å²	46.9	15%	0.147	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	159.7	161.1	-60.2	0	0	0	0	111.4	P241 K324 V325	P241-S337 WeakPolarHBondContact O-CB 3.43Å; P241-S337 PolarHBondContact O-OG 2.81Å; K324-S337 WeakPolarHBondContact CA-O 3.33Å; V325-S337 PolarHBondContact N-O 2.9Å; V325-S337 PolarHBondContact O-N 3.44Å; V325-S337 VanDerWaalsContact O-N 3.1Å
338	T	97.6	Very high	95.7	Very high	85 Å²	85	47.2 Å²	47.2	52%	0.521	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	154.1	173.5	54.1	0	0	0	0	111.9	L285 I322 M323 K324	L285-T338 HydrophobicContact CD1-CG2 4.41Å; I322-T338 HydrophobicContact CG2-CG2 4.41Å; M323-T338 CarbonylContact O-C 3.56Å; M323-T338 WeakPolarHBondContact O-CA 3.34Å; M323-T338 WeakPolarHBondContact O-CB 3.15Å; K324-T338 HydrophobicContact CG-CG2 4.43Å
339	S	97.3	Very high	95.5	Very high	8 Å²	8	45.8 Å²	45.8	6%	0.056	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	155	174.5	178.8	0	0	0	0	109.7	F243 E245 T246 M323	F243-S339 VanDerWaalsContact CG-CB 3.42Å; E245-S339 PolarHBondContact O-OG 3.05Å; T246-S339 PolarHBondContact O-OG 2.89Å; T246-S339 VanDerWaalsContact O-OG 3.12Å; M323-S339 WeakPolarHBondContact CB-O 3.37Å; M323-S339 PolarHBondContact N-O 3.04Å; M323-S339 PolarHBondContact O-N 2.85Å
340	T	98.1	Very high	95.1	Very high	44 Å²	44	46.9 Å²	46.9	27%	0.27	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	135.2	178.9	-53.2	0	0	0	0	109.7	T246 I247 Y248 T320 I342	T246-T340 PolarHBondContact O-N 2.72Å; I247-T340 CarbonylContact C-O 3.57Å; I247-T340 VanDerWaalsContact CA-O 3.31Å; I247-T340 WeakPolarHBondContact CA-O 3.28Å; Y248-T340 PolarHBondContact N-O 2.77Å; T320-T340 HydrophobicContact CG2-CG2 3.71Å; T340-I342 HydrophobicContact CG2-CG1 4.3Å
341	C	98	Very high	94.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	114.3	171	173.1	0	0	0	0	109.8	F250 L321 M323	F250-C341 VanDerWaalsContact CD2-SG 3.54Å; L321-C341 HydrophobicContact CB-CB 4.16Å; L321-C341 PolarHBondContact N-O 3.06Å; L321-C341 PolarHBondContact O-N 2.72Å; M323-C341 HydrophobicContact CG-CB 3.62Å; M323-C341 HydrophobicContact SD-CB 4.14Å
342	I	97.9	Very high	94.7	Very high	26 Å²	26	44.4 Å²	44.4	13%	0.133	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	130.7	175.9	-68.8	172.3	0	0	0	108.5	I247 Y248 N249 F250 K318 T340	I247-I342 HydrophobicContact CG2-CD1 3.96Å; I247-I342 HydrophobicContact CG2-CG1 4.41Å; Y248-I342 PolarHBondContact O-N 2.78Å; N249-I342 CarbonylContact C-O 3.53Å; N249-I342 WeakPolarHBondContact CA-O 3.04Å; F250-I342 PolarHBondContact N-O 2.98Å; K318-I342 HydrophobicContact CD-CG2 4.31Å; K318-I342 VanDerWaalsContact CE-CG2 3.49Å; K318-I342 HydrophobicContact CG-CG2 4.4Å; T340-I342 HydrophobicContact CG2-CG1 4.3Å
343	I	97.2	Very high	94.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.9	175.3	-58.5	169.8	0	0	0	107.5	F250 V252 V262 F295 I304 Y319 L321	F250-I343 WeakPolarHBondContact O-CA 3.41Å; V252-I343 HydrophobicContact CG1-CG2 3.5Å; V262-I343 HydrophobicContact CG1-CD1 4.03Å; V262-I343 HydrophobicContact CG1-CG1 4.09Å; V262-I343 HydrophobicContact CG1-CG2 3.84Å; F295-I343 HydrophobicContact CD1-CD1 3.68Å; F295-I343 HydrophobicContact CD2-CD1 4.01Å; F295-I343 HydrophobicContact CE1-CD1 3.69Å; F295-I343 HydrophobicContact CE1-CG2 3.94Å; F295-I343 HydrophobicContact CE2-CD1 4.03Å; F295-I343 HydrophobicContact CG-CD1 3.84Å; F295-I343 HydrophobicContact CZ-CB 4.24Å; F295-I343 HydrophobicContact CZ-CD1 3.87Å; F295-I343 HydrophobicContact CZ-CG2 3.72Å; I304-I343 HydrophobicContact CG2-CD1 4.26Å; Y319-I343 PolarHBondContact N-O 2.71Å; Y319-I343 PolarHBondContact O-N 2.76Å; L321-I343 HydrophobicContact CD1-CD1 3.58Å; L321-I343 HydrophobicContact CG-CD1 4.08Å
344	T	96.9	Very high	94.7	Very high	47 Å²	47	33.2 Å²	33.2	29%	0.288	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	134.1	174.3	-47.5	0	0	0	0	109.1	F250 E251 V252	F250-T344 PolarHBondContact O-N 3.31Å; E251-T344 WeakPolarHBondContact CA-O 3.38Å; V252-T344 PolarHBondContact N-O 2.87Å
345	V	95.3	Very high	94.7	Very high	7 Å²	7	33.7 Å²	33.7	4%	0.042	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130	176.9	-171.6	0	0	0	0	109.2	V252 E254 M311 R313 D317 Y319	V252-V345 CarbonylContact O-C 3.59Å; V252-V345 WeakPolarHBondContact O-CA 3.4Å; E254-V345 HydrophobicContact CB-CG1 3.64Å; M311-V345 HydrophobicContact CG-CG1 4.04Å; M311-V345 HydrophobicContact CG-CG2 4.23Å; M311-V345 HydrophobicContact SD-CG1 4.35Å; M311-V345 HydrophobicContact SD-CG2 4.47Å; R313-V345 HydrophobicContact CB-CB 4.28Å; R313-V345 HydrophobicContact CB-CG1 3.89Å; R313-V345 HydrophobicContact CG-CB 4.38Å; R313-V345 HydrophobicContact CG-CG1 4.44Å; D317-V345 PolarHBondContact O-N 2.75Å; Y319-V345 HydrophobicContact CD2-CG2 4.02Å; Y319-V345 HydrophobicContact CE2-CG2 3.98Å
346	Q	94.8	Very high	94.5	Very high	80 Å²	80	38.8 Å²	38.8	37%	0.374	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.4	178.9	-69.4	-177	-19.3	0	0	111.8	E251 V252 P253 E254 S348	E251-Q346 HydrophobicContact CB-CG 4.04Å; E251-Q346 PolarHBondContact OE2-NE2 3.49Å; V252-Q346 PolarHBondContact O-N 2.79Å; P253-Q346 WeakPolarHBondContact CA-O 3.31Å; P253-Q346 HydrophobicContact CG-CB 4.46Å; E254-Q346 PolarHBondContact N-O 2.03Å; Q346-S348 PolarHBondContact O-N 2.85Å
347	D	94.2	Very high	94.4	Very high	32 Å²	32	40.4 Å²	40.4	17%	0.171	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-54.9	118.5	178.8	-168.1	64.7	0	0	0	113.4	E254 R313 L383 S386 N388	E254-D347 WeakPolarHBondContact OE1-CA 3.02Å; R313-D347 IonicContact CZ-OD1 3.2Å; R313-D347 IonicContact NE-OD1 2.77Å; R313-D347 PolarHBondContact NE-OD1 2.95Å; R313-D347 VanDerWaalsContact NE-OD1 3.15Å; R313-D347 IonicContact NH2-OD1 3.7Å; D347-L383 HydrophobicContact CB-CB 3.87Å; D347-L383 HydrophobicContact CB-CD2 4.28Å; D347-L383 WeakPolarHBondContact OD1-CB 3.33Å; D347-L383 PolarHBondContact OD1-N 2.9Å; D347-L383 WeakPolarHBondContact OD2-CB 3.19Å; D347-S386 WeakPolarHBondContact OD2-CB 3.32Å; D347-S386 PolarHBondContact OD2-OG 2.99Å; D347-N388 PolarHBondContact O-ND2 2.93Å; D347-N388 PolarHBondContact OD2-ND2 2.81Å
348	S	92.1	Very high	94	Very high	7 Å²	7	46.3 Å²	46.3	5%	0.049	25%	0.245	C	C	.	.			trans	-114.6	137.3	173.6	-60.2	0	0	0	0	109.1	E254 S255 Q346 D350	E254-S348 PolarHBondContact OE1-N 3.27Å; S255-S348 PolarHBondContact OG-OG 2.97Å; Q346-S348 PolarHBondContact O-N 2.85Å; S348-D350 PolarHBondContact O-N 3.21Å
349	N	92.1	Very high	93.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.237	C	C	.	.			trans	-69.7	93.4	174.6	-177.5	-25.4	0	0	0	110.6	D382 N388 N439 A441 L443 I444	N349-D382 WeakPolarHBondContact CA-OD2 3.44Å; N349-N388 HydrophobicContact CB-CB 3.71Å; N349-N388 PolarHBondContact N-ND2 2.89Å; N349-N439 VanDerWaalsContact ND2-CB 3.31Å; N349-N439 WeakPolarHBondContact ND2-CB 3.47Å; N349-N439 PolarHBondContact ND2-OD1 3Å; N349-N439 VanDerWaalsContact ND2-OD1 3.13Å; N349-A441 HydrophobicContact CB-CB 4.45Å; N349-A441 PolarHBondContact ND2-O 2.65Å; N349-L443 WeakPolarHBondContact OD1-CA 3.28Å; N349-L443 WeakPolarHBondContact OD1-CD1 3.4Å; N349-I444 WeakPolarHBondContact O-CA 3.31Å; N349-I444 VanDerWaalsContact O-CB 3.31Å; N349-I444 WeakPolarHBondContact O-CB 3.39Å; N349-I444 PolarHBondContact O-N 2.65Å
350	D	88.5	Confident	93.8	Very high	90 Å²	90	44.2 Å²	44.2	48%	0.481	24%	0.237	S	C	.	.			trans	-119.9	-20.4	175.4	106.3	-40	0	0	0	112.9	S348 L443	S348-D350 PolarHBondContact O-N 3.21Å; D350-L443 WeakPolarHBondContact O-CD1 3.28Å
351	N	89	Confident	93.7	Very high	23 Å²	23	49.2 Å²	49.2	12%	0.123	26%	0.258	C	S	.	.	S	Bend	trans	-93.3	112.3	171.6	-55.7	-91.8	0	0	0	110.7	K381 D382	N351-K381 HydrophobicContact CB-CB 4.21Å; N351-K381 HydrophobicContact CB-CG 4.47Å; N351-K381 WeakPolarHBondContact OD1-CE 3.37Å; N351-K381 PolarHBondContact OD1-NZ 2.72Å; N351-D382 VanDerWaalsContact CB-OD1 3.22Å; N351-D382 WeakPolarHBondContact CB-OD1 3.43Å; N351-D382 PolarHBondContact N-OD1 3.04Å; N351-D382 PolarHBondContact ND2-OD1 3.42Å
352	A	90.6	Very high	93.7	Very high	37 Å²	37	50.5 Å²	50.5	31%	0.306	27%	0.266	S	S	.	.			trans	-71.4	145.1	170.7	0	0	0	0	0	111.4	T354 L443	A352-T354 WeakPolarHBondContact O-CG2 3.46Å; A352-L443 HydrophobicContact CB-CD1 4.23Å; A352-L443 HydrophobicContact CB-CD2 4.08Å
353	P	93.5	Very high	93.5	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.013	27%	0.274	C	S	.	.			trans	-71.2	137	-175.2	23.7	-26.9	0	0	0	110.3	D380 V437 N439 N455	P353-D380 WeakPolarHBondContact CA-OD2 3.36Å; P353-D380 HydrophobicContact CB-CB 4.25Å; P353-D380 WeakPolarHBondContact CB-OD2 3.47Å; P353-V437 HydrophobicContact CB-CG1 4.31Å; P353-V437 HydrophobicContact CB-CG2 4.21Å; P353-V437 HydrophobicContact CG-CG1 4.17Å; P353-V437 HydrophobicContact CG-CG2 3.95Å; P353-N439 WeakPolarHBondContact CD-ND2 3.25Å; P353-N439 VanDerWaalsContact CD-OD1 3.31Å; P353-N439 WeakPolarHBondContact CD-OD1 3.33Å; P353-N455 WeakPolarHBondContact O-CB 3.15Å
354	T	92.4	Very high	93.5	Very high	63 Å²	63	51.8 Å²	51.8	39%	0.387	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.6	-171.3	62.7	0	0	0	0	113.1	A352 V378 D379 N455	A352-T354 WeakPolarHBondContact O-CG2 3.46Å; T354-V378 CarbonylContact O-C 3.59Å; T354-V378 WeakPolarHBondContact O-CA 3.34Å; T354-V378 WeakPolarHBondContact O-CB 3.48Å; T354-D379 PolarHBondContact N-O 3.11Å; T354-D379 PolarHBondContact O-N 3.49Å; T354-D379 PolarHBondContact OG1-O 2.79Å; T354-N455 WeakPolarHBondContact CA-ND2 3.2Å
355	F	94.3	Very high	93.4	Very high	16 Å²	16	54.3 Å²	54.3	7%	0.07	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	133.8	168.4	-68	-73	0	0	0	110	Q357 Y360 I376 V378 F393 I435 V437 N455 A457	F355-Q357 WeakPolarHBondContact CB-O 2.94Å; F355-Q357 PolarHBondContact O-N 2.92Å; F355-Y360 HydrophobicContact CB-CE2 4.33Å; F355-Y360 HydrophobicContact CD1-CE2 4.05Å; F355-Y360 HydrophobicContact CG-CE2 4.48Å; F355-I376 HydrophobicContact CD1-CG2 3.73Å; F355-I376 HydrophobicContact CE1-CG2 3.72Å; F355-V378 HydrophobicContact CD1-CG1 3.79Å; F355-V378 HydrophobicContact CE1-CG1 4.06Å; F355-V378 HydrophobicContact CG-CG1 4.41Å; F355-F393 HydrophobicContact CE1-CD1 4.21Å; F355-F393 AromaticContact CE1-CE1 3.79Å; F355-F393 HydrophobicContact CE1-CE1 3.79Å; F355-F393 HydrophobicContact CZ-CD1 4.4Å; F355-F393 HydrophobicContact CZ-CE1 4.32Å; F355-I435 HydrophobicContact CE1-CD1 3.56Å; F355-I435 HydrophobicContact CE1-CG1 4.2Å; F355-I435 HydrophobicContact CZ-CD1 3.69Å; F355-I435 HydrophobicContact CZ-CG1 3.83Å; F355-V437 HydrophobicContact CD2-CG1 4.02Å; F355-V437 HydrophobicContact CE1-CB 4.44Å; F355-V437 HydrophobicContact CE1-CG1 4.24Å; F355-V437 HydrophobicContact CE2-CB 4.14Å; F355-V437 HydrophobicContact CE2-CG1 3.53Å; F355-V437 HydrophobicContact CZ-CB 3.82Å; F355-V437 HydrophobicContact CZ-CG1 3.65Å; F355-N455 HydrophobicContact CD2-CB 4.41Å; F355-A457 HydrophobicContact CB-CB 4.3Å; F355-A457 HydrophobicContact CD1-CB 4.06Å; F355-A457 HydrophobicContact CD2-CB 3.72Å; F355-A457 HydrophobicContact CE1-CB 4.28Å; F355-A457 HydrophobicContact CE2-CB 3.96Å; F355-A457 HydrophobicContact CG-CB 3.77Å; F355-A457 HydrophobicContact CZ-CB 4.24Å
356	R	91.9	Very high	93.3	Very high	147 Å²	147	54 Å²	54	56%	0.555	28%	0.283	S	S	*	.	S	Bend	trans	-63.6	-21.2	173.8	-72.9	-175	-178.6	151.9	8.5	113.6	Y360 D379	R356-Y360 PolarHBondContact N-OH 2.86Å; R356-D379 WeakPolarHBondContact CD-OD2 3.37Å; R356-D379 WeakPolarHBondContact CG-OD2 3.47Å; R356-D379 IonicContact CZ-OD1 3.92Å; R356-D379 IonicContact CZ-OD2 3.11Å; R356-D379 VanDerWaalsContact NE-CG 3.32Å; R356-D379 IonicContact NE-OD1 3.86Å; R356-D379 PolarHBondContact NE-OD1 2.76Å; R356-D379 IonicContact NE-OD2 3.01Å; R356-D379 PolarHBondContact NE-OD2 3.39Å; R356-D379 IonicContact NH2-OD1 3.77Å; R356-D379 PolarHBondContact NH2-OD1 2.83Å; R356-D379 IonicContact NH2-OD2 3.98Å
357	Q	92.6	Very high	93.1	Very high	114 Å²	114	53.7 Å²	53.7	53%	0.533	28%	0.284	S	S	.	.	S	Bend	trans	-141.4	143.8	-178.5	-58.7	-175.8	76.8	0	0	110.3	F355 G359 Y360	F355-Q357 WeakPolarHBondContact CB-O 2.94Å; F355-Q357 PolarHBondContact O-N 2.92Å; Q357-G359 WeakPolarHBondContact CB-O 2.93Å; Q357-G359 PolarHBondContact O-N 2.71Å; Q357-Y360 HydrophobicContact CB-CE1 4.23Å; Q357-Y360 HydrophobicContact CB-CE2 4.12Å; Q357-Y360 PolarHBondContact N-OH 3.06Å; Q357-Y360 WeakPolarHBondContact O-CE2 3.2Å
358	N	89.6	Confident	93	Very high	144 Å²	144	54 Å²	54	77%	0.77	29%	0.287	S	S	*	.	S	Bend	trans	-72.4	-17.3	177.4	-63.3	-12.3	0	0	0	112.8	A457 L458	N358-A457 WeakPolarHBondContact O-CA 3.25Å; N358-L458 PolarHBondContact O-N 2.96Å; N358-L458 VanDerWaalsContact O-N 3.09Å
359	G	94.3	Very high	93.1	Very high	35 Å²	35	60.5 Å²	60.5	36%	0.361	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	147.2	179.3	0	0	0	0	0	110.4	Q357 L458	Q357-G359 WeakPolarHBondContact CB-O 2.93Å; Q357-G359 PolarHBondContact O-N 2.71Å; G359-L458 CarbonylContact C-O 3.53Å; G359-L458 VanDerWaalsContact CA-O 3.26Å; G359-L458 WeakPolarHBondContact CA-O 3.35Å
360	Y	96.5	Very high	93.1	Very high	15 Å²	15	66.4 Å²	66.4	6%	0.059	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	147.9	174.3	-60.2	-103.2	0	0	0	108.9	F355 R356 Q357 L374 I376 P377 A457 L458 V459 T460	F355-Y360 HydrophobicContact CB-CE2 4.33Å; F355-Y360 HydrophobicContact CD1-CE2 4.05Å; F355-Y360 HydrophobicContact CG-CE2 4.48Å; R356-Y360 PolarHBondContact N-OH 2.86Å; Q357-Y360 HydrophobicContact CB-CE1 4.23Å; Q357-Y360 HydrophobicContact CB-CE2 4.12Å; Q357-Y360 PolarHBondContact N-OH 3.06Å; Q357-Y360 WeakPolarHBondContact O-CE2 3.2Å; Y360-L374 HydrophobicContact CG-CD2 4.31Å; Y360-I376 HydrophobicContact CD2-CG2 4.35Å; Y360-I376 HydrophobicContact CE1-CG2 4Å; Y360-I376 HydrophobicContact CE2-CG2 3.84Å; Y360-P377 PolarHBondContact OH-O 2.7Å; Y360-A457 HydrophobicContact CD2-CB 4.12Å; Y360-A457 HydrophobicContact CE2-CB 3.92Å; Y360-L458 PolarHBondContact N-O 2.9Å; Y360-V459 CarbonylContact O-C 3.6Å; Y360-V459 VanDerWaalsContact O-CA 3.32Å; Y360-V459 WeakPolarHBondContact O-CA 3.12Å; Y360-T460 PolarHBondContact O-N 2.81Å
361	E	96.5	Very high	93.4	Very high	149 Å²	149	64.6 Å²	64.6	70%	0.696	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	140	177.5	-62	-175.8	160.5	0	0	109.4	T460	E361-T460 WeakPolarHBondContact CA-O 3.3Å
362	T	96.8	Very high	93.7	Very high	27 Å²	27	68.6 Å²	68.6	17%	0.166	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	170.4	171.3	-170.7	0	0	0	0	110	I373 L374 T460 V461 H462	T362-I373 WeakPolarHBondContact CB-O 3.32Å; T362-I373 HydrophobicContact CG2-CB 4.24Å; T362-I373 HydrophobicContact CG2-CD1 3.98Å; T362-I373 HydrophobicContact CG2-CG1 4.27Å; T362-I373 PolarHBondContact OG1-O 2.78Å; T362-L374 HydrophobicContact CG2-CB 4.24Å; T362-T460 PolarHBondContact N-O 2.79Å; T362-V461 HydrophobicContact CG2-CB 4.49Å; T362-V461 HydrophobicContact CG2-CG1 4.38Å; T362-V461 HydrophobicContact CG2-CG2 4.02Å; T362-H462 PolarHBondContact O-N 3.31Å
363	S	95.5	Very high	94	Very high	43 Å²	43	67.8 Å²	67.8	30%	0.301	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	140.2	177	65.6	0	0	0	0	111.3	H462 R464	S363-H462 CarbonylContact C-O 3.56Å; S363-H462 WeakPolarHBondContact CA-O 3.26Å; S363-R464 VanDerWaalsContact OG-CZ 3.3Å; S363-R464 PolarHBondContact OG-NE 3.05Å; S363-R464 PolarHBondContact OG-NH2 2.82Å
364	V	96.2	Very high	94.1	Very high	9 Å²	9	69.1 Å²	69.1	6%	0.055	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	141.2	-179.5	68.6	0	0	0	0	109.8	T368 V371 I373 V419 L423 V461 H462 V463 R464	V364-T368 WeakPolarHBondContact CG2-OG1 3.24Å; V364-V371 HydrophobicContact CG2-CG2 4.04Å; V364-I373 HydrophobicContact CB-CG2 3.8Å; V364-I373 HydrophobicContact CG2-CG2 3.58Å; V364-V419 HydrophobicContact CG1-CG2 4.4Å; V364-V419 HydrophobicContact CG2-CG2 4.24Å; V364-L423 HydrophobicContact CG1-CD1 3.61Å; V364-V461 HydrophobicContact CG1-CG1 3.71Å; V364-H462 PolarHBondContact N-O 2.77Å; V364-V463 CarbonylContact O-C 3.56Å; V364-V463 WeakPolarHBondContact O-CA 3.47Å; V364-R464 PolarHBondContact O-N 3.18Å
365	E	94.8	Very high	94.3	Very high	101 Å²	101	70.1 Å²	70.1	47%	0.472	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	138.2	170.8	-72.5	159.3	-165.2	0	0	109.2	T368 R464	E365-T368 HydrophobicContact CB-CG2 3.89Å; E365-T368 WeakPolarHBondContact O-CG2 3.49Å; E365-T368 PolarHBondContact O-OG1 3.16Å; E365-R464 HydrophobicContact CG-CB 4.34Å
366	E	93.8	Very high	94.5	Very high	1 Å²	1	69.3 Å²	69.3	1%	0.005	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	170.4	176.7	76.4	-174	115.8	0	0	112.5	T368 Y425 V463 R464 D465 Q466	E366-T368 PolarHBondContact O-N 2.76Å; E366-Y425 VanDerWaalsContact CD-CB 3.44Å; E366-Y425 VanDerWaalsContact OE1-CB 3.25Å; E366-Y425 WeakPolarHBondContact OE1-CB 3.23Å; E366-Y425 VanDerWaalsContact OE2-CB 3.23Å; E366-Y425 WeakPolarHBondContact OE2-CB 3.31Å; E366-Y425 PolarHBondContact OE2-N 3.49Å; E366-V463 HydrophobicContact CB-CG1 3.66Å; E366-R464 PolarHBondContact N-O 2.93Å; E366-R464 VanDerWaalsContact N-O 3.11Å; E366-D465 VanDerWaalsContact OE1-CA 3.31Å; E366-D465 WeakPolarHBondContact OE1-CA 3.25Å; E366-Q466 HydrophobicContact CG-CB 4Å; E366-Q466 PolarHBondContact OE1-N 2.95Å
367	N	90.5	Very high	94.6	Very high	73 Å²	73	63.4 Å²	63.4	39%	0.39	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	-11.2	-172.2	-75.6	-64.7	0	0	0	116.5	L423 E468	N367-L423 PolarHBondContact N-O 3.3Å; N367-E468 PolarHBondContact ND2-OE1 2.65Å
368	T	92.1	Very high	94.7	Very high	37 Å²	37	58.8 Å²	58.8	23%	0.227	30%	0.303	C	S	.	.			trans	-75	146.1	176.2	71.2	0	0	0	0	112.1	V364 E365 E366 V419	V364-T368 WeakPolarHBondContact CG2-OG1 3.24Å; E365-T368 HydrophobicContact CB-CG2 3.89Å; E365-T368 WeakPolarHBondContact O-CG2 3.49Å; E365-T368 PolarHBondContact O-OG1 3.16Å; E366-T368 PolarHBondContact O-N 2.76Å; T368-V419 WeakPolarHBondContact O-CG1 3.18Å
369	Y	93.2	Very high	94.9	Very high	144 Å²	144	55.2 Å²	55.2	57%	0.565	28%	0.284	S	S	*	.			trans	-155.7	160.4	-178.8	67	-82	0	0	0	110.8	V371	Y369-V371 PolarHBondContact O-N 3.37Å
370	N	92.6	Very high	94.8	Very high	124 Å²	124	54.5 Å²	54.5	66%	0.663	27%	0.272	S	S	*	.	S	Bend	trans	56.3	25.4	-167.1	-61.2	-38.9	0	0	0	113.8	V419	N370-V419 VanDerWaalsContact CA-O 3.31Å; N370-V419 WeakPolarHBondContact CA-O 3.4Å; N370-V419 PolarHBondContact N-O 3.41Å
371	V	94.6	Very high	94.7	Very high	52 Å²	52	60 Å²	60	32%	0.315	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	140.4	175.7	-66.8	0	0	0	0	110.9	V364 Y369 I373 C418 V419	V364-V371 HydrophobicContact CG2-CG2 4.04Å; Y369-V371 PolarHBondContact O-N 3.37Å; V371-I373 HydrophobicContact CG2-CG2 4.15Å; V371-C418 CarbonylContact O-C 3.57Å; V371-C418 WeakPolarHBondContact O-CA 3.41Å; V371-C418 WeakPolarHBondContact O-CB 3.29Å; V371-V419 HydrophobicContact CG2-CB 4.09Å; V371-V419 PolarHBondContact O-N 2.86Å
372	E	95.9	Very high	94.6	Very high	108 Å²	108	53 Å²	53	51%	0.505	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	133.6	165.2	-176.6	-175.3	116.6	0	0	109.2	R375 V416	E372-R375 WeakPolarHBondContact OE1-CD 3.49Å; E372-R375 WeakPolarHBondContact OE1-CG 3.45Å; E372-V416 HydrophobicContact CG-CG1 3.7Å; E372-V416 VanDerWaalsContact OE2-CG1 3.3Å; E372-V416 WeakPolarHBondContact OE2-CG1 3.44Å
373	I	96.3	Very high	94.5	Very high	20 Å²	20	56 Å²	56	10%	0.103	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	-19.7	-177.8	60.5	164.8	0	0	0	113.5	T362 V364 V371 F404 L417 V419 V461	T362-I373 WeakPolarHBondContact CB-O 3.32Å; T362-I373 HydrophobicContact CG2-CB 4.24Å; T362-I373 HydrophobicContact CG2-CD1 3.98Å; T362-I373 HydrophobicContact CG2-CG1 4.27Å; T362-I373 PolarHBondContact OG1-O 2.78Å; V364-I373 HydrophobicContact CB-CG2 3.8Å; V364-I373 HydrophobicContact CG2-CG2 3.58Å; V371-I373 HydrophobicContact CG2-CG2 4.15Å; I373-F404 HydrophobicContact CD1-CD1 4.11Å; I373-F404 HydrophobicContact CD1-CE1 3.96Å; I373-L417 HydrophobicContact CD1-CD2 3.89Å; I373-L417 HydrophobicContact CD1-CG 4.09Å; I373-L417 HydrophobicContact CG1-CB 4.4Å; I373-L417 HydrophobicContact CG1-CD2 4.12Å; I373-L417 HydrophobicContact CG1-CG 4Å; I373-L417 VanDerWaalsContact CG1-O 3.32Å; I373-L417 WeakPolarHBondContact CG1-O 3.12Å; I373-L417 PolarHBondContact N-O 2.83Å; I373-V419 HydrophobicContact CD1-CG2 3.97Å; I373-V419 HydrophobicContact CG1-CG2 4.44Å; I373-V419 HydrophobicContact CG2-CG2 3.79Å; I373-V461 HydrophobicContact CD1-CG1 3.93Å; I373-V461 HydrophobicContact CD1-CG2 3.77Å
374	L	96.6	Very high	94.4	Very high	30 Å²	30	59.6 Å²	59.6	16%	0.157	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	137.4	179.3	-175.3	63.2	0	0	0	111	Y360 T362 I376 L417 V459	Y360-L374 HydrophobicContact CG-CD2 4.31Å; T362-L374 HydrophobicContact CG2-CB 4.24Å; L374-I376 HydrophobicContact CD2-CD1 3.79Å; L374-I376 HydrophobicContact CD2-CG1 3.62Å; L374-I376 HydrophobicContact CG-CD1 4.31Å; L374-I376 HydrophobicContact CG-CG1 3.68Å; L374-L417 HydrophobicContact CB-CB 4.32Å; L374-L417 HydrophobicContact CB-CD2 4.49Å; L374-L417 PolarHBondContact N-O 2.93Å; L374-L417 PolarHBondContact O-N 2.87Å; L374-V459 HydrophobicContact CD2-CG1 3.71Å; L374-V459 HydrophobicContact CD2-CG2 4.47Å
375	R	96.8	Very high	94.1	Very high	83 Å²	83	66.1 Å²	66.1	31%	0.313	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.6	164.7	-56.6	179.7	82.1	-110.2	1.5	108	E372 P377 D409 T412 E414 V416	E372-R375 WeakPolarHBondContact OE1-CD 3.49Å; E372-R375 WeakPolarHBondContact OE1-CG 3.45Å; R375-P377 WeakPolarHBondContact O-CD 3.47Å; R375-D409 IonicContact CZ-OD2 3.61Å; R375-D409 IonicContact NH2-OD2 3.8Å; R375-D409 PolarHBondContact NH2-OD2 2.81Å; R375-T412 PolarHBondContact NH2-OG1 3.04Å; R375-E414 IonicContact CZ-OE2 2.93Å; R375-E414 VanDerWaalsContact CZ-OE2 3.32Å; R375-E414 IonicContact NH1-OE1 3.85Å; R375-E414 IonicContact NH1-OE2 3.44Å; R375-E414 PolarHBondContact NH1-OE2 3.34Å; R375-E414 IonicContact NH2-OE2 2.63Å; R375-E414 PolarHBondContact NH2-OE2 3Å; R375-V416 HydrophobicContact CG-CG2 4.47Å
376	I	96.5	Very high	94.1	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	102.9	-168.2	-56.9	-179.3	0	0	0	109.5	F355 Y360 L374 I406 E414 G415 I435 V459	F355-I376 HydrophobicContact CD1-CG2 3.73Å; F355-I376 HydrophobicContact CE1-CG2 3.72Å; Y360-I376 HydrophobicContact CD2-CG2 4.35Å; Y360-I376 HydrophobicContact CE1-CG2 4Å; Y360-I376 HydrophobicContact CE2-CG2 3.84Å; L374-I376 HydrophobicContact CD2-CD1 3.79Å; L374-I376 HydrophobicContact CD2-CG1 3.62Å; L374-I376 HydrophobicContact CG-CD1 4.31Å; L374-I376 HydrophobicContact CG-CG1 3.68Å; I376-I406 HydrophobicContact CD1-CD1 4.11Å; I376-E414 WeakPolarHBondContact O-CA 3.45Å; I376-G415 WeakPolarHBondContact CB-O 3.09Å; I376-G415 WeakPolarHBondContact CG1-O 3.36Å; I376-G415 PolarHBondContact N-O 3.12Å; I376-G415 PolarHBondContact O-N 3.25Å; I376-I435 HydrophobicContact CD1-CD1 3.45Å; I376-I435 VanDerWaalsContact CD1-CD1 3.45Å; I376-I435 HydrophobicContact CG2-CD1 4.33Å; I376-V459 HydrophobicContact CD1-CG2 3.94Å
377	P	95.1	Very high	94.1	Very high	23 Å²	23	64.7 Å²	64.7	15%	0.149	33%	0.325	C	S	.	.			trans	-74.9	135.5	179.7	29.5	-35.2	0	0	0	112.1	Y360 R375 E414	Y360-P377 PolarHBondContact OH-O 2.7Å; R375-P377 WeakPolarHBondContact O-CD 3.47Å; P377-E414 HydrophobicContact CB-CG 4.37Å
378	V	94.8	Very high	94.2	Very high	16 Å²	16	62.4 Å²	62.4	10%	0.097	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	145.2	170.6	-65.8	0	0	0	0	109.9	T354 F355 A391 F393 V437	T354-V378 CarbonylContact O-C 3.59Å; T354-V378 WeakPolarHBondContact O-CA 3.34Å; T354-V378 WeakPolarHBondContact O-CB 3.48Å; F355-V378 HydrophobicContact CD1-CG1 3.79Å; F355-V378 HydrophobicContact CE1-CG1 4.06Å; F355-V378 HydrophobicContact CG-CG1 4.41Å; V378-A391 HydrophobicContact CG2-CB 3.91Å; V378-F393 HydrophobicContact CB-CZ 4.35Å; V378-F393 HydrophobicContact CG1-CE1 3.63Å; V378-F393 HydrophobicContact CG1-CZ 3.59Å; V378-F393 HydrophobicContact CG2-CZ 3.79Å; V378-V437 HydrophobicContact CG1-CG1 4.2Å; V378-V437 HydrophobicContact CG1-CG2 4.41Å
379	D	93.1	Very high	94.3	Very high	70 Å²	70	62.3 Å²	62.3	37%	0.374	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.3	171.9	-68.4	-48.5	0	0	0	109.5	T354 R356	T354-D379 PolarHBondContact N-O 3.11Å; T354-D379 PolarHBondContact O-N 3.49Å; T354-D379 PolarHBondContact OG1-O 2.79Å; R356-D379 WeakPolarHBondContact CD-OD2 3.37Å; R356-D379 WeakPolarHBondContact CG-OD2 3.47Å; R356-D379 IonicContact CZ-OD1 3.92Å; R356-D379 IonicContact CZ-OD2 3.11Å; R356-D379 VanDerWaalsContact NE-CG 3.32Å; R356-D379 IonicContact NE-OD1 3.86Å; R356-D379 PolarHBondContact NE-OD1 2.76Å; R356-D379 IonicContact NE-OD2 3.01Å; R356-D379 PolarHBondContact NE-OD2 3.39Å; R356-D379 IonicContact NH2-OD1 3.77Å; R356-D379 PolarHBondContact NH2-OD1 2.83Å; R356-D379 IonicContact NH2-OD2 3.98Å
380	D	93.7	Very high	94.4	Very high	19 Å²	19	58.9 Å²	58.9	10%	0.102	30%	0.296	C	S	.	.			trans	-137.2	142.8	177.8	-166.2	-55.7	0	0	0	106.8	P353 D382 W389 N439	P353-D380 WeakPolarHBondContact CA-OD2 3.36Å; P353-D380 HydrophobicContact CB-CB 4.25Å; P353-D380 WeakPolarHBondContact CB-OD2 3.47Å; D380-D382 WeakPolarHBondContact OD1-CB 3.39Å; D380-D382 PolarHBondContact OD1-N 3Å; D380-W389 PolarHBondContact O-NE1 2.84Å; D380-N439 PolarHBondContact OD2-ND2 3.25Å
381	K	93	Very high	94.5	Very high	132 Å²	132	53.1 Å²	53.1	57%	0.574	27%	0.265	S	S	*	.			trans	-100.7	-19.4	-172.3	-53.8	-165.8	-147.4	125.2	0	114.1	R313 E314 N351	R313-K381 PolarHBondContact NH2-O 3.1Å; E314-K381 HydrophobicContact CG-CB 3.61Å; E314-K381 HydrophobicContact CG-CD 4.18Å; N351-K381 HydrophobicContact CB-CB 4.21Å; N351-K381 HydrophobicContact CB-CG 4.47Å; N351-K381 WeakPolarHBondContact OD1-CE 3.37Å; N351-K381 PolarHBondContact OD1-NZ 2.72Å
382	D	94.2	Very high	94.5	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.271	C	S	.	.	S	Bend	trans	-59.6	166.6	-177.4	-62.2	-2.8	0	0	0	110.1	N349 N351 D380 I384 N388 W389	N349-D382 WeakPolarHBondContact CA-OD2 3.44Å; N351-D382 VanDerWaalsContact CB-OD1 3.22Å; N351-D382 WeakPolarHBondContact CB-OD1 3.43Å; N351-D382 PolarHBondContact N-OD1 3.04Å; N351-D382 PolarHBondContact ND2-OD1 3.42Å; D380-D382 WeakPolarHBondContact OD1-CB 3.39Å; D380-D382 PolarHBondContact OD1-N 3Å; D382-I384 PolarHBondContact O-N 2.82Å; D382-N388 HydrophobicContact CB-CB 3.86Å; D382-N388 VanDerWaalsContact OD2-CB 3.31Å; D382-N388 WeakPolarHBondContact OD2-CB 3.43Å; D382-W389 HydrophobicContact CB-CB 4.24Å; D382-W389 VanDerWaalsContact O-CD1 3.26Å
383	L	94.4	Very high	94.5	Very high	92 Å²	92	49.9 Å²	49.9	48%	0.482	25%	0.249	S	C	.	.			trans	-56.1	112.7	-171.9	-178.4	63.8	0	0	0	112.1	D347 K385 S386 W389	D347-L383 HydrophobicContact CB-CB 3.87Å; D347-L383 HydrophobicContact CB-CD2 4.28Å; D347-L383 WeakPolarHBondContact OD1-CB 3.33Å; D347-L383 PolarHBondContact OD1-N 2.9Å; D347-L383 WeakPolarHBondContact OD2-CB 3.19Å; L383-K385 PolarHBondContact O-N 3.45Å; L383-S386 WeakPolarHBondContact O-CB 3.3Å; L383-S386 PolarHBondContact O-N 2.89Å; L383-S386 PolarHBondContact O-OG 3.16Å; L383-S386 VanDerWaalsContact O-OG 3.08Å; L383-W389 VanDerWaalsContact O-CB 3.3Å; L383-W389 WeakPolarHBondContact O-CB 3.25Å
384	I	93.6	Very high	94.4	Very high	117 Å²	117	51.2 Å²	51.2	60%	0.6	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	126.7	-176.4	-66.3	168.9	0	0	0	111.6	D382 S386 W389	D382-I384 PolarHBondContact O-N 2.82Å; I384-S386 VanDerWaalsContact C-N 3.33Å; I384-W389 HydrophobicContact CB-CD2 4.46Å; I384-W389 HydrophobicContact CG1-CZ2 4.38Å; I384-W389 HydrophobicContact CG2-CD2 4.46Å; I384-W389 HydrophobicContact CG2-CH2 4.08Å; I384-W389 HydrophobicContact CG2-CZ2 4.06Å; I384-W389 HydrophobicContact CG2-CZ3 4.35Å
385	K	91.1	Very high	94.4	Very high	146 Å²	146	51.6 Å²	51.6	64%	0.635	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	2.7	-174	-59.3	170.5	-179.8	-176.3	0	116.7	L383 W389	L383-K385 PolarHBondContact O-N 3.45Å; K385-W389 HydrophobicContact CG-CZ3 4.13Å
386	S	93.5	Very high	94.3	Very high	24 Å²	24	50.7 Å²	50.7	17%	0.168	26%	0.261	C	S	.	.	S	Bend	trans	-68.5	165.5	166.3	88.4	0	0	0	0	111.1	D347 L383 I384 N388 W389 K390	D347-S386 WeakPolarHBondContact OD2-CB 3.32Å; D347-S386 PolarHBondContact OD2-OG 2.99Å; L383-S386 WeakPolarHBondContact O-CB 3.3Å; L383-S386 PolarHBondContact O-N 2.89Å; L383-S386 PolarHBondContact O-OG 3.16Å; L383-S386 VanDerWaalsContact O-OG 3.08Å; I384-S386 VanDerWaalsContact C-N 3.33Å; S386-N388 PolarHBondContact O-N 3.26Å; S386-N388 VanDerWaalsContact OG-CB 3.28Å; S386-N388 WeakPolarHBondContact OG-CB 3.44Å; S386-N388 PolarHBondContact OG-N 3.49Å; S386-N388 VanDerWaalsContact OG-N 3.08Å; S386-W389 PolarHBondContact O-N 2.92Å; S386-W389 PolarHBondContact OG-N 3.25Å; S386-K390 VanDerWaalsContact O-CG 3.29Å; S386-K390 WeakPolarHBondContact O-CG 3.16Å; S386-K390 PolarHBondContact O-N 2.65Å; S386-K390 VanDerWaalsContact O-N 3.15Å
387	A	93.9	Very high	94.3	Very high	48 Å²	48	56.3 Å²	56.3	40%	0.397	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-15.3	172.3	0	0	0	0	0	112.6	E440 A441	A387-E440 HydrophobicContact CB-CB 4.39Å; A387-A441 HydrophobicContact CB-CB 4.25Å; A387-A441 VanDerWaalsContact O-CB 3.25Å; A387-A441 WeakPolarHBondContact O-CB 3.19Å; A387-A441 PolarHBondContact O-N 2.6Å
388	N	92.9	Very high	94.2	Very high	26 Å²	26	56 Å²	56	14%	0.139	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-58.1	172.8	-51.3	-24.2	0	0	0	108.1	D347 N349 D382 S386 K390 N439 A441	D347-N388 PolarHBondContact O-ND2 2.93Å; D347-N388 PolarHBondContact OD2-ND2 2.81Å; N349-N388 HydrophobicContact CB-CB 3.71Å; N349-N388 PolarHBondContact N-ND2 2.89Å; D382-N388 HydrophobicContact CB-CB 3.86Å; D382-N388 VanDerWaalsContact OD2-CB 3.31Å; D382-N388 WeakPolarHBondContact OD2-CB 3.43Å; S386-N388 PolarHBondContact O-N 3.26Å; S386-N388 VanDerWaalsContact OG-CB 3.28Å; S386-N388 WeakPolarHBondContact OG-CB 3.44Å; S386-N388 PolarHBondContact OG-N 3.49Å; S386-N388 VanDerWaalsContact OG-N 3.08Å; N388-K390 VanDerWaalsContact C-N 3.35Å; N388-K390 PolarHBondContact O-N 3.26Å; N388-N439 WeakPolarHBondContact O-CB 3.48Å; N388-N439 VanDerWaalsContact O-CG 3.23Å; N388-N439 PolarHBondContact O-ND2 2.86Å; N388-A441 WeakPolarHBondContact OD1-CB 3.19Å
389	W	94.4	Very high	94.2	Very high	34 Å²	34	57.1 Å²	57.1	13%	0.129	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-30.8	180	-178.7	80.6	0	0	0	116.2	D380 D382 L383 I384 K385 S386 A391 N413	D380-W389 PolarHBondContact O-NE1 2.84Å; D382-W389 HydrophobicContact CB-CB 4.24Å; D382-W389 VanDerWaalsContact O-CD1 3.26Å; L383-W389 VanDerWaalsContact O-CB 3.3Å; L383-W389 WeakPolarHBondContact O-CB 3.25Å; I384-W389 HydrophobicContact CB-CD2 4.46Å; I384-W389 HydrophobicContact CG1-CZ2 4.38Å; I384-W389 HydrophobicContact CG2-CD2 4.46Å; I384-W389 HydrophobicContact CG2-CH2 4.08Å; I384-W389 HydrophobicContact CG2-CZ2 4.06Å; I384-W389 HydrophobicContact CG2-CZ3 4.35Å; K385-W389 HydrophobicContact CG-CZ3 4.13Å; S386-W389 PolarHBondContact O-N 2.92Å; S386-W389 PolarHBondContact OG-N 3.25Å; W389-A391 PolarHBondContact O-N 2.81Å; W389-N413 HydrophobicContact CE3-CB 4.34Å; W389-N413 HydrophobicContact CH2-CB 3.49Å; W389-N413 VanDerWaalsContact CH2-CB 3.49Å; W389-N413 HydrophobicContact CZ2-CB 3.93Å; W389-N413 HydrophobicContact CZ3-CB 3.71Å; W389-N413 PolarHBondContact O-ND2 2.93Å
390	K	94.7	Very high	94.2	Very high	73 Å²	73	60.8 Å²	60.8	32%	0.317	31%	0.307	S	S	.	.			trans	-68.8	127.4	-174.3	-79	175.3	178.9	-173.1	0	113.2	S386 N388 N413 N439 E440	S386-K390 VanDerWaalsContact O-CG 3.29Å; S386-K390 WeakPolarHBondContact O-CG 3.16Å; S386-K390 PolarHBondContact O-N 2.65Å; S386-K390 VanDerWaalsContact O-N 3.15Å; N388-K390 VanDerWaalsContact C-N 3.35Å; N388-K390 PolarHBondContact O-N 3.26Å; K390-N413 WeakPolarHBondContact CA-OD1 3.12Å; K390-N439 CarbonylContact O-C 3.55Å; K390-N439 WeakPolarHBondContact O-CA 3.45Å; K390-E440 HydrophobicContact CB-CB 4.45Å; K390-E440 HydrophobicContact CB-CG 3.99Å; K390-E440 HydrophobicContact CD-CG 4.18Å; K390-E440 WeakPolarHBondContact CD-OE1 3.31Å; K390-E440 WeakPolarHBondContact CD-OE2 3.36Å; K390-E440 VanDerWaalsContact NZ-CD 3.31Å; K390-E440 IonicContact NZ-OE1 3.64Å; K390-E440 PolarHBondContact NZ-OE1 2.97Å; K390-E440 VanDerWaalsContact NZ-OE1 3.07Å; K390-E440 IonicContact NZ-OE2 2.68Å; K390-E440 PolarHBondContact NZ-OE2 2.89Å; K390-E440 PolarHBondContact O-N 2.83Å
391	A	94.8	Very high	94.1	Very high	2 Å²	2	64.1 Å²	64.1	2%	0.017	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	147.9	179.8	0	0	0	0	0	113.5	V378 W389 F393 T408 N413 V437 N438	V378-A391 HydrophobicContact CG2-CB 3.91Å; W389-A391 PolarHBondContact O-N 2.81Å; A391-F393 HydrophobicContact CB-CD2 4.27Å; A391-F393 HydrophobicContact CB-CE2 3.6Å; A391-F393 HydrophobicContact CB-CZ 4.06Å; A391-T408 HydrophobicContact CB-CG2 4.28Å; A391-T408 WeakPolarHBondContact O-CB 3.41Å; A391-T408 WeakPolarHBondContact O-CG2 3.3Å; A391-T408 PolarHBondContact O-OG1 3.03Å; A391-N413 PolarHBondContact N-OD1 2.97Å; A391-V437 HydrophobicContact CB-CG2 3.79Å; A391-N438 CarbonylContact C-O 3.58Å
392	N	94.8	Very high	94.2	Very high	81 Å²	81	59.2 Å²	59.2	43%	0.433	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	101.8	177.8	-178.5	6.4	0	0	0	108.4	N438	N392-N438 PolarHBondContact N-O 2.9Å; N392-N438 PolarHBondContact O-N 3.14Å
393	F	95.8	Very high	94.2	Very high	12 Å²	12	61 Å²	61	5%	0.053	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	141.5	-175.3	-66.4	-90.9	0	0	0	112.3	F355 V378 A391 I406 T408 G415 V437	F355-F393 HydrophobicContact CE1-CD1 4.21Å; F355-F393 AromaticContact CE1-CE1 3.79Å; F355-F393 HydrophobicContact CE1-CE1 3.79Å; F355-F393 HydrophobicContact CZ-CD1 4.4Å; F355-F393 HydrophobicContact CZ-CE1 4.32Å; V378-F393 HydrophobicContact CB-CZ 4.35Å; V378-F393 HydrophobicContact CG1-CE1 3.63Å; V378-F393 HydrophobicContact CG1-CZ 3.59Å; V378-F393 HydrophobicContact CG2-CZ 3.79Å; A391-F393 HydrophobicContact CB-CD2 4.27Å; A391-F393 HydrophobicContact CB-CE2 3.6Å; A391-F393 HydrophobicContact CB-CZ 4.06Å; F393-I406 HydrophobicContact CB-CB 4.45Å; F393-I406 HydrophobicContact CB-CD1 3.8Å; F393-I406 HydrophobicContact CB-CG1 3.81Å; F393-I406 HydrophobicContact CB-CG2 3.84Å; F393-I406 HydrophobicContact CD1-CD1 4.11Å; F393-I406 HydrophobicContact CG-CD1 4.16Å; F393-I406 HydrophobicContact CG-CG1 4.38Å; F393-T408 HydrophobicContact CD2-CG2 4.28Å; F393-T408 HydrophobicContact CE2-CG2 4.08Å; F393-G415 VanDerWaalsContact CD2-CA 3.49Å; F393-G415 VanDerWaalsContact CZ-N 3.25Å; F393-V437 HydrophobicContact CD1-CB 3.98Å; F393-V437 HydrophobicContact CD1-CG2 3.92Å; F393-V437 HydrophobicContact CD2-CG2 4.48Å; F393-V437 HydrophobicContact CE1-CB 4Å; F393-V437 HydrophobicContact CE1-CG2 3.77Å; F393-V437 HydrophobicContact CE2-CG2 4.35Å; F393-V437 HydrophobicContact CG-CG2 4.28Å; F393-V437 HydrophobicContact CZ-CG2 4Å
394	T	95.1	Very high	94.4	Very high	47 Å²	47	57 Å²	57	29%	0.288	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.1	176.2	63	0	0	0	0	110.9	I435 G436 M454	T394-I435 WeakPolarHBondContact O-CA 3.14Å; T394-G436 PolarHBondContact N-O 3.29Å; T394-G436 PolarHBondContact O-N 3.01Å; T394-G436 PolarHBondContact OG1-O 3.01Å; T394-M454 HydrophobicContact CG2-CE 3.98Å; T394-M454 WeakPolarHBondContact OG1-CE 3.08Å
395	I	96.8	Very high	94.5	Very high	39 Å²	39	57 Å²	57	20%	0.2	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.8	169.1	-52.4	173.6	0	0	0	107.2	N399 F404 I406 L417 L433 I435	I395-N399 HydrophobicContact CG2-CB 3.77Å; I395-F404 HydrophobicContact CD1-CB 3.87Å; I395-I406 HydrophobicContact CD1-CB 4.32Å; I395-I406 HydrophobicContact CD1-CG2 4.34Å; I395-I406 HydrophobicContact CG1-CB 4.16Å; I395-I406 HydrophobicContact CG1-CG2 3.77Å; I395-L417 HydrophobicContact CD1-CD1 4.06Å; I395-L433 HydrophobicContact CG2-CB 4.45Å; I395-L433 HydrophobicContact CG2-CD2 4.4Å; I395-I435 HydrophobicContact CG1-CG2 4.27Å
396	L	94.8	Very high	94.8	Very high	64 Å²	64	50.9 Å²	50.9	34%	0.335	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-32.1	-173.1	-57.6	176.4	0	0	0	112.7	E434 M454 R456	L396-E434 WeakPolarHBondContact CA-O 3.35Å; L396-E434 HydrophobicContact CB-CB 4.43Å; L396-E434 HydrophobicContact CB-CG 4.37Å; L396-E434 WeakPolarHBondContact CB-O 3.22Å; L396-E434 HydrophobicContact CD1-CG 4.4Å; L396-E434 PolarHBondContact N-O 3.37Å; L396-M454 HydrophobicContact CD1-SD 4.36Å; L396-M454 HydrophobicContact CD2-SD 4.07Å; L396-R456 HydrophobicContact CD1-CG 4.04Å
397	K	95.1	Very high	94.9	Very high	117 Å²	117	52.6 Å²	52.6	51%	0.509	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	163.3	177.8	-56.2	-176.9	-167.9	142.7	0	111.7	L433 E434	K397-L433 WeakPolarHBondContact O-CA 3.33Å; K397-E434 HydrophobicContact CB-CB 4Å; K397-E434 VanDerWaalsContact CD-OE2 3.28Å; K397-E434 WeakPolarHBondContact CD-OE2 3.1Å; K397-E434 WeakPolarHBondContact CE-OE2 3.43Å; K397-E434 HydrophobicContact CG-CB 4.31Å; K397-E434 PolarHBondContact N-O 2.86Å; K397-E434 IonicContact NZ-OE2 3.35Å; K397-E434 PolarHBondContact NZ-OE2 2.68Å; K397-E434 PolarHBondContact O-N 2.72Å; K397-E434 VanDerWaalsContact O-N 3.09Å
398	G	93.4	Very high	95	Very high	18 Å²	18	52.4 Å²	52.4	19%	0.186	27%	0.27	C	S	.	.	S	Bend	trans	87.3	8.6	174.3	0	0	0	0	0	114.1	E400 V431 L433	G398-E400 VanDerWaalsContact CA-OE2 3.25Å; G398-E400 WeakPolarHBondContact CA-OE2 3.41Å; G398-E400 PolarHBondContact N-OE1 3.12Å; G398-E400 PolarHBondContact N-OE2 2.87Å; G398-V431 WeakPolarHBondContact O-CG1 3.38Å; G398-L433 WeakPolarHBondContact O-CD2 3.43Å
399	N	95.7	Very high	95.1	Very high	38 Å²	38	52.9 Å²	52.9	20%	0.203	27%	0.273	C	S	.	.			trans	-130.7	33.3	-176.6	-168.4	29.5	0	0	0	112	I395 N401 G402 R403 F404 L433	I395-N399 HydrophobicContact CG2-CB 3.77Å; N399-N401 PolarHBondContact O-N 3.44Å; N399-G402 PolarHBondContact O-N 2.9Å; N399-G402 WeakPolarHBondContact OD1-CA 3.44Å; N399-R403 PolarHBondContact OD1-N 2.85Å; N399-F404 PolarHBondContact ND2-O 2.91Å; N399-F404 PolarHBondContact OD1-N 2.82Å; N399-L433 HydrophobicContact CB-CD2 4.32Å
400	E	92.9	Very high	94.9	Very high	148 Å²	148	56.9 Å²	56.9	69%	0.692	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-34.7	-175.8	-64.1	66.3	-144.3	0	0	111.3	G398 G402	G398-E400 VanDerWaalsContact CA-OE2 3.25Å; G398-E400 WeakPolarHBondContact CA-OE2 3.41Å; G398-E400 PolarHBondContact N-OE1 3.12Å; G398-E400 PolarHBondContact N-OE2 2.87Å; E400-G402 VanDerWaalsContact C-N 3.31Å; E400-G402 PolarHBondContact O-N 3.48Å
401	N	92.3	Very high	94.7	Very high	89 Å²	89	61.3 Å²	61.3	48%	0.476	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-3.7	176.4	-68	-5.6	0	0	0	113.5	N399 R403 K421	N399-N401 PolarHBondContact O-N 3.44Å; N401-R403 HydrophobicContact CB-CG 4.05Å; N401-K421 PolarHBondContact O-NZ 3.3Å
402	G	94.1	Very high	94.5	Very high	28 Å²	28	64.1 Å²	64.1	29%	0.289	34%	0.342	S	S	.	.			trans	59.6	46.1	-176.8	0	0	0	0	0	113.1	N399 E400 K421	N399-G402 PolarHBondContact O-N 2.9Å; N399-G402 WeakPolarHBondContact OD1-CA 3.44Å; E400-G402 VanDerWaalsContact C-N 3.31Å; E400-G402 PolarHBondContact O-N 3.48Å; G402-K421 VanDerWaalsContact O-CD 3.29Å; G402-K421 WeakPolarHBondContact O-CD 3.21Å; G402-K421 WeakPolarHBondContact O-CE 3.33Å
403	R	94.8	Very high	94.5	Very high	38 Å²	38	60.5 Å²	60.5	14%	0.143	32%	0.323	C	S	.	.			trans	-85.7	-25.3	177.6	-65.1	-164.8	-89	-137.3	6	112.6	N399 N401 V420 K421 E427	N399-R403 PolarHBondContact OD1-N 2.85Å; N401-R403 HydrophobicContact CB-CG 4.05Å; R403-V420 WeakPolarHBondContact O-CG2 3.42Å; R403-V420 PolarHBondContact O-N 2.87Å; R403-K421 HydrophobicContact CG-CB 4.31Å; R403-K421 PolarHBondContact O-N 3.14Å; R403-E427 IonicContact CZ-OE2 2.65Å; R403-E427 IonicContact NH1-OE2 3.83Å; R403-E427 PolarHBondContact NH1-OE2 2.94Å; R403-E427 IonicContact NH2-OE2 2.72Å; R403-E427 PolarHBondContact NH2-OE2 2.73Å
404	F	97.1	Very high	94.5	Very high	8 Å²	8	61.8 Å²	61.8	4%	0.035	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	155.8	-178.5	-56.4	-85.1	0	0	0	112.3	I373 I395 N399 L417 C418 V419 L423 V431 L433 V461	I373-F404 HydrophobicContact CD1-CD1 4.11Å; I373-F404 HydrophobicContact CD1-CE1 3.96Å; I395-F404 HydrophobicContact CD1-CB 3.87Å; N399-F404 PolarHBondContact ND2-O 2.91Å; N399-F404 PolarHBondContact OD1-N 2.82Å; F404-L417 HydrophobicContact CB-CD1 4.31Å; F404-C418 CarbonylContact C-O 3.25Å; F404-C418 WeakPolarHBondContact CA-O 3.41Å; F404-V419 HydrophobicContact CD1-CG2 4.05Å; F404-V419 HydrophobicContact CE1-CG2 3.89Å; F404-L423 HydrophobicContact CE1-CD1 4.01Å; F404-L423 HydrophobicContact CE2-CD2 4.31Å; F404-L423 HydrophobicContact CZ-CD1 3.77Å; F404-L423 HydrophobicContact CZ-CD2 3.97Å; F404-L423 HydrophobicContact CZ-CG 4.42Å; F404-V431 HydrophobicContact CE2-CB 4.2Å; F404-V431 HydrophobicContact CE2-CG1 3.91Å; F404-V431 HydrophobicContact CE2-CG2 4.35Å; F404-V431 HydrophobicContact CZ-CB 4.2Å; F404-V431 HydrophobicContact CZ-CG1 4.39Å; F404-V431 HydrophobicContact CZ-CG2 4.35Å; F404-L433 HydrophobicContact CB-CD1 4.27Å; F404-L433 HydrophobicContact CD1-CD1 4.19Å; F404-L433 HydrophobicContact CD2-CD1 4.19Å; F404-L433 HydrophobicContact CD2-CD2 3.78Å; F404-L433 HydrophobicContact CE2-CD2 4.05Å; F404-L433 HydrophobicContact CG-CD1 3.95Å; F404-L433 HydrophobicContact CG-CD2 4.35Å; F404-V461 HydrophobicContact CE1-CB 4.31Å; F404-V461 HydrophobicContact CE1-CG1 4.1Å; F404-V461 HydrophobicContact CE1-CG2 3.96Å; F404-V461 HydrophobicContact CZ-CB 4.33Å; F404-V461 HydrophobicContact CZ-CG1 4.35Å; F404-V461 HydrophobicContact CZ-CG2 4.3Å
405	K	96.9	Very high	94.6	Very high	116 Å²	116	59.6 Å²	59.6	50%	0.504	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	138	170.3	-176.4	-172.1	177.6	-161.5	0	108.9	T407 C418 V420	K405-T407 HydrophobicContact CD-CG2 4.49Å; K405-C418 PolarHBondContact N-O 2.86Å; K405-C418 PolarHBondContact O-N 3.04Å; K405-V420 HydrophobicContact CB-CG1 3.62Å; K405-V420 HydrophobicContact CB-CG2 4.21Å; K405-V420 HydrophobicContact CD-CG1 4.24Å
406	I	97.3	Very high	94.6	Very high	19 Å²	19	58.4 Å²	58.4	10%	0.097	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	144.3	171.1	-160.5	162.1	0	0	0	110	I376 F393 I395 V416 L417 I435	I376-I406 HydrophobicContact CD1-CD1 4.11Å; F393-I406 HydrophobicContact CB-CB 4.45Å; F393-I406 HydrophobicContact CB-CD1 3.8Å; F393-I406 HydrophobicContact CB-CG1 3.81Å; F393-I406 HydrophobicContact CB-CG2 3.84Å; F393-I406 HydrophobicContact CD1-CD1 4.11Å; F393-I406 HydrophobicContact CG-CD1 4.16Å; F393-I406 HydrophobicContact CG-CG1 4.38Å; I395-I406 HydrophobicContact CD1-CB 4.32Å; I395-I406 HydrophobicContact CD1-CG2 4.34Å; I395-I406 HydrophobicContact CG1-CB 4.16Å; I395-I406 HydrophobicContact CG1-CG2 3.77Å; I406-V416 CarbonylContact C-O 3.5Å; I406-V416 WeakPolarHBondContact CA-O 3.35Å; I406-L417 HydrophobicContact CB-CD1 4.11Å; I406-L417 HydrophobicContact CD1-CD1 4.46Å; I406-L417 HydrophobicContact CG1-CB 4.49Å; I406-L417 HydrophobicContact CG1-CD1 4.44Å; I406-I435 HydrophobicContact CD1-CD1 4.41Å; I406-I435 HydrophobicContact CD1-CG2 4.5Å
407	T	95.8	Very high	94.8	Very high	59 Å²	59	55.3 Å²	55.3	36%	0.362	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	141.4	177.6	42.5	0	0	0	0	110.5	K405 V416	K405-T407 HydrophobicContact CD-CG2 4.49Å; T407-V416 PolarHBondContact N-O 3.32Å; T407-V416 WeakPolarHBondContact O-CB 3.34Å; T407-V416 PolarHBondContact O-N 3.03Å
408	T	96.1	Very high	94.8	Very high	44 Å²	44	51.1 Å²	51.1	27%	0.27	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	134.3	173	-40	0	0	0	0	111	A391 F393	A391-T408 HydrophobicContact CB-CG2 4.28Å; A391-T408 WeakPolarHBondContact O-CB 3.41Å; A391-T408 WeakPolarHBondContact O-CG2 3.3Å; A391-T408 PolarHBondContact O-OG1 3.03Å; F393-T408 HydrophobicContact CD2-CG2 4.28Å; F393-T408 HydrophobicContact CE2-CG2 4.08Å
409	D	95.1	Very high	95	Very high	37 Å²	37	50.3 Å²	50.3	20%	0.198	27%	0.27	C	S	.	.			trans	-73.6	120.9	163.1	-170.8	-52.9	0	0	0	110	R375 E411 T412 N413 E414 V416	R375-D409 IonicContact CZ-OD2 3.61Å; R375-D409 IonicContact NH2-OD2 3.8Å; R375-D409 PolarHBondContact NH2-OD2 2.81Å; D409-E411 VanDerWaalsContact C-N 3.29Å; D409-E411 PolarHBondContact O-N 2.69Å; D409-E411 PolarHBondContact OD1-N 2.78Å; D409-T412 PolarHBondContact OD1-N 2.91Å; D409-T412 VanDerWaalsContact OD1-N 3.12Å; D409-N413 WeakPolarHBondContact O-CA 3.44Å; D409-N413 PolarHBondContact O-N 2.92Å; D409-E414 PolarHBondContact N-O 2.63Å; D409-V416 HydrophobicContact CB-CG2 3.98Å
410	P	90.4	Very high	95	Very high	118 Å²	118	51 Å²	51	77%	0.766	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-12.1	-176	32.2	-36.6	0	0	0	114.2
411	E	88.9	Confident	95.1	Very high	166 Å²	166	49 Å²	49	78%	0.776	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-39	176.5	-61.2	-156.8	148.5	0	0	112.1	D409	D409-E411 VanDerWaalsContact C-N 3.29Å; D409-E411 PolarHBondContact O-N 2.69Å; D409-E411 PolarHBondContact OD1-N 2.78Å
412	T	92.4	Very high	95.1	Very high	61 Å²	61	47.7 Å²	47.7	37%	0.374	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-9.5	-176.6	73.1	0	0	0	0	115.4	R375 D409 E414	R375-T412 PolarHBondContact NH2-OG1 3.04Å; D409-T412 PolarHBondContact OD1-N 2.91Å; D409-T412 VanDerWaalsContact OD1-N 3.12Å; T412-E414 WeakPolarHBondContact CB-OE2 3.38Å; T412-E414 PolarHBondContact O-N 3.16Å; T412-E414 WeakPolarHBondContact OG1-CG 3.25Å; T412-E414 PolarHBondContact OG1-OE2 2.81Å
413	N	94.7	Very high	95	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.027	25%	0.248	C	C	.	.			trans	66	10.8	-175.6	-147.8	31.1	0	0	0	114.9	W389 K390 A391 D409	W389-N413 HydrophobicContact CE3-CB 4.34Å; W389-N413 HydrophobicContact CH2-CB 3.49Å; W389-N413 VanDerWaalsContact CH2-CB 3.49Å; W389-N413 HydrophobicContact CZ2-CB 3.93Å; W389-N413 HydrophobicContact CZ3-CB 3.71Å; W389-N413 PolarHBondContact O-ND2 2.93Å; K390-N413 WeakPolarHBondContact CA-OD1 3.12Å; A391-N413 PolarHBondContact N-OD1 2.97Å; D409-N413 WeakPolarHBondContact O-CA 3.44Å; D409-N413 PolarHBondContact O-N 2.92Å
414	E	95.9	Very high	94.9	Very high	39 Å²	39	47.2 Å²	47.2	18%	0.182	26%	0.255	C	S	.	.			trans	-84.4	145.9	-175.4	-62.2	173.1	101.5	0	0	111.9	R375 I376 P377 D409 T412 V416	R375-E414 IonicContact CZ-OE2 2.93Å; R375-E414 VanDerWaalsContact CZ-OE2 3.32Å; R375-E414 IonicContact NH1-OE1 3.85Å; R375-E414 IonicContact NH1-OE2 3.44Å; R375-E414 PolarHBondContact NH1-OE2 3.34Å; R375-E414 IonicContact NH2-OE2 2.63Å; R375-E414 PolarHBondContact NH2-OE2 3Å; I376-E414 WeakPolarHBondContact O-CA 3.45Å; P377-E414 HydrophobicContact CB-CG 4.37Å; D409-E414 PolarHBondContact N-O 2.63Å; T412-E414 WeakPolarHBondContact CB-OE2 3.38Å; T412-E414 PolarHBondContact O-N 3.16Å; T412-E414 WeakPolarHBondContact OG1-CG 3.25Å; T412-E414 PolarHBondContact OG1-OE2 2.81Å; E414-V416 PolarHBondContact O-N 3.4Å
415	G	96.2	Very high	94.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	102.3	177.2	0	0	0	0	0	110.9	I376 F393 L417	I376-G415 WeakPolarHBondContact CB-O 3.09Å; I376-G415 WeakPolarHBondContact CG1-O 3.36Å; I376-G415 PolarHBondContact N-O 3.12Å; I376-G415 PolarHBondContact O-N 3.25Å; F393-G415 VanDerWaalsContact CD2-CA 3.49Å; F393-G415 VanDerWaalsContact CZ-N 3.25Å; G415-L417 PolarHBondContact O-N 2.82Å
416	V	97.3	Very high	94.4	Very high	14 Å²	14	45.9 Å²	45.9	9%	0.085	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	112.8	177.5	-173.2	0	0	0	0	109	E372 R375 I406 T407 D409 E414	E372-V416 HydrophobicContact CG-CG1 3.7Å; E372-V416 VanDerWaalsContact OE2-CG1 3.3Å; E372-V416 WeakPolarHBondContact OE2-CG1 3.44Å; R375-V416 HydrophobicContact CG-CG2 4.47Å; I406-V416 CarbonylContact C-O 3.5Å; I406-V416 WeakPolarHBondContact CA-O 3.35Å; T407-V416 PolarHBondContact N-O 3.32Å; T407-V416 WeakPolarHBondContact O-CB 3.34Å; T407-V416 PolarHBondContact O-N 3.03Å; D409-V416 HydrophobicContact CB-CG2 3.98Å; E414-V416 PolarHBondContact O-N 3.4Å
417	L	97.6	Very high	94	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	124	178.6	-178.1	68.8	0	0	0	109.9	I373 L374 I395 F404 I406 G415 L433 V459	I373-L417 HydrophobicContact CD1-CD2 3.89Å; I373-L417 HydrophobicContact CD1-CG 4.09Å; I373-L417 HydrophobicContact CG1-CB 4.4Å; I373-L417 HydrophobicContact CG1-CD2 4.12Å; I373-L417 HydrophobicContact CG1-CG 4Å; I373-L417 VanDerWaalsContact CG1-O 3.32Å; I373-L417 WeakPolarHBondContact CG1-O 3.12Å; I373-L417 PolarHBondContact N-O 2.83Å; L374-L417 HydrophobicContact CB-CB 4.32Å; L374-L417 HydrophobicContact CB-CD2 4.49Å; L374-L417 PolarHBondContact N-O 2.93Å; L374-L417 PolarHBondContact O-N 2.87Å; I395-L417 HydrophobicContact CD1-CD1 4.06Å; F404-L417 HydrophobicContact CB-CD1 4.31Å; I406-L417 HydrophobicContact CB-CD1 4.11Å; I406-L417 HydrophobicContact CD1-CD1 4.46Å; I406-L417 HydrophobicContact CG1-CB 4.49Å; I406-L417 HydrophobicContact CG1-CD1 4.44Å; G415-L417 PolarHBondContact O-N 2.82Å; L417-L433 HydrophobicContact CD1-CD1 4.09Å; L417-L433 HydrophobicContact CD2-CD1 3.97Å; L417-V459 HydrophobicContact CD2-CG1 3.93Å
418	C	96.9	Very high	93.7	Very high	28 Å²	28	50 Å²	50	19%	0.189	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150.5	-178.6	-58	0	0	0	0	112.1	V371 F404 K405	V371-C418 CarbonylContact O-C 3.57Å; V371-C418 WeakPolarHBondContact O-CA 3.41Å; V371-C418 WeakPolarHBondContact O-CB 3.29Å; F404-C418 CarbonylContact C-O 3.25Å; F404-C418 WeakPolarHBondContact CA-O 3.41Å; K405-C418 PolarHBondContact N-O 2.86Å; K405-C418 PolarHBondContact O-N 3.04Å
419	V	96.6	Very high	93.5	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.2	166.7	178.1	0	0	0	0	108.5	V364 T368 N370 V371 I373 F404 K421 L423	V364-V419 HydrophobicContact CG1-CG2 4.4Å; V364-V419 HydrophobicContact CG2-CG2 4.24Å; T368-V419 WeakPolarHBondContact O-CG1 3.18Å; N370-V419 VanDerWaalsContact CA-O 3.31Å; N370-V419 WeakPolarHBondContact CA-O 3.4Å; N370-V419 PolarHBondContact N-O 3.41Å; V371-V419 HydrophobicContact CG2-CB 4.09Å; V371-V419 PolarHBondContact O-N 2.86Å; I373-V419 HydrophobicContact CD1-CG2 3.97Å; I373-V419 HydrophobicContact CG1-CG2 4.44Å; I373-V419 HydrophobicContact CG2-CG2 3.79Å; F404-V419 HydrophobicContact CD1-CG2 4.05Å; F404-V419 HydrophobicContact CE1-CG2 3.89Å; V419-K421 WeakPolarHBondContact CG1-O 3.34Å; V419-L423 HydrophobicContact CG1-CD1 4.41Å; V419-L423 HydrophobicContact CG2-CD1 4.24Å
420	V	95.6	Very high	93.5	Very high	52 Å²	52	56.7 Å²	56.7	32%	0.315	29%	0.292	S	S	.	.			trans	-116.2	-8.2	-176.4	-65.5	0	0	0	0	113.8	R403 K405	R403-V420 WeakPolarHBondContact O-CG2 3.42Å; R403-V420 PolarHBondContact O-N 2.87Å; K405-V420 HydrophobicContact CB-CG1 3.62Å; K405-V420 HydrophobicContact CB-CG2 4.21Å; K405-V420 HydrophobicContact CD-CG1 4.24Å
421	K	94.3	Very high	93.7	Very high	107 Å²	107	51.9 Å²	51.9	47%	0.465	26%	0.26	S	S	.	.	S	Bend	trans	-138.3	146.9	164.6	-57	178.3	-173	171.9	0	107.7	N401 G402 R403 V419	N401-K421 PolarHBondContact O-NZ 3.3Å; G402-K421 VanDerWaalsContact O-CD 3.29Å; G402-K421 WeakPolarHBondContact O-CD 3.21Å; G402-K421 WeakPolarHBondContact O-CE 3.33Å; R403-K421 HydrophobicContact CG-CB 4.31Å; R403-K421 PolarHBondContact O-N 3.14Å; V419-K421 WeakPolarHBondContact CG1-O 3.34Å
422	P	92.9	Very high	94	Very high	61 Å²	61	47.2 Å²	47.2	40%	0.396	24%	0.243	S	C	.	.			trans	-54.2	150.9	177.7	23.4	-34.7	0	0	0	112.8
423	L	92.9	Very high	94.3	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.016	23%	0.226	C	C	.	.			trans	-98.3	160.9	164.2	-69.8	152.7	0	0	0	108.5	V364 N367 F404 V419 V431 V463	V364-L423 HydrophobicContact CG1-CD1 3.61Å; N367-L423 PolarHBondContact N-O 3.3Å; F404-L423 HydrophobicContact CE1-CD1 4.01Å; F404-L423 HydrophobicContact CE2-CD2 4.31Å; F404-L423 HydrophobicContact CZ-CD1 3.77Å; F404-L423 HydrophobicContact CZ-CD2 3.97Å; F404-L423 HydrophobicContact CZ-CG 4.42Å; V419-L423 HydrophobicContact CG1-CD1 4.41Å; V419-L423 HydrophobicContact CG2-CD1 4.24Å; L423-V431 HydrophobicContact CD2-CG2 4.1Å; L423-V463 HydrophobicContact CB-CG1 4.29Å; L423-V463 HydrophobicContact CB-CG2 4.06Å; L423-V463 HydrophobicContact CD1-CG2 4.18Å; L423-V463 HydrophobicContact CD2-CG2 4.41Å; L423-V463 HydrophobicContact CG-CG2 4.44Å
424	D	91.9	Very high	94.3	Very high	54 Å²	54	45.6 Å²	45.6	29%	0.289	23%	0.231	S	C	.	.			trans	-135.3	112.9	-172.7	169.5	-35.8	0	0	0	104	E426 E427 N428	D424-E426 WeakPolarHBondContact OD1-CB 3.49Å; D424-E426 PolarHBondContact OD1-N 2.81Å; D424-E427 HydrophobicContact CB-CB 4.13Å; D424-E427 VanDerWaalsContact OD1-CB 3.28Å; D424-E427 WeakPolarHBondContact OD1-CB 3.4Å; D424-E427 PolarHBondContact OD1-N 2.78Å; D424-N428 PolarHBondContact O-N 2.74Å
425	Y	92.7	Very high	94.3	Very high	56 Å²	56	43.7 Å²	43.7	22%	0.22	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-43.6	-174.1	179	-102.9	0	0	0	110.1	E366 E427 N428 H429 V463 D465	E366-Y425 VanDerWaalsContact CD-CB 3.44Å; E366-Y425 VanDerWaalsContact OE1-CB 3.25Å; E366-Y425 WeakPolarHBondContact OE1-CB 3.23Å; E366-Y425 VanDerWaalsContact OE2-CB 3.23Å; E366-Y425 WeakPolarHBondContact OE2-CB 3.31Å; E366-Y425 PolarHBondContact OE2-N 3.49Å; Y425-E427 PolarHBondContact O-N 3.07Å; Y425-E427 VanDerWaalsContact O-N 3.16Å; Y425-N428 CarbonylContact O-C 3.6Å; Y425-N428 PolarHBondContact O-N 2.87Å; Y425-H429 AromaticContact CD1-CD2 3.76Å; Y425-H429 HydrophobicContact CD2-CB 4.08Å; Y425-H429 AromaticContact CD2-CD2 3.78Å; Y425-H429 AromaticContact CE1-CD2 3.53Å; Y425-H429 AromaticContact CE1-NE2 3.91Å; Y425-H429 HydrophobicContact CE2-CB 3.69Å; Y425-H429 AromaticContact CE2-CD2 3.54Å; Y425-H429 AromaticContact CE2-CG 3.82Å; Y425-H429 AromaticContact CG-CD2 3.87Å; Y425-H429 AromaticContact CZ-CD2 3.41Å; Y425-H429 VanDerWaalsContact CZ-CD2 3.41Å; Y425-H429 AromaticContact CZ-CG 3.93Å; Y425-H429 PolarHBondContact O-CD2 3.09Å; Y425-H429 PolarHBondContact O-N 2.91Å; Y425-V463 HydrophobicContact CD2-CB 4.04Å; Y425-V463 HydrophobicContact CD2-CG1 4.03Å; Y425-V463 WeakPolarHBondContact CD2-O 3.48Å; Y425-V463 WeakPolarHBondContact CE2-O 3.44Å; Y425-V463 HydrophobicContact CG-CG1 4.47Å; Y425-D465 HydrophobicContact CD1-CB 3.91Å; Y425-D465 HydrophobicContact CD2-CB 4.39Å; Y425-D465 HydrophobicContact CE1-CB 3.75Å; Y425-D465 HydrophobicContact CE2-CB 4.26Å; Y425-D465 HydrophobicContact CG-CB 4.24Å
426	E	89.9	Confident	94.3	Very high	39 Å²	39	43.7 Å²	43.7	18%	0.182	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-28.2	175.8	-82.6	28.7	-100.8	0	0	114.2	D424 P499 K502	D424-E426 WeakPolarHBondContact OD1-CB 3.49Å; D424-E426 PolarHBondContact OD1-N 2.81Å; E426-P499 HydrophobicContact CG-CB 3.89Å; E426-P499 WeakPolarHBondContact CG-O 3.42Å; E426-K502 PolarHBondContact O-NZ 2.85Å; E426-K502 IonicContact OE1-NZ 2.72Å
427	E	89.3	Confident	94.1	Very high	102 Å²	102	43.1 Å²	43.1	48%	0.477	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-49.9	168.8	-164.6	-155.8	-140.3	0	0	112	R403 D424 Y425	R403-E427 IonicContact CZ-OE2 2.65Å; R403-E427 IonicContact NH1-OE2 3.83Å; R403-E427 PolarHBondContact NH1-OE2 2.94Å; R403-E427 IonicContact NH2-OE2 2.72Å; R403-E427 PolarHBondContact NH2-OE2 2.73Å; D424-E427 HydrophobicContact CB-CB 4.13Å; D424-E427 VanDerWaalsContact OD1-CB 3.28Å; D424-E427 WeakPolarHBondContact OD1-CB 3.4Å; D424-E427 PolarHBondContact OD1-N 2.78Å; Y425-E427 PolarHBondContact O-N 3.07Å; Y425-E427 VanDerWaalsContact O-N 3.16Å
428	N	89.2	Confident	93.9	Very high	62 Å²	62	45.7 Å²	45.7	33%	0.332	23%	0.233	S	C	.	.			trans	-150.2	95.4	-171.5	-75.1	-77	0	0	0	114.3	D424 Y425 Q430 V463	D424-N428 PolarHBondContact O-N 2.74Å; Y425-N428 CarbonylContact O-C 3.6Å; Y425-N428 PolarHBondContact O-N 2.87Å; N428-Q430 PolarHBondContact O-N 3.23Å; N428-V463 VanDerWaalsContact O-CG2 3.25Å; N428-V463 WeakPolarHBondContact O-CG2 3.42Å
429	H	93.2	Very high	93.7	Very high	112 Å²	112	44.9 Å²	44.9	52%	0.519	23%	0.226	S	C	.	.	S	Bend	trans	-56.9	-20.3	174.3	-43.5	145.4	0	0	0	115.4	Y425 V463	Y425-H429 AromaticContact CD1-CD2 3.76Å; Y425-H429 HydrophobicContact CD2-CB 4.08Å; Y425-H429 AromaticContact CD2-CD2 3.78Å; Y425-H429 AromaticContact CE1-CD2 3.53Å; Y425-H429 AromaticContact CE1-NE2 3.91Å; Y425-H429 HydrophobicContact CE2-CB 3.69Å; Y425-H429 AromaticContact CE2-CD2 3.54Å; Y425-H429 AromaticContact CE2-CG 3.82Å; Y425-H429 AromaticContact CG-CD2 3.87Å; Y425-H429 AromaticContact CZ-CD2 3.41Å; Y425-H429 VanDerWaalsContact CZ-CD2 3.41Å; Y425-H429 AromaticContact CZ-CG 3.93Å; Y425-H429 PolarHBondContact O-CD2 3.09Å; Y425-H429 PolarHBondContact O-N 2.91Å; H429-V463 PolarHBondContact O-N 2.67Å
430	Q	94.1	Very high	93.4	Very high	111 Å²	111	50 Å²	50	52%	0.519	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	149.9	177.6	66.6	179.2	17.1	0	0	112.3	N428 V461	N428-Q430 PolarHBondContact O-N 3.23Å; Q430-V461 CarbonylContact C-O 3.6Å; Q430-V461 WeakPolarHBondContact CA-O 3.32Å
431	V	94.8	Very high	93.2	Very high	17 Å²	17	48.6 Å²	48.6	10%	0.103	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.3	172.6	-173.7	0	0	0	0	110	G398 F404 L423 L433 V461	G398-V431 WeakPolarHBondContact O-CG1 3.38Å; F404-V431 HydrophobicContact CE2-CB 4.2Å; F404-V431 HydrophobicContact CE2-CG1 3.91Å; F404-V431 HydrophobicContact CE2-CG2 4.35Å; F404-V431 HydrophobicContact CZ-CB 4.2Å; F404-V431 HydrophobicContact CZ-CG1 4.39Å; F404-V431 HydrophobicContact CZ-CG2 4.35Å; L423-V431 HydrophobicContact CD2-CG2 4.1Å; V431-L433 HydrophobicContact CG1-CD2 3.98Å; V431-V461 PolarHBondContact N-O 3.22Å; V431-V461 PolarHBondContact O-N 3.43Å
432	T	96.4	Very high	92.9	Very high	68 Å²	68	48.8 Å²	48.8	42%	0.417	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	117.5	172.8	-49.7	0	0	0	0	109.8	L458 V459	T432-L458 HydrophobicContact CG2-CB 4.49Å; T432-L458 HydrophobicContact CG2-CD2 4.49Å; T432-V459 WeakPolarHBondContact CA-O 3.48Å
433	L	96.9	Very high	92.6	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	139.8	174.1	-52.3	178.4	0	0	0	110	I395 K397 G398 N399 F404 L417 V431 I435 L458 V459 V461	I395-L433 HydrophobicContact CG2-CB 4.45Å; I395-L433 HydrophobicContact CG2-CD2 4.4Å; K397-L433 WeakPolarHBondContact O-CA 3.33Å; G398-L433 WeakPolarHBondContact O-CD2 3.43Å; N399-L433 HydrophobicContact CB-CD2 4.32Å; F404-L433 HydrophobicContact CB-CD1 4.27Å; F404-L433 HydrophobicContact CD1-CD1 4.19Å; F404-L433 HydrophobicContact CD2-CD1 4.19Å; F404-L433 HydrophobicContact CD2-CD2 3.78Å; F404-L433 HydrophobicContact CE2-CD2 4.05Å; F404-L433 HydrophobicContact CG-CD1 3.95Å; F404-L433 HydrophobicContact CG-CD2 4.35Å; L417-L433 HydrophobicContact CD1-CD1 4.09Å; L417-L433 HydrophobicContact CD2-CD1 3.97Å; V431-L433 HydrophobicContact CG1-CD2 3.98Å; L433-I435 HydrophobicContact CB-CG2 4.34Å; L433-L458 CarbonylContact O-C 3.57Å; L433-L458 WeakPolarHBondContact O-CA 3.43Å; L433-V459 HydrophobicContact CB-CB 4.29Å; L433-V459 PolarHBondContact N-O 2.82Å; L433-V459 PolarHBondContact O-N 2.79Å; L433-V461 HydrophobicContact CD1-CG2 4.4Å
434	E	96.4	Very high	92	Very high	31 Å²	31	51.9 Å²	51.9	15%	0.145	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	118.9	160.8	-171.9	-179.7	154.4	0	0	107.3	L396 K397 R456 L458	L396-E434 WeakPolarHBondContact CA-O 3.35Å; L396-E434 HydrophobicContact CB-CB 4.43Å; L396-E434 HydrophobicContact CB-CG 4.37Å; L396-E434 WeakPolarHBondContact CB-O 3.22Å; L396-E434 HydrophobicContact CD1-CG 4.4Å; L396-E434 PolarHBondContact N-O 3.37Å; K397-E434 HydrophobicContact CB-CB 4Å; K397-E434 VanDerWaalsContact CD-OE2 3.28Å; K397-E434 WeakPolarHBondContact CD-OE2 3.1Å; K397-E434 WeakPolarHBondContact CE-OE2 3.43Å; K397-E434 HydrophobicContact CG-CB 4.31Å; K397-E434 PolarHBondContact N-O 2.86Å; K397-E434 IonicContact NZ-OE2 3.35Å; K397-E434 PolarHBondContact NZ-OE2 2.68Å; K397-E434 PolarHBondContact O-N 2.72Å; K397-E434 VanDerWaalsContact O-N 3.09Å; E434-R456 WeakPolarHBondContact OE1-CD 3.5Å; E434-R456 IonicContact OE1-CZ 2.78Å; E434-R456 IonicContact OE1-NE 3.07Å; E434-R456 IonicContact OE1-NH1 3.32Å; E434-R456 PolarHBondContact OE1-NH1 2.8Å; E434-L458 HydrophobicContact CB-CD2 4.13Å; E434-L458 HydrophobicContact CG-CD2 4.21Å
435	I	96.3	Very high	90.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	154.4	177.6	63.8	167.5	0	0	0	110.7	F355 I376 T394 I395 I406 L433 R456 A457 V459	F355-I435 HydrophobicContact CE1-CD1 3.56Å; F355-I435 HydrophobicContact CE1-CG1 4.2Å; F355-I435 HydrophobicContact CZ-CD1 3.69Å; F355-I435 HydrophobicContact CZ-CG1 3.83Å; I376-I435 HydrophobicContact CD1-CD1 3.45Å; I376-I435 VanDerWaalsContact CD1-CD1 3.45Å; I376-I435 HydrophobicContact CG2-CD1 4.33Å; T394-I435 WeakPolarHBondContact O-CA 3.14Å; I395-I435 HydrophobicContact CG1-CG2 4.27Å; I406-I435 HydrophobicContact CD1-CD1 4.41Å; I406-I435 HydrophobicContact CD1-CG2 4.5Å; L433-I435 HydrophobicContact CB-CG2 4.34Å; I435-R456 VanDerWaalsContact O-CA 3.25Å; I435-R456 WeakPolarHBondContact O-CA 3.36Å; I435-R456 WeakPolarHBondContact O-CB 3.46Å; I435-A457 HydrophobicContact CD1-CB 4.38Å; I435-A457 HydrophobicContact CG1-CB 4.09Å; I435-A457 WeakPolarHBondContact CG1-O 3.36Å; I435-A457 PolarHBondContact N-O 3.46Å; I435-A457 PolarHBondContact O-N 2.83Å; I435-A457 VanDerWaalsContact O-N 3.11Å; I435-V459 HydrophobicContact CD1-CG2 3.7Å; I435-V459 HydrophobicContact CG1-CG2 4.05Å; I435-V459 HydrophobicContact CG2-CG2 4.23Å
436	G	94.3	Very high	89	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.7	173.8	0	0	0	0	0	112.3	T394 N455	T394-G436 PolarHBondContact N-O 3.29Å; T394-G436 PolarHBondContact O-N 3.01Å; T394-G436 PolarHBondContact OG1-O 3.01Å; G436-N455 WeakPolarHBondContact CA-O 3.31Å
437	V	94.3	Very high	87	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	134.2	177	67.8	0	0	0	0	111.1	P353 F355 V378 A391 F393 M454 N455	P353-V437 HydrophobicContact CB-CG1 4.31Å; P353-V437 HydrophobicContact CB-CG2 4.21Å; P353-V437 HydrophobicContact CG-CG1 4.17Å; P353-V437 HydrophobicContact CG-CG2 3.95Å; F355-V437 HydrophobicContact CD2-CG1 4.02Å; F355-V437 HydrophobicContact CE1-CB 4.44Å; F355-V437 HydrophobicContact CE1-CG1 4.24Å; F355-V437 HydrophobicContact CE2-CB 4.14Å; F355-V437 HydrophobicContact CE2-CG1 3.53Å; F355-V437 HydrophobicContact CZ-CB 3.82Å; F355-V437 HydrophobicContact CZ-CG1 3.65Å; V378-V437 HydrophobicContact CG1-CG1 4.2Å; V378-V437 HydrophobicContact CG1-CG2 4.41Å; A391-V437 HydrophobicContact CB-CG2 3.79Å; F393-V437 HydrophobicContact CD1-CB 3.98Å; F393-V437 HydrophobicContact CD1-CG2 3.92Å; F393-V437 HydrophobicContact CD2-CG2 4.48Å; F393-V437 HydrophobicContact CE1-CB 4Å; F393-V437 HydrophobicContact CE1-CG2 3.77Å; F393-V437 HydrophobicContact CE2-CG2 4.35Å; F393-V437 HydrophobicContact CG-CG2 4.28Å; F393-V437 HydrophobicContact CZ-CG2 4Å; V437-M454 WeakPolarHBondContact O-CG 3.2Å; V437-N455 HydrophobicContact CG1-CB 4.2Å; V437-N455 PolarHBondContact N-O 2.87Å; V437-N455 PolarHBondContact O-N 3.3Å
438	N	92.8	Very high	84.9	Confident	55 Å²	55	61.5 Å²	61.5	29%	0.294	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	176.9	167.9	-75.6	-19.7	0	0	0	107.9	A391 N392 T453 M454	A391-N438 CarbonylContact C-O 3.58Å; N392-N438 PolarHBondContact N-O 2.9Å; N392-N438 PolarHBondContact O-N 3.14Å; N438-T453 PolarHBondContact OD1-O 2.86Å; N438-M454 HydrophobicContact CB-CE 4.17Å; N438-M454 WeakPolarHBondContact OD1-CA 3.38Å; N438-M454 WeakPolarHBondContact OD1-CB 3.13Å; N438-M454 VanDerWaalsContact OD1-CG 3.31Å; N438-M454 WeakPolarHBondContact OD1-CG 3.31Å
439	N	92.7	Very high	82.9	Confident	10 Å²	10	62.1 Å²	62.1	5%	0.053	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	174.5	169.8	-44.2	87.2	0	0	0	112.5	N349 P353 D380 N388 K390 A441	N349-N439 VanDerWaalsContact ND2-CB 3.31Å; N349-N439 WeakPolarHBondContact ND2-CB 3.47Å; N349-N439 PolarHBondContact ND2-OD1 3Å; N349-N439 VanDerWaalsContact ND2-OD1 3.13Å; P353-N439 WeakPolarHBondContact CD-ND2 3.25Å; P353-N439 VanDerWaalsContact CD-OD1 3.31Å; P353-N439 WeakPolarHBondContact CD-OD1 3.33Å; D380-N439 PolarHBondContact OD2-ND2 3.25Å; N388-N439 WeakPolarHBondContact O-CB 3.48Å; N388-N439 VanDerWaalsContact O-CG 3.23Å; N388-N439 PolarHBondContact O-ND2 2.86Å; K390-N439 CarbonylContact O-C 3.55Å; K390-N439 WeakPolarHBondContact O-CA 3.45Å; N439-A441 WeakPolarHBondContact CB-O 3.19Å
440	E	91.5	Very high	80.8	Confident	110 Å²	110	68.5 Å²	68.5	51%	0.514	37%	0.367	S	S	.	.	S	Bend	trans	-67.8	-41.1	161.7	-76.5	-173.9	175.4	0	0	111.1	A387 K390	A387-E440 HydrophobicContact CB-CB 4.39Å; K390-E440 HydrophobicContact CB-CB 4.45Å; K390-E440 HydrophobicContact CB-CG 3.99Å; K390-E440 HydrophobicContact CD-CG 4.18Å; K390-E440 WeakPolarHBondContact CD-OE1 3.31Å; K390-E440 WeakPolarHBondContact CD-OE2 3.36Å; K390-E440 VanDerWaalsContact NZ-CD 3.31Å; K390-E440 IonicContact NZ-OE1 3.64Å; K390-E440 PolarHBondContact NZ-OE1 2.97Å; K390-E440 VanDerWaalsContact NZ-OE1 3.07Å; K390-E440 IonicContact NZ-OE2 2.68Å; K390-E440 PolarHBondContact NZ-OE2 2.89Å; K390-E440 PolarHBondContact O-N 2.83Å
441	A	90.3	Very high	78.8	Confident	21 Å²	21	67.8 Å²	67.8	17%	0.174	37%	0.37	C	S	.	.	S	Bend	trans	-82.8	157.2	176.7	0	0	0	0	0	113	N349 A387 N388 N439	N349-A441 HydrophobicContact CB-CB 4.45Å; N349-A441 PolarHBondContact ND2-O 2.65Å; A387-A441 HydrophobicContact CB-CB 4.25Å; A387-A441 VanDerWaalsContact O-CB 3.25Å; A387-A441 WeakPolarHBondContact O-CB 3.19Å; A387-A441 PolarHBondContact O-N 2.6Å; N388-A441 WeakPolarHBondContact OD1-CB 3.19Å; N439-A441 WeakPolarHBondContact CB-O 3.19Å
442	P	88.4	Confident	76.8	Confident	111 Å²	111	71.7 Å²	71.7	72%	0.721	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-77.2	126.9	172.4	30.9	-33.1	0	0	0	111.8	I444	P442-I444 PolarHBondContact O-N 2.84Å
443	L	86.3	Confident	75.3	Confident	44 Å²	44	72.7 Å²	72.7	23%	0.23	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-57	117.4	174.2	-178.3	72.6	0	0	0	112.2	N349 D350 A352 R445	N349-L443 WeakPolarHBondContact OD1-CA 3.28Å; N349-L443 WeakPolarHBondContact OD1-CD1 3.4Å; D350-L443 WeakPolarHBondContact O-CD1 3.28Å; A352-L443 HydrophobicContact CB-CD1 4.23Å; A352-L443 HydrophobicContact CB-CD2 4.08Å; L443-R445 HydrophobicContact CD2-CG 3.97Å; L443-R445 VanDerWaalsContact CD2-NE 3.31Å; L443-R445 HydrophobicContact CG-CG 4.01Å; L443-R445 PolarHBondContact O-N 3.15Å
444	I	80.8	Confident	74.4	Confident	85 Å²	85	74 Å²	74	44%	0.436	41%	0.408	S	S	.	.			trans	-79.2	98.6	178	-59.7	173.2	0	0	0	108.1	N349 P442	N349-I444 WeakPolarHBondContact O-CA 3.31Å; N349-I444 VanDerWaalsContact O-CB 3.31Å; N349-I444 WeakPolarHBondContact O-CB 3.39Å; N349-I444 PolarHBondContact O-N 2.65Å; P442-I444 PolarHBondContact O-N 2.84Å
445	R	67.6	Low	73.9	Confident	91 Å²	91	75.4 Å²	75.4	34%	0.343	42%	0.416	S	S	.	.			trans	-96	135.6	-179	-72.3	-167.2	168	-171.3	1.5	113.2	L443 S449 V451 P452	L443-R445 HydrophobicContact CD2-CG 3.97Å; L443-R445 VanDerWaalsContact CD2-NE 3.31Å; L443-R445 HydrophobicContact CG-CG 4.01Å; L443-R445 PolarHBondContact O-N 3.15Å; R445-S449 PolarHBondContact NH1-O 2.79Å; R445-V451 PolarHBondContact NH1-O 2.87Å; R445-P452 PolarHBondContact NH2-O 2.68Å
446	D	53	Low	73.8	Confident	138 Å²	138	81 Å²	81	74%	0.738	44%	0.437	S	S	*	.			trans	-66.4	146.7	154.1	-161.3	3.9	0	0	0	110.5	A448	D446-A448 PolarHBondContact O-N 2.75Å
447	V	48.7	Very low	73.8	Confident	137 Å²	137	81.1 Å²	81.1	83%	0.83	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-8.4	-153.7	-178.4	0	0	0	0	113.7
448	A	44.7	Very low	73.9	Confident	87 Å²	87	85.2 Å²	85.2	72%	0.719	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-33.3	-174.2	0	0	0	0	0	115.2	D446 R450	D446-A448 PolarHBondContact O-N 2.75Å; A448-R450 PolarHBondContact O-N 2.91Å; A448-R450 VanDerWaalsContact O-N 3.15Å
449	S	48	Very low	74.1	Confident	75 Å²	75	82.6 Å²	82.6	52%	0.524	45%	0.446	S	S	.	.			trans	-88.1	89	-162.3	-75.2	0	0	0	0	114.5	R445 V451	R445-S449 PolarHBondContact NH1-O 2.79Å; S449-V451 PolarHBondContact O-N 2.87Å; S449-V451 VanDerWaalsContact O-N 3.12Å
450	R	49.7	Very low	74.3	Confident	247 Å²	247	83.3 Å²	83.3	93%	0.932	45%	0.451	S	S	*	.			trans	-76.2	22.8	174.5	-62.5	-172.2	177.3	-166.9	-0	115.5	A448	A448-R450 PolarHBondContact O-N 2.91Å; A448-R450 VanDerWaalsContact O-N 3.15Å
451	V	51	Low	74.6	Confident	96 Å²	96	78.1 Å²	78.1	58%	0.582	43%	0.426	S	S	*	.	S	Bend	trans	-84	144.1	178.4	-178.6	0	0	0	0	109.1	R445 S449	R445-V451 PolarHBondContact NH1-O 2.87Å; S449-V451 PolarHBondContact O-N 2.87Å; S449-V451 VanDerWaalsContact O-N 3.12Å
452	P	53.6	Low	74.8	Confident	98 Å²	98	80.2 Å²	80.2	64%	0.636	43%	0.433	S	S	*	.			trans	-47.5	145.7	176	15.8	-31.3	0	0	0	113.3	R445	R445-P452 PolarHBondContact NH2-O 2.68Å
453	T	65.1	Low	75.2	Confident	89 Å²	89	75.3 Å²	75.3	55%	0.546	40%	0.401	S	S	.	.	S	Bend	trans	-81.1	-20.5	-166.1	46.2	0	0	0	0	115.3	N438	N438-T453 PolarHBondContact OD1-O 2.86Å
454	M	76.6	Confident	75.5	Confident	29 Å²	29	79.8 Å²	79.8	14%	0.143	41%	0.414	C	S	.	.	S	Bend	trans	-112.6	124.8	-170.8	-172.7	173.2	-129	0	0	109.9	T394 L396 V437 N438	T394-M454 HydrophobicContact CG2-CE 3.98Å; T394-M454 WeakPolarHBondContact OG1-CE 3.08Å; L396-M454 HydrophobicContact CD1-SD 4.36Å; L396-M454 HydrophobicContact CD2-SD 4.07Å; V437-M454 WeakPolarHBondContact O-CG 3.2Å; N438-M454 HydrophobicContact CB-CE 4.17Å; N438-M454 WeakPolarHBondContact OD1-CA 3.38Å; N438-M454 WeakPolarHBondContact OD1-CB 3.13Å; N438-M454 VanDerWaalsContact OD1-CG 3.31Å; N438-M454 WeakPolarHBondContact OD1-CG 3.31Å
455	N	87	Confident	76.1	Confident	60 Å²	60	79.8 Å²	79.8	32%	0.321	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	150.2	172.2	-159.1	-17.3	0	0	0	109.3	P353 T354 F355 G436 V437	P353-N455 WeakPolarHBondContact O-CB 3.15Å; T354-N455 WeakPolarHBondContact CA-ND2 3.2Å; F355-N455 HydrophobicContact CD2-CB 4.41Å; G436-N455 WeakPolarHBondContact CA-O 3.31Å; V437-N455 HydrophobicContact CG1-CB 4.2Å; V437-N455 PolarHBondContact N-O 2.87Å; V437-N455 PolarHBondContact O-N 3.3Å
456	R	92.6	Very high	77.1	Confident	116 Å²	116	80.4 Å²	80.4	44%	0.438	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	144.2	-171.6	-57.8	-169.1	-171.9	-169.6	-1	112.5	L396 E434 I435	L396-R456 HydrophobicContact CD1-CG 4.04Å; E434-R456 WeakPolarHBondContact OE1-CD 3.5Å; E434-R456 IonicContact OE1-CZ 2.78Å; E434-R456 IonicContact OE1-NE 3.07Å; E434-R456 IonicContact OE1-NH1 3.32Å; E434-R456 PolarHBondContact OE1-NH1 2.8Å; I435-R456 VanDerWaalsContact O-CA 3.25Å; I435-R456 WeakPolarHBondContact O-CA 3.36Å; I435-R456 WeakPolarHBondContact O-CB 3.46Å
457	A	94.6	Very high	78.7	Confident	3 Å²	3	78 Å²	78	3%	0.025	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	158.9	170.7	0	0	0	0	0	110.2	F355 N358 Y360 I435	F355-A457 HydrophobicContact CB-CB 4.3Å; F355-A457 HydrophobicContact CD1-CB 4.06Å; F355-A457 HydrophobicContact CD2-CB 3.72Å; F355-A457 HydrophobicContact CE1-CB 4.28Å; F355-A457 HydrophobicContact CE2-CB 3.96Å; F355-A457 HydrophobicContact CG-CB 3.77Å; F355-A457 HydrophobicContact CZ-CB 4.24Å; N358-A457 WeakPolarHBondContact O-CA 3.25Å; Y360-A457 HydrophobicContact CD2-CB 4.12Å; Y360-A457 HydrophobicContact CE2-CB 3.92Å; I435-A457 HydrophobicContact CD1-CB 4.38Å; I435-A457 HydrophobicContact CG1-CB 4.09Å; I435-A457 WeakPolarHBondContact CG1-O 3.36Å; I435-A457 PolarHBondContact N-O 3.46Å; I435-A457 PolarHBondContact O-N 2.83Å; I435-A457 VanDerWaalsContact O-N 3.11Å
458	L	96.8	Very high	80.4	Confident	87 Å²	87	73.8 Å²	73.8	46%	0.455	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	144.3	167.7	-61.8	177.6	0	0	0	109.8	N358 G359 Y360 T432 L433 E434	N358-L458 PolarHBondContact O-N 2.96Å; N358-L458 VanDerWaalsContact O-N 3.09Å; G359-L458 CarbonylContact C-O 3.53Å; G359-L458 VanDerWaalsContact CA-O 3.26Å; G359-L458 WeakPolarHBondContact CA-O 3.35Å; Y360-L458 PolarHBondContact N-O 2.9Å; T432-L458 HydrophobicContact CG2-CB 4.49Å; T432-L458 HydrophobicContact CG2-CD2 4.49Å; L433-L458 CarbonylContact O-C 3.57Å; L433-L458 WeakPolarHBondContact O-CA 3.43Å; E434-L458 HydrophobicContact CB-CD2 4.13Å; E434-L458 HydrophobicContact CG-CD2 4.21Å
459	V	97.6	Very high	82.4	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	115.3	169.2	-172.8	0	0	0	0	108.8	Y360 L374 I376 L417 T432 L433 I435 V461	Y360-V459 CarbonylContact O-C 3.6Å; Y360-V459 VanDerWaalsContact O-CA 3.32Å; Y360-V459 WeakPolarHBondContact O-CA 3.12Å; L374-V459 HydrophobicContact CD2-CG1 3.71Å; L374-V459 HydrophobicContact CD2-CG2 4.47Å; I376-V459 HydrophobicContact CD1-CG2 3.94Å; L417-V459 HydrophobicContact CD2-CG1 3.93Å; T432-V459 WeakPolarHBondContact CA-O 3.48Å; L433-V459 HydrophobicContact CB-CB 4.29Å; L433-V459 PolarHBondContact N-O 2.82Å; L433-V459 PolarHBondContact O-N 2.79Å; I435-V459 HydrophobicContact CD1-CG2 3.7Å; I435-V459 HydrophobicContact CG1-CG2 4.05Å; I435-V459 HydrophobicContact CG2-CG2 4.23Å; V459-V461 HydrophobicContact CG1-CG2 4.26Å
460	T	96.9	Very high	84.4	Confident	26 Å²	26	67.5 Å²	67.5	16%	0.16	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	119.2	171.1	-53.6	0	0	0	0	108.9	Y360 E361 T362 H462	Y360-T460 PolarHBondContact O-N 2.81Å; E361-T460 WeakPolarHBondContact CA-O 3.3Å; T362-T460 PolarHBondContact N-O 2.79Å; T460-H462 WeakPolarHBondContact CG2-NE2 3.42Å
461	V	96.7	Very high	86.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	110.5	172.8	-175.3	0	0	0	0	107.6	T362 V364 I373 F404 Q430 V431 L433 V459	T362-V461 HydrophobicContact CG2-CB 4.49Å; T362-V461 HydrophobicContact CG2-CG1 4.38Å; T362-V461 HydrophobicContact CG2-CG2 4.02Å; V364-V461 HydrophobicContact CG1-CG1 3.71Å; I373-V461 HydrophobicContact CD1-CG1 3.93Å; I373-V461 HydrophobicContact CD1-CG2 3.77Å; F404-V461 HydrophobicContact CE1-CB 4.31Å; F404-V461 HydrophobicContact CE1-CG1 4.1Å; F404-V461 HydrophobicContact CE1-CG2 3.96Å; F404-V461 HydrophobicContact CZ-CB 4.33Å; F404-V461 HydrophobicContact CZ-CG1 4.35Å; F404-V461 HydrophobicContact CZ-CG2 4.3Å; Q430-V461 CarbonylContact C-O 3.6Å; Q430-V461 WeakPolarHBondContact CA-O 3.32Å; V431-V461 PolarHBondContact N-O 3.22Å; V431-V461 PolarHBondContact O-N 3.43Å; L433-V461 HydrophobicContact CD1-CG2 4.4Å; V459-V461 HydrophobicContact CG1-CG2 4.26Å
462	H	95.9	Very high	88.2	Confident	66 Å²	66	54 Å²	54	31%	0.306	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.9	171.3	-62.8	-75.1	0	0	0	109.5	T362 S363 V364 T460	T362-H462 PolarHBondContact O-N 3.31Å; S363-H462 CarbonylContact C-O 3.56Å; S363-H462 WeakPolarHBondContact CA-O 3.26Å; V364-H462 PolarHBondContact N-O 2.77Å; T460-H462 WeakPolarHBondContact CG2-NE2 3.42Å
463	V	95.4	Very high	89.5	Confident	8 Å²	8	54.2 Å²	54.2	5%	0.048	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.7	170.4	-173.5	0	0	0	0	107.3	V364 E366 L423 Y425 N428 H429	V364-V463 CarbonylContact O-C 3.56Å; V364-V463 WeakPolarHBondContact O-CA 3.47Å; E366-V463 HydrophobicContact CB-CG1 3.66Å; L423-V463 HydrophobicContact CB-CG1 4.29Å; L423-V463 HydrophobicContact CB-CG2 4.06Å; L423-V463 HydrophobicContact CD1-CG2 4.18Å; L423-V463 HydrophobicContact CD2-CG2 4.41Å; L423-V463 HydrophobicContact CG-CG2 4.44Å; Y425-V463 HydrophobicContact CD2-CB 4.04Å; Y425-V463 HydrophobicContact CD2-CG1 4.03Å; Y425-V463 WeakPolarHBondContact CD2-O 3.48Å; Y425-V463 WeakPolarHBondContact CE2-O 3.44Å; Y425-V463 HydrophobicContact CG-CG1 4.47Å; N428-V463 VanDerWaalsContact O-CG2 3.25Å; N428-V463 WeakPolarHBondContact O-CG2 3.42Å; H429-V463 PolarHBondContact O-N 2.67Å
464	R	94.3	Very high	90.6	Very high	137 Å²	137	53.6 Å²	53.6	52%	0.517	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	121.2	171.1	-60	-176.7	-178.2	-171.8	1.4	109	S363 V364 E365 E366 Q466	S363-R464 VanDerWaalsContact OG-CZ 3.3Å; S363-R464 PolarHBondContact OG-NE 3.05Å; S363-R464 PolarHBondContact OG-NH2 2.82Å; V364-R464 PolarHBondContact O-N 3.18Å; E365-R464 HydrophobicContact CG-CB 4.34Å; E366-R464 PolarHBondContact N-O 2.93Å; E366-R464 VanDerWaalsContact N-O 3.11Å; R464-Q466 PolarHBondContact O-N 2.83Å
465	D	92.3	Very high	91	Very high	85 Å²	85	56.4 Å²	56.4	46%	0.455	29%	0.286	S	S	.	.			trans	-33.9	122	157.9	-178.5	-33	0	0	0	111.1	E366 Y425 D467	E366-D465 VanDerWaalsContact OE1-CA 3.31Å; E366-D465 WeakPolarHBondContact OE1-CA 3.25Å; Y425-D465 HydrophobicContact CD1-CB 3.91Å; Y425-D465 HydrophobicContact CD2-CB 4.39Å; Y425-D465 HydrophobicContact CE1-CB 3.75Å; Y425-D465 HydrophobicContact CE2-CB 4.26Å; Y425-D465 HydrophobicContact CG-CB 4.24Å; D465-D467 PolarHBondContact OD1-N 2.89Å; D465-D467 VanDerWaalsContact OD1-N 3.1Å
466	Q	88.9	Confident	91.1	Very high	105 Å²	105	58.3 Å²	58.3	49%	0.491	29%	0.294	S	S	.	.			trans	-133.2	65.4	166.8	-166.6	-161.9	11	0	0	110.1	E366 R464 E468	E366-Q466 HydrophobicContact CG-CB 4Å; E366-Q466 PolarHBondContact OE1-N 2.95Å; R464-Q466 PolarHBondContact O-N 2.83Å; Q466-E468 PolarHBondContact O-N 3.17Å
467	D	86.4	Confident	91	Very high	86 Å²	86	54.4 Å²	54.4	46%	0.46	28%	0.28	S	S	.	.			trans	16.3	85.9	151.2	169.5	40.7	0	0	0	113.3	D465 K558	D465-D467 PolarHBondContact OD1-N 2.89Å; D465-D467 VanDerWaalsContact OD1-N 3.1Å; D467-K558 PolarHBondContact O-NZ 3.48Å; D467-K558 IonicContact OD1-NZ 2.69Å; D467-K558 PolarHBondContact OD1-NZ 3.16Å; D467-K558 IonicContact OD2-NZ 3.92Å; D467-K558 PolarHBondContact OD2-NZ 3.34Å
468	E	84	Confident	90.8	Very high	50 Å²	50	61.2 Å²	61.2	23%	0.234	31%	0.306	C	S	.	.			trans	-78.2	-170.5	-172.1	-56.8	-158.6	105	0	0	111.4	N367 Q466 P499 E500 K558	N367-E468 PolarHBondContact ND2-OE1 2.65Å; Q466-E468 PolarHBondContact O-N 3.17Å; E468-P499 HydrophobicContact CB-CG 4.19Å; E468-P499 WeakPolarHBondContact OE2-CG 3.36Å; E468-E500 WeakPolarHBondContact CA-OE1 3.42Å; E468-E500 VanDerWaalsContact CB-OE1 3.24Å; E468-E500 WeakPolarHBondContact CB-OE1 3.37Å; E468-E500 PolarHBondContact N-OE1 3.46Å; E468-K558 WeakPolarHBondContact O-CD 3.41Å; E468-K558 WeakPolarHBondContact O-CE 3.47Å; E468-K558 PolarHBondContact O-NZ 3.11Å
469	G	86.2	Confident	90.5	Very high	25 Å²	25	58 Å²	58	26%	0.258	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-90.4	171.1	163.3	0	0	0	0	0	111.4	E471 P499	G469-E471 PolarHBondContact O-N 3.08Å; G469-P499 WeakPolarHBondContact O-CD 3.06Å
470	P	91.8	Very high	90.1	Very high	5 Å²	5	66.8 Å²	66.8	3%	0.032	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-54.7	135.9	167.3	25	-33.1	0	0	0	109.7	A496 Y497 L507 A552 D554 C560	P470-A496 HydrophobicContact CB-CB 4.49Å; P470-Y497 CarbonylContact C-O 3.43Å; P470-L507 HydrophobicContact CB-CD1 3.82Å; P470-L507 HydrophobicContact CB-CD2 3.72Å; P470-L507 HydrophobicContact CB-CG 4.42Å; P470-L507 HydrophobicContact CG-CD2 4.24Å; P470-A552 HydrophobicContact CB-CB 4.46Å; P470-A552 HydrophobicContact CG-CB 4.49Å; P470-D554 HydrophobicContact CG-CB 4.37Å; P470-C560 WeakPolarHBondContact O-CB 3.34Å; P470-C560 PolarHBondContact O-SG 2.79Å
471	E	89.9	Confident	89.7	Confident	43 Å²	43	65.7 Å²	65.7	20%	0.201	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-96.3	137.6	-177.9	174.3	157.8	-115.6	0	0	112.5	G469 K473 A496 Y497 P499	G469-E471 PolarHBondContact O-N 3.08Å; E471-K473 VanDerWaalsContact CD-CD 3.46Å; E471-K473 VanDerWaalsContact CD-CE 3.43Å; E471-K473 VanDerWaalsContact CD-CG 3.45Å; E471-K473 HydrophobicContact CG-CB 4.04Å; E471-K473 HydrophobicContact CG-CD 4.31Å; E471-K473 HydrophobicContact CG-CG 3.78Å; E471-K473 WeakPolarHBondContact OE1-CD 3.31Å; E471-K473 WeakPolarHBondContact OE1-CE 3.43Å; E471-K473 WeakPolarHBondContact OE1-CG 3.25Å; E471-K473 IonicContact OE1-NZ 3.54Å; E471-K473 PolarHBondContact OE1-NZ 2.68Å; E471-K473 WeakPolarHBondContact OE2-CD 3.45Å; E471-K473 WeakPolarHBondContact OE2-CE 3.09Å; E471-K473 IonicContact OE2-NZ 3.44Å; E471-K473 PolarHBondContact OE2-NZ 2.88Å; E471-A496 WeakPolarHBondContact O-CA 3.2Å; E471-A496 WeakPolarHBondContact O-CB 3.22Å; E471-Y497 HydrophobicContact CB-CD2 4.35Å; E471-Y497 HydrophobicContact CB-CE2 3.87Å; E471-Y497 HydrophobicContact CG-CE2 4.13Å; E471-Y497 PolarHBondContact N-O 3.31Å; E471-Y497 PolarHBondContact O-N 3.23Å; E471-Y497 WeakPolarHBondContact OE2-CE2 3.05Å; E471-Y497 PolarHBondContact OE2-OH 3.29Å; E471-P499 HydrophobicContact CB-CG 3.8Å
472	C	88.9	Confident	89.3	Confident	15 Å²	15	70.8 Å²	70.8	10%	0.101	34%	0.339	C	S	.	.			trans	-105.9	55.5	178.4	-77.8	0	0	0	0	110.9	P474 P475 Y494 C560 T561	C472-P474 CarbonylContact O-C 3.34Å; C472-P475 VanDerWaalsContact O-CA 3.25Å; C472-P475 WeakPolarHBondContact O-CA 3.49Å; C472-P475 VanDerWaalsContact O-N 3.1Å; C472-Y494 VanDerWaalsContact C-OH 3.24Å; C472-Y494 VanDerWaalsContact CA-OH 3.23Å; C472-Y494 WeakPolarHBondContact CA-OH 3.38Å; C472-Y494 HydrophobicContact CB-CE1 4.16Å; C472-Y494 WeakPolarHBondContact CB-OH 3.37Å; C472-Y494 PolarHBondContact O-OH 2.88Å; C472-C560 HydrophobicContact CB-CB 3.64Å; C472-C560 WeakPolarHBondContact CB-SG 3.41Å; C472-C560 PolarHBondContact N-SG 3.49Å; C472-C560 VanDerWaalsContact SG-C 3.55Å; C472-C560 WeakPolarHBondContact SG-CB 3.44Å; C472-C560 CovalentContact SG-SG 2.03Å; C472-C560 PolarHBondContact SG-SG 2.95Å; C472-T561 VanDerWaalsContact SG-C 3.57Å
473	K	82.6	Confident	88.9	Confident	103 Å²	103	68.1 Å²	68.1	45%	0.448	33%	0.326	S	S	.	.	S	Bend	trans	-96.9	128.8	170.1	-78.1	-176.3	-167.9	119.6	0	110.4	E471 Y497	E471-K473 VanDerWaalsContact CD-CD 3.46Å; E471-K473 VanDerWaalsContact CD-CE 3.43Å; E471-K473 VanDerWaalsContact CD-CG 3.45Å; E471-K473 HydrophobicContact CG-CB 4.04Å; E471-K473 HydrophobicContact CG-CD 4.31Å; E471-K473 HydrophobicContact CG-CG 3.78Å; E471-K473 WeakPolarHBondContact OE1-CD 3.31Å; E471-K473 WeakPolarHBondContact OE1-CE 3.43Å; E471-K473 WeakPolarHBondContact OE1-CG 3.25Å; E471-K473 IonicContact OE1-NZ 3.54Å; E471-K473 PolarHBondContact OE1-NZ 2.68Å; E471-K473 WeakPolarHBondContact OE2-CD 3.45Å; E471-K473 WeakPolarHBondContact OE2-CE 3.09Å; E471-K473 IonicContact OE2-NZ 3.44Å; E471-K473 PolarHBondContact OE2-NZ 2.88Å; K473-Y497 HydrophobicContact CB-CE1 4.37Å; K473-Y497 WeakPolarHBondContact CB-OH 3.5Å
474	P	87.4	Confident	88.5	Confident	76 Å²	76	73 Å²	73	49%	0.494	35%	0.352	S	S	.	.	S	Bend	cis	-70.1	152.4	-12.2	31.5	-35.3	0	0	0	111.6	C472 E476 Q477 Y494	C472-P474 CarbonylContact O-C 3.34Å; P474-E476 WeakPolarHBondContact CG-O 3.33Å; P474-E476 PolarHBondContact O-N 3.36Å; P474-Q477 HydrophobicContact CG-CG 3.88Å; P474-Y494 PolarHBondContact O-OH 3.2Å
475	P	84.9	Confident	88.2	Confident	88 Å²	88	67.8 Å²	67.8	57%	0.571	34%	0.337	S	S	*	.	S	Bend	trans	-65.6	-22.2	-179.7	27.5	-35.9	0	0	0	112.7	C472 T563	C472-P475 VanDerWaalsContact O-CA 3.25Å; C472-P475 WeakPolarHBondContact O-CA 3.49Å; C472-P475 VanDerWaalsContact O-N 3.1Å; P475-T563 PolarHBondContact O-N 2.74Å
476	E	89.1	Confident	88	Confident	101 Å²	101	67.1 Å²	67.1	47%	0.472	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	121.7	170.8	-67.7	177.9	-172.3	0	0	109.8	P474 Y478 T563	P474-E476 WeakPolarHBondContact CG-O 3.33Å; P474-E476 PolarHBondContact O-N 3.36Å; E476-Y478 HydrophobicContact CB-CE2 3.78Å; E476-Y478 PolarHBondContact OE2-OH 2.93Å; E476-T563 WeakPolarHBondContact CA-O 3.21Å
477	Q	90.4	Very high	88.1	Confident	33 Å²	33	66.5 Å²	66.5	15%	0.154	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.5	172.6	-69.4	179	20.1	0	0	109.6	P474 Y494 K495 T563 L564 A565	P474-Q477 HydrophobicContact CG-CG 3.88Å; Q477-Y494 HydrophobicContact CB-CD2 3.91Å; Q477-Y494 HydrophobicContact CB-CE2 3.92Å; Q477-Y494 HydrophobicContact CG-CD2 3.94Å; Q477-Y494 HydrophobicContact CG-CE2 3.55Å; Q477-Y494 VanDerWaalsContact NE2-CZ 3.26Å; Q477-Y494 PolarHBondContact NE2-OH 3.23Å; Q477-K495 PolarHBondContact NE2-O 3.11Å; Q477-T563 PolarHBondContact N-O 3.04Å; Q477-L564 HydrophobicContact CB-CD1 3.85Å; Q477-L564 CarbonylContact O-C 3.59Å; Q477-L564 WeakPolarHBondContact O-CA 3.32Å; Q477-A565 PolarHBondContact O-N 3.06Å
478	Y	90.3	Very high	88	Confident	146 Å²	146	65 Å²	65	57%	0.573	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	127	-170.3	-71.5	-101.3	0	0	0	111.1	E476 L545 A565	E476-Y478 HydrophobicContact CB-CE2 3.78Å; E476-Y478 PolarHBondContact OE2-OH 2.93Å; Y478-L545 HydrophobicContact CD1-CD1 4.45Å; Y478-L545 HydrophobicContact CE1-CD1 3.87Å; Y478-A565 WeakPolarHBondContact CA-O 3.45Å; Y478-A565 HydrophobicContact CD1-CB 3.88Å; Y478-A565 HydrophobicContact CE1-CB 3.8Å; Y478-A565 HydrophobicContact CG-CB 4.36Å
479	V	89.9	Confident	88.2	Confident	20 Å²	20	64.5 Å²	64.5	12%	0.121	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	144	-179.3	176.8	0	0	0	0	109.7	I481 I491 N492 L564 A565 V566 N567	V479-I481 HydrophobicContact CG1-CD1 4.38Å; V479-I481 HydrophobicContact CG1-CG1 4.02Å; V479-I491 HydrophobicContact CG1-CG2 3.78Å; V479-N492 WeakPolarHBondContact CG2-O 3.45Å; V479-L564 HydrophobicContact CG2-CD1 3.68Å; V479-L564 HydrophobicContact CG2-CG 4.3Å; V479-A565 PolarHBondContact N-O 3.32Å; V479-A565 VanDerWaalsContact N-O 3.12Å; V479-V566 HydrophobicContact CB-CG2 4.48Å; V479-V566 WeakPolarHBondContact O-CA 3.02Å; V479-N567 PolarHBondContact O-N 2.83Å
480	R	89.3	Confident	88.3	Confident	185 Å²	185	68.6 Å²	68.6	70%	0.698	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.4	175.4	-55.2	-166.2	-173.9	178.8	-2.1	110.6	N567 E569	R480-N567 WeakPolarHBondContact CA-O 3.4Å; R480-N567 HydrophobicContact CG-CB 4.35Å; R480-E569 HydrophobicContact CB-CG 4.37Å; R480-E569 WeakPolarHBondContact CD-OE1 3.36Å; R480-E569 IonicContact NH1-OE1 3.6Å
481	I	89.6	Confident	88.2	Confident	3 Å²	3	70.1 Å²	70.1	2%	0.015	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130	-177.6	-55.1	-175.1	0	0	0	107.8	V479 I491 L528 I530 L534 V566 N567 I568 E569	V479-I481 HydrophobicContact CG1-CD1 4.38Å; V479-I481 HydrophobicContact CG1-CG1 4.02Å; I481-I491 HydrophobicContact CB-CD1 4.31Å; I481-I491 HydrophobicContact CD1-CD1 3.92Å; I481-I491 HydrophobicContact CG1-CD1 3.81Å; I481-I491 HydrophobicContact CG1-CG2 4.39Å; I481-I491 HydrophobicContact CG2-CD1 3.79Å; I481-L528 HydrophobicContact CD1-CD1 4.37Å; I481-I530 HydrophobicContact CG2-CD1 3.87Å; I481-L534 HydrophobicContact CB-CD2 4.49Å; I481-L534 HydrophobicContact CG2-CD1 4.23Å; I481-L534 HydrophobicContact CG2-CD2 3.87Å; I481-V566 HydrophobicContact CB-CG1 4.26Å; I481-V566 HydrophobicContact CD1-CG1 3.65Å; I481-V566 HydrophobicContact CD1-CG2 4.44Å; I481-V566 HydrophobicContact CG1-CG1 3.85Å; I481-N567 PolarHBondContact N-O 2.94Å; I481-N567 VanDerWaalsContact N-O 3.08Å; I481-I568 CarbonylContact O-C 3.59Å; I481-I568 VanDerWaalsContact O-CA 3.27Å; I481-I568 WeakPolarHBondContact O-CA 3.45Å; I481-E569 PolarHBondContact O-N 2.88Å
482	K	87.8	Confident	88	Confident	106 Å²	106	73.4 Å²	73.4	46%	0.461	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	139.6	171.6	-61.6	-165.2	170.1	-154.5	0	109.7	N484 S485 E569 V571	K482-N484 VanDerWaalsContact C-N 3.28Å; K482-N484 WeakPolarHBondContact CB-OD1 3.31Å; K482-N484 PolarHBondContact O-N 3.08Å; K482-S485 WeakPolarHBondContact O-CB 3.32Å; K482-S485 PolarHBondContact O-N 2.83Å; K482-S485 PolarHBondContact O-OG 2.88Å; K482-E569 WeakPolarHBondContact CE-OE2 3.45Å; K482-E569 HydrophobicContact CG-CB 4.02Å; K482-E569 IonicContact NZ-OE2 2.79Å; K482-V571 HydrophobicContact CB-CG2 4.35Å
483	E	88.2	Confident	87.9	Confident	10 Å²	10	73.1 Å²	73.1	5%	0.047	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-34.4	-175.4	66.9	-149.8	123.1	0	0	113.8	S485 L534 R536 I568 E569 D570 V571	E483-S485 PolarHBondContact O-N 3.24Å; E483-L534 HydrophobicContact CB-CB 4.08Å; E483-R536 WeakPolarHBondContact OE2-CB 3.42Å; E483-R536 PolarHBondContact OE2-N 2.68Å; E483-I568 HydrophobicContact CB-CG2 3.79Å; E483-E569 PolarHBondContact N-O 2.83Å; E483-D570 VanDerWaalsContact OE1-CA 3.29Å; E483-D570 WeakPolarHBondContact OE1-CA 3.28Å; E483-V571 HydrophobicContact CG-CB 4.19Å; E483-V571 HydrophobicContact CG-CG2 4.26Å; E483-V571 PolarHBondContact OE1-N 3.18Å
484	N	86.6	Confident	88.1	Confident	110 Å²	110	68.2 Å²	68.2	59%	0.588	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	11.5	172.2	74.9	-2.3	0	0	0	115.2	K482 A486 V571	K482-N484 VanDerWaalsContact C-N 3.28Å; K482-N484 WeakPolarHBondContact CB-OD1 3.31Å; K482-N484 PolarHBondContact O-N 3.08Å; N484-A486 PolarHBondContact O-N 3.15Å; N484-V571 HydrophobicContact CB-CG1 4.49Å; N484-V571 HydrophobicContact CB-CG2 4.48Å
485	S	88.9	Confident	88.2	Confident	29 Å²	29	70.5 Å²	70.5	20%	0.203	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-65.7	126	173.8	-65	0	0	0	0	111	K482 E483 I530	K482-S485 WeakPolarHBondContact O-CB 3.32Å; K482-S485 PolarHBondContact O-N 2.83Å; K482-S485 PolarHBondContact O-OG 2.88Å; E483-S485 PolarHBondContact O-N 3.24Å; S485-I530 VanDerWaalsContact CB-CD1 3.43Å
486	A	87.9	Confident	88.4	Confident	71 Å²	71	66.3 Å²	66.3	59%	0.587	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-61.5	138.2	-175	0	0	0	0	0	112.8	N484 G488 S489	N484-A486 PolarHBondContact O-N 3.15Å; A486-G488 PolarHBondContact O-N 3.26Å; A486-S489 VanDerWaalsContact O-CB 3.25Å; A486-S489 WeakPolarHBondContact O-CB 3.42Å; A486-S489 PolarHBondContact O-N 3.44Å; A486-S489 PolarHBondContact O-OG 2.82Å
487	V	89.3	Confident	88.5	Confident	91 Å²	91	65 Å²	65	55%	0.552	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	134.8	172.9	-177	0	0	0	0	110.1
488	G	85.6	Confident	88.4	Confident	55 Å²	55	64.5 Å²	64.5	57%	0.567	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-5.5	-173.5	0	0	0	0	0	115.1	A486 I530	A486-G488 PolarHBondContact O-N 3.26Å; G488-I530 PolarHBondContact N-O 2.86Å
489	S	88	Confident	88.3	Confident	40 Å²	40	57.8 Å²	57.8	28%	0.28	31%	0.308	S	S	.	.			trans	-68.1	145.5	173.2	59.8	0	0	0	0	112	A486 T529 I530	A486-S489 VanDerWaalsContact O-CB 3.25Å; A486-S489 WeakPolarHBondContact O-CB 3.42Å; A486-S489 PolarHBondContact O-N 3.44Å; A486-S489 PolarHBondContact O-OG 2.82Å; S489-T529 WeakPolarHBondContact O-CA 3.45Å; S489-I530 PolarHBondContact O-N 2.78Å; S489-I530 VanDerWaalsContact O-N 3.09Å
490	K	88	Confident	88.2	Confident	111 Å²	111	59 Å²	59	48%	0.483	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	135.5	-179.8	-80	-169.1	171.6	-163.9	0	111.3	E522 L527 L528 T529	K490-E522 IonicContact NZ-OE1 2.66Å; K490-E522 PolarHBondContact NZ-OE1 3.39Å; K490-E522 IonicContact NZ-OE2 2.71Å; K490-E522 PolarHBondContact NZ-OE2 2.87Å; K490-L527 HydrophobicContact CD-CD1 4.23Å; K490-L528 WeakPolarHBondContact CA-O 2.99Å; K490-T529 HydrophobicContact CD-CG2 4.41Å; K490-T529 HydrophobicContact CG-CG2 3.67Å
491	I	89.1	Confident	87.9	Confident	37 Å²	37	54 Å²	54	19%	0.19	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152.6	-177.5	-57.8	-178.4	0	0	0	108.5	V479 I481 G493 L528 I530	V479-I491 HydrophobicContact CG1-CG2 3.78Å; I481-I491 HydrophobicContact CB-CD1 4.31Å; I481-I491 HydrophobicContact CD1-CD1 3.92Å; I481-I491 HydrophobicContact CG1-CD1 3.81Å; I481-I491 HydrophobicContact CG1-CG2 4.39Å; I481-I491 HydrophobicContact CG2-CD1 3.79Å; I491-G493 PolarHBondContact O-N 3.48Å; I491-L528 HydrophobicContact CB-CB 4.48Å; I491-L528 PolarHBondContact N-O 2.78Å; I491-L528 PolarHBondContact O-N 2.92Å; I491-I530 HydrophobicContact CD1-CD1 3.71Å; I491-I530 HydrophobicContact CD1-CG1 4.39Å
492	N	86.9	Confident	87.6	Confident	112 Å²	112	59.8 Å²	59.8	60%	0.599	33%	0.327	S	S	*	.			trans	-54.9	122.9	170.7	-70.2	-23.3	0	0	0	109.6	V479	V479-N492 WeakPolarHBondContact CG2-O 3.45Å
493	G	85.8	Confident	87.4	Confident	9 Å²	9	57.1 Å²	57.1	9%	0.093	32%	0.318	C	S	.	.			trans	-102.5	-155.8	171.1	0	0	0	0	0	111.9	I491 G526	I491-G493 PolarHBondContact O-N 3.48Å; G493-G526 CarbonylContact C-O 3.54Å; G493-G526 WeakPolarHBondContact CA-O 3.4Å
494	Y	87.9	Confident	87.2	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.332	C	S	.	.			trans	-73.2	136.6	-179.7	-165.2	-85.9	0	0	0	110.8	C472 P474 Q477 A496 Y509 V550 L564	C472-Y494 VanDerWaalsContact C-OH 3.24Å; C472-Y494 VanDerWaalsContact CA-OH 3.23Å; C472-Y494 WeakPolarHBondContact CA-OH 3.38Å; C472-Y494 HydrophobicContact CB-CE1 4.16Å; C472-Y494 WeakPolarHBondContact CB-OH 3.37Å; C472-Y494 PolarHBondContact O-OH 2.88Å; P474-Y494 PolarHBondContact O-OH 3.2Å; Q477-Y494 HydrophobicContact CB-CD2 3.91Å; Q477-Y494 HydrophobicContact CB-CE2 3.92Å; Q477-Y494 HydrophobicContact CG-CD2 3.94Å; Q477-Y494 HydrophobicContact CG-CE2 3.55Å; Q477-Y494 VanDerWaalsContact NE2-CZ 3.26Å; Q477-Y494 PolarHBondContact NE2-OH 3.23Å; Y494-A496 HydrophobicContact CE1-CB 4.37Å; Y494-Y509 WeakPolarHBondContact O-CE1 3.44Å; Y494-V550 HydrophobicContact CG-CB 4.26Å; Y494-V550 HydrophobicContact CG-CG1 4.45Å; Y494-L564 HydrophobicContact CD2-CB 4.39Å; Y494-L564 HydrophobicContact CD2-CD1 4.23Å
495	K	88.6	Confident	87	Confident	123 Å²	123	59.7 Å²	59.7	54%	0.535	34%	0.336	S	S	.	.			trans	-116.9	123.6	171.3	-67.9	-171.2	176.8	-172.3	0	110.8	Q477	Q477-K495 PolarHBondContact NE2-O 3.11Å
496	A	89.9	Confident	86.8	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.008	35%	0.345	C	S	.	.			trans	-99.2	164.7	162.4	0	0	0	0	0	109.3	P470 E471 Y494 S504 L507 Y509 A552	P470-A496 HydrophobicContact CB-CB 4.49Å; E471-A496 WeakPolarHBondContact O-CA 3.2Å; E471-A496 WeakPolarHBondContact O-CB 3.22Å; Y494-A496 HydrophobicContact CE1-CB 4.37Å; A496-S504 WeakPolarHBondContact O-CB 3.47Å; A496-S504 PolarHBondContact O-OG 2.97Å; A496-L507 HydrophobicContact CB-CD1 4.08Å; A496-Y509 HydrophobicContact CB-CE1 4.24Å; A496-Y509 PolarHBondContact N-OH 3.27Å; A496-Y509 PolarHBondContact O-OH 2.94Å; A496-A552 HydrophobicContact CB-CB 3.42Å; A496-A552 VanDerWaalsContact CB-CB 3.42Å
497	Y	89.7	Confident	86.9	Confident	72 Å²	72	56.9 Å²	56.9	28%	0.282	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-134.5	147.2	167.4	57.3	-97.6	0	0	0	109.3	P470 E471 K473 N503	P470-Y497 CarbonylContact C-O 3.43Å; E471-Y497 HydrophobicContact CB-CD2 4.35Å; E471-Y497 HydrophobicContact CB-CE2 3.87Å; E471-Y497 HydrophobicContact CG-CE2 4.13Å; E471-Y497 PolarHBondContact N-O 3.31Å; E471-Y497 PolarHBondContact O-N 3.23Å; E471-Y497 WeakPolarHBondContact OE2-CE2 3.05Å; E471-Y497 PolarHBondContact OE2-OH 3.29Å; K473-Y497 HydrophobicContact CB-CE1 4.37Å; K473-Y497 WeakPolarHBondContact CB-OH 3.5Å; Y497-N503 CarbonylContact C-O 3.59Å; Y497-N503 VanDerWaalsContact CA-O 3.29Å; Y497-N503 WeakPolarHBondContact CA-O 3.48Å
498	D	89.8	Confident	87	Confident	24 Å²	24	59.1 Å²	59.1	13%	0.128	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-73.6	124.4	166.9	145.2	-47.3	0	0	0	107.3	E500 T501 K502 N503 L507	D498-E500 PolarHBondContact OD1-N 3.45Å; D498-T501 WeakPolarHBondContact OD1-CA 3.37Å; D498-T501 WeakPolarHBondContact OD1-CB 3.38Å; D498-T501 WeakPolarHBondContact OD1-CG2 3.14Å; D498-T501 PolarHBondContact OD1-N 2.92Å; D498-T501 PolarHBondContact OD1-OG1 3.46Å; D498-K502 WeakPolarHBondContact O-CA 3.41Å; D498-K502 PolarHBondContact O-N 2.79Å; D498-N503 PolarHBondContact N-O 3.39Å; D498-L507 HydrophobicContact CB-CD2 4.31Å
499	P	87.8	Confident	87.3	Confident	4 Å²	4	57 Å²	57	3%	0.026	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-36.9	-174.6	-27.8	37.2	0	0	0	114.4	E426 E468 G469 E471 K502	E426-P499 HydrophobicContact CG-CB 3.89Å; E426-P499 WeakPolarHBondContact CG-O 3.42Å; E468-P499 HydrophobicContact CB-CG 4.19Å; E468-P499 WeakPolarHBondContact OE2-CG 3.36Å; G469-P499 WeakPolarHBondContact O-CD 3.06Å; E471-P499 HydrophobicContact CB-CG 3.8Å; P499-K502 WeakPolarHBondContact O-CE 3.46Å; P499-K502 WeakPolarHBondContact O-CG 3.11Å
500	E	86.8	Confident	87.5	Confident	47 Å²	47	60.5 Å²	60.5	22%	0.22	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-46.6	-171.1	-56.2	66	-144.5	0	0	110.2	E468 D498	E468-E500 WeakPolarHBondContact CA-OE1 3.42Å; E468-E500 VanDerWaalsContact CB-OE1 3.24Å; E468-E500 WeakPolarHBondContact CB-OE1 3.37Å; E468-E500 PolarHBondContact N-OE1 3.46Å; D498-E500 PolarHBondContact OD1-N 3.45Å
501	T	84.1	Confident	87.7	Confident	80 Å²	80	58.1 Å²	58.1	49%	0.491	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-5.9	-178.8	78.3	0	0	0	0	112.8	D498 N503	D498-T501 WeakPolarHBondContact OD1-CA 3.37Å; D498-T501 WeakPolarHBondContact OD1-CB 3.38Å; D498-T501 WeakPolarHBondContact OD1-CG2 3.14Å; D498-T501 PolarHBondContact OD1-N 2.92Å; D498-T501 PolarHBondContact OD1-OG1 3.46Å; T501-N503 WeakPolarHBondContact CB-ND2 3.2Å; T501-N503 PolarHBondContact O-N 3.48Å; T501-N503 PolarHBondContact O-ND2 2.82Å; T501-N503 PolarHBondContact OG1-ND2 2.85Å
502	K	83.1	Confident	87.8	Confident	124 Å²	124	60.5 Å²	60.5	54%	0.539	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	36.6	174.5	-59.2	-175.5	-178	176.6	0	113.3	E426 D498 P499	E426-K502 PolarHBondContact O-NZ 2.85Å; E426-K502 IonicContact OE1-NZ 2.72Å; D498-K502 WeakPolarHBondContact O-CA 3.41Å; D498-K502 PolarHBondContact O-N 2.79Å; P499-K502 WeakPolarHBondContact O-CE 3.46Å; P499-K502 WeakPolarHBondContact O-CG 3.11Å
503	N	84.6	Confident	87.9	Confident	49 Å²	49	61.2 Å²	61.2	26%	0.262	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-148.9	176.8	-179	75	82.6	0	0	0	113	Y497 D498 T501 N505	Y497-N503 CarbonylContact C-O 3.59Å; Y497-N503 VanDerWaalsContact CA-O 3.29Å; Y497-N503 WeakPolarHBondContact CA-O 3.48Å; D498-N503 PolarHBondContact N-O 3.39Å; T501-N503 WeakPolarHBondContact CB-ND2 3.2Å; T501-N503 PolarHBondContact O-N 3.48Å; T501-N503 PolarHBondContact O-ND2 2.82Å; T501-N503 PolarHBondContact OG1-ND2 2.85Å; N503-N505 WeakPolarHBondContact OD1-CB 3.4Å; N503-N505 VanDerWaalsContact OD1-CG 3.25Å; N503-N505 PolarHBondContact OD1-N 3.01Å; N503-N505 PolarHBondContact OD1-ND2 2.97Å
504	S	84	Confident	88	Confident	48 Å²	48	62 Å²	62	34%	0.336	31%	0.305	S	S	.	.			trans	-107.3	13.6	-175	-47.8	0	0	0	0	114.3	A496	A496-S504 WeakPolarHBondContact O-CB 3.47Å; A496-S504 PolarHBondContact O-OG 2.97Å
505	N	82.4	Confident	87.9	Confident	126 Å²	126	66.1 Å²	66.1	67%	0.674	33%	0.332	S	S	*	.	S	Bend	trans	-76.8	150.4	-178.8	-58.6	-57	0	0	0	110.6	N503 L507	N503-N505 WeakPolarHBondContact OD1-CB 3.4Å; N503-N505 VanDerWaalsContact OD1-CG 3.25Å; N503-N505 PolarHBondContact OD1-N 3.01Å; N503-N505 PolarHBondContact OD1-ND2 2.97Å; N505-L507 PolarHBondContact O-N 3.33Å
506	G	83.2	Confident	87.8	Confident	38 Å²	38	63.9 Å²	63.9	39%	0.392	32%	0.322	S	S	.	.	S	Bend	trans	79.4	-32.1	-177	0	0	0	0	0	114.3
507	L	90.4	Very high	87.7	Confident	3 Å²	3	69.3 Å²	69.3	2%	0.016	35%	0.348	C	S	.	.			trans	-60.8	141.1	179.9	-54.6	-169.3	0	0	0	113.4	P470 A496 D498 N505 Y509 I553 D554	P470-L507 HydrophobicContact CB-CD1 3.82Å; P470-L507 HydrophobicContact CB-CD2 3.72Å; P470-L507 HydrophobicContact CB-CG 4.42Å; P470-L507 HydrophobicContact CG-CD2 4.24Å; A496-L507 HydrophobicContact CB-CD1 4.08Å; D498-L507 HydrophobicContact CB-CD2 4.31Å; N505-L507 PolarHBondContact O-N 3.33Å; L507-Y509 HydrophobicContact CB-CE2 4.19Å; L507-I553 CarbonylContact C-O 3.52Å; L507-I553 WeakPolarHBondContact CA-O 3.39Å; L507-D554 HydrophobicContact CD2-CB 3.81Å
508	R	91.7	Very high	87.7	Confident	138 Å²	138	66.7 Å²	66.7	52%	0.521	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.9	176.8	-63.5	178.7	-176.1	-122.3	8.3	111.3	E523 A552 I553	R508-E523 CarbonylContact C-O 3.49Å; R508-E523 VanDerWaalsContact CA-O 3.31Å; R508-E523 WeakPolarHBondContact CA-O 3.45Å; R508-E523 HydrophobicContact CB-CG 4.15Å; R508-E523 WeakPolarHBondContact CD-OE1 3.32Å; R508-E523 HydrophobicContact CG-CG 4.39Å; R508-E523 IonicContact CZ-OE1 2.97Å; R508-E523 IonicContact NE-OE1 3.22Å; R508-E523 IonicContact NH1-OE1 3.43Å; R508-E523 PolarHBondContact NH1-OE1 2.73Å; R508-A552 CarbonylContact O-C 3.46Å; R508-A552 WeakPolarHBondContact O-CA 3.24Å; R508-I553 PolarHBondContact N-O 2.99Å; R508-I553 PolarHBondContact O-N 3.43Å
509	Y	92.2	Very high	87.7	Confident	10 Å²	10	65.5 Å²	65.5	4%	0.039	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132.3	-175.1	-67	-91.9	0	0	0	111.9	Y494 A496 L507 I521 E523 V550 A552	Y494-Y509 WeakPolarHBondContact O-CE1 3.44Å; A496-Y509 HydrophobicContact CB-CE1 4.24Å; A496-Y509 PolarHBondContact N-OH 3.27Å; A496-Y509 PolarHBondContact O-OH 2.94Å; L507-Y509 HydrophobicContact CB-CE2 4.19Å; Y509-I521 HydrophobicContact CD1-CD1 4.39Å; Y509-I521 HydrophobicContact CG-CD1 4.47Å; Y509-E523 PolarHBondContact N-O 3.47Å; Y509-V550 HydrophobicContact CD1-CG1 4.07Å; Y509-A552 HydrophobicContact CD1-CB 4.18Å; Y509-A552 HydrophobicContact CE1-CB 3.96Å
510	K	91.8	Very high	87.9	Confident	114 Å²	114	67.6 Å²	67.6	50%	0.496	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	127.2	179.9	-176.4	176.6	177.9	-177	0	111.1	M551	K510-M551 HydrophobicContact CD-CE 4.29Å; K510-M551 PolarHBondContact N-O 3.2Å; K510-M551 PolarHBondContact O-N 3.37Å
511	K	92.6	Very high	88.1	Confident	62 Å²	62	66.6 Å²	66.6	27%	0.27	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129.2	170	-163.8	178.7	76.9	170.6	0	109.2	D514 V519 I521 I548	K511-D514 HydrophobicContact CD-CB 3.73Å; K511-D514 HydrophobicContact CG-CB 4.33Å; K511-D514 IonicContact NZ-OD2 2.81Å; K511-D514 PolarHBondContact NZ-OD2 3.33Å; K511-V519 PolarHBondContact NZ-O 3.2Å; K511-I521 HydrophobicContact CB-CG2 3.99Å; K511-I548 HydrophobicContact CD-CG2 4.07Å; K511-I548 HydrophobicContact CG-CG2 3.78Å
512	L	90.3	Very high	88.4	Confident	87 Å²	87	66.3 Å²	66.3	46%	0.455	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-64.5	176.3	-67.6	-174.6	0	0	0	111.2	T549 M551 T561	L512-T549 PolarHBondContact N-O 2.78Å; L512-M551 HydrophobicContact CD1-CB 3.83Å; L512-M551 HydrophobicContact CD1-CG 4.41Å; L512-M551 HydrophobicContact CD1-SD 3.98Å; L512-M551 HydrophobicContact CD2-CB 4.3Å; L512-M551 HydrophobicContact CD2-CE 4.26Å; L512-M551 HydrophobicContact CD2-SD 4.25Å; L512-M551 HydrophobicContact CG-CB 3.87Å; L512-M551 HydrophobicContact CG-SD 4.5Å; L512-T561 HydrophobicContact CD1-CG2 4.27Å
513	Q	88.9	Confident	88.8	Confident	127 Å²	127	65.1 Å²	65.1	59%	0.593	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	133	179.1	-170.9	176.7	-14.3	0	0	110.8	T549	Q513-T549 HydrophobicContact CB-CG2 4.43Å; Q513-T549 WeakPolarHBondContact CB-OG1 3.21Å; Q513-T549 PolarHBondContact N-OG1 3.03Å; Q513-T549 PolarHBondContact O-N 2.75Å
514	D	89	Confident	88.9	Confident	24 Å²	24	68.5 Å²	68.5	13%	0.128	35%	0.353	C	S	.	.			trans	-150.4	117.4	171.4	174.3	-18.4	0	0	0	107.2	K511 K516 E517 Y546	K511-D514 HydrophobicContact CD-CB 3.73Å; K511-D514 HydrophobicContact CG-CB 4.33Å; K511-D514 IonicContact NZ-OD2 2.81Å; K511-D514 PolarHBondContact NZ-OD2 3.33Å; D514-K516 VanDerWaalsContact C-N 3.34Å; D514-K516 PolarHBondContact O-N 3.36Å; D514-K516 PolarHBondContact OD1-N 2.95Å; D514-E517 VanDerWaalsContact CG-N 3.33Å; D514-E517 WeakPolarHBondContact OD1-CA 3.27Å; D514-E517 PolarHBondContact OD1-N 3.39Å; D514-E517 VanDerWaalsContact OD2-CA 3.24Å; D514-E517 WeakPolarHBondContact OD2-CA 3.5Å; D514-Y546 PolarHBondContact OD1-OH 3.05Å; D514-Y546 PolarHBondContact OD2-OH 2.82Å; D514-Y546 VanDerWaalsContact OD2-OH 3.05Å
515	P	86.1	Confident	89	Confident	87 Å²	87	68.2 Å²	68.2	57%	0.565	35%	0.352	S	S	*	.	S	Bend	trans	-79.5	-6.8	-175.5	31.3	-35.7	0	0	0	115.1	Y546	P515-Y546 HydrophobicContact CG-CD2 4.27Å; P515-Y546 HydrophobicContact CG-CE2 4.13Å
516	K	85.5	Confident	89.2	Confident	76 Å²	76	62.3 Å²	62.3	33%	0.33	32%	0.32	S	S	.	.	S	Bend	trans	-129.9	-18.5	-173.3	-64.3	-68.7	-167.1	171.5	0	114	D514 W518 K532 A538 Y546	D514-K516 VanDerWaalsContact C-N 3.34Å; D514-K516 PolarHBondContact O-N 3.36Å; D514-K516 PolarHBondContact OD1-N 2.95Å; K516-W518 VanDerWaalsContact C-N 3.26Å; K516-W518 HydrophobicContact CB-CD2 3.48Å; K516-W518 VanDerWaalsContact CB-CD2 3.48Å; K516-W518 HydrophobicContact CB-CE3 3.66Å; K516-W518 HydrophobicContact CB-CG 3.93Å; K516-W518 HydrophobicContact CB-CH2 4.38Å; K516-W518 HydrophobicContact CB-CZ2 4.22Å; K516-W518 HydrophobicContact CB-CZ3 4.11Å; K516-W518 HydrophobicContact CD-CH2 4.17Å; K516-W518 HydrophobicContact CD-CZ2 4.09Å; K516-W518 HydrophobicContact CG-CD2 4.02Å; K516-W518 HydrophobicContact CG-CE3 3.83Å; K516-W518 HydrophobicContact CG-CH2 3.83Å; K516-W518 HydrophobicContact CG-CZ2 4Å; K516-W518 HydrophobicContact CG-CZ3 3.73Å; K516-W518 PolarHBondContact O-N 2.72Å; K516-K532 PolarHBondContact O-NZ 2.72Å; K516-A538 PolarHBondContact NZ-O 3.24Å; K516-Y546 HydrophobicContact CB-CE2 4.01Å; K516-Y546 HydrophobicContact CG-CE2 4.2Å
517	E	88.6	Confident	89.5	Confident	115 Å²	115	62.8 Å²	62.8	54%	0.537	31%	0.313	S	S	.	.			trans	56.3	35	-171	-50.5	175.8	140	0	0	113.3	D514 V519 K532	D514-E517 VanDerWaalsContact CG-N 3.33Å; D514-E517 WeakPolarHBondContact OD1-CA 3.27Å; D514-E517 PolarHBondContact OD1-N 3.39Å; D514-E517 VanDerWaalsContact OD2-CA 3.24Å; D514-E517 WeakPolarHBondContact OD2-CA 3.5Å; E517-V519 VanDerWaalsContact C-N 3.29Å; E517-V519 PolarHBondContact O-N 2.82Å; E517-K532 WeakPolarHBondContact O-CD 3.31Å; E517-K532 VanDerWaalsContact O-CE 3.3Å; E517-K532 WeakPolarHBondContact O-CE 3.4Å; E517-K532 IonicContact OE2-NZ 3.19Å; E517-K532 PolarHBondContact OE2-NZ 3.26Å
518	W	89.1	Confident	89.5	Confident	17 Å²	17	62.7 Å²	62.7	6%	0.064	31%	0.313	C	S	.	.			trans	-72.7	-22.5	178.5	-70.8	-46.5	0	0	0	113	K516 S531 K532 A533 L534 D535 A538 M539 Y546 I568	K516-W518 VanDerWaalsContact C-N 3.26Å; K516-W518 HydrophobicContact CB-CD2 3.48Å; K516-W518 VanDerWaalsContact CB-CD2 3.48Å; K516-W518 HydrophobicContact CB-CE3 3.66Å; K516-W518 HydrophobicContact CB-CG 3.93Å; K516-W518 HydrophobicContact CB-CH2 4.38Å; K516-W518 HydrophobicContact CB-CZ2 4.22Å; K516-W518 HydrophobicContact CB-CZ3 4.11Å; K516-W518 HydrophobicContact CD-CH2 4.17Å; K516-W518 HydrophobicContact CD-CZ2 4.09Å; K516-W518 HydrophobicContact CG-CD2 4.02Å; K516-W518 HydrophobicContact CG-CE3 3.83Å; K516-W518 HydrophobicContact CG-CH2 3.83Å; K516-W518 HydrophobicContact CG-CZ2 4Å; K516-W518 HydrophobicContact CG-CZ3 3.73Å; K516-W518 PolarHBondContact O-N 2.72Å; W518-S531 PolarHBondContact O-N 2.68Å; W518-K532 PolarHBondContact O-N 2.74Å; W518-A533 PolarHBondContact NE1-O 3.37Å; W518-L534 HydrophobicContact CB-CG 4.28Å; W518-L534 HydrophobicContact CG-CG 4.39Å; W518-D535 WeakPolarHBondContact CH2-O 3.49Å; W518-D535 HydrophobicContact CZ2-CB 4.23Å; W518-D535 WeakPolarHBondContact CZ2-O 3.24Å; W518-A538 HydrophobicContact CZ2-CB 4.44Å; W518-M539 HydrophobicContact CH2-CG 3.58Å; W518-M539 HydrophobicContact CH2-SD 4.08Å; W518-M539 HydrophobicContact CZ3-CG 3.91Å; W518-M539 HydrophobicContact CZ3-SD 3.75Å; W518-Y546 HydrophobicContact CB-CE1 4.25Å; W518-Y546 WeakPolarHBondContact CB-OH 3.39Å; W518-Y546 AromaticContact CE3-CD1 3.99Å; W518-Y546 HydrophobicContact CE3-CD1 3.99Å; W518-Y546 AromaticContact CE3-CD2 3.9Å; W518-Y546 HydrophobicContact CE3-CD2 3.9Å; W518-Y546 AromaticContact CE3-CE1 3.81Å; W518-Y546 HydrophobicContact CE3-CE1 3.81Å; W518-Y546 AromaticContact CE3-CE2 3.69Å; W518-Y546 HydrophobicContact CE3-CE2 3.69Å; W518-Y546 HydrophobicContact CE3-CG 4.05Å; W518-Y546 AromaticContact CE3-CZ 3.65Å; W518-Y546 HydrophobicContact CZ3-CD1 4.45Å; W518-Y546 HydrophobicContact CZ3-CD2 4Å; W518-Y546 HydrophobicContact CZ3-CE2 4.22Å; W518-Y546 HydrophobicContact CZ3-CG 4.13Å; W518-Y546 PolarHBondContact N-OH 3.26Å; W518-I568 HydrophobicContact CE3-CD1 3.98Å; W518-I568 HydrophobicContact CH2-CD1 4.15Å; W518-I568 HydrophobicContact CZ3-CD1 3.5Å; W518-I568 VanDerWaalsContact CZ3-CD1 3.5Å
519	V	90.8	Very high	89.5	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	154	-175	-56.8	0	0	0	0	114	K511 E517 L528 T529 I530 S531 Y546 I548	K511-V519 PolarHBondContact NZ-O 3.2Å; E517-V519 VanDerWaalsContact C-N 3.29Å; E517-V519 PolarHBondContact O-N 2.82Å; V519-L528 HydrophobicContact CB-CD2 4.19Å; V519-L528 HydrophobicContact CG2-CD1 4.33Å; V519-L528 HydrophobicContact CG2-CD2 3.82Å; V519-T529 CarbonylContact C-O 3.56Å; V519-T529 VanDerWaalsContact CA-O 3.29Å; V519-T529 WeakPolarHBondContact CA-O 3.46Å; V519-I530 HydrophobicContact CG1-CG1 4.32Å; V519-S531 WeakPolarHBondContact CA-OG 3.28Å; V519-Y546 HydrophobicContact CG1-CE1 4.49Å; V519-Y546 HydrophobicContact CG2-CE1 4.34Å; V519-I548 HydrophobicContact CG2-CD1 3.49Å; V519-I548 VanDerWaalsContact CG2-CD1 3.49Å; V519-I548 HydrophobicContact CG2-CG1 4.34Å
520	S	90.3	Very high	89.4	Confident	48 Å²	48	57.2 Å²	57.2	34%	0.336	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	147.7	171.1	37.4	0	0	0	0	109.4	L528 T529 S531	S520-L528 CarbonylContact O-C 3.52Å; S520-L528 WeakPolarHBondContact O-CA 3.36Å; S520-T529 WeakPolarHBondContact CB-OG1 3.49Å; S520-T529 PolarHBondContact N-O 2.86Å; S520-T529 PolarHBondContact O-N 2.98Å; S520-T529 PolarHBondContact O-OG1 2.86Å; S520-T529 PolarHBondContact OG-O 3.15Å; S520-T529 PolarHBondContact OG-OG1 3.06Å; S520-S531 WeakPolarHBondContact CB-OG 3.45Å; S520-S531 PolarHBondContact N-OG 3.24Å; S520-S531 PolarHBondContact OG-OG 2.82Å
521	I	92.1	Very high	89.3	Confident	26 Å²	26	54.1 Å²	54.1	13%	0.133	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	139.5	176.1	-163.7	163.8	0	0	0	110.2	Y509 K511 L527 L528 V550	Y509-I521 HydrophobicContact CD1-CD1 4.39Å; Y509-I521 HydrophobicContact CG-CD1 4.47Å; K511-I521 HydrophobicContact CB-CG2 3.99Å; I521-L527 WeakPolarHBondContact CA-O 2.89Å; I521-L528 HydrophobicContact CB-CD2 4.39Å; I521-V550 HydrophobicContact CD1-CB 4.42Å; I521-V550 HydrophobicContact CD1-CG1 3.54Å; I521-V550 HydrophobicContact CD1-CG2 3.94Å
522	E	90.9	Very high	89.1	Confident	73 Å²	73	55.4 Å²	55.4	34%	0.341	29%	0.294	S	S	.	.			trans	-84.7	118.6	178.7	178.4	167.8	-111.7	0	0	110.6	K490 V524 S525 G526 L527	K490-E522 IonicContact NZ-OE1 2.66Å; K490-E522 PolarHBondContact NZ-OE1 3.39Å; K490-E522 IonicContact NZ-OE2 2.71Å; K490-E522 PolarHBondContact NZ-OE2 2.87Å; E522-V524 VanDerWaalsContact C-N 3.26Å; E522-V524 PolarHBondContact O-N 3.31Å; E522-V524 VanDerWaalsContact O-N 3.07Å; E522-S525 WeakPolarHBondContact CB-OG 3.04Å; E522-S525 VanDerWaalsContact CG-OG 3.3Å; E522-S525 WeakPolarHBondContact CG-OG 3.48Å; E522-S525 PolarHBondContact O-N 3.42Å; E522-S525 PolarHBondContact OE2-OG 2.89Å; E522-G526 PolarHBondContact O-N 2.75Å; E522-L527 HydrophobicContact CB-CB 4.5Å; E522-L527 PolarHBondContact N-O 3.44Å
523	E	89.8	Confident	88.9	Confident	99 Å²	99	54.5 Å²	54.5	46%	0.463	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-38.4	-166.4	-172.5	-176.9	156.6	0	0	114	R508 Y509	R508-E523 CarbonylContact C-O 3.49Å; R508-E523 VanDerWaalsContact CA-O 3.31Å; R508-E523 WeakPolarHBondContact CA-O 3.45Å; R508-E523 HydrophobicContact CB-CG 4.15Å; R508-E523 WeakPolarHBondContact CD-OE1 3.32Å; R508-E523 HydrophobicContact CG-CG 4.39Å; R508-E523 IonicContact CZ-OE1 2.97Å; R508-E523 IonicContact NE-OE1 3.22Å; R508-E523 IonicContact NH1-OE1 3.43Å; R508-E523 PolarHBondContact NH1-OE1 2.73Å; Y509-E523 PolarHBondContact N-O 3.47Å
524	V	87.4	Confident	88.9	Confident	120 Å²	120	49 Å²	49	73%	0.727	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-20.4	-172.8	-174.7	0	0	0	0	113.2	E522	E522-V524 VanDerWaalsContact C-N 3.26Å; E522-V524 PolarHBondContact O-N 3.31Å; E522-V524 VanDerWaalsContact O-N 3.07Å
525	S	85.6	Confident	88.9	Confident	43 Å²	43	51.3 Å²	51.3	30%	0.301	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-14.9	-169.4	71.6	0	0	0	0	114.5	E522 L527	E522-S525 WeakPolarHBondContact CB-OG 3.04Å; E522-S525 VanDerWaalsContact CG-OG 3.3Å; E522-S525 WeakPolarHBondContact CG-OG 3.48Å; E522-S525 PolarHBondContact O-N 3.42Å; E522-S525 PolarHBondContact OE2-OG 2.89Å; S525-L527 PolarHBondContact O-N 3.13Å; S525-L527 WeakPolarHBondContact OG-CB 3Å; S525-L527 WeakPolarHBondContact OG-CG 3.34Å; S525-L527 PolarHBondContact OG-N 2.93Å
526	G	86.3	Confident	88.9	Confident	2 Å²	2	48 Å²	48	2%	0.021	26%	0.263	C	S	.	.			trans	68	2.8	-171.4	0	0	0	0	0	114.1	G493 E522	G493-G526 CarbonylContact C-O 3.54Å; G493-G526 WeakPolarHBondContact CA-O 3.4Å; E522-G526 PolarHBondContact O-N 2.75Å
527	L	90.7	Very high	88.9	Confident	47 Å²	47	45.2 Å²	45.2	25%	0.246	25%	0.251	C	S	.	.			trans	-68.8	137.9	-179.5	-69	173.3	0	0	0	111.4	K490 I521 E522 S525	K490-L527 HydrophobicContact CD-CD1 4.23Å; I521-L527 WeakPolarHBondContact CA-O 2.89Å; E522-L527 HydrophobicContact CB-CB 4.5Å; E522-L527 PolarHBondContact N-O 3.44Å; S525-L527 PolarHBondContact O-N 3.13Å; S525-L527 WeakPolarHBondContact OG-CB 3Å; S525-L527 WeakPolarHBondContact OG-CG 3.34Å; S525-L527 PolarHBondContact OG-N 2.93Å
528	L	90.9	Very high	88.6	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	146.1	166.6	-74.2	-173	0	0	0	110.6	I481 K490 I491 V519 S520 I521 I548 L564 V566	I481-L528 HydrophobicContact CD1-CD1 4.37Å; K490-L528 WeakPolarHBondContact CA-O 2.99Å; I491-L528 HydrophobicContact CB-CB 4.48Å; I491-L528 PolarHBondContact N-O 2.78Å; I491-L528 PolarHBondContact O-N 2.92Å; V519-L528 HydrophobicContact CB-CD2 4.19Å; V519-L528 HydrophobicContact CG2-CD1 4.33Å; V519-L528 HydrophobicContact CG2-CD2 3.82Å; S520-L528 CarbonylContact O-C 3.52Å; S520-L528 WeakPolarHBondContact O-CA 3.36Å; I521-L528 HydrophobicContact CB-CD2 4.39Å; L528-I548 HydrophobicContact CD1-CD1 4.34Å; L528-L564 HydrophobicContact CD1-CD2 3.62Å; L528-L564 HydrophobicContact CD2-CD2 4.16Å; L528-L564 HydrophobicContact CG-CD2 3.92Å; L528-V566 HydrophobicContact CD1-CG2 4.43Å
529	T	90.6	Very high	87.9	Confident	28 Å²	28	42 Å²	42	17%	0.172	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.4	170.3	40.2	0	0	0	0	108.1	S489 K490 V519 S520 S531	S489-T529 WeakPolarHBondContact O-CA 3.45Å; K490-T529 HydrophobicContact CD-CG2 4.41Å; K490-T529 HydrophobicContact CG-CG2 3.67Å; V519-T529 CarbonylContact C-O 3.56Å; V519-T529 VanDerWaalsContact CA-O 3.29Å; V519-T529 WeakPolarHBondContact CA-O 3.46Å; S520-T529 WeakPolarHBondContact CB-OG1 3.49Å; S520-T529 PolarHBondContact N-O 2.86Å; S520-T529 PolarHBondContact O-N 2.98Å; S520-T529 PolarHBondContact O-OG1 2.86Å; S520-T529 PolarHBondContact OG-O 3.15Å; S520-T529 PolarHBondContact OG-OG1 3.06Å; T529-S531 PolarHBondContact O-N 2.84Å
530	I	91.2	Very high	86.6	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.021	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	116.1	178.7	-69.1	174.1	0	0	0	109.1	I481 S485 G488 S489 I491 V519 K532 L534	I481-I530 HydrophobicContact CG2-CD1 3.87Å; S485-I530 VanDerWaalsContact CB-CD1 3.43Å; G488-I530 PolarHBondContact N-O 2.86Å; S489-I530 PolarHBondContact O-N 2.78Å; S489-I530 VanDerWaalsContact O-N 3.09Å; I491-I530 HydrophobicContact CD1-CD1 3.71Å; I491-I530 HydrophobicContact CD1-CG1 4.39Å; V519-I530 HydrophobicContact CG1-CG1 4.32Å; I530-K532 WeakPolarHBondContact CG2-O 3.43Å; I530-L534 HydrophobicContact CB-CD1 4.4Å; I530-L534 HydrophobicContact CD1-CD1 3.58Å; I530-L534 HydrophobicContact CG1-CD1 3.95Å; I530-L534 HydrophobicContact CG2-CD1 3.55Å
531	S	88.9	Confident	85.4	Confident	50 Å²	50	48.3 Å²	48.3	35%	0.35	29%	0.292	S	S	.	.			trans	-92.9	-29.1	-174	-41.3	0	0	0	0	113.2	W518 V519 S520 T529	W518-S531 PolarHBondContact O-N 2.68Å; V519-S531 WeakPolarHBondContact CA-OG 3.28Å; S520-S531 WeakPolarHBondContact CB-OG 3.45Å; S520-S531 PolarHBondContact N-OG 3.24Å; S520-S531 PolarHBondContact OG-OG 2.82Å; T529-S531 PolarHBondContact O-N 2.84Å
532	K	88.2	Confident	84.1	Confident	88 Å²	88	51.6 Å²	51.6	38%	0.383	30%	0.302	S	S	.	.	S	Bend	trans	-137.1	161.8	179.3	-57	179.2	-169.5	179.2	0	108.2	K516 E517 W518 I530 L534	K516-K532 PolarHBondContact O-NZ 2.72Å; E517-K532 WeakPolarHBondContact O-CD 3.31Å; E517-K532 VanDerWaalsContact O-CE 3.3Å; E517-K532 WeakPolarHBondContact O-CE 3.4Å; E517-K532 IonicContact OE2-NZ 3.19Å; E517-K532 PolarHBondContact OE2-NZ 3.26Å; W518-K532 PolarHBondContact O-N 2.74Å; I530-K532 WeakPolarHBondContact CG2-O 3.43Å; K532-L534 PolarHBondContact O-N 3.09Å
533	A	87.3	Confident	82.6	Confident	68 Å²	68	54.6 Å²	54.6	56%	0.562	32%	0.321	S	S	*	.			trans	-58.5	137.4	168.5	0	0	0	0	0	109.6	W518	W518-A533 PolarHBondContact NE1-O 3.37Å
534	L	88.9	Confident	81.6	Confident	11 Å²	11	54.5 Å²	54.5	6%	0.058	32%	0.324	C	S	.	.			trans	-83.6	154.6	170.3	-60.7	93.8	0	0	0	108.7	I481 E483 W518 I530 K532 I568	I481-L534 HydrophobicContact CB-CD2 4.49Å; I481-L534 HydrophobicContact CG2-CD1 4.23Å; I481-L534 HydrophobicContact CG2-CD2 3.87Å; E483-L534 HydrophobicContact CB-CB 4.08Å; W518-L534 HydrophobicContact CB-CG 4.28Å; W518-L534 HydrophobicContact CG-CG 4.39Å; I530-L534 HydrophobicContact CB-CD1 4.4Å; I530-L534 HydrophobicContact CD1-CD1 3.58Å; I530-L534 HydrophobicContact CG1-CD1 3.95Å; I530-L534 HydrophobicContact CG2-CD1 3.55Å; K532-L534 PolarHBondContact O-N 3.09Å; L534-I568 HydrophobicContact CD2-CD1 4Å; L534-I568 HydrophobicContact CD2-CG1 4.21Å
535	D	87.6	Confident	81.3	Confident	74 Å²	74	51.6 Å²	51.6	40%	0.396	30%	0.304	S	S	.	.			trans	-156.2	104	-171.8	164.8	-15.4	0	0	0	105	W518 E537 A538	W518-D535 WeakPolarHBondContact CH2-O 3.49Å; W518-D535 HydrophobicContact CZ2-CB 4.23Å; W518-D535 WeakPolarHBondContact CZ2-O 3.24Å; D535-E537 PolarHBondContact OD1-N 3.4Å; D535-A538 HydrophobicContact CB-CB 4.26Å; D535-A538 VanDerWaalsContact CG-CB 3.41Å; D535-A538 WeakPolarHBondContact OD1-CB 3.41Å; D535-A538 PolarHBondContact OD1-N 2.85Å; D535-A538 WeakPolarHBondContact OD2-CB 3.33Å
536	R	87.3	Confident	81.4	Confident	17 Å²	17	49.7 Å²	49.7	6%	0.064	29%	0.29	C	S	.	.	S	Bend	trans	-72.9	-34.1	-174.2	-170.2	-163.3	73.3	114.6	0.8	110.9	E483 A538 M539 I568 D570 L600 E602	E483-R536 WeakPolarHBondContact OE2-CB 3.42Å; E483-R536 PolarHBondContact OE2-N 2.68Å; R536-A538 VanDerWaalsContact C-N 3.25Å; R536-A538 PolarHBondContact O-N 2.98Å; R536-M539 WeakPolarHBondContact O-CB 3.38Å; R536-M539 PolarHBondContact O-N 3.2Å; R536-I568 HydrophobicContact CB-CB 4.49Å; R536-I568 HydrophobicContact CB-CG2 3.93Å; R536-I568 HydrophobicContact CG-CB 4.25Å; R536-I568 HydrophobicContact CG-CG2 4.17Å; R536-D570 IonicContact CZ-OD1 2.72Å; R536-D570 IonicContact NE-OD1 2.89Å; R536-D570 PolarHBondContact NE-OD1 2.77Å; R536-D570 IonicContact NH1-OD1 2.75Å; R536-D570 IonicContact NH2-OD1 3.75Å; R536-D570 PolarHBondContact NH2-OD1 3.3Å; R536-L600 PolarHBondContact NH2-O 2.95Å; R536-E602 IonicContact NH1-OE1 3.27Å
537	E	85.7	Confident	81.5	Confident	17 Å²	17	53.3 Å²	53.3	8%	0.079	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.3	-176.3	-78.4	54.4	-115.6	0	0	113	D535 M539 R542 L600	D535-E537 PolarHBondContact OD1-N 3.4Å; E537-M539 PolarHBondContact O-N 2.85Å; E537-R542 PolarHBondContact O-NE 3.12Å; E537-R542 PolarHBondContact O-NH2 2.95Å; E537-R542 VanDerWaalsContact O-NH2 3.12Å; E537-L600 HydrophobicContact CG-CB 3.59Å
538	A	81.8	Confident	81.5	Confident	40 Å²	40	51.1 Å²	51.1	33%	0.331	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-5.7	169.9	0	0	0	0	0	113.9	K516 W518 D535 R536	K516-A538 PolarHBondContact NZ-O 3.24Å; W518-A538 HydrophobicContact CZ2-CB 4.44Å; D535-A538 HydrophobicContact CB-CB 4.26Å; D535-A538 VanDerWaalsContact CG-CB 3.41Å; D535-A538 WeakPolarHBondContact OD1-CB 3.41Å; D535-A538 PolarHBondContact OD1-N 2.85Å; D535-A538 WeakPolarHBondContact OD2-CB 3.33Å; R536-A538 VanDerWaalsContact C-N 3.25Å; R536-A538 PolarHBondContact O-N 2.98Å
539	M	73.4	Confident	81.6	Confident	24 Å²	24	52.4 Å²	52.4	12%	0.118	31%	0.306	C	S	.	.	S	Bend	trans	-87.3	133.5	168.6	-59.8	-143.7	-70	0	0	111.5	W518 R536 E537 R542 D544 Y546 I568	W518-M539 HydrophobicContact CH2-CG 3.58Å; W518-M539 HydrophobicContact CH2-SD 4.08Å; W518-M539 HydrophobicContact CZ3-CG 3.91Å; W518-M539 HydrophobicContact CZ3-SD 3.75Å; R536-M539 WeakPolarHBondContact O-CB 3.38Å; R536-M539 PolarHBondContact O-N 3.2Å; E537-M539 PolarHBondContact O-N 2.85Å; M539-R542 VanDerWaalsContact O-CG 3.3Å; M539-R542 WeakPolarHBondContact O-CG 3.47Å; M539-D544 WeakPolarHBondContact CE-O 3.45Å; M539-Y546 HydrophobicContact SD-CD2 4.44Å; M539-Y546 HydrophobicContact SD-CG 4.48Å; M539-I568 HydrophobicContact CE-CD1 4.02Å; M539-I568 HydrophobicContact CE-CG1 4.5Å
540	A	64	Low	81.7	Confident	98 Å²	98	51.1 Å²	51.1	81%	0.81	30%	0.298	S	S	*	.	S	Bend	trans	-137.3	122.6	178.3	0	0	0	0	0	108.6
541	P	65.5	Low	81.8	Confident	84 Å²	84	52.6 Å²	52.6	55%	0.545	31%	0.305	S	S	.	.	S	Bend	cis	-65.6	154.7	-1.2	31	-35.7	0	0	0	112.6	D544	P541-D544 WeakPolarHBondContact CD-OD2 3.34Å; P541-D544 HydrophobicContact CG-CB 4.17Å; P541-D544 VanDerWaalsContact CG-OD2 3.25Å; P541-D544 WeakPolarHBondContact CG-OD2 3.42Å
542	R	63.5	Low	81.9	Confident	94 Å²	94	50.2 Å²	50.2	36%	0.355	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	144.3	172.4	-67.9	-178	180	177.4	-0.7	109.2	E537 M539 L600	E537-R542 PolarHBondContact O-NE 3.12Å; E537-R542 PolarHBondContact O-NH2 2.95Å; E537-R542 VanDerWaalsContact O-NH2 3.12Å; M539-R542 VanDerWaalsContact O-CG 3.3Å; M539-R542 WeakPolarHBondContact O-CG 3.47Å; R542-L600 PolarHBondContact NH1-O 2.96Å
543	N	61.1	Low	82.1	Confident	137 Å²	137	48 Å²	48	73%	0.733	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	6.9	-169.3	-45	-10.7	0	0	0	116
544	D	68.4	Low	82.3	Confident	97 Å²	97	45.8 Å²	45.8	52%	0.519	26%	0.259	S	S	.	.			trans	-76.3	147.1	167.6	-121.8	-23.3	0	0	0	111.2	M539 P541	M539-D544 WeakPolarHBondContact CE-O 3.45Å; P541-D544 WeakPolarHBondContact CD-OD2 3.34Å; P541-D544 HydrophobicContact CG-CB 4.17Å; P541-D544 VanDerWaalsContact CG-OD2 3.25Å; P541-D544 WeakPolarHBondContact CG-OD2 3.42Å
545	L	81.3	Confident	82.1	Confident	58 Å²	58	52.5 Å²	52.5	30%	0.304	29%	0.29	S	S	.	.			trans	-80.1	137.1	178.7	-69	171.5	0	0	0	111	Y478 N547 A565 N567	Y478-L545 HydrophobicContact CD1-CD1 4.45Å; Y478-L545 HydrophobicContact CE1-CD1 3.87Å; L545-N547 VanDerWaalsContact C-N 3.31Å; L545-N547 PolarHBondContact O-N 2.79Å; L545-A565 HydrophobicContact CD1-CB 4.22Å; L545-N567 HydrophobicContact CD2-CB 3.74Å
546	Y	86.8	Confident	81.9	Confident	3 Å²	3	55.1 Å²	55.1	1%	0.012	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	85.6	177	172.8	-130.2	0	0	0	109.5	D514 P515 K516 W518 V519 M539 I548 V566 I568	D514-Y546 PolarHBondContact OD1-OH 3.05Å; D514-Y546 PolarHBondContact OD2-OH 2.82Å; D514-Y546 VanDerWaalsContact OD2-OH 3.05Å; P515-Y546 HydrophobicContact CG-CD2 4.27Å; P515-Y546 HydrophobicContact CG-CE2 4.13Å; K516-Y546 HydrophobicContact CB-CE2 4.01Å; K516-Y546 HydrophobicContact CG-CE2 4.2Å; W518-Y546 HydrophobicContact CB-CE1 4.25Å; W518-Y546 WeakPolarHBondContact CB-OH 3.39Å; W518-Y546 AromaticContact CE3-CD1 3.99Å; W518-Y546 HydrophobicContact CE3-CD1 3.99Å; W518-Y546 AromaticContact CE3-CD2 3.9Å; W518-Y546 HydrophobicContact CE3-CD2 3.9Å; W518-Y546 AromaticContact CE3-CE1 3.81Å; W518-Y546 HydrophobicContact CE3-CE1 3.81Å; W518-Y546 AromaticContact CE3-CE2 3.69Å; W518-Y546 HydrophobicContact CE3-CE2 3.69Å; W518-Y546 HydrophobicContact CE3-CG 4.05Å; W518-Y546 AromaticContact CE3-CZ 3.65Å; W518-Y546 HydrophobicContact CZ3-CD1 4.45Å; W518-Y546 HydrophobicContact CZ3-CD2 4Å; W518-Y546 HydrophobicContact CZ3-CE2 4.22Å; W518-Y546 HydrophobicContact CZ3-CG 4.13Å; W518-Y546 PolarHBondContact N-OH 3.26Å; V519-Y546 HydrophobicContact CG1-CE1 4.49Å; V519-Y546 HydrophobicContact CG2-CE1 4.34Å; M539-Y546 HydrophobicContact SD-CD2 4.44Å; M539-Y546 HydrophobicContact SD-CG 4.48Å; Y546-I548 HydrophobicContact CD1-CD1 4.19Å; Y546-I548 HydrophobicContact CD1-CG1 4.34Å; Y546-I548 HydrophobicContact CE1-CD1 3.74Å; Y546-I548 HydrophobicContact CE1-CG1 3.94Å; Y546-I548 HydrophobicContact CE2-CG1 4.37Å; Y546-V566 WeakPolarHBondContact CB-O 3.44Å; Y546-V566 HydrophobicContact CD1-CB 3.75Å; Y546-V566 HydrophobicContact CD1-CG1 3.93Å; Y546-V566 HydrophobicContact CD1-CG2 4.26Å; Y546-V566 HydrophobicContact CG-CB 4.36Å; Y546-V566 PolarHBondContact N-O 2.81Å; Y546-V566 WeakPolarHBondContact O-CB 3.44Å; Y546-V566 PolarHBondContact O-N 2.76Å; Y546-I568 HydrophobicContact CD1-CD1 4.49Å
547	N	89.7	Confident	81.7	Confident	79 Å²	79	56.8 Å²	56.8	42%	0.422	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	119.4	-176.4	-68.4	-26.3	0	0	0	111.4	L545 T563 A565	L545-N547 VanDerWaalsContact C-N 3.31Å; L545-N547 PolarHBondContact O-N 2.79Å; N547-T563 HydrophobicContact CB-CG2 4.03Å; N547-A565 WeakPolarHBondContact OD1-CA 3.26Å; N547-A565 WeakPolarHBondContact OD1-CB 3.5Å
548	I	90.4	Very high	81.9	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.1	175.3	-54.2	152.3	0	0	0	107.7	K511 V519 L528 Y546 V550 L564 V566	K511-I548 HydrophobicContact CD-CG2 4.07Å; K511-I548 HydrophobicContact CG-CG2 3.78Å; V519-I548 HydrophobicContact CG2-CD1 3.49Å; V519-I548 VanDerWaalsContact CG2-CD1 3.49Å; V519-I548 HydrophobicContact CG2-CG1 4.34Å; L528-I548 HydrophobicContact CD1-CD1 4.34Å; Y546-I548 HydrophobicContact CD1-CD1 4.19Å; Y546-I548 HydrophobicContact CD1-CG1 4.34Å; Y546-I548 HydrophobicContact CE1-CD1 3.74Å; Y546-I548 HydrophobicContact CE1-CG1 3.94Å; Y546-I548 HydrophobicContact CE2-CG1 4.37Å; I548-V550 HydrophobicContact CG2-CG2 4.28Å; I548-L564 HydrophobicContact CB-CB 4.44Å; I548-L564 PolarHBondContact N-O 3.31Å; I548-L564 PolarHBondContact O-N 2.92Å; I548-V566 HydrophobicContact CD1-CG2 3.68Å
549	T	92.1	Very high	82.4	Confident	30 Å²	30	59.7 Å²	59.7	18%	0.184	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.1	171	62.5	0	0	0	0	111	L512 Q513	L512-T549 PolarHBondContact N-O 2.78Å; Q513-T549 HydrophobicContact CB-CG2 4.43Å; Q513-T549 WeakPolarHBondContact CB-OG1 3.21Å; Q513-T549 PolarHBondContact N-OG1 3.03Å; Q513-T549 PolarHBondContact O-N 2.75Å
550	V	92.6	Very high	83.3	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.006	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.3	-178.9	178.4	0	0	0	0	108.6	Y494 Y509 I521 I548 T561 G562	Y494-V550 HydrophobicContact CG-CB 4.26Å; Y494-V550 HydrophobicContact CG-CG1 4.45Å; Y509-V550 HydrophobicContact CD1-CG1 4.07Å; I521-V550 HydrophobicContact CD1-CB 4.42Å; I521-V550 HydrophobicContact CD1-CG1 3.54Å; I521-V550 HydrophobicContact CD1-CG2 3.94Å; I548-V550 HydrophobicContact CG2-CG2 4.28Å; V550-T561 CarbonylContact O-C 3.27Å; V550-T561 WeakPolarHBondContact O-CA 3.34Å; V550-G562 PolarHBondContact N-O 3.05Å; V550-G562 PolarHBondContact O-N 2.88Å
551	M	92.6	Very high	84.7	Confident	34 Å²	34	58.5 Å²	58.5	17%	0.167	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.1	172.9	-169.2	170.2	79.5	0	0	109.1	K510 L512 I553 C560	K510-M551 HydrophobicContact CD-CE 4.29Å; K510-M551 PolarHBondContact N-O 3.2Å; K510-M551 PolarHBondContact O-N 3.37Å; L512-M551 HydrophobicContact CD1-CB 3.83Å; L512-M551 HydrophobicContact CD1-CG 4.41Å; L512-M551 HydrophobicContact CD1-SD 3.98Å; L512-M551 HydrophobicContact CD2-CB 4.3Å; L512-M551 HydrophobicContact CD2-CE 4.26Å; L512-M551 HydrophobicContact CD2-SD 4.25Å; L512-M551 HydrophobicContact CG-CB 3.87Å; L512-M551 HydrophobicContact CG-SD 4.5Å; M551-I553 HydrophobicContact CE-CD1 3.54Å; M551-I553 HydrophobicContact CE-CG1 3.83Å; M551-I553 HydrophobicContact CG-CG1 4.24Å; M551-C560 VanDerWaalsContact CA-O 3.28Å; M551-C560 WeakPolarHBondContact CA-O 3.41Å; M551-C560 WeakPolarHBondContact CG-O 3.12Å
552	A	92.7	Very high	85.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	136.4	167.7	0	0	0	0	0	108.5	P470 A496 R508 Y509 S559 C560	P470-A552 HydrophobicContact CB-CB 4.46Å; P470-A552 HydrophobicContact CG-CB 4.49Å; A496-A552 HydrophobicContact CB-CB 3.42Å; A496-A552 VanDerWaalsContact CB-CB 3.42Å; R508-A552 CarbonylContact O-C 3.46Å; R508-A552 WeakPolarHBondContact O-CA 3.24Å; Y509-A552 HydrophobicContact CD1-CB 4.18Å; Y509-A552 HydrophobicContact CE1-CB 3.96Å; A552-S559 CarbonylContact O-C 3.54Å; A552-S559 WeakPolarHBondContact O-CA 3.12Å; A552-S559 WeakPolarHBondContact O-CB 3.49Å; A552-C560 PolarHBondContact N-O 3Å; A552-C560 PolarHBondContact O-N 2.93Å; A552-C560 VanDerWaalsContact O-N 3.11Å
553	I	91.8	Very high	87.3	Confident	42 Å²	42	51.9 Å²	51.9	22%	0.215	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.3	-175	-39.7	171.8	0	0	0	108.1	L507 R508 M551 K558	L507-I553 CarbonylContact C-O 3.52Å; L507-I553 WeakPolarHBondContact CA-O 3.39Å; R508-I553 PolarHBondContact N-O 2.99Å; R508-I553 PolarHBondContact O-N 3.43Å; M551-I553 HydrophobicContact CE-CD1 3.54Å; M551-I553 HydrophobicContact CE-CG1 3.83Å; M551-I553 HydrophobicContact CG-CG1 4.24Å; I553-K558 WeakPolarHBondContact CA-O 3.26Å; I553-K558 WeakPolarHBondContact CG2-O 3.44Å
554	D	90.3	Very high	88.8	Confident	21 Å²	21	45.4 Å²	45.4	11%	0.112	26%	0.257	C	S	.	.			trans	-85.4	167.9	170.8	177.1	55.4	0	0	0	112.2	P470 L507 D556 G557 K558	P470-D554 HydrophobicContact CG-CB 4.37Å; L507-D554 HydrophobicContact CD2-CB 3.81Å; D554-D556 VanDerWaalsContact C-N 3.28Å; D554-D556 PolarHBondContact O-N 2.65Å; D554-D556 PolarHBondContact OD2-N 3Å; D554-G557 WeakPolarHBondContact O-CA 3.31Å; D554-G557 PolarHBondContact O-N 2.84Å; D554-K558 PolarHBondContact N-O 3.45Å
555	Q	84.9	Confident	89.8	Confident	153 Å²	153	40.9 Å²	40.9	72%	0.715	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45	-43.4	168.7	-62.3	173	97.4	0	0	114	G557	Q555-G557 PolarHBondContact O-N 2.89Å
556	D	83.6	Confident	90.2	Very high	128 Å²	128	38.1 Å²	38.1	68%	0.684	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	10.2	177.3	-78.5	-27.9	0	0	0	113.6	D554 K558	D554-D556 VanDerWaalsContact C-N 3.28Å; D554-D556 PolarHBondContact O-N 2.65Å; D554-D556 PolarHBondContact OD2-N 3Å; D556-K558 VanDerWaalsContact C-N 3.28Å; D556-K558 PolarHBondContact O-N 3.35Å
557	G	84.6	Confident	90.3	Very high	52 Å²	52	41.1 Å²	41.1	54%	0.536	24%	0.235	S	C	.	.	S	Bend	trans	81.3	-0.7	167.1	0	0	0	0	0	115.5	D554 Q555	D554-G557 WeakPolarHBondContact O-CA 3.31Å; D554-G557 PolarHBondContact O-N 2.84Å; Q555-G557 PolarHBondContact O-N 2.89Å
558	K	89.1	Confident	90.3	Very high	58 Å²	58	37.8 Å²	37.8	25%	0.252	22%	0.218	S	C	.	.			trans	-65.2	150.9	168.1	-52.4	171.6	-158.7	166.2	0	109.7	D467 E468 I553 D554 D556	D467-K558 PolarHBondContact O-NZ 3.48Å; D467-K558 IonicContact OD1-NZ 2.69Å; D467-K558 PolarHBondContact OD1-NZ 3.16Å; D467-K558 IonicContact OD2-NZ 3.92Å; D467-K558 PolarHBondContact OD2-NZ 3.34Å; E468-K558 WeakPolarHBondContact O-CD 3.41Å; E468-K558 WeakPolarHBondContact O-CE 3.47Å; E468-K558 PolarHBondContact O-NZ 3.11Å; I553-K558 WeakPolarHBondContact CA-O 3.26Å; I553-K558 WeakPolarHBondContact CG2-O 3.44Å; D554-K558 PolarHBondContact N-O 3.45Å; D556-K558 VanDerWaalsContact C-N 3.28Å; D556-K558 PolarHBondContact O-N 3.35Å
559	S	92	Very high	90.1	Very high	60 Å²	60	40.5 Å²	40.5	42%	0.42	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	141.1	-176.1	63.6	0	0	0	0	114.4	A552	A552-S559 CarbonylContact O-C 3.54Å; A552-S559 WeakPolarHBondContact O-CA 3.12Å; A552-S559 WeakPolarHBondContact O-CB 3.49Å
560	C	91.9	Very high	89.9	Confident	20 Å²	20	40 Å²	40	14%	0.135	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	159.6	162.5	69.5	0	0	0	0	111.8	P470 C472 M551 A552	P470-C560 WeakPolarHBondContact O-CB 3.34Å; P470-C560 PolarHBondContact O-SG 2.79Å; C472-C560 HydrophobicContact CB-CB 3.64Å; C472-C560 WeakPolarHBondContact CB-SG 3.41Å; C472-C560 PolarHBondContact N-SG 3.49Å; C472-C560 VanDerWaalsContact SG-C 3.55Å; C472-C560 WeakPolarHBondContact SG-CB 3.44Å; C472-C560 CovalentContact SG-SG 2.03Å; C472-C560 PolarHBondContact SG-SG 2.95Å; M551-C560 VanDerWaalsContact CA-O 3.28Å; M551-C560 WeakPolarHBondContact CA-O 3.41Å; M551-C560 WeakPolarHBondContact CG-O 3.12Å; A552-C560 PolarHBondContact N-O 3Å; A552-C560 PolarHBondContact O-N 2.93Å; A552-C560 VanDerWaalsContact O-N 3.11Å
561	T	93.3	Very high	89.8	Confident	77 Å²	77	41.3 Å²	41.3	47%	0.472	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.8	169.9	-59.7	0	0	0	0	109.3	C472 L512 V550	C472-T561 VanDerWaalsContact SG-C 3.57Å; L512-T561 HydrophobicContact CD1-CG2 4.27Å; V550-T561 CarbonylContact O-C 3.27Å; V550-T561 WeakPolarHBondContact O-CA 3.34Å
562	G	91.8	Very high	89.6	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	156.9	172.9	0	0	0	0	0	111.3	V550	V550-G562 PolarHBondContact N-O 3.05Å; V550-G562 PolarHBondContact O-N 2.88Å
563	T	92.4	Very high	89.4	Confident	39 Å²	39	46.1 Å²	46.1	24%	0.239	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	131.7	172.9	-56.7	0	0	0	0	109.4	P475 E476 Q477 N547	P475-T563 PolarHBondContact O-N 2.74Å; E476-T563 WeakPolarHBondContact CA-O 3.21Å; Q477-T563 PolarHBondContact N-O 3.04Å; N547-T563 HydrophobicContact CB-CG2 4.03Å
564	L	92.2	Very high	89.2	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	101.8	172	-167.6	67.7	0	0	0	107.6	Q477 V479 Y494 L528 I548 V566	Q477-L564 HydrophobicContact CB-CD1 3.85Å; Q477-L564 CarbonylContact O-C 3.59Å; Q477-L564 WeakPolarHBondContact O-CA 3.32Å; V479-L564 HydrophobicContact CG2-CD1 3.68Å; V479-L564 HydrophobicContact CG2-CG 4.3Å; Y494-L564 HydrophobicContact CD2-CB 4.39Å; Y494-L564 HydrophobicContact CD2-CD1 4.23Å; L528-L564 HydrophobicContact CD1-CD2 3.62Å; L528-L564 HydrophobicContact CD2-CD2 4.16Å; L528-L564 HydrophobicContact CG-CD2 3.92Å; I548-L564 HydrophobicContact CB-CB 4.44Å; I548-L564 PolarHBondContact N-O 3.31Å; I548-L564 PolarHBondContact O-N 2.92Å; L564-V566 HydrophobicContact CG-CG2 4.41Å; L564-V566 PolarHBondContact O-N 2.83Å
565	A	90.6	Very high	89.2	Confident	2 Å²	2	46.6 Å²	46.6	2%	0.017	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	101.7	-179.7	0	0	0	0	0	109.3	Q477 Y478 V479 L545 N547	Q477-A565 PolarHBondContact O-N 3.06Å; Y478-A565 WeakPolarHBondContact CA-O 3.45Å; Y478-A565 HydrophobicContact CD1-CB 3.88Å; Y478-A565 HydrophobicContact CE1-CB 3.8Å; Y478-A565 HydrophobicContact CG-CB 4.36Å; V479-A565 PolarHBondContact N-O 3.32Å; V479-A565 VanDerWaalsContact N-O 3.12Å; L545-A565 HydrophobicContact CD1-CB 4.22Å; N547-A565 WeakPolarHBondContact OD1-CA 3.26Å; N547-A565 WeakPolarHBondContact OD1-CB 3.5Å
566	V	89.3	Confident	89.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.8	-179.3	175.7	0	0	0	0	110.1	V479 I481 L528 Y546 I548 L564 I568	V479-V566 HydrophobicContact CB-CG2 4.48Å; V479-V566 WeakPolarHBondContact O-CA 3.02Å; I481-V566 HydrophobicContact CB-CG1 4.26Å; I481-V566 HydrophobicContact CD1-CG1 3.65Å; I481-V566 HydrophobicContact CD1-CG2 4.44Å; I481-V566 HydrophobicContact CG1-CG1 3.85Å; L528-V566 HydrophobicContact CD1-CG2 4.43Å; Y546-V566 WeakPolarHBondContact CB-O 3.44Å; Y546-V566 HydrophobicContact CD1-CB 3.75Å; Y546-V566 HydrophobicContact CD1-CG1 3.93Å; Y546-V566 HydrophobicContact CD1-CG2 4.26Å; Y546-V566 HydrophobicContact CG-CB 4.36Å; Y546-V566 PolarHBondContact N-O 2.81Å; Y546-V566 WeakPolarHBondContact O-CB 3.44Å; Y546-V566 PolarHBondContact O-N 2.76Å; I548-V566 HydrophobicContact CD1-CG2 3.68Å; L564-V566 HydrophobicContact CG-CG2 4.41Å; L564-V566 PolarHBondContact O-N 2.83Å; V566-I568 HydrophobicContact CG1-CG1 4.23Å
567	N	88.7	Confident	90	Very high	66 Å²	66	38.5 Å²	38.5	35%	0.353	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	110.6	167.2	-175.9	96.2	0	0	0	109.1	V479 R480 I481 L545 E569	V479-N567 PolarHBondContact O-N 2.83Å; R480-N567 WeakPolarHBondContact CA-O 3.4Å; R480-N567 HydrophobicContact CG-CB 4.35Å; I481-N567 PolarHBondContact N-O 2.94Å; I481-N567 VanDerWaalsContact N-O 3.08Å; L545-N567 HydrophobicContact CD2-CB 3.74Å; N567-E569 PolarHBondContact O-N 2.86Å
568	I	88.5	Confident	90.3	Very high	10 Å²	10	36.1 Å²	36.1	5%	0.051	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	116.7	171.9	-55.7	178.3	0	0	0	108	I481 E483 W518 L534 R536 M539 Y546 V566	I481-I568 CarbonylContact O-C 3.59Å; I481-I568 VanDerWaalsContact O-CA 3.27Å; I481-I568 WeakPolarHBondContact O-CA 3.45Å; E483-I568 HydrophobicContact CB-CG2 3.79Å; W518-I568 HydrophobicContact CE3-CD1 3.98Å; W518-I568 HydrophobicContact CH2-CD1 4.15Å; W518-I568 HydrophobicContact CZ3-CD1 3.5Å; W518-I568 VanDerWaalsContact CZ3-CD1 3.5Å; L534-I568 HydrophobicContact CD2-CD1 4Å; L534-I568 HydrophobicContact CD2-CG1 4.21Å; R536-I568 HydrophobicContact CB-CB 4.49Å; R536-I568 HydrophobicContact CB-CG2 3.93Å; R536-I568 HydrophobicContact CG-CB 4.25Å; R536-I568 HydrophobicContact CG-CG2 4.17Å; M539-I568 HydrophobicContact CE-CD1 4.02Å; M539-I568 HydrophobicContact CE-CG1 4.5Å; Y546-I568 HydrophobicContact CD1-CD1 4.49Å; V566-I568 HydrophobicContact CG1-CG1 4.23Å
569	E	87.8	Confident	90.3	Very high	57 Å²	57	38 Å²	38	27%	0.266	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	120.3	176.8	-74.3	-174.1	176.1	0	0	109.9	R480 I481 K482 E483 N567	R480-E569 HydrophobicContact CB-CG 4.37Å; R480-E569 WeakPolarHBondContact CD-OE1 3.36Å; R480-E569 IonicContact NH1-OE1 3.6Å; I481-E569 PolarHBondContact O-N 2.88Å; K482-E569 WeakPolarHBondContact CE-OE2 3.45Å; K482-E569 HydrophobicContact CG-CB 4.02Å; K482-E569 IonicContact NZ-OE2 2.79Å; E483-E569 PolarHBondContact N-O 2.83Å; N567-E569 PolarHBondContact O-N 2.86Å
570	D	87.6	Confident	90.2	Very high	19 Å²	19	37.4 Å²	37.4	10%	0.102	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-58.5	137.3	179.9	-179.1	104.2	0	0	0	113	E483 R536 D601 E602 H605	E483-D570 VanDerWaalsContact OE1-CA 3.29Å; E483-D570 WeakPolarHBondContact OE1-CA 3.28Å; R536-D570 IonicContact CZ-OD1 2.72Å; R536-D570 IonicContact NE-OD1 2.89Å; R536-D570 PolarHBondContact NE-OD1 2.77Å; R536-D570 IonicContact NH1-OD1 2.75Å; R536-D570 IonicContact NH2-OD1 3.75Å; R536-D570 PolarHBondContact NH2-OD1 3.3Å; D570-D601 WeakPolarHBondContact OD1-CA 3.19Å; D570-E602 HydrophobicContact CB-CB 4.22Å; D570-E602 HydrophobicContact CB-CG 3.77Å; D570-E602 WeakPolarHBondContact OD1-CG 3.32Å; D570-E602 PolarHBondContact OD1-N 2.99Å; D570-E602 PolarHBondContact OD2-N 2.83Å; D570-H605 IonicContact OD2-CE1 3.05Å; D570-H605 PolarHBondContact OD2-CE1 3.09Å; D570-H605 IonicContact OD2-CG 3.61Å; D570-H605 IonicContact OD2-ND1 2.75Å; D570-H605 PolarHBondContact OD2-ND1 3.41Å
571	V	89.8	Confident	90	Very high	29 Å²	29	40.6 Å²	40.6	18%	0.176	22%	0.219	C	C	.	.			trans	-130.5	135.9	176.8	176.8	0	0	0	0	108	K482 E483 N484 D573	K482-V571 HydrophobicContact CB-CG2 4.35Å; E483-V571 HydrophobicContact CG-CB 4.19Å; E483-V571 HydrophobicContact CG-CG2 4.26Å; E483-V571 PolarHBondContact OE1-N 3.18Å; N484-V571 HydrophobicContact CB-CG1 4.49Å; N484-V571 HydrophobicContact CB-CG2 4.48Å; V571-D573 PolarHBondContact O-N 3.43Å
572	N	89.1	Confident	89.8	Confident	36 Å²	36	41.7 Å²	41.7	19%	0.193	22%	0.216	C	C	.	.	S	Bend	trans	-59.4	106.5	173.6	-173.7	-29.7	0	0	0	111.3	N574 D601 H605 D655 A657 Q659	N572-N574 PolarHBondContact OD1-O 2.78Å; N572-D601 VanDerWaalsContact CA-OD2 3.27Å; N572-D601 WeakPolarHBondContact CA-OD2 3.47Å; N572-H605 HydrophobicContact CB-CB 3.89Å; N572-H605 PolarHBondContact N-ND1 3.08Å; N572-D655 PolarHBondContact ND2-OD2 3.2Å; N572-A657 WeakPolarHBondContact ND2-CB 3.48Å; N572-Q659 WeakPolarHBondContact OD1-CG 3.32Å; N572-Q659 PolarHBondContact OD1-NE2 3.17Å
573	D	87.4	Confident	89.7	Confident	98 Å²	98	42.5 Å²	42.5	52%	0.524	22%	0.22	S	C	.	.			trans	-139.4	-30	-172.7	137.4	-57.9	0	0	0	111.2	V571 D601 Q659	V571-D573 PolarHBondContact O-N 3.43Å; D573-D601 PolarHBondContact N-OD2 2.81Å; D573-Q659 PolarHBondContact O-NE2 2.99Å
574	N	89.1	Confident	89.4	Confident	40 Å²	40	42 Å²	42	21%	0.214	22%	0.217	C	C	.	.			trans	-89.6	155.6	168.8	-61.3	-91	0	0	0	112.4	N572 L600 D601 Q659	N572-N574 PolarHBondContact OD1-O 2.78Å; N574-L600 HydrophobicContact CB-CB 4.12Å; N574-D601 WeakPolarHBondContact CB-OD1 3.45Å; N574-D601 PolarHBondContact N-OD1 2.95Å; N574-D601 PolarHBondContact N-OD2 3.05Å; N574-D601 PolarHBondContact ND2-OD1 3.02Å; N574-Q659 PolarHBondContact O-NE2 2.71Å; N574-Q659 VanDerWaalsContact O-NE2 3.14Å
575	A	90.3	Very high	89.2	Confident	34 Å²	34	42 Å²	42	28%	0.281	22%	0.217	S	C	.	.			trans	-112.6	139	170.8	0	0	0	0	0	108.9	E577 Q659 A661	A575-E577 PolarHBondContact O-N 2.72Å; A575-Q659 HydrophobicContact CB-CB 4.05Å; A575-A661 HydrophobicContact CB-CB 4.09Å
576	P	92.9	Very high	89	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-62.9	131.7	-170.7	18.8	-29.2	0	0	0	111.8	A597 D599 F609 V653 D655 A661	P576-A597 HydrophobicContact CB-CB 4.38Å; P576-D599 HydrophobicContact CB-CB 4.41Å; P576-D599 WeakPolarHBondContact CB-OD2 3.4Å; P576-D599 VanDerWaalsContact CD-OD2 3.3Å; P576-D599 WeakPolarHBondContact CD-OD2 3.4Å; P576-F609 HydrophobicContact CB-CD1 3.92Å; P576-F609 HydrophobicContact CB-CE1 3.67Å; P576-F609 HydrophobicContact CB-CZ 4.11Å; P576-F609 HydrophobicContact CG-CD1 4.05Å; P576-F609 HydrophobicContact CG-CE1 4.17Å; P576-V653 HydrophobicContact CB-CG1 4.26Å; P576-V653 HydrophobicContact CB-CG2 4.35Å; P576-V653 HydrophobicContact CG-CG1 4.23Å; P576-V653 HydrophobicContact CG-CG2 4.19Å; P576-V653 WeakPolarHBondContact O-CG1 3.42Å; P576-D655 HydrophobicContact CG-CB 4.12Å; P576-A661 WeakPolarHBondContact O-CB 3.25Å
577	E	91.2	Very high	88.7	Confident	111 Å²	111	45.4 Å²	45.4	52%	0.519	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	136.4	-179.7	-152.5	-159.4	152	0	0	111.7	A575 I579 A597 M598 K663	A575-E577 PolarHBondContact O-N 2.72Å; E577-I579 PolarHBondContact O-N 2.85Å; E577-A597 CarbonylContact O-C 3.59Å; E577-A597 WeakPolarHBondContact O-CA 2.93Å; E577-M598 PolarHBondContact N-O 2.95Å; E577-M598 PolarHBondContact O-N 3.32Å; E577-K663 HydrophobicContact CG-CD 4.26Å; E577-K663 WeakPolarHBondContact OE1-CE 3.32Å; E577-K663 IonicContact OE1-NZ 2.73Å; E577-K663 PolarHBondContact OE1-NZ 3.03Å
578	I	91.2	Very high	88.4	Confident	1 Å²	1	46 Å²	46	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	121.4	174.2	-56.5	170.9	0	0	0	109.2	Q580 I595 A597 V651 V653 K663 L665	I578-Q580 VanDerWaalsContact C-N 3.28Å; I578-Q580 PolarHBondContact O-N 3.06Å; I578-I595 HydrophobicContact CD1-CD1 4.38Å; I578-I595 HydrophobicContact CG2-CB 4.27Å; I578-I595 HydrophobicContact CG2-CD1 4.49Å; I578-A597 HydrophobicContact CG1-CB 4.35Å; I578-V651 HydrophobicContact CD1-CB 3.62Å; I578-V651 HydrophobicContact CD1-CG1 3.51Å; I578-V653 HydrophobicContact CD1-CB 4.33Å; I578-V653 HydrophobicContact CD1-CG1 4.16Å; I578-V653 HydrophobicContact CG1-CB 4.23Å; I578-V653 HydrophobicContact CG1-CG1 3.74Å; I578-K663 HydrophobicContact CB-CD 4.17Å; I578-K663 HydrophobicContact CD1-CB 4.43Å; I578-K663 VanDerWaalsContact O-CD 3.24Å; I578-K663 WeakPolarHBondContact O-CD 3.01Å; I578-K663 PolarHBondContact O-NZ 2.73Å; I578-L665 HydrophobicContact CB-CD2 4.45Å; I578-L665 HydrophobicContact CG2-CD2 3.91Å
579	I	89.8	Confident	88.1	Confident	98 Å²	98	52.6 Å²	52.6	50%	0.503	27%	0.267	S	S	.	.	S	Bend	trans	-66.1	-29.9	-170.6	-55.5	178.3	0	0	0	111.9	E577 S596 M598	E577-I579 PolarHBondContact O-N 2.85Å; I579-S596 PolarHBondContact N-O 2.91Å; I579-M598 HydrophobicContact CD1-CB 4Å; I579-M598 HydrophobicContact CG1-CB 4.09Å
580	Q	90.3	Very high	87.9	Confident	48 Å²	48	52.7 Å²	52.7	22%	0.224	27%	0.268	C	S	.	.			trans	-90.1	126.2	-176.7	-58.9	81.3	20.4	0	0	112.7	I578 L583 S596 L665	I578-Q580 VanDerWaalsContact C-N 3.28Å; I578-Q580 PolarHBondContact O-N 3.06Å; Q580-L583 HydrophobicContact CB-CD2 3.86Å; Q580-L583 HydrophobicContact CB-CG 4.42Å; Q580-L583 HydrophobicContact CG-CD2 4.03Å; Q580-S596 PolarHBondContact NE2-OG 2.89Å; Q580-S596 PolarHBondContact OE1-O 3.2Å; Q580-L665 WeakPolarHBondContact O-CD2 3.46Å
581	D	86.9	Confident	87.7	Confident	86 Å²	86	53.8 Å²	53.8	46%	0.46	28%	0.284	S	S	.	.	S	Bend	trans	-90.4	-30	171.7	-65.9	-27.3	0	0	0	113.7	K663 R666	D581-K663 WeakPolarHBondContact OD1-CE 3.34Å; D581-K663 IonicContact OD1-NZ 3.13Å; D581-K663 PolarHBondContact OD1-NZ 2.83Å; D581-R666 PolarHBondContact O-N 3.45Å
582	Y	89.3	Confident	87.7	Confident	100 Å²	100	57.3 Å²	57.3	39%	0.392	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	130.4	-169.8	-171.1	-102.2	0	0	0	110.3	V584 R666 N668	Y582-V584 HydrophobicContact CD1-CG2 4.02Å; Y582-V584 HydrophobicContact CE1-CG2 3.38Å; Y582-R666 CarbonylContact C-O 3.6Å; Y582-R666 WeakPolarHBondContact CA-O 3.38Å; Y582-R666 HydrophobicContact CD2-CB 3.69Å; Y582-R666 HydrophobicContact CE2-CB 4.24Å; Y582-N668 HydrophobicContact CE2-CB 4.44Å; Y582-N668 WeakPolarHBondContact OH-CB 3.4Å; Y582-N668 PolarHBondContact OH-ND2 3.19Å
583	L	88.5	Confident	87.7	Confident	19 Å²	19	56.1 Å²	56.1	10%	0.099	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	142	-178.4	-60.7	168.7	0	0	0	109.3	Q580 I595 L636 L665 R666 V667 N668	Q580-L583 HydrophobicContact CB-CD2 3.86Å; Q580-L583 HydrophobicContact CB-CG 4.42Å; Q580-L583 HydrophobicContact CG-CD2 4.03Å; L583-I595 HydrophobicContact CD1-CG2 3.49Å; L583-I595 VanDerWaalsContact CD1-CG2 3.49Å; L583-I595 HydrophobicContact CD2-CG2 4.42Å; L583-L636 HydrophobicContact CD1-CD2 4.21Å; L583-L665 HydrophobicContact CD1-CD1 4.22Å; L583-R666 PolarHBondContact N-O 3.13Å; L583-V667 HydrophobicContact CB-CG1 4.18Å; L583-V667 HydrophobicContact CB-CG2 4.13Å; L583-V667 HydrophobicContact CD1-CG2 4.01Å; L583-V667 CarbonylContact O-C 3.51Å; L583-V667 WeakPolarHBondContact O-CA 3.26Å; L583-N668 PolarHBondContact O-N 2.88Å
584	V	87.1	Confident	87.9	Confident	29 Å²	29	54.7 Å²	54.7	18%	0.176	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	127.9	174.8	-177.4	0	0	0	0	108.6	Y582 N668 C670 P675 C678	Y582-V584 HydrophobicContact CD1-CG2 4.02Å; Y582-V584 HydrophobicContact CE1-CG2 3.38Å; V584-N668 WeakPolarHBondContact CA-O 3.35Å; V584-N668 HydrophobicContact CG2-CB 4.33Å; V584-C670 WeakPolarHBondContact CG1-SG 3.22Å; V584-P675 HydrophobicContact CB-CB 4.08Å; V584-P675 HydrophobicContact CG1-CB 4.13Å; V584-C678 HydrophobicContact CG1-CB 3.82Å
585	I	87.7	Confident	88.1	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	111.7	-177.4	-57	-173	0	0	0	108.5	K587 M590 A593 W624 Y638 V667 N668 L669 C670	I585-K587 PolarHBondContact O-N 2.87Å; I585-K587 VanDerWaalsContact O-N 3.1Å; I585-M590 HydrophobicContact CG2-CB 3.78Å; I585-A593 HydrophobicContact CD1-CB 3.79Å; I585-A593 HydrophobicContact CG1-CB 3.98Å; I585-W624 HydrophobicContact CD1-CH2 3.98Å; I585-W624 HydrophobicContact CD1-CZ3 3.85Å; I585-Y638 HydrophobicContact CG2-CD1 4.12Å; I585-Y638 HydrophobicContact CG2-CE1 3.62Å; I585-V667 HydrophobicContact CD1-CG1 3.75Å; I585-V667 HydrophobicContact CG1-CG1 4.05Å; I585-N668 PolarHBondContact N-O 3.22Å; I585-L669 HydrophobicContact CB-CD1 3.89Å; I585-L669 HydrophobicContact CG2-CD1 3.77Å; I585-C670 PolarHBondContact O-N 3.39Å; I585-C670 VanDerWaalsContact O-N 3.09Å
586	C	87.1	Confident	88.2	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.014	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	98.8	173	-71.5	0	0	0	0	110.3	P588 K589 M590 C672	C586-P588 VanDerWaalsContact C-N 3.26Å; C586-P588 VanDerWaalsContact O-N 3.07Å; C586-K589 HydrophobicContact CB-CB 4.48Å; C586-K589 PolarHBondContact O-N 3.42Å; C586-M590 HydrophobicContact CB-CG 4.25Å; C586-M590 HydrophobicContact CB-SD 4.05Å; C586-M590 PolarHBondContact N-SD 3.46Å; C586-M590 PolarHBondContact O-N 2.84Å; C586-C672 WeakPolarHBondContact CA-SG 3.35Å; C586-C672 HydrophobicContact CB-CB 4.2Å; C586-C672 VanDerWaalsContact CB-O 3.32Å; C586-C672 WeakPolarHBondContact CB-O 3.23Å; C586-C672 WeakPolarHBondContact CB-SG 3.39Å; C586-C672 VanDerWaalsContact SG-C 3.57Å; C586-C672 WeakPolarHBondContact SG-CB 3.46Å; C586-C672 CovalentContact SG-SG 2.03Å; C586-C672 PolarHBondContact SG-SG 2.75Å
587	K	83.4	Confident	88.1	Confident	71 Å²	71	52.8 Å²	52.8	31%	0.309	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-33.7	-177.7	-167	172.7	177.3	178	0	115.1	I585 Y638 A642 V644 L669 C670	I585-K587 PolarHBondContact O-N 2.87Å; I585-K587 VanDerWaalsContact O-N 3.1Å; K587-Y638 HydrophobicContact CG-CE2 4.14Å; K587-Y638 PolarHBondContact O-OH 2.87Å; K587-A642 PolarHBondContact NZ-O 2.57Å; K587-V644 HydrophobicContact CD-CG2 4.21Å; K587-L669 HydrophobicContact CB-CD1 3.97Å; K587-L669 HydrophobicContact CB-CG 4.5Å; K587-L669 HydrophobicContact CD-CD2 4.47Å; K587-L669 HydrophobicContact CD-CG 4.44Å; K587-L669 HydrophobicContact CG-CD1 4.3Å; K587-C670 PolarHBondContact N-O 3.12Å
588	P	82.1	Confident	88.1	Confident	79 Å²	79	52.3 Å²	52.3	51%	0.513	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-17.5	175.9	-18.4	32.2	0	0	0	116	C586 D671	C586-P588 VanDerWaalsContact C-N 3.26Å; C586-P588 VanDerWaalsContact O-N 3.07Å; P588-D671 WeakPolarHBondContact CG-OD1 3.33Å
589	K	81.1	Confident	88.1	Confident	147 Å²	147	53 Å²	53	64%	0.639	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.4	-17.3	-170.4	-70.6	-168	-179.4	179.8	0	115.2	C586 T673	C586-K589 HydrophobicContact CB-CB 4.48Å; C586-K589 PolarHBondContact O-N 3.42Å; K589-T673 PolarHBondContact NZ-O 2.84Å
590	M	84.4	Confident	88.1	Confident	59 Å²	59	51.3 Å²	51.3	29%	0.291	27%	0.265	S	S	.	.			trans	-123.7	120.6	-175.9	-61.5	173.7	71.8	0	0	108.7	I585 C586 Y638 P675	I585-M590 HydrophobicContact CG2-CB 3.78Å; C586-M590 HydrophobicContact CB-CG 4.25Å; C586-M590 HydrophobicContact CB-SD 4.05Å; C586-M590 PolarHBondContact N-SD 3.46Å; C586-M590 PolarHBondContact O-N 2.84Å; M590-Y638 VanDerWaalsContact O-CE1 3.23Å; M590-Y638 WeakPolarHBondContact O-CE1 3.45Å; M590-Y638 PolarHBondContact O-OH 3.49Å; M590-P675 HydrophobicContact SD-CG 4.22Å
591	G	83.8	Confident	88	Confident	42 Å²	42	49.6 Å²	49.6	43%	0.433	26%	0.257	S	S	.	.	S	Bend	trans	-90	-9.1	172.2	0	0	0	0	0	113.8
592	Y	89.3	Confident	88	Confident	104 Å²	104	49 Å²	49	41%	0.408	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	168.7	-176	61.8	-94	0	0	0	110.8	D594 R635 L636	Y592-D594 WeakPolarHBondContact CD2-OD1 3.47Å; Y592-R635 HydrophobicContact CD1-CG 4.49Å; Y592-R635 HydrophobicContact CD2-CG 3.71Å; Y592-R635 VanDerWaalsContact CD2-NE 3.27Å; Y592-R635 HydrophobicContact CE2-CG 4.5Å; Y592-R635 VanDerWaalsContact CE2-CZ 3.45Å; Y592-R635 HydrophobicContact CG-CG 3.71Å; Y592-L636 CarbonylContact C-O 3.56Å; Y592-L636 VanDerWaalsContact CA-O 3.23Å; Y592-L636 WeakPolarHBondContact CA-O 3.32Å; Y592-L636 WeakPolarHBondContact CB-O 3.32Å
593	A	89.6	Confident	87.9	Confident	11 Å²	11	48.7 Å²	48.7	9%	0.091	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	147.2	158.1	0	0	0	0	0	108.7	I585 L636	I585-A593 HydrophobicContact CD1-CB 3.79Å; I585-A593 HydrophobicContact CG1-CB 3.98Å; A593-L636 PolarHBondContact N-O 2.85Å; A593-L636 PolarHBondContact O-N 3.42Å
594	D	90.8	Very high	87.8	Confident	67 Å²	67	51.9 Å²	51.9	36%	0.358	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	137.4	174.9	-64.3	-28.9	0	0	0	109.5	Y592 A634 R635	Y592-D594 WeakPolarHBondContact CD2-OD1 3.47Å; D594-A634 WeakPolarHBondContact CA-O 3.35Å; D594-R635 WeakPolarHBondContact OD1-CA 3.28Å; D594-R635 VanDerWaalsContact OD1-CB 3.31Å; D594-R635 WeakPolarHBondContact OD1-CB 3.42Å; D594-R635 VanDerWaalsContact OD1-CG 3.32Å; D594-R635 WeakPolarHBondContact OD1-CG 3.45Å; D594-R635 IonicContact OD1-CZ 3.59Å; D594-R635 IonicContact OD1-NE 3.35Å; D594-R635 PolarHBondContact OD1-NE 3.12Å; D594-R635 IonicContact OD1-NH2 2.73Å; D594-R635 PolarHBondContact OD1-NH2 2.84Å; D594-R635 IonicContact OD2-CZ 2.67Å; D594-R635 IonicContact OD2-NE 2.68Å; D594-R635 IonicContact OD2-NH2 3.46Å; D594-R635 PolarHBondContact OD2-NH2 2.79Å
595	I	93	Very high	87.9	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.2	179.2	63.4	171	0	0	0	109.1	I578 L583 F611 L626 A633 A634 V651 L665	I578-I595 HydrophobicContact CD1-CD1 4.38Å; I578-I595 HydrophobicContact CG2-CB 4.27Å; I578-I595 HydrophobicContact CG2-CD1 4.49Å; L583-I595 HydrophobicContact CD1-CG2 3.49Å; L583-I595 VanDerWaalsContact CD1-CG2 3.49Å; L583-I595 HydrophobicContact CD2-CG2 4.42Å; I595-F611 HydrophobicContact CD1-CD1 4.38Å; I595-L626 HydrophobicContact CD1-CD1 4.01Å; I595-L626 HydrophobicContact CG1-CD1 4.47Å; I595-A633 CarbonylContact O-C 3.57Å; I595-A633 WeakPolarHBondContact O-CA 3.35Å; I595-A633 VanDerWaalsContact O-CB 3.23Å; I595-A633 WeakPolarHBondContact O-CB 3.35Å; I595-A634 HydrophobicContact CG1-CB 4.28Å; I595-A634 WeakPolarHBondContact CG1-O 3.36Å; I595-A634 PolarHBondContact N-O 3.11Å; I595-A634 PolarHBondContact O-N 3.09Å; I595-V651 HydrophobicContact CD1-CG1 4.16Å; I595-V651 HydrophobicContact CD1-CG2 4.31Å; I595-L665 HydrophobicContact CD1-CD1 3.79Å; I595-L665 HydrophobicContact CG2-CD1 4.05Å
596	S	92.8	Very high	87.9	Confident	28 Å²	28	52.7 Å²	52.7	20%	0.196	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	137.5	-178.8	58.6	0	0	0	0	110.1	I579 Q580 T632	I579-S596 PolarHBondContact N-O 2.91Å; Q580-S596 PolarHBondContact NE2-OG 2.89Å; Q580-S596 PolarHBondContact OE1-O 3.2Å; S596-T632 WeakPolarHBondContact CA-O 3.25Å
597	A	91.5	Very high	87.9	Confident	5 Å²	5	54.2 Å²	54.2	4%	0.041	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	158.3	166.5	0	0	0	0	0	110.9	P576 E577 I578 F609 F611 T632 V653	P576-A597 HydrophobicContact CB-CB 4.38Å; E577-A597 CarbonylContact O-C 3.59Å; E577-A597 WeakPolarHBondContact O-CA 2.93Å; I578-A597 HydrophobicContact CG1-CB 4.35Å; A597-F609 HydrophobicContact CB-CD2 3.71Å; A597-F609 HydrophobicContact CB-CE2 3.83Å; A597-F609 HydrophobicContact CB-CG 4.45Å; A597-F609 WeakPolarHBondContact O-CE2 3.15Å; A597-F611 HydrophobicContact CB-CE1 3.95Å; A597-F611 HydrophobicContact CB-CZ 3.83Å; A597-T632 PolarHBondContact N-O 2.8Å; A597-V653 HydrophobicContact CB-CG1 4.28Å; A597-V653 HydrophobicContact CB-CG2 3.88Å
598	M	91.1	Very high	88.3	Confident	101 Å²	101	53.4 Å²	53.4	50%	0.498	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	135.2	168.7	175.1	166.1	177.6	0	0	107.5	E577 I579 L600	E577-M598 PolarHBondContact N-O 2.95Å; E577-M598 PolarHBondContact O-N 3.32Å; I579-M598 HydrophobicContact CD1-CB 4Å; I579-M598 HydrophobicContact CG1-CB 4.09Å; M598-L600 HydrophobicContact CE-CD2 4.19Å
599	D	91.4	Very high	88.8	Confident	15 Å²	15	49.8 Å²	49.8	8%	0.08	27%	0.272	C	S	.	.			trans	-97.4	160.9	164.5	-133.2	-47.3	0	0	0	109.7	P576 G606 F609	P576-D599 HydrophobicContact CB-CB 4.41Å; P576-D599 WeakPolarHBondContact CB-OD2 3.4Å; P576-D599 VanDerWaalsContact CD-OD2 3.3Å; P576-D599 WeakPolarHBondContact CD-OD2 3.4Å; D599-G606 WeakPolarHBondContact OD2-CA 3.4Å; D599-F609 HydrophobicContact CB-CE1 3.91Å; D599-F609 HydrophobicContact CB-CZ 3.88Å
600	L	88.1	Confident	89.2	Confident	64 Å²	64	47.6 Å²	47.6	34%	0.335	26%	0.264	S	S	.	.	S	Bend	trans	-96.9	-30	174.8	-55.8	-170.2	0	0	0	112.3	R536 E537 R542 N574 M598	R536-L600 PolarHBondContact NH2-O 2.95Å; E537-L600 HydrophobicContact CG-CB 3.59Å; R542-L600 PolarHBondContact NH1-O 2.96Å; N574-L600 HydrophobicContact CB-CB 4.12Å; M598-L600 HydrophobicContact CE-CD2 4.19Å
601	D	89.2	Confident	89.6	Confident	12 Å²	12	45.8 Å²	45.8	6%	0.064	25%	0.254	C	S	.	.	S	Bend	trans	-67.8	173.1	178.7	-58	3.9	0	0	0	113	D570 N572 D573 N574 H605	D570-D601 WeakPolarHBondContact OD1-CA 3.19Å; N572-D601 VanDerWaalsContact CA-OD2 3.27Å; N572-D601 WeakPolarHBondContact CA-OD2 3.47Å; D573-D601 PolarHBondContact N-OD2 2.81Å; N574-D601 WeakPolarHBondContact CB-OD1 3.45Å; N574-D601 PolarHBondContact N-OD1 2.95Å; N574-D601 PolarHBondContact N-OD2 3.05Å; N574-D601 PolarHBondContact ND2-OD1 3.02Å; D601-H605 HydrophobicContact CB-CB 4.19Å
602	E	87.1	Confident	89.8	Confident	72 Å²	72	48 Å²	48	34%	0.336	26%	0.256	S	S	.	.			trans	-63.4	156.2	176.7	-80.1	-165.8	-165.4	0	0	113	R536 D570 V604 H605 G606	R536-E602 IonicContact NH1-OE1 3.27Å; D570-E602 HydrophobicContact CB-CB 4.22Å; D570-E602 HydrophobicContact CB-CG 3.77Å; D570-E602 WeakPolarHBondContact OD1-CG 3.32Å; D570-E602 PolarHBondContact OD1-N 2.99Å; D570-E602 PolarHBondContact OD2-N 2.83Å; E602-V604 PolarHBondContact O-N 3.34Å; E602-H605 PolarHBondContact O-N 3Å; E602-G606 PolarHBondContact O-N 3.26Å
603	P	87.1	Confident	89.7	Confident	95 Å²	95	44.8 Å²	44.8	62%	0.617	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-5.1	170.4	-24.6	35	0	0	0	116
604	V	86.6	Confident	89	Confident	86 Å²	86	45.3 Å²	45.3	52%	0.521	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-37.8	170.6	-178.8	0	0	0	0	111.2	E602	E602-V604 PolarHBondContact O-N 3.34Å
605	H	88.6	Confident	87.8	Confident	46 Å²	46	47.7 Å²	47.7	21%	0.213	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-38.1	-178.4	-65	132	0	0	0	112.9	D570 N572 D601 E602 R656 A657	D570-H605 IonicContact OD2-CE1 3.05Å; D570-H605 PolarHBondContact OD2-CE1 3.09Å; D570-H605 IonicContact OD2-CG 3.61Å; D570-H605 IonicContact OD2-ND1 2.75Å; D570-H605 PolarHBondContact OD2-ND1 3.41Å; N572-H605 HydrophobicContact CB-CB 3.89Å; N572-H605 PolarHBondContact N-ND1 3.08Å; D601-H605 HydrophobicContact CB-CB 4.19Å; E602-H605 PolarHBondContact O-N 3Å; H605-R656 PolarHBondContact O-N 2.99Å; H605-A657 HydrophobicContact CB-CB 4.48Å
606	G	87	Confident	86.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	-71.4	-111.1	-179.9	0	0	0	0	0	115	D599 E602 F609 R656	D599-G606 WeakPolarHBondContact OD2-CA 3.4Å; E602-G606 PolarHBondContact O-N 3.26Å; G606-F609 VanDerWaalsContact C-CE1 3.5Å; G606-R656 WeakPolarHBondContact O-CB 3.42Å; G606-R656 PolarHBondContact O-N 3Å
607	P	88.9	Confident	84.7	Confident	34 Å²	34	52.5 Å²	52.5	22%	0.221	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-68.8	156.7	-173.6	26.8	-34.8	0	0	0	114	F609 D631 T632	P607-F609 HydrophobicContact CB-CD1 4.3Å; P607-F609 HydrophobicContact CB-CE1 4.05Å; P607-F609 HydrophobicContact CB-CE2 4.32Å; P607-F609 HydrophobicContact CB-CZ 4.04Å; P607-F609 HydrophobicContact CG-CE1 4.49Å; P607-F609 HydrophobicContact CG-CZ 4.31Å; P607-D631 HydrophobicContact CB-CB 4.47Å; P607-T632 HydrophobicContact CB-CG2 4.2Å
608	P	91.1	Very high	83.5	Confident	53 Å²	53	57 Å²	57	34%	0.344	34%	0.335	S	S	.	.	S	Bend	cis	-80.2	131	7.9	31.5	-35.7	0	0	0	113.6	D631	P608-D631 WeakPolarHBondContact CA-O 3.31Å; P608-D631 HydrophobicContact CB-CB 3.79Å
609	F	92.3	Very high	82.5	Confident	3 Å²	3	58.9 Å²	58.9	1%	0.013	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-77.8	149.7	-178.2	-53.4	-45.4	0	0	0	112.8	P576 A597 D599 G606 P607 F611 Q628 D631 T632 V653 K654	P576-F609 HydrophobicContact CB-CD1 3.92Å; P576-F609 HydrophobicContact CB-CE1 3.67Å; P576-F609 HydrophobicContact CB-CZ 4.11Å; P576-F609 HydrophobicContact CG-CD1 4.05Å; P576-F609 HydrophobicContact CG-CE1 4.17Å; A597-F609 HydrophobicContact CB-CD2 3.71Å; A597-F609 HydrophobicContact CB-CE2 3.83Å; A597-F609 HydrophobicContact CB-CG 4.45Å; A597-F609 WeakPolarHBondContact O-CE2 3.15Å; D599-F609 HydrophobicContact CB-CE1 3.91Å; D599-F609 HydrophobicContact CB-CZ 3.88Å; G606-F609 VanDerWaalsContact C-CE1 3.5Å; P607-F609 HydrophobicContact CB-CD1 4.3Å; P607-F609 HydrophobicContact CB-CE1 4.05Å; P607-F609 HydrophobicContact CB-CE2 4.32Å; P607-F609 HydrophobicContact CB-CZ 4.04Å; P607-F609 HydrophobicContact CG-CE1 4.49Å; P607-F609 HydrophobicContact CG-CZ 4.31Å; F609-F611 HydrophobicContact CB-CD2 4.26Å; F609-F611 HydrophobicContact CB-CE2 3.7Å; F609-F611 HydrophobicContact CB-CZ 4.12Å; F609-F611 HydrophobicContact CD2-CE2 4.38Å; F609-F611 HydrophobicContact CD2-CZ 4.2Å; F609-Q628 PolarHBondContact O-NE2 2.89Å; F609-Q628 PolarHBondContact O-OE1 2.74Å; F609-D631 WeakPolarHBondContact CD2-O 3.4Å; F609-D631 PolarHBondContact N-O 3.17Å; F609-T632 HydrophobicContact CE2-CG2 4.08Å; F609-V653 HydrophobicContact CB-CG2 3.74Å; F609-V653 HydrophobicContact CG-CG2 4.17Å; F609-K654 CarbonylContact C-O 3.46Å; F609-K654 WeakPolarHBondContact CA-O 3.5Å; F609-K654 WeakPolarHBondContact CB-O 3.32Å
610	Q	90.6	Very high	81.7	Confident	102 Å²	102	58.7 Å²	58.7	48%	0.477	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	113.1	173.6	-55.8	179.1	10.6	0	0	110.2	K654	Q610-K654 HydrophobicContact CB-CB 4.28Å; Q610-K654 PolarHBondContact N-O 3.12Å; Q610-K654 PolarHBondContact O-N 3.15Å
611	F	91.1	Very high	81	Confident	20 Å²	20	58.8 Å²	58.8	9%	0.088	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123.5	-175.9	-68	-92.8	0	0	0	112	I595 A597 F609 L626 T632 A634 V651 V653	I595-F611 HydrophobicContact CD1-CD1 4.38Å; A597-F611 HydrophobicContact CB-CE1 3.95Å; A597-F611 HydrophobicContact CB-CZ 3.83Å; F609-F611 HydrophobicContact CB-CD2 4.26Å; F609-F611 HydrophobicContact CB-CE2 3.7Å; F609-F611 HydrophobicContact CB-CZ 4.12Å; F609-F611 HydrophobicContact CD2-CE2 4.38Å; F609-F611 HydrophobicContact CD2-CZ 4.2Å; F611-L626 HydrophobicContact CB-CD2 3.93Å; F611-L626 HydrophobicContact CB-CG 4.25Å; F611-T632 WeakPolarHBondContact CZ-O 3.37Å; F611-A634 HydrophobicContact CB-CB 3.73Å; F611-A634 HydrophobicContact CD1-CB 3.91Å; F611-A634 HydrophobicContact CD2-CB 3.63Å; F611-A634 HydrophobicContact CE1-CB 4.39Å; F611-A634 HydrophobicContact CE2-CB 4.13Å; F611-A634 HydrophobicContact CG-CB 3.49Å; F611-A634 VanDerWaalsContact CG-CB 3.49Å; F611-A634 HydrophobicContact CZ-CB 4.49Å; F611-V651 HydrophobicContact CD1-CG1 4.37Å; F611-V653 HydrophobicContact CD1-CB 3.97Å; F611-V653 HydrophobicContact CD1-CG2 3.81Å; F611-V653 HydrophobicContact CE1-CB 4.01Å; F611-V653 HydrophobicContact CE1-CG2 3.6Å; F611-V653 HydrophobicContact CE2-CG2 4.39Å; F611-V653 HydrophobicContact CG-CG2 4.29Å; F611-V653 HydrophobicContact CZ-CG2 3.92Å
612	N	88.6	Confident	80.6	Confident	89 Å²	89	66.6 Å²	66.6	48%	0.476	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	150	-177.8	-71.1	-79.1	0	0	0	111.7	V651 T652	N612-V651 WeakPolarHBondContact O-CA 3.39Å; N612-T652 PolarHBondContact N-O 2.93Å; N612-T652 PolarHBondContact O-N 2.92Å; N612-T652 VanDerWaalsContact O-O 3.1Å
613	L	87	Confident	80.4	Confident	37 Å²	37	64.3 Å²	64.3	19%	0.194	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	120.6	170.7	-69	170.6	0	0	0	109.5	N621 W624 L626 I649 V651	L613-N621 WeakPolarHBondContact CB-OD1 3.39Å; L613-W624 HydrophobicContact CD1-CB 4.48Å; L613-L626 HydrophobicContact CD1-CB 4.25Å; L613-L626 HydrophobicContact CD2-CB 4.31Å; L613-L626 HydrophobicContact CD2-CD2 4.18Å; L613-L626 HydrophobicContact CG-CB 4Å; L613-L626 HydrophobicContact CG-CD2 4.26Å; L613-I649 HydrophobicContact CD2-CG2 3.66Å; L613-V651 HydrophobicContact CD2-CG2 4.18Å
614	A	75	Confident	80.4	Confident	22 Å²	22	59.9 Å²	59.9	18%	0.182	33%	0.332	C	S	.	.			trans	-70.2	133.7	-177.3	0	0	0	0	0	110.9	S616 P650 T652 T662	A614-S616 VanDerWaalsContact C-N 3.29Å; A614-S616 PolarHBondContact O-N 3.01Å; A614-P650 HydrophobicContact CB-CB 3.91Å; A614-P650 HydrophobicContact CB-CG 4.07Å; A614-P650 PolarHBondContact N-O 3.21Å; A614-T652 WeakPolarHBondContact CB-OG1 3.46Å; A614-T662 HydrophobicContact CB-CG2 3.9Å
615	S	65.1	Low	80.4	Confident	116 Å²	116	57.6 Å²	57.6	81%	0.811	32%	0.318	S	S	*	.	S	Bend	trans	-82.1	59.5	-167.7	60.8	0	0	0	0	114.1
616	S	57.1	Low	80.4	Confident	94 Å²	94	56.7 Å²	56.7	66%	0.657	32%	0.315	S	S	*	.	S	Bend	trans	-108.1	-8.1	179	64.2	0	0	0	0	115.5	A614 P650	A614-S616 VanDerWaalsContact C-N 3.29Å; A614-S616 PolarHBondContact O-N 3.01Å; S616-P650 WeakPolarHBondContact OG-CG 3.34Å
617	S	64.6	Low	80.6	Confident	36 Å²	36	61.4 Å²	61.4	25%	0.252	34%	0.34	S	S	.	.			trans	-143.9	135.7	166.2	70.7	0	0	0	0	113.2	E619 V620	S617-E619 PolarHBondContact O-N 2.7Å; S617-V620 WeakPolarHBondContact OG-CB 3.24Å; S617-V620 VanDerWaalsContact OG-CG2 3.25Å; S617-V620 WeakPolarHBondContact OG-CG2 3.39Å; S617-V620 PolarHBondContact OG-N 2.97Å
618	P	67.1	Low	80.6	Confident	101 Å²	101	64.5 Å²	64.5	66%	0.656	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-17.8	173.4	-22.3	34.3	0	0	0	114	R622	P618-R622 WeakPolarHBondContact O-CD 3.35Å; P618-R622 VanDerWaalsContact O-CG 3.25Å; P618-R622 WeakPolarHBondContact O-CG 3.32Å; P618-R622 PolarHBondContact O-N 2.95Å
619	E	69.7	Low	80.5	Confident	139 Å²	139	65.4 Å²	65.4	65%	0.65	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-44.4	-175	-62.6	-179.6	168.2	0	0	111.7	S617 N621 R622 I623	S617-E619 PolarHBondContact O-N 2.7Å; E619-N621 PolarHBondContact O-N 3.1Å; E619-R622 WeakPolarHBondContact O-CB 3.17Å; E619-R622 PolarHBondContact O-N 3.36Å; E619-R622 VanDerWaalsContact O-N 3.08Å; E619-I623 WeakPolarHBondContact O-CG1 3.2Å; E619-I623 PolarHBondContact O-N 2.87Å; E619-I623 VanDerWaalsContact O-N 3.1Å
620	V	74.6	Confident	80.4	Confident	12 Å²	12	69 Å²	69	7%	0.073	38%	0.375	C	S	.	.	H	α-helix	trans	-59	-47.3	176.2	169.1	0	0	0	0	110.6	S617 R622 I623 W624 I649	S617-V620 WeakPolarHBondContact OG-CB 3.24Å; S617-V620 VanDerWaalsContact OG-CG2 3.25Å; S617-V620 WeakPolarHBondContact OG-CG2 3.39Å; S617-V620 PolarHBondContact OG-N 2.97Å; V620-R622 PolarHBondContact O-N 3Å; V620-R622 VanDerWaalsContact O-N 3.16Å; V620-I623 PolarHBondContact O-N 2.85Å; V620-W624 HydrophobicContact CG1-CB 4.37Å; V620-W624 PolarHBondContact O-N 2.98Å; V620-I649 HydrophobicContact CG1-CG1 4.39Å; V620-I649 HydrophobicContact CG1-CG2 4.01Å
621	N	73.9	Confident	80.4	Confident	65 Å²	65	69 Å²	69	35%	0.348	38%	0.378	S	S	.	.	H	α-helix	trans	-69.2	-11.9	178.8	-70.9	-4.6	0	0	0	114.3	L613 E619	L613-N621 WeakPolarHBondContact CB-OD1 3.39Å; E619-N621 PolarHBondContact O-N 3.1Å
622	R	78.8	Confident	80.4	Confident	177 Å²	177	70.8 Å²	70.8	67%	0.668	39%	0.391	S	S	*	.	H	α-helix	trans	-87.8	-28.2	170.3	-80.3	173.5	173	-173.5	-1.1	113	P618 E619 V620 R639	P618-R622 WeakPolarHBondContact O-CD 3.35Å; P618-R622 VanDerWaalsContact O-CG 3.25Å; P618-R622 WeakPolarHBondContact O-CG 3.32Å; P618-R622 PolarHBondContact O-N 2.95Å; E619-R622 WeakPolarHBondContact O-CB 3.17Å; E619-R622 PolarHBondContact O-N 3.36Å; E619-R622 VanDerWaalsContact O-N 3.08Å; V620-R622 PolarHBondContact O-N 3Å; V620-R622 VanDerWaalsContact O-N 3.16Å; R622-R639 WeakPolarHBondContact O-CD 3.44Å; R622-R639 PolarHBondContact O-NH1 3.16Å
623	I	83.1	Confident	80.6	Confident	23 Å²	23	67.3 Å²	67.3	12%	0.118	38%	0.375	C	S	.	.	H	α-helix	trans	-101.2	-36.8	-172	-64.4	169.5	0	0	0	111.8	E619 V620 Y638 R639 A642 Y647	E619-I623 WeakPolarHBondContact O-CG1 3.2Å; E619-I623 PolarHBondContact O-N 2.87Å; E619-I623 VanDerWaalsContact O-N 3.1Å; V620-I623 PolarHBondContact O-N 2.85Å; I623-Y638 CarbonylContact O-C 3.59Å; I623-Y638 WeakPolarHBondContact O-CA 3.43Å; I623-R639 WeakPolarHBondContact O-CB 3.35Å; I623-R639 WeakPolarHBondContact O-CG 3.45Å; I623-R639 PolarHBondContact O-N 2.9Å; I623-A642 HydrophobicContact CG2-CB 3.54Å; I623-Y647 HydrophobicContact CD1-CE1 3.81Å; I623-Y647 HydrophobicContact CG2-CE1 4.43Å
624	W	87.3	Confident	80.9	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.008	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	148.4	-171.7	-63.5	92.3	0	0	0	112.3	I585 L613 V620 L636 S637 Y638 Y647 I649 V667	I585-W624 HydrophobicContact CD1-CH2 3.98Å; I585-W624 HydrophobicContact CD1-CZ3 3.85Å; L613-W624 HydrophobicContact CD1-CB 4.48Å; V620-W624 HydrophobicContact CG1-CB 4.37Å; V620-W624 PolarHBondContact O-N 2.98Å; W624-L636 HydrophobicContact CB-CD1 4.32Å; W624-L636 HydrophobicContact CD2-CD1 4.46Å; W624-L636 HydrophobicContact CE3-CD1 3.8Å; W624-L636 HydrophobicContact CE3-CD2 4.38Å; W624-L636 HydrophobicContact CE3-CG 3.78Å; W624-L636 HydrophobicContact CZ3-CD2 4.44Å; W624-L636 HydrophobicContact CZ3-CG 4.05Å; W624-S637 CarbonylContact C-O 3.59Å; W624-S637 WeakPolarHBondContact CA-O 3.49Å; W624-Y638 HydrophobicContact CH2-CD1 4.49Å; W624-Y638 HydrophobicContact CZ3-CD1 4.34Å; W624-Y638 HydrophobicContact CZ3-CG 4.5Å; W624-Y647 AromaticContact CZ2-CD2 3.68Å; W624-Y647 HydrophobicContact CZ2-CD2 3.68Å; W624-Y647 HydrophobicContact CZ2-CE2 4.18Å; W624-Y647 HydrophobicContact CZ2-CG 4.01Å; W624-Y647 AromaticContact NE1-CD1 3.62Å; W624-Y647 AromaticContact NE1-CG 3.61Å; W624-I649 HydrophobicContact CD2-CD1 3.41Å; W624-I649 VanDerWaalsContact CD2-CD1 3.41Å; W624-I649 HydrophobicContact CE3-CD1 3.86Å; W624-I649 HydrophobicContact CG-CD1 3.75Å; W624-I649 HydrophobicContact CH2-CD1 4.23Å; W624-I649 HydrophobicContact CZ2-CD1 3.83Å; W624-I649 HydrophobicContact CZ3-CD1 4.24Å; W624-V667 HydrophobicContact CH2-CB 4.33Å; W624-V667 HydrophobicContact CH2-CG1 3.55Å; W624-V667 HydrophobicContact CZ2-CG1 4.19Å; W624-V667 HydrophobicContact CZ3-CG1 4.11Å
625	T	87.2	Confident	81.7	Confident	39 Å²	39	68.2 Å²	68.2	24%	0.239	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	128	175.8	29.8	0	0	0	0	109.6	S637	T625-S637 PolarHBondContact N-O 3.49Å; T625-S637 PolarHBondContact O-N 2.88Å; T625-S637 PolarHBondContact O-OG 2.79Å; T625-S637 PolarHBondContact OG1-OG 2.84Å
626	L	89.6	Confident	83	Confident	27 Å²	27	62.7 Å²	62.7	14%	0.141	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	116.9	-177.3	-174.2	60.3	0	0	0	108.5	I595 F611 L613 A634 R635 L636 V651	I595-L626 HydrophobicContact CD1-CD1 4.01Å; I595-L626 HydrophobicContact CG1-CD1 4.47Å; F611-L626 HydrophobicContact CB-CD2 3.93Å; F611-L626 HydrophobicContact CB-CG 4.25Å; L613-L626 HydrophobicContact CD1-CB 4.25Å; L613-L626 HydrophobicContact CD2-CB 4.31Å; L613-L626 HydrophobicContact CD2-CD2 4.18Å; L613-L626 HydrophobicContact CG-CB 4Å; L613-L626 HydrophobicContact CG-CD2 4.26Å; L626-A634 HydrophobicContact CD1-CB 3.72Å; L626-A634 HydrophobicContact CG-CB 4.25Å; L626-R635 WeakPolarHBondContact CA-O 3.5Å; L626-L636 HydrophobicContact CD1-CB 4.08Å; L626-L636 HydrophobicContact CD1-CD1 4.28Å; L626-V651 HydrophobicContact CD2-CG1 3.62Å; L626-V651 HydrophobicContact CD2-CG2 4.23Å
627	N	89.2	Confident	84.5	Confident	98 Å²	98	59.2 Å²	59.2	52%	0.524	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133.5	-179.5	-62.8	-27.7	0	0	0	109	A634 R635	N627-A634 CarbonylContact O-C 3.58Å; N627-A634 WeakPolarHBondContact O-CA 3.37Å; N627-R635 PolarHBondContact N-O 3Å; N627-R635 PolarHBondContact O-N 2.67Å
628	Q	89.3	Confident	85.6	Confident	100 Å²	100	59.4 Å²	59.4	47%	0.467	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	143.5	175.4	-172.2	159.1	6.3	0	0	111.7	F609 N630	F609-Q628 PolarHBondContact O-NE2 2.89Å; F609-Q628 PolarHBondContact O-OE1 2.74Å; Q628-N630 WeakPolarHBondContact CG-O 3.29Å; Q628-N630 PolarHBondContact NE2-O 3.3Å
629	V	89.8	Confident	86.5	Confident	72 Å²	72	59.8 Å²	59.8	44%	0.436	29%	0.292	S	S	.	.			trans	-107.7	-44.8	178.8	177.4	0	0	0	0	110.7	A633 R635	V629-A633 PolarHBondContact N-O 2.87Å; V629-R635 HydrophobicContact CG2-CB 3.55Å
630	N	90.8	Very high	86.7	Confident	77 Å²	77	63.1 Å²	63.1	41%	0.412	30%	0.304	S	S	.	.	S	Bend	trans	-154.9	-168.1	175.8	68	3.1	0	0	0	109.3	Q628 T632 A633	Q628-N630 WeakPolarHBondContact CG-O 3.29Å; Q628-N630 PolarHBondContact NE2-O 3.3Å; N630-T632 PolarHBondContact O-N 3.03Å; N630-T632 PolarHBondContact OD1-N 3.11Å; N630-T632 VanDerWaalsContact OD1-N 3.1Å; N630-T632 PolarHBondContact OD1-OG1 2.91Å; N630-A633 PolarHBondContact N-O 3.07Å; N630-A633 WeakPolarHBondContact OD1-CA 3.43Å; N630-A633 VanDerWaalsContact OD1-CB 3.3Å; N630-A633 WeakPolarHBondContact OD1-CB 3.44Å; N630-A633 PolarHBondContact OD1-N 2.84Å
631	D	89.6	Confident	86.9	Confident	102 Å²	102	67.1 Å²	67.1	55%	0.545	33%	0.325	S	S	.	.	S	Bend	trans	-65.6	-19.5	-176.1	-55.1	-37.4	0	0	0	114.3	P607 P608 F609	P607-D631 HydrophobicContact CB-CB 4.47Å; P608-D631 WeakPolarHBondContact CA-O 3.31Å; P608-D631 HydrophobicContact CB-CB 3.79Å; F609-D631 WeakPolarHBondContact CD2-O 3.4Å; F609-D631 PolarHBondContact N-O 3.17Å
632	T	91.8	Very high	87.2	Confident	59 Å²	59	64.1 Å²	64.1	36%	0.362	31%	0.309	S	S	.	.	S	Bend	trans	-119.2	-8.4	-175.8	57.3	0	0	0	0	115	S596 A597 P607 F609 F611 N630	S596-T632 WeakPolarHBondContact CA-O 3.25Å; A597-T632 PolarHBondContact N-O 2.8Å; P607-T632 HydrophobicContact CB-CG2 4.2Å; F609-T632 HydrophobicContact CE2-CG2 4.08Å; F611-T632 WeakPolarHBondContact CZ-O 3.37Å; N630-T632 PolarHBondContact O-N 3.03Å; N630-T632 PolarHBondContact OD1-N 3.11Å; N630-T632 VanDerWaalsContact OD1-N 3.1Å; N630-T632 PolarHBondContact OD1-OG1 2.91Å
633	A	92.9	Very high	87.4	Confident	15 Å²	15	62.1 Å²	62.1	12%	0.124	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	151.5	-171.1	0	0	0	0	0	114.5	I595 V629 N630	I595-A633 CarbonylContact O-C 3.57Å; I595-A633 WeakPolarHBondContact O-CA 3.35Å; I595-A633 VanDerWaalsContact O-CB 3.23Å; I595-A633 WeakPolarHBondContact O-CB 3.35Å; V629-A633 PolarHBondContact N-O 2.87Å; N630-A633 PolarHBondContact N-O 3.07Å; N630-A633 WeakPolarHBondContact OD1-CA 3.43Å; N630-A633 VanDerWaalsContact OD1-CB 3.3Å; N630-A633 WeakPolarHBondContact OD1-CB 3.44Å; N630-A633 PolarHBondContact OD1-N 2.84Å
634	A	92.4	Very high	87.4	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	155	176.8	0	0	0	0	0	112.2	D594 I595 F611 L626 N627	D594-A634 WeakPolarHBondContact CA-O 3.35Å; I595-A634 HydrophobicContact CG1-CB 4.28Å; I595-A634 WeakPolarHBondContact CG1-O 3.36Å; I595-A634 PolarHBondContact N-O 3.11Å; I595-A634 PolarHBondContact O-N 3.09Å; F611-A634 HydrophobicContact CB-CB 3.73Å; F611-A634 HydrophobicContact CD1-CB 3.91Å; F611-A634 HydrophobicContact CD2-CB 3.63Å; F611-A634 HydrophobicContact CE1-CB 4.39Å; F611-A634 HydrophobicContact CE2-CB 4.13Å; F611-A634 HydrophobicContact CG-CB 3.49Å; F611-A634 VanDerWaalsContact CG-CB 3.49Å; F611-A634 HydrophobicContact CZ-CB 4.49Å; L626-A634 HydrophobicContact CD1-CB 3.72Å; L626-A634 HydrophobicContact CG-CB 4.25Å; N627-A634 CarbonylContact O-C 3.58Å; N627-A634 WeakPolarHBondContact O-CA 3.37Å
635	R	92.6	Very high	87.2	Confident	79 Å²	79	69.7 Å²	69.7	30%	0.298	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	108.1	-177.9	-178.2	156.7	-69.9	164.8	1.3	110	Y592 D594 L626 N627 V629	Y592-R635 HydrophobicContact CD1-CG 4.49Å; Y592-R635 HydrophobicContact CD2-CG 3.71Å; Y592-R635 VanDerWaalsContact CD2-NE 3.27Å; Y592-R635 HydrophobicContact CE2-CG 4.5Å; Y592-R635 VanDerWaalsContact CE2-CZ 3.45Å; Y592-R635 HydrophobicContact CG-CG 3.71Å; D594-R635 WeakPolarHBondContact OD1-CA 3.28Å; D594-R635 VanDerWaalsContact OD1-CB 3.31Å; D594-R635 WeakPolarHBondContact OD1-CB 3.42Å; D594-R635 VanDerWaalsContact OD1-CG 3.32Å; D594-R635 WeakPolarHBondContact OD1-CG 3.45Å; D594-R635 IonicContact OD1-CZ 3.59Å; D594-R635 IonicContact OD1-NE 3.35Å; D594-R635 PolarHBondContact OD1-NE 3.12Å; D594-R635 IonicContact OD1-NH2 2.73Å; D594-R635 PolarHBondContact OD1-NH2 2.84Å; D594-R635 IonicContact OD2-CZ 2.67Å; D594-R635 IonicContact OD2-NE 2.68Å; D594-R635 IonicContact OD2-NH2 3.46Å; D594-R635 PolarHBondContact OD2-NH2 2.79Å; L626-R635 WeakPolarHBondContact CA-O 3.5Å; N627-R635 PolarHBondContact N-O 3Å; N627-R635 PolarHBondContact O-N 2.67Å; V629-R635 HydrophobicContact CG2-CB 3.55Å
636	L	91.3	Very high	87.2	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	113	174	-177.4	61.2	0	0	0	109.3	L583 Y592 A593 W624 L626 I649 L665 V667	L583-L636 HydrophobicContact CD1-CD2 4.21Å; Y592-L636 CarbonylContact C-O 3.56Å; Y592-L636 VanDerWaalsContact CA-O 3.23Å; Y592-L636 WeakPolarHBondContact CA-O 3.32Å; Y592-L636 WeakPolarHBondContact CB-O 3.32Å; A593-L636 PolarHBondContact N-O 2.85Å; A593-L636 PolarHBondContact O-N 3.42Å; W624-L636 HydrophobicContact CB-CD1 4.32Å; W624-L636 HydrophobicContact CD2-CD1 4.46Å; W624-L636 HydrophobicContact CE3-CD1 3.8Å; W624-L636 HydrophobicContact CE3-CD2 4.38Å; W624-L636 HydrophobicContact CE3-CG 3.78Å; W624-L636 HydrophobicContact CZ3-CD2 4.44Å; W624-L636 HydrophobicContact CZ3-CG 4.05Å; L626-L636 HydrophobicContact CD1-CB 4.08Å; L626-L636 HydrophobicContact CD1-CD1 4.28Å; L636-I649 HydrophobicContact CD1-CG2 4.42Å; L636-I649 HydrophobicContact CD2-CD1 4.05Å; L636-L665 HydrophobicContact CD2-CD1 4.27Å; L636-V667 HydrophobicContact CD2-CG2 3.98Å
637	S	89.6	Confident	87	Confident	21 Å²	21	72 Å²	72	15%	0.147	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150.7	-175.1	59.3	0	0	0	0	111.1	W624 T625	W624-S637 CarbonylContact C-O 3.59Å; W624-S637 WeakPolarHBondContact CA-O 3.49Å; T625-S637 PolarHBondContact N-O 3.49Å; T625-S637 PolarHBondContact O-N 2.88Å; T625-S637 PolarHBondContact O-OG 2.79Å; T625-S637 PolarHBondContact OG1-OG 2.84Å
638	Y	88.3	Confident	86.9	Confident	39 Å²	39	70.9 Å²	70.9	15%	0.153	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	149.9	178.5	65.7	-84.6	0	0	0	111.5	I585 K587 M590 I623 W624 A642 L669	I585-Y638 HydrophobicContact CG2-CD1 4.12Å; I585-Y638 HydrophobicContact CG2-CE1 3.62Å; K587-Y638 HydrophobicContact CG-CE2 4.14Å; K587-Y638 PolarHBondContact O-OH 2.87Å; M590-Y638 VanDerWaalsContact O-CE1 3.23Å; M590-Y638 WeakPolarHBondContact O-CE1 3.45Å; M590-Y638 PolarHBondContact O-OH 3.49Å; I623-Y638 CarbonylContact O-C 3.59Å; I623-Y638 WeakPolarHBondContact O-CA 3.43Å; W624-Y638 HydrophobicContact CH2-CD1 4.49Å; W624-Y638 HydrophobicContact CZ3-CD1 4.34Å; W624-Y638 HydrophobicContact CZ3-CG 4.5Å; Y638-A642 HydrophobicContact CD2-CB 3.77Å; Y638-A642 HydrophobicContact CG-CB 4.27Å; Y638-L669 HydrophobicContact CD1-CD1 4.03Å; Y638-L669 HydrophobicContact CD2-CD1 4.46Å; Y638-L669 HydrophobicContact CD2-CD2 3.97Å; Y638-L669 HydrophobicContact CE1-CD1 3.87Å; Y638-L669 HydrophobicContact CE2-CD1 4.31Å; Y638-L669 HydrophobicContact CE2-CD2 4.36Å; Y638-L669 HydrophobicContact CG-CD1 4.34Å; Y638-L669 HydrophobicContact CG-CD2 4.11Å
639	R	84.4	Confident	86.9	Confident	109 Å²	109	66.1 Å²	66.1	41%	0.411	33%	0.333	S	S	.	.			trans	-89	160.5	177.3	-62	-176.1	-170.6	156.2	-2.6	110.9	R622 I623 N641 A642	R622-R639 WeakPolarHBondContact O-CD 3.44Å; R622-R639 PolarHBondContact O-NH1 3.16Å; I623-R639 WeakPolarHBondContact O-CB 3.35Å; I623-R639 WeakPolarHBondContact O-CG 3.45Å; I623-R639 PolarHBondContact O-N 2.9Å; R639-N641 VanDerWaalsContact CB-OD1 3.27Å; R639-N641 WeakPolarHBondContact CB-OD1 3.41Å; R639-N641 PolarHBondContact O-N 3.25Å; R639-A642 WeakPolarHBondContact O-CB 3.14Å; R639-A642 PolarHBondContact O-N 3.33Å
640	K	75.5	Confident	86.9	Confident	209 Å²	209	63.4 Å²	63.4	91%	0.909	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-20.4	-171.6	-65.4	-173.4	178.3	-177.3	0	114.9
641	N	78.6	Confident	86.8	Confident	96 Å²	96	59.7 Å²	59.7	51%	0.513	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	6.3	176.8	63.9	-61	0	0	0	114.6	R639	R639-N641 VanDerWaalsContact CB-OD1 3.27Å; R639-N641 WeakPolarHBondContact CB-OD1 3.41Å; R639-N641 PolarHBondContact O-N 3.25Å
642	A	79.6	Confident	86.9	Confident	2 Å²	2	56.1 Å²	56.1	2%	0.017	28%	0.279	C	S	.	.			trans	-68.9	131.7	173.8	0	0	0	0	0	111.3	K587 I623 Y638 R639 L669	K587-A642 PolarHBondContact NZ-O 2.57Å; I623-A642 HydrophobicContact CG2-CB 3.54Å; Y638-A642 HydrophobicContact CD2-CB 3.77Å; Y638-A642 HydrophobicContact CG-CB 4.27Å; R639-A642 WeakPolarHBondContact O-CB 3.14Å; R639-A642 PolarHBondContact O-N 3.33Å; A642-L669 HydrophobicContact CB-CD2 3.37Å
643	E	82.4	Confident	86.9	Confident	135 Å²	135	53.3 Å²	53.3	63%	0.631	26%	0.262	S	S	*	.			trans	-89.6	166.7	178.2	-63.3	-165.7	171.7	0	0	111.6	Q645 Y647	E643-Q645 PolarHBondContact O-N 3.31Å; E643-Q645 VanDerWaalsContact O-N 3.12Å; E643-Y647 PolarHBondContact N-OH 2.76Å
644	V	83.3	Confident	86.8	Confident	91 Å²	91	56 Å²	56	55%	0.552	27%	0.27	S	S	*	.	S	Bend	trans	-88.2	80.9	-172.7	-172.5	0	0	0	0	109.3	K587 L669	K587-V644 HydrophobicContact CD-CG2 4.21Å; V644-L669 CarbonylContact C-O 3.37Å; V644-L669 VanDerWaalsContact CA-O 3.29Å; V644-L669 WeakPolarHBondContact CA-O 3.23Å; V644-L669 WeakPolarHBondContact CG1-O 3.44Å
645	Q	83.9	Confident	86.9	Confident	93 Å²	93	56 Å²	56	44%	0.435	27%	0.271	S	S	.	.	S	Bend	trans	-151.4	173	-175.3	67.9	177.4	15.6	0	0	112.9	E643 Y647 L669	E643-Q645 PolarHBondContact O-N 3.31Å; E643-Q645 VanDerWaalsContact O-N 3.12Å; Q645-Y647 HydrophobicContact CG-CD2 3.98Å; Q645-Y647 HydrophobicContact CG-CE1 4.26Å; Q645-Y647 HydrophobicContact CG-CE2 3.51Å; Q645-L669 PolarHBondContact N-O 2.86Å; Q645-L669 VanDerWaalsContact N-O 3.15Å; Q645-L669 PolarHBondContact O-N 2.83Å
646	E	85.9	Confident	86.7	Confident	99 Å²	99	59.6 Å²	59.6	46%	0.463	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	126.9	169.5	-170.5	172.5	-179.5	0	0	110.6
647	Y	86.3	Confident	86.5	Confident	16 Å²	16	62.3 Å²	62.3	6%	0.063	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.8	178	-71	-89.8	0	0	0	110.6	I623 W624 E643 Q645 V667 L669	I623-Y647 HydrophobicContact CD1-CE1 3.81Å; I623-Y647 HydrophobicContact CG2-CE1 4.43Å; W624-Y647 AromaticContact CZ2-CD2 3.68Å; W624-Y647 HydrophobicContact CZ2-CD2 3.68Å; W624-Y647 HydrophobicContact CZ2-CE2 4.18Å; W624-Y647 HydrophobicContact CZ2-CG 4.01Å; W624-Y647 AromaticContact NE1-CD1 3.62Å; W624-Y647 AromaticContact NE1-CG 3.61Å; E643-Y647 PolarHBondContact N-OH 2.76Å; Q645-Y647 HydrophobicContact CG-CD2 3.98Å; Q645-Y647 HydrophobicContact CG-CE1 4.26Å; Q645-Y647 HydrophobicContact CG-CE2 3.51Å; Y647-V667 PolarHBondContact N-O 3.17Å; Y647-V667 PolarHBondContact O-N 2.95Å; Y647-L669 HydrophobicContact CD2-CB 4.41Å; Y647-L669 HydrophobicContact CE2-CB 4.33Å; Y647-L669 HydrophobicContact CE2-CD2 4.41Å
648	S	87.6	Confident	86.3	Confident	75 Å²	75	63.3 Å²	63.3	52%	0.524	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	109.8	168.5	-65.4	0	0	0	0	109.4
649	I	88.3	Confident	86.4	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	104.9	-170.4	-57.8	175.2	0	0	0	108.7	L613 V620 W624 L636 V651 L665 V667	L613-I649 HydrophobicContact CD2-CG2 3.66Å; V620-I649 HydrophobicContact CG1-CG1 4.39Å; V620-I649 HydrophobicContact CG1-CG2 4.01Å; W624-I649 HydrophobicContact CD2-CD1 3.41Å; W624-I649 VanDerWaalsContact CD2-CD1 3.41Å; W624-I649 HydrophobicContact CE3-CD1 3.86Å; W624-I649 HydrophobicContact CG-CD1 3.75Å; W624-I649 HydrophobicContact CH2-CD1 4.23Å; W624-I649 HydrophobicContact CZ2-CD1 3.83Å; W624-I649 HydrophobicContact CZ3-CD1 4.24Å; L636-I649 HydrophobicContact CD1-CG2 4.42Å; L636-I649 HydrophobicContact CD2-CD1 4.05Å; I649-V651 HydrophobicContact CG2-CG2 4.08Å; I649-V651 PolarHBondContact O-N 2.7Å; I649-L665 PolarHBondContact N-O 3.44Å; I649-L665 PolarHBondContact O-N 2.9Å; I649-V667 HydrophobicContact CD1-CB 3.93Å; I649-V667 HydrophobicContact CD1-CG2 3.68Å; I649-V667 HydrophobicContact CG1-CG2 4.35Å
650	P	89.4	Confident	86.7	Confident	14 Å²	14	62.7 Å²	62.7	9%	0.091	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	111.4	176.7	32.1	-32.6	0	0	0	109.5	A614 S616 T662 I664	A614-P650 HydrophobicContact CB-CB 3.91Å; A614-P650 HydrophobicContact CB-CG 4.07Å; A614-P650 PolarHBondContact N-O 3.21Å; S616-P650 WeakPolarHBondContact OG-CG 3.34Å; P650-T662 HydrophobicContact CB-CG2 4.16Å; P650-I664 HydrophobicContact CB-CG1 4.33Å
651	V	89.8	Confident	87.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121.5	174.1	-178.7	0	0	0	0	108.2	I578 I595 F611 N612 L613 L626 I649 T662 K663 L665	I578-V651 HydrophobicContact CD1-CB 3.62Å; I578-V651 HydrophobicContact CD1-CG1 3.51Å; I595-V651 HydrophobicContact CD1-CG1 4.16Å; I595-V651 HydrophobicContact CD1-CG2 4.31Å; F611-V651 HydrophobicContact CD1-CG1 4.37Å; N612-V651 WeakPolarHBondContact O-CA 3.39Å; L613-V651 HydrophobicContact CD2-CG2 4.18Å; L626-V651 HydrophobicContact CD2-CG1 3.62Å; L626-V651 HydrophobicContact CD2-CG2 4.23Å; I649-V651 HydrophobicContact CG2-CG2 4.08Å; I649-V651 PolarHBondContact O-N 2.7Å; V651-T662 CarbonylContact O-C 3.57Å; V651-T662 WeakPolarHBondContact O-CA 3.45Å; V651-K663 PolarHBondContact N-O 2.75Å; V651-K663 PolarHBondContact O-N 2.74Å; V651-L665 HydrophobicContact CB-CD1 4.27Å; V651-L665 HydrophobicContact CG2-CD1 3.53Å; V651-L665 HydrophobicContact CG2-CG 4.04Å
652	T	90.4	Very high	88	Confident	26 Å²	26	53.3 Å²	53.3	16%	0.16	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.8	165.9	-55.4	0	0	0	0	107.7	N612 A614 A661 T662	N612-T652 PolarHBondContact N-O 2.93Å; N612-T652 PolarHBondContact O-N 2.92Å; N612-T652 VanDerWaalsContact O-O 3.1Å; A614-T652 WeakPolarHBondContact CB-OG1 3.46Å; T652-A661 WeakPolarHBondContact CA-O 3.41Å; T652-T662 WeakPolarHBondContact CB-OG1 3.3Å; T652-T662 PolarHBondContact OG1-OG1 2.7Å
653	V	92.4	Very high	88.5	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	136.6	166.3	60	0	0	0	0	108	P576 I578 A597 F609 F611 S660 A661	P576-V653 HydrophobicContact CB-CG1 4.26Å; P576-V653 HydrophobicContact CB-CG2 4.35Å; P576-V653 HydrophobicContact CG-CG1 4.23Å; P576-V653 HydrophobicContact CG-CG2 4.19Å; P576-V653 WeakPolarHBondContact O-CG1 3.42Å; I578-V653 HydrophobicContact CD1-CB 4.33Å; I578-V653 HydrophobicContact CD1-CG1 4.16Å; I578-V653 HydrophobicContact CG1-CB 4.23Å; I578-V653 HydrophobicContact CG1-CG1 3.74Å; A597-V653 HydrophobicContact CB-CG1 4.28Å; A597-V653 HydrophobicContact CB-CG2 3.88Å; F609-V653 HydrophobicContact CB-CG2 3.74Å; F609-V653 HydrophobicContact CG-CG2 4.17Å; F611-V653 HydrophobicContact CD1-CB 3.97Å; F611-V653 HydrophobicContact CD1-CG2 3.81Å; F611-V653 HydrophobicContact CE1-CB 4.01Å; F611-V653 HydrophobicContact CE1-CG2 3.6Å; F611-V653 HydrophobicContact CE2-CG2 4.39Å; F611-V653 HydrophobicContact CG-CG2 4.29Å; F611-V653 HydrophobicContact CZ-CG2 3.92Å; V653-S660 CarbonylContact O-C 3.53Å; V653-S660 WeakPolarHBondContact O-CA 3.19Å; V653-S660 VanDerWaalsContact O-CB 3.29Å; V653-S660 WeakPolarHBondContact O-CB 3.5Å; V653-A661 PolarHBondContact N-O 3.17Å; V653-A661 PolarHBondContact O-N 3.48Å; V653-A661 VanDerWaalsContact O-N 3.08Å
654	K	91.8	Very high	88.8	Confident	71 Å²	71	53.8 Å²	53.8	31%	0.309	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.4	176.7	-174.1	-174.9	179.6	-178.1	0	109.4	F609 Q610 G658 Q659	F609-K654 CarbonylContact C-O 3.46Å; F609-K654 WeakPolarHBondContact CA-O 3.5Å; F609-K654 WeakPolarHBondContact CB-O 3.32Å; Q610-K654 HydrophobicContact CB-CB 4.28Å; Q610-K654 PolarHBondContact N-O 3.12Å; Q610-K654 PolarHBondContact O-N 3.15Å; K654-G658 WeakPolarHBondContact CE-O 3.38Å; K654-Q659 WeakPolarHBondContact CA-O 3.21Å; K654-Q659 VanDerWaalsContact CG-O 3.22Å; K654-Q659 WeakPolarHBondContact CG-O 3.5Å
655	D	92.9	Very high	89.2	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	28%	0.275	C	S	.	.			trans	-69.3	-168	171.3	73.1	-11.6	0	0	0	113.6	N572 P576 A657 G658 Q659	N572-D655 PolarHBondContact ND2-OD2 3.2Å; P576-D655 HydrophobicContact CG-CB 4.12Å; D655-A657 PolarHBondContact OD1-N 3.32Å; D655-A657 PolarHBondContact OD2-N 2.95Å; D655-G658 WeakPolarHBondContact OD1-CA 3.49Å; D655-G658 PolarHBondContact OD1-N 2.84Å; D655-G658 PolarHBondContact OD2-N 2.83Å; D655-Q659 VanDerWaalsContact CG-O 3.23Å; D655-Q659 PolarHBondContact N-O 3.09Å; D655-Q659 PolarHBondContact OD1-N 2.86Å; D655-Q659 PolarHBondContact OD2-N 3.47Å
656	R	89.5	Confident	89.4	Confident	153 Å²	153	50.8 Å²	50.8	58%	0.577	28%	0.276	S	S	*	.	S	Bend	trans	-81.6	-35	168.7	-174.9	-176.4	-173.7	171.3	-0.2	113.1	H605 G606	H605-R656 PolarHBondContact O-N 2.99Å; G606-R656 WeakPolarHBondContact O-CB 3.42Å; G606-R656 PolarHBondContact O-N 3Å
657	A	86.2	Confident	89.6	Confident	58 Å²	58	46.1 Å²	46.1	48%	0.479	25%	0.254	S	S	.	.	S	Bend	trans	-102.1	-22.7	-162	0	0	0	0	0	115.9	N572 H605 D655	N572-A657 WeakPolarHBondContact ND2-CB 3.48Å; H605-A657 HydrophobicContact CB-CB 4.48Å; D655-A657 PolarHBondContact OD1-N 3.32Å; D655-A657 PolarHBondContact OD2-N 2.95Å
658	G	85.7	Confident	89.7	Confident	42 Å²	42	46.3 Å²	46.3	43%	0.433	26%	0.256	S	S	.	.	S	Bend	trans	164.1	-30.2	171.5	0	0	0	0	0	116.8	K654 D655	K654-G658 WeakPolarHBondContact CE-O 3.38Å; D655-G658 WeakPolarHBondContact OD1-CA 3.49Å; D655-G658 PolarHBondContact OD1-N 2.84Å; D655-G658 PolarHBondContact OD2-N 2.83Å
659	Q	90.3	Very high	89.7	Confident	69 Å²	69	42.8 Å²	42.8	32%	0.322	23%	0.231	S	C	.	.			trans	-79.5	148.5	-171.3	-72.5	-145	72.6	0	0	115.1	N572 D573 N574 A575 K654 D655	N572-Q659 WeakPolarHBondContact OD1-CG 3.32Å; N572-Q659 PolarHBondContact OD1-NE2 3.17Å; D573-Q659 PolarHBondContact O-NE2 2.99Å; N574-Q659 PolarHBondContact O-NE2 2.71Å; N574-Q659 VanDerWaalsContact O-NE2 3.14Å; A575-Q659 HydrophobicContact CB-CB 4.05Å; K654-Q659 WeakPolarHBondContact CA-O 3.21Å; K654-Q659 VanDerWaalsContact CG-O 3.22Å; K654-Q659 WeakPolarHBondContact CG-O 3.5Å; D655-Q659 VanDerWaalsContact CG-O 3.23Å; D655-Q659 PolarHBondContact N-O 3.09Å; D655-Q659 PolarHBondContact OD1-N 2.86Å; D655-Q659 PolarHBondContact OD2-N 3.47Å
660	S	91.5	Very high	89.5	Confident	66 Å²	66	43.2 Å²	43.2	46%	0.462	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	126.4	178.5	64.6	0	0	0	0	113.6	V653	V653-S660 CarbonylContact O-C 3.53Å; V653-S660 WeakPolarHBondContact O-CA 3.19Å; V653-S660 VanDerWaalsContact O-CB 3.29Å; V653-S660 WeakPolarHBondContact O-CB 3.5Å
661	A	91.4	Very high	89.2	Confident	29 Å²	29	48.8 Å²	48.8	24%	0.24	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	154.4	168.4	0	0	0	0	0	110.9	A575 P576 T652 V653	A575-A661 HydrophobicContact CB-CB 4.09Å; P576-A661 WeakPolarHBondContact O-CB 3.25Å; T652-A661 WeakPolarHBondContact CA-O 3.41Å; V653-A661 PolarHBondContact N-O 3.17Å; V653-A661 PolarHBondContact O-N 3.48Å; V653-A661 VanDerWaalsContact O-N 3.08Å
662	T	89.7	Confident	88.9	Confident	79 Å²	79	49 Å²	49	49%	0.485	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	114	172.7	-59.8	0	0	0	0	110.1	A614 P650 V651 T652	A614-T662 HydrophobicContact CB-CG2 3.9Å; P650-T662 HydrophobicContact CB-CG2 4.16Å; V651-T662 CarbonylContact O-C 3.57Å; V651-T662 WeakPolarHBondContact O-CA 3.45Å; T652-T662 WeakPolarHBondContact CB-OG1 3.3Å; T652-T662 PolarHBondContact OG1-OG1 2.7Å
663	K	89.7	Confident	88.3	Confident	39 Å²	39	51.7 Å²	51.7	17%	0.17	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137.3	-178.2	-161	169.9	-177.1	177.9	0	110.5	E577 I578 D581 V651 L665	E577-K663 HydrophobicContact CG-CD 4.26Å; E577-K663 WeakPolarHBondContact OE1-CE 3.32Å; E577-K663 IonicContact OE1-NZ 2.73Å; E577-K663 PolarHBondContact OE1-NZ 3.03Å; I578-K663 HydrophobicContact CB-CD 4.17Å; I578-K663 HydrophobicContact CD1-CB 4.43Å; I578-K663 VanDerWaalsContact O-CD 3.24Å; I578-K663 WeakPolarHBondContact O-CD 3.01Å; I578-K663 PolarHBondContact O-NZ 2.73Å; D581-K663 WeakPolarHBondContact OD1-CE 3.34Å; D581-K663 IonicContact OD1-NZ 3.13Å; D581-K663 PolarHBondContact OD1-NZ 2.83Å; V651-K663 PolarHBondContact N-O 2.75Å; V651-K663 PolarHBondContact O-N 2.74Å; K663-L665 PolarHBondContact O-N 3.14Å
664	I	89.6	Confident	87.6	Confident	107 Å²	107	56.8 Å²	56.8	55%	0.549	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	100.1	179.8	-55	178.1	0	0	0	108.8	P650	P650-I664 HydrophobicContact CB-CG1 4.33Å
665	L	89.8	Confident	86.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.6	176.5	-53.1	-176.3	0	0	0	109.7	I578 Q580 L583 I595 L636 I649 V651 K663 V667	I578-L665 HydrophobicContact CB-CD2 4.45Å; I578-L665 HydrophobicContact CG2-CD2 3.91Å; Q580-L665 WeakPolarHBondContact O-CD2 3.46Å; L583-L665 HydrophobicContact CD1-CD1 4.22Å; I595-L665 HydrophobicContact CD1-CD1 3.79Å; I595-L665 HydrophobicContact CG2-CD1 4.05Å; L636-L665 HydrophobicContact CD2-CD1 4.27Å; I649-L665 PolarHBondContact N-O 3.44Å; I649-L665 PolarHBondContact O-N 2.9Å; V651-L665 HydrophobicContact CB-CD1 4.27Å; V651-L665 HydrophobicContact CG2-CD1 3.53Å; V651-L665 HydrophobicContact CG2-CG 4.04Å; K663-L665 PolarHBondContact O-N 3.14Å; L665-V667 HydrophobicContact CB-CG2 4.09Å
666	R	89.8	Confident	86.1	Confident	122 Å²	122	59.8 Å²	59.8	46%	0.46	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	117.1	169.8	-78	174.1	-70.6	177	-3.1	109.4	D581 Y582 L583	D581-R666 PolarHBondContact O-N 3.45Å; Y582-R666 CarbonylContact C-O 3.6Å; Y582-R666 WeakPolarHBondContact CA-O 3.38Å; Y582-R666 HydrophobicContact CD2-CB 3.69Å; Y582-R666 HydrophobicContact CE2-CB 4.24Å; L583-R666 PolarHBondContact N-O 3.13Å
667	V	88.8	Confident	85.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	103.7	-172.8	-170.5	0	0	0	0	110.4	L583 I585 W624 L636 Y647 I649 L665 L669	L583-V667 HydrophobicContact CB-CG1 4.18Å; L583-V667 HydrophobicContact CB-CG2 4.13Å; L583-V667 HydrophobicContact CD1-CG2 4.01Å; L583-V667 CarbonylContact O-C 3.51Å; L583-V667 WeakPolarHBondContact O-CA 3.26Å; I585-V667 HydrophobicContact CD1-CG1 3.75Å; I585-V667 HydrophobicContact CG1-CG1 4.05Å; W624-V667 HydrophobicContact CH2-CB 4.33Å; W624-V667 HydrophobicContact CH2-CG1 3.55Å; W624-V667 HydrophobicContact CZ2-CG1 4.19Å; W624-V667 HydrophobicContact CZ3-CG1 4.11Å; L636-V667 HydrophobicContact CD2-CG2 3.98Å; Y647-V667 PolarHBondContact N-O 3.17Å; Y647-V667 PolarHBondContact O-N 2.95Å; I649-V667 HydrophobicContact CD1-CB 3.93Å; I649-V667 HydrophobicContact CD1-CG2 3.68Å; I649-V667 HydrophobicContact CG1-CG2 4.35Å; L665-V667 HydrophobicContact CB-CG2 4.09Å; V667-L669 PolarHBondContact O-N 2.94Å
668	N	88.3	Confident	84.8	Confident	21 Å²	21	55.6 Å²	55.6	11%	0.112	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	100.4	177.5	-176.4	-1.1	0	0	0	109.4	Y582 L583 V584 I585 C670 C678	Y582-N668 HydrophobicContact CE2-CB 4.44Å; Y582-N668 WeakPolarHBondContact OH-CB 3.4Å; Y582-N668 PolarHBondContact OH-ND2 3.19Å; L583-N668 PolarHBondContact O-N 2.88Å; V584-N668 WeakPolarHBondContact CA-O 3.35Å; V584-N668 HydrophobicContact CG2-CB 4.33Å; I585-N668 PolarHBondContact N-O 3.22Å; N668-C670 PolarHBondContact O-N 2.92Å; N668-C678 PolarHBondContact ND2-O 3.07Å
669	L	87.9	Confident	83.8	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	104.3	174.5	-177.8	62.9	0	0	0	108.8	I585 K587 Y638 A642 V644 Q645 Y647 V667	I585-L669 HydrophobicContact CB-CD1 3.89Å; I585-L669 HydrophobicContact CG2-CD1 3.77Å; K587-L669 HydrophobicContact CB-CD1 3.97Å; K587-L669 HydrophobicContact CB-CG 4.5Å; K587-L669 HydrophobicContact CD-CD2 4.47Å; K587-L669 HydrophobicContact CD-CG 4.44Å; K587-L669 HydrophobicContact CG-CD1 4.3Å; Y638-L669 HydrophobicContact CD1-CD1 4.03Å; Y638-L669 HydrophobicContact CD2-CD1 4.46Å; Y638-L669 HydrophobicContact CD2-CD2 3.97Å; Y638-L669 HydrophobicContact CE1-CD1 3.87Å; Y638-L669 HydrophobicContact CE2-CD1 4.31Å; Y638-L669 HydrophobicContact CE2-CD2 4.36Å; Y638-L669 HydrophobicContact CG-CD1 4.34Å; Y638-L669 HydrophobicContact CG-CD2 4.11Å; A642-L669 HydrophobicContact CB-CD2 3.37Å; V644-L669 CarbonylContact C-O 3.37Å; V644-L669 VanDerWaalsContact CA-O 3.29Å; V644-L669 WeakPolarHBondContact CA-O 3.23Å; V644-L669 WeakPolarHBondContact CG1-O 3.44Å; Q645-L669 PolarHBondContact N-O 2.86Å; Q645-L669 VanDerWaalsContact N-O 3.15Å; Q645-L669 PolarHBondContact O-N 2.83Å; Y647-L669 HydrophobicContact CD2-CB 4.41Å; Y647-L669 HydrophobicContact CE2-CB 4.33Å; Y647-L669 HydrophobicContact CE2-CD2 4.41Å; V667-L669 PolarHBondContact O-N 2.94Å
670	C	85.3	Confident	81.9	Confident	10 Å²	10	59 Å²	59	7%	0.068	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	159.8	-167.5	59.5	0	0	0	0	112.8	V584 I585 K587 N668 C672 C678	V584-C670 WeakPolarHBondContact CG1-SG 3.22Å; I585-C670 PolarHBondContact O-N 3.39Å; I585-C670 VanDerWaalsContact O-N 3.09Å; K587-C670 PolarHBondContact N-O 3.12Å; N668-C670 PolarHBondContact O-N 2.92Å; C670-C672 PolarHBondContact O-N 3.23Å; C670-C672 PolarHBondContact SG-SG 2.86Å; C670-C678 HydrophobicContact CB-CB 3.7Å; C670-C678 WeakPolarHBondContact CB-SG 3.21Å; C670-C678 WeakPolarHBondContact SG-CB 3.47Å; C670-C678 CovalentContact SG-SG 2.02Å; C670-C678 PolarHBondContact SG-SG 2.86Å
671	D	83.4	Confident	79.8	Confident	130 Å²	130	67.7 Å²	67.7	70%	0.695	37%	0.371	S	S	*	.			trans	-86.8	98.8	174.3	-163.9	-5.4	0	0	0	109.7	P588	P588-D671 WeakPolarHBondContact CG-OD1 3.33Å
672	C	81.7	Confident	77.2	Confident	5 Å²	5	71.8 Å²	71.8	3%	0.034	40%	0.398	C	S	.	.			trans	-144.9	165.1	-178.4	56	0	0	0	0	114.1	C586 C670 Q677 C678	C586-C672 WeakPolarHBondContact CA-SG 3.35Å; C586-C672 HydrophobicContact CB-CB 4.2Å; C586-C672 VanDerWaalsContact CB-O 3.32Å; C586-C672 WeakPolarHBondContact CB-O 3.23Å; C586-C672 WeakPolarHBondContact CB-SG 3.39Å; C586-C672 VanDerWaalsContact SG-C 3.57Å; C586-C672 WeakPolarHBondContact SG-CB 3.46Å; C586-C672 CovalentContact SG-SG 2.03Å; C586-C672 PolarHBondContact SG-SG 2.75Å; C670-C672 PolarHBondContact O-N 3.23Å; C670-C672 PolarHBondContact SG-SG 2.86Å; C672-Q677 HydrophobicContact CB-CB 4.01Å; C672-C678 VanDerWaalsContact CB-SG 3.51Å; C672-C678 PolarHBondContact SG-SG 2.87Å
673	T	78.1	Confident	74.7	Confident	82 Å²	82	79.2 Å²	79.2	50%	0.503	42%	0.417	S	S	.	.	S	Bend	trans	-102.8	-15.7	169.8	60.4	0	0	0	0	113.2	K589 Q677	K589-T673 PolarHBondContact NZ-O 2.84Å; T673-Q677 VanDerWaalsContact OG1-CD 3.32Å; T673-Q677 PolarHBondContact OG1-NE2 2.83Å; T673-Q677 PolarHBondContact OG1-OE1 2.92Å
674	H	78.5	Confident	72.1	Confident	109 Å²	109	83.2 Å²	83.2	51%	0.505	45%	0.45	S	S	.	.	S	Bend	trans	-151.9	139.8	173.2	-170.9	-99.1	0	0	0	110.6	S676 Q677	H674-S676 VanDerWaalsContact C-N 3.28Å; H674-S676 PolarHBondContact ND1-OG 2.9Å; H674-S676 PolarHBondContact O-N 2.78Å; H674-S676 VanDerWaalsContact O-N 3.09Å; H674-Q677 WeakPolarHBondContact O-CB 3.09Å; H674-Q677 WeakPolarHBondContact O-CG 3.32Å; H674-Q677 PolarHBondContact O-N 3.2Å
675	P	77.5	Confident	69.5	Low	47 Å²	47	82.1 Å²	82.1	31%	0.305	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-51.5	-35.2	-174	-34.5	39.2	0	0	0	116.6	V584 M590 Q677 C678	V584-P675 HydrophobicContact CB-CB 4.08Å; V584-P675 HydrophobicContact CG1-CB 4.13Å; M590-P675 HydrophobicContact SD-CG 4.22Å; P675-Q677 PolarHBondContact O-N 2.93Å; P675-C678 PolarHBondContact O-N 3.26Å
676	S	76.3	Confident	67.2	Low	88 Å²	88	85.3 Å²	85.3	62%	0.615	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-63.5	-12.4	179.4	57	0	0	0	0	114.8	H674 C678	H674-S676 VanDerWaalsContact C-N 3.28Å; H674-S676 PolarHBondContact ND1-OG 2.9Å; H674-S676 PolarHBondContact O-N 2.78Å; H674-S676 VanDerWaalsContact O-N 3.09Å; S676-C678 VanDerWaalsContact C-N 3.29Å; S676-C678 PolarHBondContact O-N 2.93Å
677	Q	74.9	Confident	65.3	Low	107 Å²	107	86.9 Å²	86.9	50%	0.5	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-78	-11	-179.5	-64.5	167.7	-7.4	0	0	113.4	C672 T673 H674 P675	C672-Q677 HydrophobicContact CB-CB 4.01Å; T673-Q677 VanDerWaalsContact OG1-CD 3.32Å; T673-Q677 PolarHBondContact OG1-NE2 2.83Å; T673-Q677 PolarHBondContact OG1-OE1 2.92Å; H674-Q677 WeakPolarHBondContact O-CB 3.09Å; H674-Q677 WeakPolarHBondContact O-CG 3.32Å; H674-Q677 PolarHBondContact O-N 3.2Å; P675-Q677 PolarHBondContact O-N 2.93Å
678	C	72.3	Confident	63.5	Low	16 Å²	16	93.1 Å²	93.1	11%	0.108	54%	0.544	C	S	.	.	G	3₁₀ helix	trans	-99.3	7.7	-174	-58	0	0	0	0	115.5	V584 N668 C670 C672 P675 S676 A680	V584-C678 HydrophobicContact CG1-CB 3.82Å; N668-C678 PolarHBondContact ND2-O 3.07Å; C670-C678 HydrophobicContact CB-CB 3.7Å; C670-C678 WeakPolarHBondContact CB-SG 3.21Å; C670-C678 WeakPolarHBondContact SG-CB 3.47Å; C670-C678 CovalentContact SG-SG 2.02Å; C670-C678 PolarHBondContact SG-SG 2.86Å; C672-C678 VanDerWaalsContact CB-SG 3.51Å; C672-C678 PolarHBondContact SG-SG 2.87Å; P675-C678 PolarHBondContact O-N 3.26Å; S676-C678 VanDerWaalsContact C-N 3.29Å; S676-C678 PolarHBondContact O-N 2.93Å; C678-A680 PolarHBondContact O-N 3.1Å
679	A	64.4	Low	62	Low	91 Å²	91	97.1 Å²	97.1	75%	0.752	57%	0.565	S	S	*	*	S	Bend	trans	-64	97.1	165.8	0	0	0	0	0	108.7
680	A	52	Low	60.7	Low	92 Å²	92	99.2 Å²	99.2	76%	0.76	59%	0.586	S	S	*	*			trans	-63.9	150.8	-167.2	0	0	0	0	0	112.8	C678 S682	C678-A680 PolarHBondContact O-N 3.1Å; A680-S682 PolarHBondContact O-N 2.97Å
681	R	47.3	Very low	60	Low	248 Å²	248	107.5 Å²	107.5	94%	0.936	62%	0.621	S	S	*	*			trans	-48.9	103.5	175.6	-70.3	170	169.5	156.3	-5.7	111.4	R683	R681-R683 PolarHBondContact O-N 2.82Å
682	S	35.2	Very low	58.9	Low	115 Å²	115	111.3 Å²	111.3	80%	0.804	63%	0.626	S	S	*	*			trans	-58.6	126.6	159.1	-175.8	0	0	0	0	108.3	A680 S684	A680-S682 PolarHBondContact O-N 2.97Å; S682-S684 PolarHBondContact O-N 2.83Å
683	R	37.5	Very low	58	Low	235 Å²	235	112.9 Å²	112.9	89%	0.887	64%	0.64	S	S	*	*			trans	-63.7	129	173.8	-77.3	177.5	169.9	162.7	-3.6	108	R681 A685	R681-R683 PolarHBondContact O-N 2.82Å; R683-A685 PolarHBondContact O-N 2.78Å
684	S	36	Very low	57.7	Low	122 Å²	122	113.2 Å²	113.2	85%	0.853	64%	0.637	S	S	*	*			trans	-68.4	80.6	176	57.2	0	0	0	0	111.1	S682 G686	S682-S684 PolarHBondContact O-N 2.83Å; S684-G686 PolarHBondContact O-N 2.86Å
685	A	35.5	Very low	57.3	Low	85 Å²	85	112.5 Å²	112.5	70%	0.702	64%	0.637	S	S	*	*			trans	-61	113.6	160.5	0	0	0	0	0	107.4	R683 I687	R683-A685 PolarHBondContact O-N 2.78Å; A685-I687 PolarHBondContact O-N 3.43Å
686	G	41.1	Very low	57	Low	67 Å²	67	113.1 Å²	113.1	69%	0.691	65%	0.646	S	S	*	*			trans	-64.8	109.7	-176.5	0	0	0	0	0	110.7	S684 T688	S684-G686 PolarHBondContact O-N 2.86Å; G686-T688 VanDerWaalsContact C-N 3.27Å; G686-T688 PolarHBondContact O-N 2.77Å
687	I	48.9	Very low	57.2	Low	154 Å²	154	113.6 Å²	113.6	79%	0.79	64%	0.641	S	S	*	*			trans	-74.5	83.6	178	-54.8	179.6	0	0	0	108.8	A685 L689	A685-I687 PolarHBondContact O-N 3.43Å; I687-L689 HydrophobicContact CG2-CD1 4.48Å; I687-L689 PolarHBondContact O-N 3.23Å
688	T	52.4	Low	57.3	Low	132 Å²	132	113.5 Å²	113.5	81%	0.81	64%	0.643	S	S	*	*			trans	-69.6	106.9	166.5	52.2	0	0	0	0	108.5	G686 G690	G686-T688 VanDerWaalsContact C-N 3.27Å; G686-T688 PolarHBondContact O-N 2.77Å; T688-G690 PolarHBondContact O-N 3.42Å
689	L	55.1	Low	57.7	Low	105 Å²	105	117.9 Å²	117.9	55%	0.55	67%	0.665	S	S	.	*			trans	-62	110.4	-178.6	-140.3	79.3	0	0	0	110.1	I687 A693 I694 I697	I687-L689 HydrophobicContact CG2-CD1 4.48Å; I687-L689 PolarHBondContact O-N 3.23Å; L689-A693 HydrophobicContact CD2-CB 4.33Å; L689-A693 HydrophobicContact CG-CB 3.99Å; L689-I694 HydrophobicContact CD2-CG1 4.15Å; L689-I697 HydrophobicContact CD2-CD1 4.36Å
690	G	62.2	Low	58.2	Low	43 Å²	43	115.1 Å²	115.1	44%	0.443	65%	0.645	S	S	.	*			trans	-63.5	149.3	-178.8	0	0	0	0	0	111.9	T688 W692 A693 I694	T688-G690 PolarHBondContact O-N 3.42Å; G690-W692 PolarHBondContact O-N 3.07Å; G690-A693 WeakPolarHBondContact O-CB 3.44Å; G690-A693 PolarHBondContact O-N 3.16Å; G690-I694 PolarHBondContact O-N 2.94Å
691	K	68.6	Low	59.6	Low	185 Å²	185	114.9 Å²	114.9	80%	0.804	63%	0.63	S	S	*	*	H	α-helix	trans	-52.8	-32.7	-178.5	-65.8	-176.7	178.9	-179.8	0	113.1	I694 L695	K691-I694 PolarHBondContact O-N 3.17Å; K691-L695 PolarHBondContact O-N 3.43Å
692	W	62	Low	60.9	Low	209 Å²	209	106 Å²	106	79%	0.792	61%	0.609	S	S	*	*	H	α-helix	trans	-65.9	-31.5	175	-64.1	110.5	0	0	0	114.5	G690 L695 A696	G690-W692 PolarHBondContact O-N 3.07Å; W692-L695 HydrophobicContact CE3-CD2 3.81Å; W692-L695 HydrophobicContact CZ3-CD2 3.77Å; W692-L695 WeakPolarHBondContact O-CB 3.19Å; W692-L695 PolarHBondContact O-N 3.05Å; W692-A696 WeakPolarHBondContact O-CB 3.37Å; W692-A696 PolarHBondContact O-N 3.27Å
693	A	63	Low	62.9	Low	39 Å²	39	105.1 Å²	105.1	32%	0.322	60%	0.595	S	S	.	*	H	α-helix	trans	-71.9	-37.9	175.2	0	0	0	0	0	111.4	L689 G690 L695 A696 I697	L689-A693 HydrophobicContact CD2-CB 4.33Å; L689-A693 HydrophobicContact CG-CB 3.99Å; G690-A693 WeakPolarHBondContact O-CB 3.44Å; G690-A693 PolarHBondContact O-N 3.16Å; A693-L695 VanDerWaalsContact C-N 3.32Å; A693-A696 PolarHBondContact O-N 3.22Å; A693-I697 VanDerWaalsContact O-CG1 3.3Å; A693-I697 WeakPolarHBondContact O-CG1 2.77Å; A693-I697 PolarHBondContact O-N 2.97Å
694	I	69.9	Low	64.7	Low	88 Å²	88	99.2 Å²	99.2	45%	0.451	58%	0.581	S	S	.	*	H	α-helix	trans	-63.7	-41.7	171.3	-57.4	174.8	0	0	0	109.9	L689 G690 K691 I697 L698	L689-I694 HydrophobicContact CD2-CG1 4.15Å; G690-I694 PolarHBondContact O-N 2.94Å; K691-I694 PolarHBondContact O-N 3.17Å; I694-I697 PolarHBondContact O-N 3.12Å; I694-L698 HydrophobicContact CG2-CD1 4.22Å; I694-L698 WeakPolarHBondContact O-CG 3.12Å; I694-L698 PolarHBondContact O-N 3.3Å
695	L	70.1	Confident	66.3	Low	94 Å²	94	100.7 Å²	100.7	49%	0.492	57%	0.572	S	S	.	*	H	α-helix	trans	-61.8	-42.1	174.8	-150.8	82.2	0	0	0	112.1	K691 W692 A693 L698 L699	K691-L695 PolarHBondContact O-N 3.43Å; W692-L695 HydrophobicContact CE3-CD2 3.81Å; W692-L695 HydrophobicContact CZ3-CD2 3.77Å; W692-L695 WeakPolarHBondContact O-CB 3.19Å; W692-L695 PolarHBondContact O-N 3.05Å; A693-L695 VanDerWaalsContact C-N 3.32Å; L695-L698 PolarHBondContact O-N 2.74Å; L695-L699 VanDerWaalsContact O-CB 3.26Å; L695-L699 WeakPolarHBondContact O-CB 3.32Å; L695-L699 PolarHBondContact O-N 2.64Å
696	A	73.2	Confident	67.7	Low	60 Å²	60	99.2 Å²	99.2	50%	0.496	56%	0.557	S	S	.	*	H	α-helix	trans	-66.8	-37.6	177.5	0	0	0	0	0	112.7	W692 A693 L699 G700	W692-A696 WeakPolarHBondContact O-CB 3.37Å; W692-A696 PolarHBondContact O-N 3.27Å; A693-A696 PolarHBondContact O-N 3.22Å; A696-L699 PolarHBondContact O-N 2.76Å; A696-G700 PolarHBondContact O-N 3.2Å
697	I	78.4	Confident	69.1	Low	99 Å²	99	99.7 Å²	99.7	51%	0.508	55%	0.546	S	S	.	.	H	α-helix	trans	-65.8	-44.4	173.9	-69	163.5	0	0	0	110.5	L689 A693 I694 G700 I701	L689-I697 HydrophobicContact CD2-CD1 4.36Å; A693-I697 VanDerWaalsContact O-CG1 3.3Å; A693-I697 WeakPolarHBondContact O-CG1 2.77Å; A693-I697 PolarHBondContact O-N 2.97Å; I694-I697 PolarHBondContact O-N 3.12Å; I697-G700 PolarHBondContact O-N 2.62Å; I697-I701 HydrophobicContact CG2-CD1 4.01Å; I697-I701 VanDerWaalsContact O-CG1 3.32Å; I697-I701 WeakPolarHBondContact O-CG1 3.28Å; I697-I701 PolarHBondContact O-N 3.27Å
698	L	77	Confident	69.8	Low	105 Å²	105	97.2 Å²	97.2	55%	0.55	53%	0.533	S	S	.	.	H	α-helix	trans	-64.4	-39.8	175.7	-72.1	169.8	0	0	0	112.4	I694 L695 I701 A702	I694-L698 HydrophobicContact CG2-CD1 4.22Å; I694-L698 WeakPolarHBondContact O-CG 3.12Å; I694-L698 PolarHBondContact O-N 3.3Å; L695-L698 PolarHBondContact O-N 2.74Å; L698-I701 PolarHBondContact O-N 3.4Å; L698-A702 WeakPolarHBondContact O-CB 3.46Å; L698-A702 PolarHBondContact O-N 3.08Å
699	L	80.8	Confident	70.1	Confident	108 Å²	108	97 Å²	97	57%	0.565	53%	0.527	S	S	*	.	H	α-helix	trans	-69.3	-34.2	176.1	-169.5	132.8	0	0	0	111.9	L695 A696 A702 L703	L695-L699 VanDerWaalsContact O-CB 3.26Å; L695-L699 WeakPolarHBondContact O-CB 3.32Å; L695-L699 PolarHBondContact O-N 2.64Å; A696-L699 PolarHBondContact O-N 2.76Å; L699-A702 PolarHBondContact O-N 2.66Å; L699-L703 HydrophobicContact CD2-CD1 3.88Å; L699-L703 WeakPolarHBondContact O-CB 3.3Å; L699-L703 PolarHBondContact O-N 3.05Å
700	G	76.4	Confident	70.2	Confident	32 Å²	32	96.5 Å²	96.5	33%	0.33	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-43.4	170.2	0	0	0	0	0	112.6	A696 I697 L703 L704	A696-G700 PolarHBondContact O-N 3.2Å; I697-G700 PolarHBondContact O-N 2.62Å; G700-L703 PolarHBondContact O-N 2.84Å; G700-L704 WeakPolarHBondContact O-CB 3.31Å; G700-L704 PolarHBondContact O-N 2.81Å
701	I	81.5	Confident	69.9	Low	87 Å²	87	101 Å²	101	45%	0.446	54%	0.542	S	S	.	.	H	α-helix	trans	-64.3	-41.2	174.6	-68.4	163.7	0	0	0	110.9	I697 L698 L704 F705	I697-I701 HydrophobicContact CG2-CD1 4.01Å; I697-I701 VanDerWaalsContact O-CG1 3.32Å; I697-I701 WeakPolarHBondContact O-CG1 3.28Å; I697-I701 PolarHBondContact O-N 3.27Å; L698-I701 PolarHBondContact O-N 3.4Å; I701-L704 PolarHBondContact O-N 3.43Å; I701-F705 HydrophobicContact CG2-CD2 4.27Å; I701-F705 PolarHBondContact O-N 3.5Å
702	A	74.2	Confident	69.2	Low	61 Å²	61	97.9 Å²	97.9	50%	0.504	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-41.5	175	0	0	0	0	0	112.3	L698 L699 F705 S706	L698-A702 WeakPolarHBondContact O-CB 3.46Å; L698-A702 PolarHBondContact O-N 3.08Å; L699-A702 PolarHBondContact O-N 2.66Å; A702-F705 PolarHBondContact O-N 2.79Å; A702-S706 PolarHBondContact O-N 3.43Å
703	L	77.2	Confident	68.7	Low	98 Å²	98	93 Å²	93	51%	0.513	53%	0.534	S	S	.	.	H	α-helix	trans	-61.3	-45.6	172.5	-87.9	164.5	0	0	0	111.4	L699 G700 F705 S706 V707	L699-L703 HydrophobicContact CD2-CD1 3.88Å; L699-L703 WeakPolarHBondContact O-CB 3.3Å; L699-L703 PolarHBondContact O-N 3.05Å; G700-L703 PolarHBondContact O-N 2.84Å; L703-F705 VanDerWaalsContact C-N 3.32Å; L703-F705 PolarHBondContact O-N 3.48Å; L703-S706 WeakPolarHBondContact CA-OG 3.38Å; L703-S706 PolarHBondContact O-N 3.4Å; L703-S706 PolarHBondContact O-OG 2.89Å; L703-V707 WeakPolarHBondContact O-CG2 3.16Å; L703-V707 PolarHBondContact O-N 2.96Å
704	L	75.4	Confident	68	Low	111 Å²	111	94.2 Å²	94.2	58%	0.581	55%	0.55	S	S	*	*	H	α-helix	trans	-58.8	-42.3	177.2	-122.2	162.8	0	0	0	111.9	G700 I701 V707 L708	G700-L704 WeakPolarHBondContact O-CB 3.31Å; G700-L704 PolarHBondContact O-N 2.81Å; I701-L704 PolarHBondContact O-N 3.43Å; L704-V707 PolarHBondContact O-N 2.77Å; L704-L708 HydrophobicContact CD2-CD1 4.08Å; L704-L708 PolarHBondContact O-N 2.72Å
705	F	70.1	Confident	66.6	Low	153 Å²	153	96.6 Å²	96.6	67%	0.671	57%	0.569	S	S	*	*	H	α-helix	trans	-63.9	-39.1	172.1	-98.4	-83.2	0	0	0	113.1	I701 A702 L703 L708 L709	I701-F705 HydrophobicContact CG2-CD2 4.27Å; I701-F705 PolarHBondContact O-N 3.5Å; A702-F705 PolarHBondContact O-N 2.79Å; L703-F705 VanDerWaalsContact C-N 3.32Å; L703-F705 PolarHBondContact O-N 3.48Å; F705-L708 PolarHBondContact O-N 2.81Å; F705-L709 WeakPolarHBondContact O-CB 3.22Å; F705-L709 PolarHBondContact O-N 2.79Å
706	S	65.1	Low	65.2	Low	54 Å²	54	97.9 Å²	97.9	38%	0.378	58%	0.58	S	S	.	*	H	α-helix	trans	-66.9	-35.3	175.6	71.9	0	0	0	0	113.3	A702 L703 L709 T710	A702-S706 PolarHBondContact O-N 3.43Å; L703-S706 WeakPolarHBondContact CA-OG 3.38Å; L703-S706 PolarHBondContact O-N 3.4Å; L703-S706 PolarHBondContact O-OG 2.89Å; S706-L709 PolarHBondContact O-N 2.91Å; S706-T710 PolarHBondContact O-N 3.1Å; S706-T710 PolarHBondContact O-OG1 3.19Å
707	V	68.8	Low	63.3	Low	76 Å²	76	101 Å²	101	46%	0.461	59%	0.593	S	S	.	*	H	α-helix	trans	-71.5	-37	177	170.4	0	0	0	0	111.2	L703 L704 L709 T710 L711	L703-V707 WeakPolarHBondContact O-CG2 3.16Å; L703-V707 PolarHBondContact O-N 2.96Å; L704-V707 PolarHBondContact O-N 2.77Å; V707-L709 VanDerWaalsContact C-N 3.32Å; V707-T710 PolarHBondContact O-OG1 2.91Å; V707-T710 VanDerWaalsContact O-OG1 3.1Å; V707-L711 HydrophobicContact CG1-CD1 4.3Å; V707-L711 WeakPolarHBondContact O-CB 3.44Å; V707-L711 PolarHBondContact O-N 3Å; V707-L711 VanDerWaalsContact O-N 3.09Å
708	L	64.2	Low	61.1	Low	102 Å²	102	100.4 Å²	100.4	53%	0.534	60%	0.603	S	S	.	*	H	α-helix	trans	-64.1	-36.3	168.9	-98.5	131.7	0	0	0	112.1	L704 F705 V712	L704-L708 HydrophobicContact CD2-CD1 4.08Å; L704-L708 PolarHBondContact O-N 2.72Å; F705-L708 PolarHBondContact O-N 2.81Å; L708-V712 WeakPolarHBondContact O-CG2 3.24Å; L708-V712 PolarHBondContact O-N 2.82Å
709	L	58	Low	59	Low	128 Å²	128	106.4 Å²	106.4	67%	0.67	62%	0.618	S	S	*	*	H	α-helix	trans	-70.1	-38.7	178.2	-157.8	74.5	0	0	0	112.5	F705 S706 V707 V712	F705-L709 WeakPolarHBondContact O-CB 3.22Å; F705-L709 PolarHBondContact O-N 2.79Å; S706-L709 PolarHBondContact O-N 2.91Å; V707-L709 VanDerWaalsContact C-N 3.32Å; L709-V712 PolarHBondContact O-N 3.14Å
710	T	58.9	Low	56.6	Low	95 Å²	95	111.3 Å²	111.3	58%	0.583	64%	0.635	S	S	*	*	H	α-helix	trans	-71.4	-34.4	175.7	54.1	0	0	0	0	112.7	S706 V707 V712 C713 G714	S706-T710 PolarHBondContact O-N 3.1Å; S706-T710 PolarHBondContact O-OG1 3.19Å; V707-T710 PolarHBondContact O-OG1 2.91Å; V707-T710 VanDerWaalsContact O-OG1 3.1Å; T710-V712 VanDerWaalsContact C-N 3.26Å; T710-V712 PolarHBondContact O-N 2.81Å; T710-C713 PolarHBondContact O-N 3.15Å; T710-G714 PolarHBondContact O-N 2.73Å; T710-G714 VanDerWaalsContact O-N 3.09Å
711	L	55	Low	54.4	Low	138 Å²	138	113.6 Å²	113.6	72%	0.723	66%	0.659	S	S	*	*	H	α-helix	trans	-62.5	-28.2	174.1	-94.6	160.9	0	0	0	113.8	V707	V707-L711 HydrophobicContact CG1-CD1 4.3Å; V707-L711 WeakPolarHBondContact O-CB 3.44Å; V707-L711 PolarHBondContact O-N 3Å; V707-L711 VanDerWaalsContact O-N 3.09Å
712	V	53.6	Low	51.9	Low	118 Å²	118	119.1 Å²	119.1	72%	0.715	68%	0.679	S	S	*	*	H	α-helix	trans	-83.2	-21.8	178.9	172.8	0	0	0	0	112.9	L708 L709 T710	L708-V712 WeakPolarHBondContact O-CG2 3.24Å; L708-V712 PolarHBondContact O-N 2.82Å; L709-V712 PolarHBondContact O-N 3.14Å; T710-V712 VanDerWaalsContact C-N 3.26Å; T710-V712 PolarHBondContact O-N 2.81Å
713	C	52.3	Low	49.6	Very low	108 Å²	108	123.9 Å²	123.9	73%	0.73	69%	0.691	S	S	*	*	H	α-helix	trans	-108.7	0.5	-178.9	-66.3	0	0	0	0	114.7	T710 V715	T710-C713 PolarHBondContact O-N 3.15Å; C713-V715 PolarHBondContact O-N 3.33Å
714	G	47.3	Very low	47.2	Very low	64 Å²	64	127.3 Å²	127.3	66%	0.66	70%	0.702	S	S	*	*			trans	-90.3	35.5	-168.2	0	0	0	0	0	117.6	T710 V716	T710-G714 PolarHBondContact O-N 2.73Å; T710-G714 VanDerWaalsContact O-N 3.09Å; G714-V716 PolarHBondContact O-N 2.87Å
715	V	42.2	Very low	46.1	Very low	137 Å²	137	126.8 Å²	126.8	83%	0.83	71%	0.706	S	S	*	*			trans	-86.7	105.9	177.4	179.5	0	0	0	0	111	C713	C713-V715 PolarHBondContact O-N 3.33Å
716	V	39.7	Very low	44.1	Very low	122 Å²	122	127.4 Å²	127.4	74%	0.739	71%	0.71	S	S	*	*			trans	-173.3	116.5	144.7	137	0	0	0	0	113	G714	G714-V716 PolarHBondContact O-N 2.87Å
717	T	33.8	Very low	42.5	Very low	126 Å²	126	130.8 Å²	130.8	77%	0.773	72%	0.724	S	S	*	*			trans	42.8	127.6	151	72.5	0	0	0	0	124.3
718	A	32	Very low	40.8	Very low	85 Å²	85	134.6 Å²	134.6	70%	0.702	74%	0.741	S	S	*	*				120.7	105.7	116.9	0	0	0	0	0	121.6
719	R	32.3	Very low	39.2	Very low	232 Å²	232	133.6 Å²	133.6	88%	0.875	75%	0.748	S	S	*	*				70.1	111.9	129.3	-68.4	-175.4	171.1	-170.8	-1.1	122.8
720	K	30.9	Very low	38	Very low	210 Å²	210	135.5 Å²	135.5	91%	0.913	75%	0.753	S	S	*	*				64.6	113.4	129.7	-70.1	-170.9	171	-173	0	120.6
721	G	30.1	Very low	36.6	Very low	81 Å²	81	137.5 Å²	137.5	84%	0.835	76%	0.756	S	S	*	*			trans	-141.2	170.1	150.2	0	0	0	0	0	109.7
722	K	29.5	Very low	35.5	Very low	202 Å²	202	136.4 Å²	136.4	88%	0.878	75%	0.751	S	S	*	*			trans	-126.4	156.6	-177	-89	-172	175.4	-175.4	0	112.6
723	H	25.5	Very low	34.4	Very low	161 Å²	161	137.2 Å²	137.2	75%	0.745	75%	0.751	S	S	*	*			trans	94.4	134.7	145.8	-107.6	45.4	0	0	0	121.7
724	F	26.8	Very low	33.3	Very low	170 Å²	170	138.2 Å²	138.2	75%	0.746	75%	0.747	S	S	*	*			trans	-22	173.1	153.8	-67.3	-83.1	0	0	0	119.8
725	P	52.8	Low	32.3	Very low	101 Å²	101	142.3 Å²	142.3	66%	0.656	75%	0.752	S	S	*	*			cis	-113.8	-147.7	2.2	22.4	3.3	0	0	0	111.7
726	E	28.3	Very low	31.6	Very low	165 Å²	165	141 Å²	141	77%	0.771	75%	0.75	S	S	*	*			cis	-169	171.2	28.1	-153.8	154.9	-131.1	0	0	115.2
727	D	31.3	Very low	31	Very low	125 Å²	125	142.4 Å²	142.4	67%	0.668	75%	0.753	S	S	*	*			trans	62.7	108.7	161.4	-82.3	-3.8	0	0	0	124.7
728	L	31.6	Very low	30.7	Very low	156 Å²	156	141.9 Å²	141.9	82%	0.817	75%	0.749	S	S	*	*				30.7	125.2	101.5	-78.6	160.2	0	0	0	119
729	A	30.5	Very low	30.6	Very low	81 Å²	81	146.3 Å²	146.3	67%	0.669	76%	0.756	S	S	*	*			trans	-161	130.8	130.7	0	0	0	0	0	112.7
730	Q	33.3	Very low	30.5	Very low	168 Å²	168	139.7 Å²	139.7	79%	0.785	75%	0.751	S	S	*	*			trans	68.3	145.1	134.4	-70.3	177.3	-15.5	0	0	121.6
731	Q	30.9	Very low	30.9	Very low	138 Å²	138	136 Å²	136	65%	0.645	75%	0.748	S	S	*	*			cis	-174.7	163.6	-25.6	-128	-178.2	9.5	0	0	110.6
732	N	30	Very low	30.7	Very low	115 Å²	115	135.6 Å²	135.6	62%	0.615	74%	0.744	S	S	*	*			trans	69	152.6	147.9	-59.5	-17.3	0	0	0	120.6
733	L	31.2	Very low	30.6	Very low	135 Å²	135	133.9 Å²	133.9	71%	0.707	75%	0.745	S	S	*	*			cis	-166.1	158.8	-21.8	-106.9	170.4	0	0	0	109.9
734	I	29.1	Very low	30.6	Very low	129 Å²	129	132.2 Å²	132.2	66%	0.662	74%	0.741	S	S	*	*			trans	79.6	101.3	146.1	-72.4	163.3	0	0	0	121.4
735	I	27	Very low	30.6	Very low	149 Å²	149	134.9 Å²	134.9	76%	0.764	75%	0.746	S	S	*	*				52.6	117.8	122	-54.9	165.3	0	0	0	120.5
736	S	26.9	Very low	29.4	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	75%	0.75	S	S	*	*				-168.5	143.8	109.1	41.7	0	0	0	0	113.5
737	N	26.5	Very low	29.3	Very low	150 Å²	150	132.8 Å²	132.8	80%	0.802	75%	0.746	S	S	*	*			trans	-82.1	162.3	170.9	-59.8	-16.1	0	0	0	109
738	T	29.3	Very low	29	Very low	115 Å²	115	132.4 Å²	132.4	71%	0.706	75%	0.753	S	S	*	*				-165.4	164.1	54.9	34.3	0	0	0	0	112.9
739	E	29.7	Very low	28.9	Very low	178 Å²	178	128.5 Å²	128.5	83%	0.832	74%	0.743	S	S	*	*			trans	61.2	82.5	151.4	-69.9	171.3	126.4	0	0	120.9
740	A	29	Very low	28.8	Very low	94 Å²	94	132.6 Å²	132.6	78%	0.777	75%	0.754	S	S	*	*				27.2	160.5	104.8	0	0	0	0	0	121.9
741	P	39.2	Very low	28.4	Very low	131 Å²	131	127.8 Å²	127.8	85%	0.851	75%	0.75	S	S	*	*			cis	-129.9	177	-16.9	36.4	-19.1	0	0	0	114.2
742	G	25.8	Very low	28.1	Very low	74 Å²	74	131 Å²	131	76%	0.763	76%	0.762	S	S	*	*			trans	168.8	116.6	167.1	0	0	0	0	0	112.4
743	D	28.3	Very low	27.9	Very low	166 Å²	166	131.1 Å²	131.1	89%	0.888	77%	0.767	S	S	*	*			trans	-75.6	164.2	-161.5	-65.6	-53	0	0	0	117
744	D	26.1	Very low	27.6	Very low	125 Å²	125	132 Å²	132	67%	0.668	77%	0.769	S	S	*	*			trans	-41.7	147.2	174.5	-78.8	-57.3	0	0	0	115.8
745	R	26.4	Very low	27.4	Very low	226 Å²	226	133 Å²	133	85%	0.853	77%	0.771	S	S	*	*				56.4	151.1	67.2	-54.1	179.5	161.4	-169.1	-1.7	112.1
746	V	27.4	Very low	27.2	Very low	121 Å²	121	131.7 Å²	131.7	73%	0.733	77%	0.77	S	S	*	*			cis	-147.8	120.6	34.6	170.1	0	0	0	0	107
747	C	25.5	Very low	27.1	Very low	102 Å²	102	131.1 Å²	131.1	69%	0.689	77%	0.772	S	S	*	*				43.5	128.8	99.3	-66.1	0	0	0	0	115.2
748	S	26.4	Very low	27	Very low	116 Å²	116	130.7 Å²	130.7	81%	0.811	77%	0.77	S	S	*	*				63.4	139.3	59.5	-52.6	0	0	0	0	114
749	A	28.1	Very low	26.8	Very low	74 Å²	74	131.6 Å²	131.6	61%	0.612	77%	0.77	S	S	*	*			cis	-174.3	-176.3	-13.3	0	0	0	0	0	109.4
750	N	28.8	Very low	26.7	Very low	168 Å²	168	127.9 Å²	127.9	90%	0.898	76%	0.764	S	S	*	*			trans	73.7	160.2	160.6	-50.6	-28.2	0	0	0	117.1
751	G	24.6	Very low	26.6	Very low	67 Å²	67	128.7 Å²	128.7	69%	0.691	76%	0.764	S	S	*	*			cis	162.6	85.6	-11.9	0	0	0	0	0	116.8
752	F	24.5	Very low	26.3	Very low	204 Å²	204	131.9 Å²	131.9	90%	0.895	77%	0.768	S	S	*	*			trans	71.4	154.1	152.8	-91.2	-82.6	0	0	0	124.3
753	T	25.4	Very low	26.3	Very low	119 Å²	119	131.5 Å²	131.5	73%	0.73	76%	0.764	S	S	*	*			trans	83.8	87.1	153.6	32.3	0	0	0	0	123.5
754	M	25.3	Very low	26.1	Very low	153 Å²	153	133.7 Å²	133.7	75%	0.754	77%	0.765	S	S	*	*				74.5	134.4	112	-80.4	-135.7	107.6	0	0	125.5
755	Q	25.2	Very low	26.1	Very low	151 Å²	151	132 Å²	132	71%	0.706	76%	0.763	S	S	*	*			trans	72.7	149.1	152.5	-64.4	178.4	28	0	0	117.6
756	T	23.4	Very low	26.1	Very low	121 Å²	121	124.4 Å²	124.4	74%	0.742	76%	0.755	S	S	*	*			cis	-154.1	147.7	10.4	-19	0	0	0	0	113.3
757	A	24	Very low	26.3	Very low	98 Å²	98	124.1 Å²	124.1	81%	0.81	75%	0.753	S	S	*	*			trans	59.3	170.8	149.6	0	0	0	0	0	121.1
758	N	24.9	Very low	26.4	Very low	141 Å²	141	128.4 Å²	128.4	75%	0.754	77%	0.766	S	S	*	*			cis	-168.5	166.7	-48.6	-166.5	18.2	0	0	0	109.6
759	N	25.5	Very low	26.3	Very low	135 Å²	135	126.5 Å²	126.5	72%	0.722	76%	0.764	S	S	*	*			trans	69.6	156	165.7	-75.6	0.2	0	0	0	119.5
760	S	27.8	Very low	26.3	Very low	99 Å²	99	129 Å²	129	69%	0.692	78%	0.777	S	S	*	*			cis	-179.3	134.7	-25.4	56.5	0	0	0	0	113.5
761	S	27	Very low	26	Very low	112 Å²	112	124.4 Å²	124.4	78%	0.783	77%	0.769	S	S	*	*			trans	168.2	152.7	148.8	53.1	0	0	0	0	110.2
762	Q	31.3	Very low	26.1	Very low	198 Å²	198	128.8 Å²	128.8	93%	0.925	77%	0.773	S	S	*	*			cis	-165.3	153.6	-20.6	-106.9	179.2	-29.7	0	0	105.1
763	G	25.5	Very low	26.2	Very low	66 Å²	66	129 Å²	129	68%	0.68	77%	0.768	S	S	*	*			cis	-152.7	168.4	-1.1	0	0	0	0	0	110.6
764	F	24.3	Very low	26.2	Very low	211 Å²	211	130.9 Å²	130.9	93%	0.925	77%	0.774	S	S	*	*				80.7	127.1	94.3	-159.8	-87	0	0	0	113.3
765	C	26.4	Very low	26.2	Very low	91 Å²	91	127.5 Å²	127.5	62%	0.615	78%	0.778	S	S	*	*			cis	-167.3	157.4	-8	-172.5	0	0	0	0	106.2
766	G	26.2	Very low	26.2	Very low	66 Å²	66	124.3 Å²	124.3	68%	0.68	79%	0.786	S	S	*	*			cis	-175	-158.8	3.4	0	0	0	0	0	107.7
767	T	31.2	Very low	26.3	Very low	115 Å²	115	126.5 Å²	126.5	71%	0.706	79%	0.788	S	S	*	*			cis	-168.6	127	-8.3	-1.9	0	0	0	0	109.3
768	M	28.6	Very low	26.4	Very low	192 Å²	192	128.7 Å²	128.7	95%	0.946	78%	0.781	S	S	*	*			trans	57.8	148.2	163.5	-58.3	-170.5	173.7	0	0	117.7
769	G	25	Very low	26.3	Very low	76 Å²	76	127.3 Å²	127.3	78%	0.784	78%	0.778	S	S	*	*			cis	120.2	146.8	19.6	0	0	0	0	0	109
770	S	26.4	Very low	26.3	Very low	127 Å²	127	127.9 Å²	127.9	89%	0.888	78%	0.78	S	S	*	*			cis	-164.8	150.6	7.1	-177.8	0	0	0	0	111.5
771	G	24.3	Very low	26.1	Very low	70 Å²	70	131.9 Å²	131.9	72%	0.722	79%	0.787	S	S	*	*			trans	80.9	172.1	158.7	0	0	0	0	0	118.2
772	M	25.1	Very low	26.1	Very low	159 Å²	159	135 Å²	135	78%	0.783	79%	0.792	S	S	*	*			cis	-168.4	111.9	-13.5	173.6	64.2	156.1	0	0	111.9
773	R	27.2	Very low	25.7	Very low	209 Å²	209	134.3 Å²	134.3	79%	0.789	79%	0.791	S	S	*	*			trans	64	158.6	156.6	-85.1	-173.5	174.7	-167.8	-2.8	122
774	N	25.7	Very low	25.6	Very low	158 Å²	158	140.2 Å²	140.2	85%	0.845	80%	0.798	S	S	*	*			trans	67	146.4	169.7	-56.2	-7.2	0	0	0	115.3
775	G	24.3	Very low	25.5	Very low	82 Å²	82	133.4 Å²	133.4	85%	0.845	79%	0.787	S	S	*	*			cis	145.5	125.3	-4.5	0	0	0	0	0	110.9
776	G	25.6	Very low	25.4	Very low	84 Å²	84	136.6 Å²	136.6	87%	0.866	79%	0.792	S	S	*	*			trans	-178.9	160.1	-177.6	0	0	0	0	0	113.6
777	Q	26	Very low	25.3	Very low	167 Å²	167	141.7 Å²	141.7	78%	0.78	80%	0.798	S	S	*	*			trans	-128.6	156.1	-171.3	-112.2	166	-86.2	0	0	111.5
778	E	26.3	Very low	24.9	Very low	144 Å²	144	141.9 Å²	141.9	67%	0.673	80%	0.799	S	S	*	*			trans	73.1	115.1	141.3	-74	169.4	-160.7	0	0	123.5
779	T	23.4	Very low	24.6	Very low	113 Å²	113	139.5 Å²	139.5	69%	0.693	79%	0.79	S	S	*	*				84.4	141.4	123.1	60.2	0	0	0	0	123.7
780	I	24.7	Very low	24.5	Very low	147 Å²	147	142.1 Å²	142.1	75%	0.754	79%	0.786	S	S	*	*			trans	73.7	143.4	149.9	-71	158.6	0	0	0	113.8
781	E	24.1	Very low	24.4	Very low	182 Å²	182	140.3 Å²	140.3	85%	0.85	77%	0.773	S	S	*	*			cis	-148.1	178.4	31.3	-156.6	145.2	-125.7	0	0	115
782	M	26.3	Very low	24.4	Very low	177 Å²	177	142.2 Å²	142.2	87%	0.872	77%	0.774	S	S	*	*			trans	-125	122.7	170	-77.9	-168.7	-71.3	0	0	113
783	M	22.8	Very low	24.3	Very low	184 Å²	184	146.1 Å²	146.1	91%	0.906	78%	0.78	S	S	*	*			trans	-155	144.5	147	-82.9	-154.9	178.7	0	0	108.5
784	K	23.8	Very low	24.1	Very low	191 Å²	191	142.8 Å²	142.8	83%	0.83	78%	0.783	S	S	*	*			cis	108.5	108.7	16.5	-171.9	-178.4	-178	-178.9	0	113.2
785	G	23.2	Very low	24.2	Very low	67 Å²	67	140.3 Å²	140.3	69%	0.691	78%	0.784	S	S	*	*			trans	132.5	155.6	167.3	0	0	0	0	0	112.4
786	H	24.2	Very low	24.2	Very low	159 Å²	159	139.3 Å²	139.3	74%	0.736	77%	0.774	S	S	*	*			cis	172.4	151.5	-27.6	-122.7	54.2	0	0	0	106.5
787	Q	23.3	Very low	24.3	Very low	172 Å²	172	143.9 Å²	143.9	80%	0.804	77%	0.772	S	S	*	*			trans	68.3	150.3	165.4	-60.9	172.3	-14.5	0	0	116.8
788	T	22.3	Very low	24.3	Very low	119 Å²	119	142.9 Å²	142.9	73%	0.73	77%	0.767	S	S	*	*			cis	-158.9	-177.1	-14.9	16	0	0	0	0	110.3
789	L	23.2	Very low	24.3	Very low	143 Å²	143	144.1 Å²	144.1	75%	0.749	77%	0.773	S	S	*	*			trans	-48.3	170.3	165.9	-60.3	72.1	0	0	0	113.4
790	D	23.2	Very low	24.4	Very low	131 Å²	131	144.2 Å²	144.2	70%	0.701	77%	0.774	S	S	*	*			cis	-167.4	164.7	30.4	-144.7	-32.2	0	0	0	115.9
791	S	23.4	Very low	24.4	Very low	88 Å²	88	144.6 Å²	144.6	62%	0.615	78%	0.776	S	S	*	*			trans	55.8	114.5	140.9	-80	0	0	0	0	126.2
792	C	23.6	Very low	24.3	Very low	111 Å²	111	142 Å²	142	75%	0.75	77%	0.768	S	S	*	*				65.5	122.1	115.9	-61	0	0	0	0	124.3
793	R	24.8	Very low	24.2	Very low	241 Å²	241	139 Å²	139	91%	0.909	77%	0.765	S	S	*	*				-175.5	127	123.8	-97.8	167	-176.8	-151.6	-0.6	109.1
794	V	22.8	Very low	24.3	Very low	139 Å²	139	137 Å²	137	84%	0.842	77%	0.767	S	S	*	*			cis	97.8	104.4	47.6	167.4	0	0	0	0	113.5
795	A	26.6	Very low	24.3	Very low	105 Å²	105	139.8 Å²	139.8	87%	0.868	77%	0.772	S	S	*	*			trans	173.5	143.6	147.1	0	0	0	0	0	109.1
796	G	24.5	Very low	24.3	Very low	61 Å²	61	140.2 Å²	140.2	63%	0.629	78%	0.776	S	S	*	*			cis	163.4	156.7	-10	0	0	0	0	0	112.3
797	H	27.3	Very low	24.3	Very low	180 Å²	180	136.2 Å²	136.2	83%	0.833	78%	0.778	S	S	*	*			trans	84.4	154	178.7	-52.9	84	0	0	0	118.6
798	H	26.1	Very low	24.3	Very low	147 Å²	147	136.3 Å²	136.3	68%	0.681	78%	0.778	S	S	*	*				-174.3	168.1	-52.5	-106.8	-52.5	0	0	0	110.5
799	H	26.1	Very low	24.4	Very low	169 Å²	169	137.5 Å²	137.5	78%	0.782	78%	0.777	S	S	*	*			trans	72.7	108.8	175.4	-48	-70.4	0	0	0	114.8
800	T	26	Very low	24.4	Very low	116 Å²	116	140.1 Å²	140.1	71%	0.712	79%	0.786	S	S	*	*			cis	85.3	116.2	23.3	-43.3	0	0	0	0	115.3
801	L	24.7	Very low	24.5	Very low	155 Å²	155	138.5 Å²	138.5	81%	0.812	78%	0.781	S	S	*	*			trans	-160.7	115.6	139	-107.1	173.1	0	0	0	112.7
802	D	22.9	Very low	24.7	Very low	128 Å²	128	140.5 Å²	140.5	68%	0.684	79%	0.785	S	S	*	*			trans	47.4	94.6	146.3	-59.9	-3.6	0	0	0	124.3
803	S	23.4	Very low	24.7	Very low	114 Å²	114	142.4 Å²	142.4	80%	0.797	79%	0.787	S	S	*	*				27.2	133.7	103.6	-57.1	0	0	0	0	121.8
804	C	24.3	Very low	24.7	Very low	140 Å²	140	135 Å²	135	95%	0.946	77%	0.772	S	S	*	*				-147.4	160.2	126.8	-133.8	0	0	0	0	110.7
805	R	25	Very low	25.3	Very low	251 Å²	251	139 Å²	139	95%	0.947	77%	0.772	S	S	*	*			trans	-150.1	137.3	-158.7	-172.5	-169	-164.3	-147	7.3	113.7
806	G	23.1	Very low	25.3	Very low	75 Å²	75	143 Å²	143	77%	0.773	77%	0.766	S	S	*	*			trans	162	136	161.6	0	0	0	0	0	116.3
807	G	23.8	Very low	26	Very low	76 Å²	76	144.9 Å²	144.9	78%	0.784	77%	0.765	S	S	*	*			trans	69.5	109.9	173.6	0	0	0	0	0	114.5
808	H	22.6	Very low	26.2	Very low	173 Å²	173	146.7 Å²	146.7	80%	0.801	77%	0.766	S	S	*	*			cis	72.4	99	22.2	-127.4	-75.7	0	0	0	115.5
809	M	25.4	Very low	26.9	Very low	144 Å²	144	143.7 Å²	143.7	71%	0.709	76%	0.762	S	S	*	*			trans	25.4	130.2	144.1	-58.4	168.3	63.4	0	0	119.7
810	E	23.7	Very low	27.4	Very low	199 Å²	199	140.1 Å²	140.1	93%	0.93	75%	0.745	S	S	*	*				-144.3	137.3	114.5	-137.2	163	-145.7	0	0	110.9
811	T	25	Very low	27.8	Very low	96 Å²	96	144.1 Å²	144.1	59%	0.589	75%	0.747	S	S	*	*			trans	-105.6	162.1	-178.1	-16.8	0	0	0	0	110
812	D	26	Very low	28.4	Very low	131 Å²	131	143.8 Å²	143.8	70%	0.701	74%	0.741	S	S	*	*			trans	50.5	112.4	155.3	-54.6	-41.5	0	0	0	119.4
813	N	24.7	Very low	29.3	Very low	150 Å²	150	141.5 Å²	141.5	80%	0.802	74%	0.736	S	S	*	*				-179.9	155.5	98.8	-96.9	-77	0	0	0	109.7
814	C	24.6	Very low	30.1	Very low	86 Å²	86	142.7 Å²	142.7	58%	0.581	73%	0.726	S	S	*	*			cis	-147.4	166.3	11.8	-150.2	0	0	0	0	112
815	R	36.5	Very low	30.9	Very low	224 Å²	224	138.6 Å²	138.6	85%	0.845	70%	0.697	S	S	*	*			trans	-12.1	129.9	164.9	-65.3	168.4	170.1	158	-3.5	117.8
816	Y	26.7	Very low	31.9	Very low	189 Å²	189	134.1 Å²	134.1	74%	0.741	69%	0.687	S	S	*	*			trans	-127	154	143.1	-87.2	-86.1	0	0	0	111.2	E820	Y816-E820 VanDerWaalsContact CB-OE2 3.3Å; Y816-E820 WeakPolarHBondContact CB-OE2 3.46Å; Y816-E820 HydrophobicContact CD1-CG 4.49Å; Y816-E820 WeakPolarHBondContact CD1-OE1 3.44Å; Y816-E820 WeakPolarHBondContact CD1-OE2 3.37Å
817	T	37.7	Very low	32.7	Very low	100 Å²	100	134.5 Å²	134.5	61%	0.613	68%	0.676	S	S	*	*			trans	-89.2	162	-170.1	42.8	0	0	0	0	113.4	S819 E820	T817-S819 PolarHBondContact O-N 3.18Å; T817-S819 PolarHBondContact OG1-OG 2.92Å; T817-E820 PolarHBondContact O-N 2.85Å
818	Y	32	Very low	33.4	Very low	218 Å²	218	138.5 Å²	138.5	86%	0.855	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.1	-22.6	-179.1	-162.1	-99.4	0	0	0	115.8	E820	Y818-E820 VanDerWaalsContact C-N 3.33Å; Y818-E820 PolarHBondContact O-N 3.25Å
819	S	40	Very low	34.2	Very low	84 Å²	84	136.4 Å²	136.4	59%	0.587	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-23.4	176.2	43.2	0	0	0	0	115.7	T817	T817-S819 PolarHBondContact O-N 3.18Å; T817-S819 PolarHBondContact OG1-OG 2.92Å
820	E	37	Very low	35	Very low	94 Å²	94	131.4 Å²	131.4	44%	0.439	65%	0.647	S	S	.	*	H	α-helix	trans	-86.5	-15	-178.6	-63.7	-162	150.9	0	0	114.2	Y816 T817 Y818 H822 S823 F824	Y816-E820 VanDerWaalsContact CB-OE2 3.3Å; Y816-E820 WeakPolarHBondContact CB-OE2 3.46Å; Y816-E820 HydrophobicContact CD1-CG 4.49Å; Y816-E820 WeakPolarHBondContact CD1-OE1 3.44Å; Y816-E820 WeakPolarHBondContact CD1-OE2 3.37Å; T817-E820 PolarHBondContact O-N 2.85Å; Y818-E820 VanDerWaalsContact C-N 3.33Å; Y818-E820 PolarHBondContact O-N 3.25Å; E820-H822 VanDerWaalsContact C-N 3.31Å; E820-H822 PolarHBondContact O-N 3.04Å; E820-S823 WeakPolarHBondContact O-CA 3.48Å; E820-S823 VanDerWaalsContact O-CB 3.29Å; E820-S823 WeakPolarHBondContact O-CB 3.09Å; E820-S823 PolarHBondContact O-N 3.41Å; E820-F824 PolarHBondContact O-N 3.49Å; E820-F824 VanDerWaalsContact O-N 3.13Å
821	W	34.1	Very low	35.8	Very low	199 Å²	199	128.4 Å²	128.4	75%	0.754	63%	0.633	S	S	*	*	H	α-helix	trans	-64.9	-35.5	-176.3	-125.9	83.6	0	0	0	112.5	F824 T825	W821-F824 PolarHBondContact O-N 3.26Å; W821-T825 HydrophobicContact CE3-CG2 3.78Å; W821-T825 HydrophobicContact CZ3-CG2 3.83Å; W821-T825 WeakPolarHBondContact O-CG2 3.29Å; W821-T825 PolarHBondContact O-N 3.11Å; W821-T825 PolarHBondContact O-OG1 2.96Å
822	H	38.7	Very low	36.4	Very low	148 Å²	148	132 Å²	132	69%	0.685	64%	0.64	S	S	*	*	H	α-helix	trans	-61.6	-43.6	170.4	-82.6	-49.3	0	0	0	112	E820 F824 T825 Q826	E820-H822 VanDerWaalsContact C-N 3.31Å; E820-H822 PolarHBondContact O-N 3.04Å; H822-F824 PolarHBondContact O-N 2.96Å; H822-T825 PolarHBondContact O-N 3.38Å; H822-T825 PolarHBondContact O-OG1 2.97Å; H822-Q826 PolarHBondContact O-N 3.23Å
823	S	41.5	Very low	37	Very low	81 Å²	81	132.5 Å²	132.5	57%	0.566	64%	0.642	S	S	*	*	H	α-helix	trans	-61.1	-30.2	178.1	-48.6	0	0	0	0	113.3	E820 P827	E820-S823 WeakPolarHBondContact O-CA 3.48Å; E820-S823 VanDerWaalsContact O-CB 3.29Å; E820-S823 WeakPolarHBondContact O-CB 3.09Å; E820-S823 PolarHBondContact O-N 3.41Å; S823-P827 WeakPolarHBondContact O-CD 3.39Å
824	F	40.1	Very low	37.7	Very low	138 Å²	138	132.7 Å²	132.7	61%	0.605	64%	0.638	S	S	*	*	H	α-helix	trans	-84.5	-32.7	-179.6	-159	-97.9	0	0	0	113.6	E820 W821 H822	E820-F824 PolarHBondContact O-N 3.49Å; E820-F824 VanDerWaalsContact O-N 3.13Å; W821-F824 PolarHBondContact O-N 3.26Å; H822-F824 PolarHBondContact O-N 2.96Å
825	T	40.7	Very low	38.5	Very low	54 Å²	54	132.5 Å²	132.5	33%	0.331	64%	0.642	S	S	.	*	H	α-helix	trans	-70.4	-31.4	179.4	53.8	0	0	0	0	113.8	W821 H822 L829	W821-T825 HydrophobicContact CE3-CG2 3.78Å; W821-T825 HydrophobicContact CZ3-CG2 3.83Å; W821-T825 WeakPolarHBondContact O-CG2 3.29Å; W821-T825 PolarHBondContact O-N 3.11Å; W821-T825 PolarHBondContact O-OG1 2.96Å; H822-T825 PolarHBondContact O-N 3.38Å; H822-T825 PolarHBondContact O-OG1 2.97Å; T825-L829 PolarHBondContact O-N 3.26Å
826	Q	45.5	Very low	38.7	Very low	158 Å²	158	127.4 Å²	127.4	74%	0.738	64%	0.64	S	S	*	*	H	α-helix	trans	-77.4	-38	-168.4	-156.2	159.6	3	0	0	115.3	H822	H822-Q826 PolarHBondContact O-N 3.23Å
827	P	41.4	Very low	39.2	Very low	82 Å²	82	122.1 Å²	122.1	53%	0.532	63%	0.625	S	S	.	*	H	α-helix	trans	-68.4	-40.6	173.8	-20.6	33.1	0	0	0	112.8	S823 G830 E831	S823-P827 WeakPolarHBondContact O-CD 3.39Å; P827-G830 WeakPolarHBondContact O-CA 3.5Å; P827-G830 PolarHBondContact O-N 2.98Å; P827-E831 PolarHBondContact O-N 3.35Å; P827-E831 VanDerWaalsContact O-N 3.09Å
828	R	37.8	Very low	39.1	Very low	161 Å²	161	123.8 Å²	123.8	61%	0.608	63%	0.625	S	S	*	*	H	α-helix	trans	-80.4	-22.3	-166.8	-137.6	171.7	-171.6	176.1	0.1	114.3
829	L	39.5	Very low	39.8	Very low	129 Å²	129	120.6 Å²	120.6	68%	0.675	62%	0.623	S	S	*	*	H	α-helix	trans	-73.1	-32.7	162.1	-93.8	81.2	0	0	0	111.8	T825 K832 L833	T825-L829 PolarHBondContact O-N 3.26Å; L829-K832 PolarHBondContact O-N 3.46Å; L829-L833 PolarHBondContact O-N 3.34Å
830	G	41.3	Very low	40.2	Very low	39 Å²	39	125.7 Å²	125.7	40%	0.402	64%	0.637	S	S	.	*	H	α-helix	trans	-60.7	-49.4	175.8	0	0	0	0	0	112.6	P827 K832 L833 H834	P827-G830 WeakPolarHBondContact O-CA 3.5Å; P827-G830 PolarHBondContact O-N 2.98Å; G830-K832 PolarHBondContact O-N 3.34Å; G830-L833 PolarHBondContact O-N 3.4Å; G830-H834 PolarHBondContact O-N 3.19Å; G830-H834 VanDerWaalsContact O-N 3.09Å
831	E	40.5	Very low	40.8	Very low	136 Å²	136	128.1 Å²	128.1	64%	0.636	65%	0.654	S	S	*	*	H	α-helix	trans	-60.2	-41.6	176.5	-68.4	-176.1	130.3	0	0	112.6	P827 H834 A835	P827-E831 PolarHBondContact O-N 3.35Å; P827-E831 VanDerWaalsContact O-N 3.09Å; E831-H834 WeakPolarHBondContact O-CB 3.3Å; E831-H834 PolarHBondContact O-N 3.44Å; E831-A835 PolarHBondContact O-N 3.41Å; E831-A835 VanDerWaalsContact O-N 3.14Å
832	K	37.5	Very low	41.3	Very low	170 Å²	170	125.5 Å²	125.5	74%	0.739	65%	0.65	S	S	*	*	H	α-helix	trans	-71.7	-26.7	177.3	-89.1	-153.3	169.9	-166.7	0	114.2	L829 G830 H834	L829-K832 PolarHBondContact O-N 3.46Å; G830-K832 PolarHBondContact O-N 3.34Å; K832-H834 VanDerWaalsContact C-N 3.32Å
833	L	38.9	Very low	41.3	Very low	142 Å²	142	124.2 Å²	124.2	74%	0.743	65%	0.652	S	S	*	*	H	α-helix	trans	-68.3	-36.4	169.4	-136.1	77.4	0	0	0	111.1	L829 G830 A835 C836	L829-L833 PolarHBondContact O-N 3.34Å; G830-L833 PolarHBondContact O-N 3.4Å; L833-A835 VanDerWaalsContact C-N 3.33Å; L833-A835 PolarHBondContact O-N 3.05Å; L833-C836 PolarHBondContact O-N 2.82Å
834	H	40	Very low	41	Very low	154 Å²	154	125.6 Å²	125.6	71%	0.713	66%	0.659	S	S	*	*	H	α-helix	trans	-69.2	-28.9	178.7	-127.1	-59.2	0	0	0	113.7	G830 E831 K832	G830-H834 PolarHBondContact O-N 3.19Å; G830-H834 VanDerWaalsContact O-N 3.09Å; E831-H834 WeakPolarHBondContact O-CB 3.3Å; E831-H834 PolarHBondContact O-N 3.44Å; K832-H834 VanDerWaalsContact C-N 3.32Å
835	A	40.9	Very low	40.6	Very low	82 Å²	82	122.8 Å²	122.8	68%	0.678	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-8.2	-179.5	0	0	0	0	0	114.7	E831 L833	E831-A835 PolarHBondContact O-N 3.41Å; E831-A835 VanDerWaalsContact O-N 3.14Å; L833-A835 VanDerWaalsContact C-N 3.33Å; L833-A835 PolarHBondContact O-N 3.05Å
836	C	40.9	Very low	40.6	Very low	118 Å²	118	127.7 Å²	127.7	80%	0.797	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	12.8	-177.9	-138.5	0	0	0	0	113.3	L833	L833-C836 PolarHBondContact O-N 2.82Å
837	N	37.3	Very low	40	Very low	78 Å²	78	128 Å²	128	42%	0.417	68%	0.682	S	S	.	*	S	Bend	trans	-131.5	43.6	-174.1	-155.6	11.4	0	0	0	112.3	S845	N837-S845 VanDerWaalsContact CG-OG 3.28Å; N837-S845 PolarHBondContact ND2-OG 3.04Å; N837-S845 PolarHBondContact OD1-OG 3.01Å
838	Q	36	Very low	39.6	Very low	135 Å²	135	132.6 Å²	132.6	63%	0.631	69%	0.69	S	S	*	*			trans	-137.8	110.5	169.8	-70.9	-168.8	-9.8	0	0	110.6
839	N	46	Very low	39.2	Very low	151 Å²	151	131.9 Å²	131.9	81%	0.807	70%	0.704	S	S	*	*			trans	-87.9	174.4	149.3	-74.2	-11.6	0	0	0	108.7	D841 H842	N839-D841 PolarHBondContact O-N 2.89Å; N839-H842 PolarHBondContact O-N 2.84Å
840	E	48.1	Very low	38.7	Very low	190 Å²	190	132.8 Å²	132.8	89%	0.888	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-23.5	-165.7	-59.3	-174.4	121.2	0	0	114.9
841	D	49.5	Very low	38.2	Very low	146 Å²	146	136.7 Å²	136.7	78%	0.781	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	17.9	-174.4	-63.7	-56.6	0	0	0	116.7	N839 T843	N839-D841 PolarHBondContact O-N 2.89Å; D841-T843 PolarHBondContact O-N 3.44Å
842	H	44.9	Very low	37.5	Very low	144 Å²	144	140.7 Å²	140.7	67%	0.667	74%	0.736	S	S	*	*			trans	52	45	159.5	-81.6	27.5	0	0	0	117.6	N839	N839-H842 PolarHBondContact O-N 2.84Å
843	T	39.7	Very low	37.1	Very low	120 Å²	120	140.9 Å²	140.9	74%	0.736	74%	0.739	S	S	*	*			trans	-126.3	139.2	171.4	43.3	0	0	0	0	113	D841	D841-T843 PolarHBondContact O-N 3.44Å
844	P	35.3	Very low	36.5	Very low	111 Å²	111	143.6 Å²	143.6	72%	0.721	74%	0.741	S	S	*	*			trans	-90.3	134.4	-171.2	34	-34.4	0	0	0	113.6
845	S	30.9	Very low	36.1	Very low	79 Å²	79	143.5 Å²	143.5	55%	0.552	74%	0.74	S	S	*	*			trans	-76.3	144.8	165.8	57.6	0	0	0	0	111.4	N837	N837-S845 VanDerWaalsContact CG-OG 3.28Å; N837-S845 PolarHBondContact ND2-OG 3.04Å; N837-S845 PolarHBondContact OD1-OG 3.01Å
846	Q	39.6	Very low	35.5	Very low	156 Å²	156	143.3 Å²	143.3	73%	0.729	75%	0.747	S	S	*	*			trans	-115.3	109.9	174.8	-69.8	-172.6	3.8	0	0	110.4
847	D	33	Very low	35	Very low	164 Å²	164	149.9 Å²	149.9	88%	0.877	76%	0.755	S	S	*	*			trans	-145.3	138.9	161.9	-105.4	-44.6	0	0	0	109.4
848	Y	34.1	Very low	34.8	Very low	179 Å²	179	149.6 Å²	149.6	70%	0.702	77%	0.77	S	S	*	*			trans	-133.7	118.4	-171.2	25.6	-98.6	0	0	0	111.6	L850	Y848-L850 PolarHBondContact O-N 3.09Å
849	V	29.1	Very low	34.4	Very low	147 Å²	147	149.1 Å²	149.1	89%	0.891	78%	0.782	S	S	*	*			trans	-82.6	110.4	-178.8	-178.5	0	0	0	0	110.4
850	L	28.9	Very low	34	Very low	147 Å²	147	147.8 Å²	147.8	77%	0.77	78%	0.781	S	S	*	*			trans	-83.7	126.5	169	-76.7	166.6	0	0	0	110.8	Y848	Y848-L850 PolarHBondContact O-N 3.09Å
851	T	31.7	Very low	33.1	Very low	122 Å²	122	143.8 Å²	143.8	75%	0.748	78%	0.78	S	S	*	*			trans	-76.7	142.8	168.1	35.6	0	0	0	0	111.3
852	Y	25.7	Very low	32.2	Very low	220 Å²	220	140.7 Å²	140.7	86%	0.863	78%	0.783	S	S	*	*			trans	-135.6	146.9	168.8	-111.2	-88.5	0	0	0	112
853	H	28	Very low	31.2	Very low	173 Å²	173	139.2 Å²	139.2	80%	0.801	79%	0.789	S	S	*	*			trans	-105.6	150.7	-175	-76.1	-90.8	0	0	0	113.1
854	Y	27.7	Very low	30.6	Very low	200 Å²	200	141 Å²	141	78%	0.784	80%	0.799	S	S	*	*			trans	89	166.1	149.3	-133.5	-100.4	0	0	0	120.4
855	E	30.8	Very low	30.1	Very low	152 Å²	152	139.2 Å²	139.2	71%	0.71	80%	0.801	S	S	*	*			trans	-74.4	154.3	-155.1	-60.4	172.4	-163.9	0	0	117.3
856	G	27.6	Very low	29.9	Very low	78 Å²	78	141.7 Å²	141.7	80%	0.804	82%	0.817	S	S	*	*			trans	-160.1	138.4	162.1	0	0	0	0	0	113
857	R	31	Very low	29.4	Very low	256 Å²	256	139.9 Å²	139.9	97%	0.966	82%	0.82	S	S	*	*			trans	-101	111.8	-179.2	-73.2	-174.2	-176.6	166.9	4.9	113.4
858	G	33.3	Very low	29.3	Very low	72 Å²	72	136.7 Å²	136.7	74%	0.742	81%	0.811	S	S	*	*			trans	54.1	120.3	132.2	0	0	0	0	0	121.3
859	S	28.1	Very low	29	Very low	125 Å²	125	135.2 Å²	135.2	87%	0.874	81%	0.81	S	S	*	*			trans	-153.5	145	147.9	-78.2	0	0	0	0	109.8
860	P	36.7	Very low	29.1	Very low	123 Å²	123	135 Å²	135	80%	0.799	80%	0.798	S	S	*	*			trans	-103.7	146.6	-176.1	37.1	-32.3	0	0	0	115
861	A	29	Very low	29.1	Very low	105 Å²	105	134.1 Å²	134.1	87%	0.868	79%	0.79	S	S	*	*			trans	61.3	83.7	152.8	0	0	0	0	0	120.4
862	G	30.8	Very low	29.1	Very low	82 Å²	82	134.6 Å²	134.6	85%	0.845	78%	0.783	S	S	*	*				90.2	110.6	111.7	0	0	0	0	0	121.3
863	S	23.9	Very low	29.5	Very low	113 Å²	113	132.6 Å²	132.6	79%	0.79	78%	0.782	S	S	*	*			trans	-165	112.8	142.8	57.7	0	0	0	0	114.1
864	V	27.9	Very low	29.7	Very low	156 Å²	156	132.8 Å²	132.8	95%	0.945	78%	0.783	S	S	*	*			trans	41	128.9	136.2	-166.9	0	0	0	0	121.1
865	G	23.8	Very low	30	Very low	74 Å²	74	127.1 Å²	127.1	76%	0.763	79%	0.785	S	S	*	*			trans	163.3	124.6	152.3	0	0	0	0	0	114.9
866	C	27.9	Very low	30.2	Very low	131 Å²	131	126.7 Å²	126.7	89%	0.885	79%	0.787	S	S	*	*			trans	-111.7	159.1	176.1	-60.9	0	0	0	0	112.1
867	C	27.9	Very low	30.8	Very low	118 Å²	118	129 Å²	129	80%	0.797	78%	0.781	S	S	*	*			trans	177.7	113.9	142.6	-103.4	0	0	0	0	108.5
868	S	30.6	Very low	31.2	Very low	98 Å²	98	125.6 Å²	125.6	69%	0.685	77%	0.773	S	S	*	*				79.2	147.2	79.4	73.6	0	0	0	0	113.3
869	E	29.3	Very low	31.3	Very low	147 Å²	147	130 Å²	130	69%	0.687	78%	0.779	S	S	*	*			cis	-112.7	-154.7	9.5	-52	-178.5	90.3	0	0	110.5
870	K	29.5	Very low	32.1	Very low	144 Å²	144	131 Å²	131	63%	0.626	77%	0.774	S	S	*	*			cis	-163.6	174.4	-3.2	-134.2	155.8	-176.3	145.9	0	106.8
871	Q	30	Very low	32.5	Very low	128 Å²	128	132.2 Å²	132.2	60%	0.598	78%	0.775	S	S	*	*			cis	-153.4	-176.8	3.1	-162.7	154.3	-52.5	0	0	109.6
872	E	32.5	Very low	33.3	Very low	132 Å²	132	135 Å²	135	62%	0.617	77%	0.774	S	S	*	*			trans	1.5	128.6	160.3	-80.2	120.5	-119.4	0	0	121
873	E	32.7	Very low	33.9	Very low	177 Å²	177	137.3 Å²	137.3	83%	0.827	76%	0.763	S	S	*	*				79.7	137.7	68.1	-71.9	175.6	-177.9	0	0	113.5
874	E	32.8	Very low	35.2	Very low	178 Å²	178	137.3 Å²	137.3	83%	0.832	76%	0.76	S	S	*	*			cis	-128.8	162.8	3	-64.2	-178.3	104.4	0	0	112
875	G	34.5	Very low	36	Very low	80 Å²	80	137.8 Å²	137.8	83%	0.825	75%	0.749	S	S	*	*			trans	175.4	79.6	175.2	0	0	0	0	0	113.5
876	L	33.9	Very low	37.2	Very low	143 Å²	143	141.5 Å²	141.5	75%	0.749	75%	0.745	S	S	*	*			trans	-82.9	154.1	-162.2	-69.5	166.5	0	0	0	116.6
877	D	41.6	Very low	38.2	Very low	126 Å²	126	140.6 Å²	140.6	67%	0.674	73%	0.731	S	S	*	*			trans	28.8	106.4	145.8	-65.2	-48.5	0	0	0	120.2
878	F	38.1	Very low	39.2	Very low	185 Å²	185	139.6 Å²	139.6	81%	0.811	72%	0.721	S	S	*	*			trans	-138.7	8.5	162.1	-163.4	-109.9	0	0	0	116.6
879	L	36.6	Very low	39.8	Very low	166 Å²	166	141.5 Å²	141.5	87%	0.869	72%	0.723	S	S	*	*	S	Bend	trans	-116.5	7.1	-176.8	-69.9	177.4	0	0	0	116.2
880	N	44.8	Very low	40.6	Very low	144 Å²	144	137.5 Å²	137.5	77%	0.77	72%	0.715	S	S	*	*	S	Bend	trans	-105.8	1.2	176.9	-73.5	-38.3	0	0	0	114.7
881	N	45	Very low	41.7	Very low	150 Å²	150	137.3 Å²	137.3	80%	0.802	72%	0.716	S	S	*	*			trans	-130.7	101.6	177.7	-77.9	-46.6	0	0	0	111.1
882	L	45	Very low	42.6	Very low	164 Å²	164	136.4 Å²	136.4	86%	0.859	72%	0.72	S	S	*	*			trans	-91.5	135.9	168.8	-79.4	166.1	0	0	0	110.2
883	E	43.7	Very low	43.1	Very low	130 Å²	130	135.6 Å²	135.6	61%	0.607	73%	0.727	S	S	*	*			trans	-66.6	150.1	179.1	-77.5	-157.5	153.4	0	0	113	K885 F886	E883-K885 PolarHBondContact O-N 3.21Å; E883-F886 PolarHBondContact O-N 3.09Å
884	P	51.1	Low	43.7	Very low	113 Å²	113	132.5 Å²	132.5	73%	0.734	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-9.9	-177.7	-25.9	35.2	0	0	0	116.7
885	K	45.5	Very low	44.3	Very low	165 Å²	165	133.3 Å²	133.3	72%	0.717	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-12.8	-175	-75	177.1	178.4	166.9	0	115.1	E883	E883-K885 PolarHBondContact O-N 3.21Å
886	F	48.3	Very low	44.3	Very low	152 Å²	152	144.8 Å²	144.8	67%	0.667	74%	0.74	S	S	*	*	S	Bend	trans	-107.5	-5.7	-174.6	-69	-78.3	0	0	0	115.1	E883	E883-F886 PolarHBondContact O-N 3.09Å
887	L	48.6	Very low	44.8	Very low	113 Å²	113	144.9 Å²	144.9	59%	0.592	74%	0.739	S	S	*	*	H	α-helix	trans	-67.9	-41.2	-179.5	-89.8	151.9	0	0	0	113.6	L889 A890 E891	L887-L889 VanDerWaalsContact C-N 3.27Å; L887-L889 PolarHBondContact O-N 3.42Å; L887-A890 PolarHBondContact O-N 3.47Å; L887-A890 VanDerWaalsContact O-N 3.12Å; L887-E891 PolarHBondContact O-N 3.03Å
888	T	49	Very low	45	Very low	97 Å²	97	145.8 Å²	145.8	60%	0.595	74%	0.743	S	S	*	*	H	α-helix	trans	-66.8	-22.4	-175.4	39.8	0	0	0	0	114.4	T892	T888-T892 PolarHBondContact O-OG1 3.13Å
889	L	42.3	Very low	45.4	Very low	137 Å²	137	143.7 Å²	143.7	72%	0.717	74%	0.739	S	S	*	*	H	α-helix	trans	-76.5	-32	174.6	-138.8	80.3	0	0	0	112.1	L887	L887-L889 VanDerWaalsContact C-N 3.27Å; L887-L889 PolarHBondContact O-N 3.42Å
890	A	48	Very low	45.9	Very low	63 Å²	63	142.4 Å²	142.4	52%	0.521	73%	0.731	S	S	.	*	H	α-helix	trans	-75.2	-39	-177.9	0	0	0	0	0	112.9	L887 T892 T894	L887-A890 PolarHBondContact O-N 3.47Å; L887-A890 VanDerWaalsContact O-N 3.12Å; A890-T892 VanDerWaalsContact C-N 3.32Å; A890-T892 PolarHBondContact O-N 3.14Å; A890-T894 PolarHBondContact O-OG1 3.14Å
891	E	50.8	Low	46	Very low	140 Å²	140	142.3 Å²	142.3	65%	0.654	73%	0.729	S	S	*	*	H	α-helix	trans	-71.8	-25.5	178.5	-64.2	-169.2	130.7	0	0	113.2	L887 T894	L887-E891 PolarHBondContact O-N 3.03Å; E891-T894 PolarHBondContact O-OG1 3.17Å
892	T	49.7	Very low	46	Very low	110 Å²	110	141.7 Å²	141.7	68%	0.675	72%	0.724	S	S	*	*	H	α-helix	trans	-74.4	-31.2	-177.8	-56.4	0	0	0	0	112.4	T888 A890	T888-T892 PolarHBondContact O-OG1 3.13Å; A890-T892 VanDerWaalsContact C-N 3.32Å; A890-T892 PolarHBondContact O-N 3.14Å
893	C	42.7	Very low	46.1	Very low	114 Å²	114	140.1 Å²	140.1	77%	0.77	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-0.5	-177.5	-67.7	0	0	0	0	114.8
894	T	46.3	Very low	46.3	Very low	113 Å²	113	140.9 Å²	140.9	69%	0.693	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	15.1	-177	38.4	0	0	0	0	114.3	A890 E891	A890-T894 PolarHBondContact O-OG1 3.14Å; E891-T894 PolarHBondContact O-OG1 3.17Å
895	K	44.4	Very low	45.9	Very low	195 Å²	195	143.3 Å²	143.3	85%	0.848	72%	0.721	S	S	*	*			trans	-134	72.7	171.5	-77.1	-173.7	177.2	172.1	0	113.7
896	R	35.2	Very low	45.9	Very low	320 Å²	320	141.3 Å²	141.3	100%	1.208	72%	0.722	S	S	*	*			trans	-152.2	0	148	-123.5	178.5	-173.1	-172.3	1.8	111.6

Retrieved 896 of 896 residues in 536.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).