A0A077YWD1_TRITR Loading...

tripeptidyl-peptidase II

AlphaFold DB , UniProt , Accession A0A077YWD1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,051 aa.

						>A0A077YWD1_TRITR|A0A077YWD1
MSFLRIYYLFYCLLGRWQSSNVPSLQSALSKLVLQEPMDDENNGKRETEVEEFCSKHPTYDGRGVLIAVLDTGVDPSTPGMQTTTDGHTKVVDIVDFTGAGDVDTSTVRQADNGFVIGLTGRKLRIPNSWKNPSGKYYLGVKAIYELYPQELKRRVQVCLLLRILGKCPCSILEFLKNTRLKRKNLDSGLKLLKALDSNYDDCGPTADCIVFHDGTNWVACLDTSFCGELSGCKLMASYRIRNEYATITETDMMTYSFNIRDNGMMLEIACTAGLHGTHVACIAAGCFPEDPHRNGVAPGAQIISLQIGDSRLKNLETGTALLRAITYCIEKRVHIINYSYAEPVTINDAVYNHGIVFIGSSGNNGPCLSTVTSPGGSCSACLGVAYLAPQMRTKLYSLRESIGPMLFPWSSRGPCSDGWLGTAICAPGAAITSTPRWTLNNRQLLSGTSMSSPNAAGAVALLISGLKMEEVSYSPFSIRLALANTAKKVDQSTVFEAGRGLMQIQQAFEYLLRFVLEDGSRGVYLRELYEVQQPSEVVVFIEAAFNEHTLAALEPCVRFQFSRLLALRCEAEWVRIPTHLEINSAPRSFRLRIDPTRLEPDRVHYAEVMISTDKPILGPVLCIPITVVIPMQPKECVNEKLSFTNVLLSVSGCRRHFIHVPKGCNTAGASAWLTFFLYRSALFQCFIWRVKSLVRFGDETKFTFNIPVIEGRTAEICIASWWMASEELVVDYRITFCGFRANPEAISWVRCSATNDLLFKVMAICGPSSEELNPTMSFRSLCVPLKPIKSLITNLGPRDLYNDGRQCYQVLNTYEFSVDFSTTVTPVIPLVSDYLYEAPFCGFLWTIYSKHDRYLMSGSYFSHRYQVKLEKGDYKLILQVRHVDEETLIDLKDLGIFIECRLNSNIQAQCYASFVDALSVNSKKFSSRRVPANSVTPLYFVGPSKDRLGFPCLATWFFQLPINHSACQSICKFSPHNPTLLQQTEKTEKHLWDCAVRITQLVKIQDLLQFSGANDDCFPVVSQITEYVSYFFNQCSFCSVFMFCAWSQFK
					

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	37.2	Very low	36.7	Very low	215 Å²	215	145.1 Å²	145.1	100%	1.059	66%	0.662	S	S	*	*				0	-11.9	0	-82.8	-165.3	176.5	0	0	114.8
2	S	36.8	Very low	36.6	Very low	76 Å²	76	138.8 Å²	138.8	53%	0.531	65%	0.646	S	S	.	*			trans	-78.9	-20.7	179.3	-31.8	0	0	0	0	114.5
3	F	32.5	Very low	36.8	Very low	189 Å²	189	136.2 Å²	136.2	83%	0.829	64%	0.638	S	S	*	*	H	α-helix	trans	-78.3	-26.3	176.4	-111	-97.6	0	0	0	113.8
4	L	36.1	Very low	36.6	Very low	136 Å²	136	134.1 Å²	134.1	71%	0.712	63%	0.633	S	S	*	*	H	α-helix	trans	-77.6	-19.7	-177.2	-96	113.6	0	0	0	114.4	Y8	L4-Y8 WeakPolarHBondContact O-CB 3.47Å; L4-Y8 PolarHBondContact O-N 3.14Å; L4-Y8 VanDerWaalsContact O-N 3.08Å
5	R	37.5	Very low	36.2	Very low	171 Å²	171	128.1 Å²	128.1	65%	0.645	62%	0.62	S	S	*	*	H	α-helix	trans	-85.6	-29.5	179.7	-85.4	-176.6	176	175.8	-0.2	114.2	Y7 Y8 L9	R5-Y7 VanDerWaalsContact C-N 3.31Å; R5-Y8 PolarHBondContact O-N 3.25Å; R5-L9 PolarHBondContact O-N 3.13Å
6	I	41.2	Very low	36	Very low	100 Å²	100	134.6 Å²	134.6	51%	0.513	64%	0.636	S	S	.	*	H	α-helix	trans	-68.5	-38.6	170.8	-64	175	0	0	0	109.1	L9 F10	I6-L9 PolarHBondContact O-N 2.8Å; I6-F10 WeakPolarHBondContact O-CB 3.4Å; I6-F10 PolarHBondContact O-N 3.31Å
7	Y	36.9	Very low	35.6	Very low	162 Å²	162	140.4 Å²	140.4	64%	0.635	65%	0.651	S	S	*	*	H	α-helix	trans	-64.5	-37.9	172	-131.3	-92.3	0	0	0	112.5	R5 F10 Y11	R5-Y7 VanDerWaalsContact C-N 3.31Å; Y7-F10 WeakPolarHBondContact O-CB 3.42Å; Y7-F10 PolarHBondContact O-N 2.95Å; Y7-Y11 AromaticContact CD1-CD2 4Å; Y7-Y11 HydrophobicContact CD1-CD2 4Å; Y7-Y11 HydrophobicContact CD1-CE2 4.41Å; Y7-Y11 HydrophobicContact CE1-CD2 4.15Å; Y7-Y11 HydrophobicContact CE1-CE2 4.17Å; Y7-Y11 WeakPolarHBondContact O-CB 3.48Å; Y7-Y11 PolarHBondContact O-N 2.83Å
8	Y	36.4	Very low	35.1	Very low	166 Å²	166	141.6 Å²	141.6	65%	0.651	66%	0.657	S	S	*	*	H	α-helix	trans	-72	-33	177.5	-151.5	-95.7	0	0	0	113.1	L4 R5 Y11 C12	L4-Y8 WeakPolarHBondContact O-CB 3.47Å; L4-Y8 PolarHBondContact O-N 3.14Å; L4-Y8 VanDerWaalsContact O-N 3.08Å; R5-Y8 PolarHBondContact O-N 3.25Å; Y8-Y11 PolarHBondContact O-N 3.09Å; Y8-C12 VanDerWaalsContact CD1-SG 3.54Å; Y8-C12 WeakPolarHBondContact CE1-SG 3.5Å; Y8-C12 VanDerWaalsContact O-CB 3.27Å; Y8-C12 WeakPolarHBondContact O-CB 3.31Å; Y8-C12 PolarHBondContact O-N 3.18Å; Y8-C12 PolarHBondContact O-SG 3.09Å
9	L	36.7	Very low	34.6	Very low	113 Å²	113	139.6 Å²	139.6	59%	0.592	66%	0.661	S	S	*	*	H	α-helix	trans	-69.4	-38.1	170.3	-97	146.3	0	0	0	111.7	R5 I6 C12 L13	R5-L9 PolarHBondContact O-N 3.13Å; I6-L9 PolarHBondContact O-N 2.8Å; L9-C12 PolarHBondContact O-N 2.78Å; L9-L13 WeakPolarHBondContact O-CB 3.23Å; L9-L13 WeakPolarHBondContact O-CD1 3.5Å; L9-L13 WeakPolarHBondContact O-CG 3.27Å; L9-L13 PolarHBondContact O-N 3.29Å
10	F	36.1	Very low	34.2	Very low	125 Å²	125	137.9 Å²	137.9	55%	0.548	66%	0.664	S	S	.	*	H	α-helix	trans	-63.1	-40.9	169.7	-123.6	-97.8	0	0	0	111.8	I6 Y7 L14	I6-F10 WeakPolarHBondContact O-CB 3.4Å; I6-F10 PolarHBondContact O-N 3.31Å; Y7-F10 WeakPolarHBondContact O-CB 3.42Å; Y7-F10 PolarHBondContact O-N 2.95Å; F10-L14 HydrophobicContact CD1-CD1 4.15Å; F10-L14 WeakPolarHBondContact O-CB 3.38Å; F10-L14 PolarHBondContact O-N 2.83Å
11	Y	36.4	Very low	33.9	Very low	143 Å²	143	138.9 Å²	138.9	56%	0.561	67%	0.673	S	S	*	*	H	α-helix	trans	-73.5	-31.9	177.9	-120.2	-91.7	0	0	0	113.2	Y7 Y8 L14 G15	Y7-Y11 AromaticContact CD1-CD2 4Å; Y7-Y11 HydrophobicContact CD1-CD2 4Å; Y7-Y11 HydrophobicContact CD1-CE2 4.41Å; Y7-Y11 HydrophobicContact CE1-CD2 4.15Å; Y7-Y11 HydrophobicContact CE1-CE2 4.17Å; Y7-Y11 WeakPolarHBondContact O-CB 3.48Å; Y7-Y11 PolarHBondContact O-N 2.83Å; Y8-Y11 PolarHBondContact O-N 3.09Å; Y11-L14 CarbonylContact O-C 3.49Å; Y11-G15 VanDerWaalsContact O-CA 3.27Å; Y11-G15 WeakPolarHBondContact O-CA 3.45Å; Y11-G15 PolarHBondContact O-N 2.9Å
12	C	36	Very low	33.5	Very low	70 Å²	70	135.4 Å²	135.4	47%	0.473	66%	0.664	S	S	.	*	H	α-helix	trans	-77	-28.4	175.5	-74.6	0	0	0	0	112.4	Y8 L9	Y8-C12 VanDerWaalsContact CD1-SG 3.54Å; Y8-C12 WeakPolarHBondContact CE1-SG 3.5Å; Y8-C12 VanDerWaalsContact O-CB 3.27Å; Y8-C12 WeakPolarHBondContact O-CB 3.31Å; Y8-C12 PolarHBondContact O-N 3.18Å; Y8-C12 PolarHBondContact O-SG 3.09Å; L9-C12 PolarHBondContact O-N 2.78Å
13	L	38.8	Very low	33.1	Very low	104 Å²	104	137 Å²	137	55%	0.545	67%	0.672	S	S	.	*	H	α-helix	trans	-75.3	-32.4	171.5	-78.1	162.4	0	0	0	112	L9 L162	L9-L13 WeakPolarHBondContact O-CB 3.23Å; L9-L13 WeakPolarHBondContact O-CD1 3.5Å; L9-L13 WeakPolarHBondContact O-CG 3.27Å; L9-L13 PolarHBondContact O-N 3.29Å; L13-L162 HydrophobicContact CD1-CD2 4.48Å
14	L	33.7	Very low	33.1	Very low	108 Å²	108	132.1 Å²	132.1	57%	0.565	66%	0.662	S	S	*	*	H	α-helix	trans	-81.8	-20.2	169.6	-75.1	161.3	0	0	0	113.3	F10 Y11 R16 W17	F10-L14 HydrophobicContact CD1-CD1 4.15Å; F10-L14 WeakPolarHBondContact O-CB 3.38Å; F10-L14 PolarHBondContact O-N 2.83Å; Y11-L14 CarbonylContact O-C 3.49Å; L14-R16 PolarHBondContact O-N 2.78Å; L14-W17 CarbonylContact O-C 3.52Å; L14-W17 PolarHBondContact O-N 3.13Å
15	G	31.1	Very low	32.6	Very low	43 Å²	43	134.1 Å²	134.1	44%	0.443	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.7	2	-177.2	0	0	0	0	0	115.6	Y11	Y11-G15 VanDerWaalsContact O-CA 3.27Å; Y11-G15 WeakPolarHBondContact O-CA 3.45Å; Y11-G15 PolarHBondContact O-N 2.9Å
16	R	32.4	Very low	32.2	Very low	233 Å²	233	134.9 Å²	134.9	88%	0.879	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	6	165	-81.7	-173.3	174.9	-168.3	-0.5	113.6	L14	L14-R16 PolarHBondContact O-N 2.78Å
17	W	29.8	Very low	31.6	Very low	232 Å²	232	134.7 Å²	134.7	88%	0.879	69%	0.691	S	S	*	*	S	Bend	trans	-127.6	58.9	169.4	-80.5	71.5	0	0	0	109.2	L14	L14-W17 CarbonylContact O-C 3.52Å; L14-W17 PolarHBondContact O-N 3.13Å
18	Q	25.5	Very low	31.2	Very low	162 Å²	162	131.2 Å²	131.2	76%	0.757	70%	0.695	S	S	*	*			trans	-128.4	74.1	162.7	-85	-169.4	-24.8	0	0	109.3
19	S	26.3	Very low	30.7	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	71%	0.706	S	S	*	*	S	Bend	trans	-129.3	139	134.9	63.7	0	0	0	0	106.8
20	S	26.9	Very low	30.2	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	71%	0.714	S	S	*	*	S	Bend	trans	72.1	102	179.4	39.5	0	0	0	0	119
21	N	28.5	Very low	29.9	Very low	159 Å²	159	134.2 Å²	134.2	85%	0.85	73%	0.727	S	S	*	*			trans	49	98.7	140.4	-63.8	-14	0	0	0	119.6
22	V	27.7	Very low	29.5	Very low	142 Å²	142	136 Å²	136	86%	0.861	75%	0.745	S	S	*	*			trans	-123.5	113.5	155.2	-176.5	0	0	0	0	108
23	P	28.4	Very low	29.2	Very low	109 Å²	109	137.3 Å²	137.3	71%	0.708	75%	0.751	S	S	*	*			trans	-73	150.5	171.6	-4.2	20.8	0	0	0	110.5
24	S	32.7	Very low	28.7	Very low	87 Å²	87	140.4 Å²	140.4	61%	0.608	77%	0.768	S	S	*	*			trans	-50.9	146.9	-174.6	50.1	0	0	0	0	115.7	Q26 S27	S24-Q26 PolarHBondContact O-N 2.81Å; S24-S27 PolarHBondContact O-OG 3.03Å
25	L	25.7	Very low	28.6	Very low	178 Å²	178	142.9 Å²	142.9	93%	0.932	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	30.1	176.4	-116.2	145.6	0	0	0	114.4
26	Q	30	Very low	28.7	Very low	187 Å²	187	149.2 Å²	149.2	87%	0.874	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.1	11.3	178.9	-130.9	170.7	-6.3	0	0	112.7	S24	S24-Q26 PolarHBondContact O-N 2.81Å
27	S	28.2	Very low	28.9	Very low	96 Å²	96	142.3 Å²	142.3	67%	0.671	78%	0.78	S	S	*	*	S	Bend	trans	-108.1	5.8	174.6	62.2	0	0	0	0	114.5	S24 L29	S24-S27 PolarHBondContact O-OG 3.03Å; S27-L29 PolarHBondContact O-N 3.06Å
28	A	28.1	Very low	29.6	Very low	88 Å²	88	135.2 Å²	135.2	73%	0.727	76%	0.757	S	S	*	*	S	Bend	trans	-92.1	17.5	-173.6	0	0	0	0	0	115.5
29	L	26.3	Very low	30.5	Very low	170 Å²	170	128.9 Å²	128.9	89%	0.89	73%	0.728	S	S	*	*	S	Bend	trans	-133.9	4.4	-172.7	-96.1	164.3	0	0	0	117.7	S27	S27-L29 PolarHBondContact O-N 3.06Å
30	S	25.5	Very low	31.4	Very low	108 Å²	108	128.2 Å²	128.2	76%	0.755	72%	0.717	S	S	*	*			trans	-165.1	68	178.7	52.1	0	0	0	0	115
31	K	30.8	Very low	32.7	Very low	189 Å²	189	125.2 Å²	125.2	82%	0.822	69%	0.691	S	S	*	*			trans	-143	79.3	146.4	-78.8	-162	179.6	177	0	109.7	V33	K31-V33 HydrophobicContact CB-CG2 4.28Å; K31-V33 HydrophobicContact CD-CG2 4.46Å; K31-V33 PolarHBondContact O-N 3.49Å
32	L	27.2	Very low	34	Very low	180 Å²	180	118.1 Å²	118.1	94%	0.942	65%	0.653	S	S	*	*			trans	-54.6	79.9	140.9	-87.3	144.2	0	0	0	107.6
33	V	30.2	Very low	35.6	Very low	99 Å²	99	111.7 Å²	111.7	60%	0.6	61%	0.614	S	S	*	*			trans	-98.9	110.3	152.1	176	0	0	0	0	102.9	K31 Q35	K31-V33 HydrophobicContact CB-CG2 4.28Å; K31-V33 HydrophobicContact CD-CG2 4.46Å; K31-V33 PolarHBondContact O-N 3.49Å; V33-Q35 PolarHBondContact O-N 3.13Å
34	L	28.3	Very low	37.5	Very low	169 Å²	169	106.5 Å²	106.5	89%	0.885	58%	0.58	S	S	*	*			trans	-50.9	91.4	153.8	-76.3	153.3	0	0	0	105.6	E36	L34-E36 PolarHBondContact O-N 3.17Å; L34-E36 VanDerWaalsContact O-N 3.17Å
35	Q	30.8	Very low	39.9	Very low	160 Å²	160	103.6 Å²	103.6	75%	0.748	56%	0.557	S	S	*	*			trans	-63.3	114.7	158.9	-85.6	-177.8	-42.8	0	0	103.5	V33	V33-Q35 PolarHBondContact O-N 3.13Å
36	E	33.3	Very low	42.7	Very low	175 Å²	175	102.1 Å²	102.1	82%	0.818	54%	0.539	S	S	*	.			trans	-41.4	131.9	157.7	-75.2	-176.9	166.7	0	0	106.9	L34 M38	L34-E36 PolarHBondContact O-N 3.17Å; L34-E36 VanDerWaalsContact O-N 3.17Å; E36-M38 PolarHBondContact O-N 3.18Å
37	P	36.2	Very low	45.2	Very low	89 Å²	89	95.1 Å²	95.1	58%	0.578	51%	0.506	S	S	*	.			trans	-68.1	134.1	-163.5	42.5	-42.9	0	0	0	104	D39	P37-D39 VanDerWaalsContact C-CB 3.48Å; P37-D39 WeakPolarHBondContact CA-OD2 3.24Å; P37-D39 HydrophobicContact CB-CB 4.01Å; P37-D39 WeakPolarHBondContact CB-OD1 3.4Å; P37-D39 WeakPolarHBondContact CB-OD2 3.24Å; P37-D39 HydrophobicContact CG-CB 3.89Å; P37-D39 VanDerWaalsContact CG-CG 3.41Å; P37-D39 WeakPolarHBondContact CG-OD1 3.33Å; P37-D39 VanDerWaalsContact O-CB 3.31Å; P37-D39 WeakPolarHBondContact O-CB 3.17Å; P37-D39 PolarHBondContact O-N 3.35Å
38	M	45.9	Very low	48	Very low	82 Å²	82	90.5 Å²	90.5	40%	0.404	47%	0.474	S	S	.	.			trans	-66.6	49	-175.7	-101.9	-155.1	72.1	0	0	111.5	E36 N42 K395	E36-M38 PolarHBondContact O-N 3.18Å; M38-N42 PolarHBondContact O-ND2 3.31Å; M38-K395 HydrophobicContact CE-CB 3.92Å
39	D	43.6	Very low	51.1	Low	29 Å²	29	87.4 Å²	87.4	16%	0.155	44%	0.444	C	S	.	.			trans	-98.3	-45.5	-130.2	-95.4	-141.2	0	0	0	114.4	P37 H293	P37-D39 VanDerWaalsContact C-CB 3.48Å; P37-D39 WeakPolarHBondContact CA-OD2 3.24Å; P37-D39 HydrophobicContact CB-CB 4.01Å; P37-D39 WeakPolarHBondContact CB-OD1 3.4Å; P37-D39 WeakPolarHBondContact CB-OD2 3.24Å; P37-D39 HydrophobicContact CG-CB 3.89Å; P37-D39 VanDerWaalsContact CG-CG 3.41Å; P37-D39 WeakPolarHBondContact CG-OD1 3.33Å; P37-D39 VanDerWaalsContact O-CB 3.31Å; P37-D39 WeakPolarHBondContact O-CB 3.17Å; P37-D39 PolarHBondContact O-N 3.35Å; D39-H293 HydrophobicContact CB-CB 3.61Å; D39-H293 WeakPolarHBondContact O-CB 3.38Å; D39-H293 WeakPolarHBondContact OD1-CB 3.33Å; D39-H293 IonicContact OD1-CD2 2.68Å; D39-H293 PolarHBondContact OD1-CD2 2.88Å; D39-H293 IonicContact OD1-CG 3.86Å
40	D	46.1	Very low	54.1	Low	91 Å²	91	79.4 Å²	79.4	49%	0.487	40%	0.403	S	S	.	.	S	Bend	trans	-86	-16.8	-174	-89	-33.5	0	0	0	116	H293	D40-H293 IonicContact OD1-CE1 3.18Å; D40-H293 PolarHBondContact OD1-CE1 3.11Å; D40-H293 IonicContact OD1-CG 3.28Å; D40-H293 IonicContact OD1-ND1 3.13Å; D40-H293 PolarHBondContact OD1-ND1 2.93Å; D40-H293 IonicContact OD2-CE1 2.97Å; D40-H293 IonicContact OD2-ND1 2.76Å
41	E	53	Low	57.1	Low	43 Å²	43	77.3 Å²	77.3	20%	0.201	38%	0.381	C	S	.	.			trans	-108.2	4.4	-160.3	-71.7	172.8	-147.9	0	0	115.6	N43 G44 Q391 K395	E41-N43 PolarHBondContact O-N 3Å; E41-G44 PolarHBondContact O-N 3.42Å; E41-Q391 WeakPolarHBondContact OE2-CB 3.37Å; E41-Q391 PolarHBondContact OE2-OE1 3.39Å; E41-K395 IonicContact OE1-NZ 3.69Å; E41-K395 PolarHBondContact OE1-NZ 2.86Å; E41-K395 WeakPolarHBondContact OE2-CD 3.43Å; E41-K395 WeakPolarHBondContact OE2-CE 3.33Å; E41-K395 IonicContact OE2-NZ 2.74Å; E41-K395 PolarHBondContact OE2-NZ 3.17Å
42	N	55.3	Low	60	Low	9 Å²	9	72.7 Å²	72.7	5%	0.048	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-14.6	-170.2	-81	-46.8	0	0	0	115.2	M38 A431 R443	M38-N42 PolarHBondContact O-ND2 3.31Å; N42-A431 WeakPolarHBondContact O-CA 3.43Å; N42-R443 PolarHBondContact ND2-NH2 2.96Å
43	N	62.3	Low	63.1	Low	7 Å²	7	64.1 Å²	64.1	4%	0.037	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126	8.5	-176.5	-69.5	-28.9	0	0	0	114.1	E41 K45 N295 A431 N455	E41-N43 PolarHBondContact O-N 3Å; N43-K45 VanDerWaalsContact C-N 3.3Å; N43-K45 HydrophobicContact CB-CG 4.15Å; N43-K45 PolarHBondContact O-N 3.36Å; N43-N295 PolarHBondContact ND2-O 2.68Å; N43-A431 VanDerWaalsContact OD1-CB 3.28Å; N43-A431 WeakPolarHBondContact OD1-CB 3.25Å; N43-N455 PolarHBondContact O-ND2 2.86Å
44	G	69.1	Low	66	Low	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.301	C	S	.	.			trans	59.7	35.2	-179.7	0	0	0	0	0	114.5	E41 E47 T48 P428	E41-G44 PolarHBondContact O-N 3.42Å; G44-E47 WeakPolarHBondContact CA-OE2 3.35Å; G44-T48 PolarHBondContact O-OG1 3.47Å; G44-P428 VanDerWaalsContact O-CG 3.27Å; G44-P428 WeakPolarHBondContact O-CG 3.42Å
45	K	81.5	Confident	69	Low	27 Å²	27	57.9 Å²	57.9	12%	0.117	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-38.2	-176.7	-66.6	178.5	-174.9	174.8	0	111.6	N43 E47 T48 E49 V50 E51 N295 G296	N43-K45 VanDerWaalsContact C-N 3.3Å; N43-K45 HydrophobicContact CB-CG 4.15Å; N43-K45 PolarHBondContact O-N 3.36Å; K45-E47 PolarHBondContact O-N 3.43Å; K45-T48 PolarHBondContact O-N 2.96Å; K45-T48 PolarHBondContact O-OG1 2.95Å; K45-T48 VanDerWaalsContact O-OG1 3.13Å; K45-E49 PolarHBondContact O-N 3.42Å; K45-V50 HydrophobicContact CB-CB 4Å; K45-V50 HydrophobicContact CB-CG1 4.05Å; K45-V50 HydrophobicContact CD-CG1 4.32Å; K45-V50 HydrophobicContact CG-CG1 4.17Å; K45-V50 WeakPolarHBondContact O-CB 3.46Å; K45-V50 PolarHBondContact O-N 3.07Å; K45-E51 HydrophobicContact CB-CG 3.88Å; K45-N295 VanDerWaalsContact CE-O 3.29Å; K45-N295 WeakPolarHBondContact CE-O 3.27Å; K45-N295 PolarHBondContact NZ-O 3.36Å; K45-G296 VanDerWaalsContact CE-O 3.24Å; K45-G296 WeakPolarHBondContact CE-O 3.45Å; K45-G296 PolarHBondContact NZ-O 2.81Å; K45-G296 VanDerWaalsContact NZ-O 3.07Å
46	R	84.4	Confident	72	Confident	147 Å²	147	55.3 Å²	55.3	56%	0.555	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-57.3	-44.9	178.3	-165.7	174.7	-179.5	173.7	4.2	113.4	T48 E49 E51	R46-T48 PolarHBondContact O-N 2.88Å; R46-E49 PolarHBondContact O-N 3.12Å; R46-E49 VanDerWaalsContact O-N 3.16Å; R46-E51 WeakPolarHBondContact CB-OE2 3.39Å; R46-E51 PolarHBondContact N-OE1 3.48Å
47	E	83.4	Confident	74.9	Confident	39 Å²	39	49 Å²	49	18%	0.182	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-71.6	-18	-174.5	-67	77.8	-179.7	0	0	113.4	G44 K45 Y387 A389 L502 Q504	G44-E47 WeakPolarHBondContact CA-OE2 3.35Å; K45-E47 PolarHBondContact O-N 3.43Å; E47-Y387 HydrophobicContact CB-CE1 4.25Å; E47-Y387 HydrophobicContact CG-CE1 4.25Å; E47-A389 HydrophobicContact CG-CB 3.83Å; E47-A389 WeakPolarHBondContact OE1-CB 2.99Å; E47-L502 HydrophobicContact CB-CD2 3.82Å; E47-L502 VanDerWaalsContact O-CD2 3.23Å; E47-L502 WeakPolarHBondContact O-CD2 3.25Å; E47-Q504 PolarHBondContact O-NE2 3.17Å
48	T	87.5	Confident	77.6	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-103	9.3	176.2	51.7	0	0	0	0	113	G44 K45 R46 V50 P428 L502 M503 I505	G44-T48 PolarHBondContact O-OG1 3.47Å; K45-T48 PolarHBondContact O-N 2.96Å; K45-T48 PolarHBondContact O-OG1 2.95Å; K45-T48 VanDerWaalsContact O-OG1 3.13Å; R46-T48 PolarHBondContact O-N 2.88Å; T48-V50 PolarHBondContact O-N 3.16Å; T48-V50 WeakPolarHBondContact OG1-CG2 3.06Å; T48-P428 HydrophobicContact CG2-CG 4.08Å; T48-L502 HydrophobicContact CG2-CD1 4.12Å; T48-L502 HydrophobicContact CG2-CG 4.37Å; T48-M503 WeakPolarHBondContact CA-O 3.26Å; T48-M503 HydrophobicContact CG2-CG 3.69Å; T48-M503 HydrophobicContact CG2-SD 4.49Å; T48-I505 PolarHBondContact O-N 2.97Å
49	E	91.6	Very high	79.9	Confident	22 Å²	22	48 Å²	48	10%	0.103	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	13.2	-178	-46.1	-171.9	136.4	0	0	115.1	K45 R46 E51 E52 F53 Q504 Q506 Q507	K45-E49 PolarHBondContact O-N 3.42Å; R46-E49 PolarHBondContact O-N 3.12Å; R46-E49 VanDerWaalsContact O-N 3.16Å; E49-E51 VanDerWaalsContact C-N 3.32Å; E49-E51 PolarHBondContact O-N 2.78Å; E49-E52 PolarHBondContact O-N 3.43Å; E49-F53 VanDerWaalsContact O-CB 3.29Å; E49-F53 WeakPolarHBondContact O-CB 3.4Å; E49-F53 PolarHBondContact O-N 2.98Å; E49-Q504 HydrophobicContact CG-CB 4.24Å; E49-Q504 PolarHBondContact OE1-OE1 3Å; E49-Q504 WeakPolarHBondContact OE2-CB 3.35Å; E49-Q506 HydrophobicContact CB-CB 4.22Å; E49-Q506 VanDerWaalsContact OE2-CB 3.29Å; E49-Q506 WeakPolarHBondContact OE2-CB 3.35Å; E49-Q506 PolarHBondContact OE2-N 3.24Å; E49-Q507 VanDerWaalsContact CD-OE1 3.25Å; E49-Q507 VanDerWaalsContact OE1-CD 3.23Å; E49-Q507 PolarHBondContact OE1-NE2 2.89Å; E49-Q507 PolarHBondContact OE1-OE1 3.03Å; E49-Q507 VanDerWaalsContact OE1-OE1 3.06Å; E49-Q507 PolarHBondContact OE2-N 3.06Å; E49-Q507 PolarHBondContact OE2-NE2 3.08Å; E49-Q507 VanDerWaalsContact OE2-NE2 3.09Å; E49-Q507 PolarHBondContact OE2-OE1 2.95Å
50	V	90.6	Very high	82.4	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.018	24%	0.244	C	C	.	.	H	α-helix	trans	-62.1	-42.1	-179.1	164.2	0	0	0	0	111.2	K45 T48 F53 C54 V297 A459 L462 I505	K45-V50 HydrophobicContact CB-CB 4Å; K45-V50 HydrophobicContact CB-CG1 4.05Å; K45-V50 HydrophobicContact CD-CG1 4.32Å; K45-V50 HydrophobicContact CG-CG1 4.17Å; K45-V50 WeakPolarHBondContact O-CB 3.46Å; K45-V50 PolarHBondContact O-N 3.07Å; T48-V50 PolarHBondContact O-N 3.16Å; T48-V50 WeakPolarHBondContact OG1-CG2 3.06Å; V50-F53 PolarHBondContact O-N 3.4Å; V50-C54 WeakPolarHBondContact O-CB 3.34Å; V50-C54 PolarHBondContact O-N 2.96Å; V50-C54 PolarHBondContact O-SG 2.88Å; V50-C54 VanDerWaalsContact O-SG 3.36Å; V50-V297 HydrophobicContact CG1-CG1 4.07Å; V50-V297 HydrophobicContact CG2-CG1 3.86Å; V50-A459 HydrophobicContact CG2-CB 4.2Å; V50-L462 HydrophobicContact CB-CD1 4.24Å; V50-L462 HydrophobicContact CG1-CD1 3.57Å; V50-L462 HydrophobicContact CG2-CD1 3.96Å; V50-I505 HydrophobicContact CG2-CG1 4.22Å
51	E	88.8	Confident	84.8	Confident	64 Å²	64	44 Å²	44	30%	0.299	22%	0.224	S	C	.	.	H	α-helix	trans	-61.8	-44.9	177.9	-77.6	165.6	-149.9	0	0	111.9	K45 R46 E49 S55	K45-E51 HydrophobicContact CB-CG 3.88Å; R46-E51 WeakPolarHBondContact CB-OE2 3.39Å; R46-E51 PolarHBondContact N-OE1 3.48Å; E49-E51 VanDerWaalsContact C-N 3.32Å; E49-E51 PolarHBondContact O-N 2.78Å; E51-S55 VanDerWaalsContact O-CB 3.28Å; E51-S55 WeakPolarHBondContact O-CB 3.42Å; E51-S55 PolarHBondContact O-N 3.49Å
52	E	90.6	Very high	86.8	Confident	91 Å²	91	42 Å²	42	43%	0.425	22%	0.215	S	C	.	.	H	α-helix	trans	-65.8	-45.4	177.9	-174.8	-179.8	158.8	0	0	111.3	E49 S55 K56	E49-E52 PolarHBondContact O-N 3.43Å; E52-S55 PolarHBondContact O-N 3.18Å; E52-K56 HydrophobicContact CG-CD 4.25Å; E52-K56 PolarHBondContact O-N 2.8Å; E52-K56 WeakPolarHBondContact OE1-CE 3.33Å; E52-K56 IonicContact OE1-NZ 3.41Å; E52-K56 PolarHBondContact OE1-NZ 2.84Å
53	F	93	Very high	88.8	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.1	-50	178.5	-178.3	-96.7	0	0	0	111.6	E49 V50 S55 K56 H57 Y60 L462 I505 Q506 F509	E49-F53 VanDerWaalsContact O-CB 3.29Å; E49-F53 WeakPolarHBondContact O-CB 3.4Å; E49-F53 PolarHBondContact O-N 2.98Å; V50-F53 PolarHBondContact O-N 3.4Å; F53-S55 VanDerWaalsContact C-N 3.31Å; F53-S55 PolarHBondContact O-N 3.19Å; F53-K56 PolarHBondContact O-N 3.27Å; F53-H57 PolarHBondContact O-N 3.12Å; F53-Y60 HydrophobicContact CE1-CD2 4.41Å; F53-Y60 AromaticContact CZ-CD2 3.89Å; F53-Y60 HydrophobicContact CZ-CD2 3.89Å; F53-Y60 HydrophobicContact CZ-CG 4.45Å; F53-L462 HydrophobicContact CD1-CB 4.09Å; F53-L462 HydrophobicContact CD1-CD1 4.49Å; F53-L462 HydrophobicContact CE1-CB 3.82Å; F53-I505 HydrophobicContact CB-CG2 4.11Å; F53-I505 HydrophobicContact CD1-CG2 4Å; F53-I505 HydrophobicContact CD2-CG2 3.86Å; F53-I505 HydrophobicContact CE1-CG2 4.39Å; F53-I505 HydrophobicContact CE2-CG2 4.28Å; F53-I505 HydrophobicContact CG-CG2 3.71Å; F53-Q506 VanDerWaalsContact CD2-OE1 3.28Å; F53-F509 HydrophobicContact CD2-CB 4.47Å; F53-F509 HydrophobicContact CE2-CB 3.74Å; F53-F509 AromaticContact CE2-CD1 3.8Å; F53-F509 HydrophobicContact CE2-CD1 3.8Å; F53-F509 HydrophobicContact CE2-CD2 4.23Å; F53-F509 HydrophobicContact CE2-CE1 4.43Å; F53-F509 AromaticContact CE2-CG 3.66Å; F53-F509 HydrophobicContact CE2-CG 3.66Å; F53-F509 HydrophobicContact CZ-CD2 4.41Å; F53-F509 HydrophobicContact CZ-CG 4.28Å
54	C	91.1	Very high	90.4	Very high	39 Å²	39	47 Å²	47	26%	0.264	25%	0.248	S	C	.	.	H	α-helix	trans	-66.8	-31.7	178	-70.5	0	0	0	0	112.5	V50 H57 P58	V50-C54 WeakPolarHBondContact O-CB 3.34Å; V50-C54 PolarHBondContact O-N 2.96Å; V50-C54 PolarHBondContact O-SG 2.88Å; V50-C54 VanDerWaalsContact O-SG 3.36Å; C54-H57 CarbonylContact O-C 3.5Å; C54-H57 VanDerWaalsContact O-C 3.28Å; C54-P58 VanDerWaalsContact O-CA 3.28Å; C54-P58 WeakPolarHBondContact O-CA 3.26Å
55	S	91.7	Very high	91.8	Very high	99 Å²	99	47.1 Å²	47.1	69%	0.692	25%	0.249	S	C	*	.	H	α-helix	trans	-68.1	-40.7	175	-178.3	0	0	0	0	112	E51 E52 F53	E51-S55 VanDerWaalsContact O-CB 3.28Å; E51-S55 WeakPolarHBondContact O-CB 3.42Å; E51-S55 PolarHBondContact O-N 3.49Å; E52-S55 PolarHBondContact O-N 3.18Å; F53-S55 VanDerWaalsContact C-N 3.31Å; F53-S55 PolarHBondContact O-N 3.19Å
56	K	93.9	Very high	92.6	Very high	105 Å²	105	47 Å²	47	46%	0.457	25%	0.249	S	C	.	.	H	α-helix	trans	-71.9	-35.3	175.1	-75.6	174.3	171.7	171	0	112.6	E52 F53	E52-K56 HydrophobicContact CG-CD 4.25Å; E52-K56 PolarHBondContact O-N 2.8Å; E52-K56 WeakPolarHBondContact OE1-CE 3.33Å; E52-K56 IonicContact OE1-NZ 3.41Å; E52-K56 PolarHBondContact OE1-NZ 2.84Å; F53-K56 PolarHBondContact O-N 3.27Å
57	H	94.1	Very high	93.2	Very high	42 Å²	42	40 Å²	40	19%	0.194	22%	0.223	C	C	.	.			trans	-129.4	75.1	-175.9	-54.5	-76	0	0	0	111.8	F53 C54 T59 Y60	F53-H57 PolarHBondContact O-N 3.12Å; C54-H57 CarbonylContact O-C 3.5Å; C54-H57 VanDerWaalsContact O-C 3.28Å; H57-T59 PolarHBondContact O-N 2.97Å; H57-Y60 HydrophobicContact CB-CD1 4.29Å; H57-Y60 HydrophobicContact CB-CD2 3.26Å; H57-Y60 HydrophobicContact CB-CE2 3.74Å; H57-Y60 HydrophobicContact CB-CG 3.55Å; H57-Y60 AromaticContact CG-CD2 3.48Å; H57-Y60 VanDerWaalsContact CG-CD2 3.48Å; H57-Y60 AromaticContact CG-CE2 3.56Å; H57-Y60 AromaticContact ND1-CD2 3.81Å; H57-Y60 AromaticContact ND1-CE2 3.35Å; H57-Y60 WeakPolarHBondContact ND1-CE2 3.23Å; H57-Y60 AromaticContact ND1-CZ 3.95Å; H57-Y60 PolarHBondContact O-N 3.37Å
58	P	93.3	Very high	93.9	Very high	91 Å²	91	38.1 Å²	38.1	59%	0.591	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-23	-175.2	-26.4	35.5	0	0	0	114.8	C54	C54-P58 VanDerWaalsContact O-CA 3.28Å; C54-P58 WeakPolarHBondContact O-CA 3.26Å
59	T	93.5	Very high	94.3	Very high	59 Å²	59	38.2 Å²	38.2	36%	0.362	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-6.3	177.8	51.1	0	0	0	0	113.8	H57 D61 R63	H57-T59 PolarHBondContact O-N 2.97Å; T59-D61 PolarHBondContact O-N 2.79Å; T59-R63 WeakPolarHBondContact O-CD 3.47Å; T59-R63 WeakPolarHBondContact O-CG 3.39Å; T59-R63 PolarHBondContact O-NE 2.87Å
60	Y	95.8	Very high	94.5	Very high	22 Å²	22	37.1 Å²	37.1	9%	0.086	21%	0.21	C	C	.	.			trans	-95.8	39.6	-178.7	-57	-3.5	0	0	0	110.2	F53 H57 G62 L462 G466 M469 E470 F509	F53-Y60 HydrophobicContact CE1-CD2 4.41Å; F53-Y60 AromaticContact CZ-CD2 3.89Å; F53-Y60 HydrophobicContact CZ-CD2 3.89Å; F53-Y60 HydrophobicContact CZ-CG 4.45Å; H57-Y60 HydrophobicContact CB-CD1 4.29Å; H57-Y60 HydrophobicContact CB-CD2 3.26Å; H57-Y60 HydrophobicContact CB-CE2 3.74Å; H57-Y60 HydrophobicContact CB-CG 3.55Å; H57-Y60 AromaticContact CG-CD2 3.48Å; H57-Y60 VanDerWaalsContact CG-CD2 3.48Å; H57-Y60 AromaticContact CG-CE2 3.56Å; H57-Y60 AromaticContact ND1-CD2 3.81Å; H57-Y60 AromaticContact ND1-CE2 3.35Å; H57-Y60 WeakPolarHBondContact ND1-CE2 3.23Å; H57-Y60 AromaticContact ND1-CZ 3.95Å; H57-Y60 PolarHBondContact O-N 3.37Å; Y60-G62 PolarHBondContact O-N 2.9Å; Y60-L462 VanDerWaalsContact O-CD2 3.23Å; Y60-L462 WeakPolarHBondContact O-CD2 3.08Å; Y60-G466 VanDerWaalsContact CG-CA 3.44Å; Y60-M469 HydrophobicContact CD1-CB 4.02Å; Y60-M469 HydrophobicContact CD1-CG 3.85Å; Y60-M469 HydrophobicContact CE1-CB 3.49Å; Y60-M469 VanDerWaalsContact CE1-CB 3.49Å; Y60-M469 HydrophobicContact CE1-CG 3.74Å; Y60-E470 PolarHBondContact OH-OE1 2.91Å; Y60-F509 HydrophobicContact CD2-CZ 4.21Å; Y60-F509 HydrophobicContact CE2-CE1 4.22Å; Y60-F509 AromaticContact CE2-CZ 3.82Å; Y60-F509 HydrophobicContact CE2-CZ 3.82Å
61	D	95.4	Very high	94.7	Very high	15 Å²	15	37 Å²	37	8%	0.08	21%	0.209	C	C	.	.	S	Bend	trans	-83.8	8.7	-172.9	62.8	-3.8	0	0	0	113.9	T59 R63 T85 A298 G300	T59-D61 PolarHBondContact O-N 2.79Å; D61-R63 WeakPolarHBondContact OD1-CB 3.32Å; D61-R63 IonicContact OD1-CZ 3.99Å; D61-R63 PolarHBondContact OD1-N 2.79Å; D61-R63 IonicContact OD1-NE 3.58Å; D61-R63 PolarHBondContact OD1-NE 2.89Å; D61-R63 IonicContact OD1-NH2 3.56Å; D61-R63 PolarHBondContact OD1-NH2 2.93Å; D61-R63 IonicContact OD2-CZ 3.72Å; D61-R63 IonicContact OD2-NE 3.43Å; D61-R63 IonicContact OD2-NH2 3.69Å; D61-R63 PolarHBondContact OD2-NH2 2.77Å; D61-T85 WeakPolarHBondContact OD2-CB 3.2Å; D61-T85 PolarHBondContact OD2-OG1 3.3Å; D61-A298 CarbonylContact O-C 3.47Å; D61-A298 VanDerWaalsContact O-C 3.28Å; D61-A298 WeakPolarHBondContact O-CA 3.37Å; D61-G300 WeakPolarHBondContact O-CA 2.93Å; D61-G300 PolarHBondContact O-N 2.84Å
62	G	96.7	Very high	95	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	103.4	-2.9	-177.2	0	0	0	0	0	114.1	Y60 V65 G300 A301 S465	Y60-G62 PolarHBondContact O-N 2.9Å; G62-V65 VanDerWaalsContact O-CB 3.24Å; G62-V65 WeakPolarHBondContact O-CB 3.21Å; G62-V65 PolarHBondContact O-N 3.37Å; G62-V65 VanDerWaalsContact O-N 3.1Å; G62-G300 VanDerWaalsContact C-C 3.48Å; G62-G300 CarbonylContact O-C 3.54Å; G62-A301 WeakPolarHBondContact O-CA 3.49Å; G62-A301 PolarHBondContact O-N 3Å; G62-S465 PolarHBondContact N-OG 3.13Å
63	R	96.8	Very high	95.3	Very high	72 Å²	72	30 Å²	30	27%	0.272	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	144	175.7	67.9	-172.4	65.8	-175.6	-0.1	112	T59 D61 V65 S465	T59-R63 WeakPolarHBondContact O-CD 3.47Å; T59-R63 WeakPolarHBondContact O-CG 3.39Å; T59-R63 PolarHBondContact O-NE 2.87Å; D61-R63 WeakPolarHBondContact OD1-CB 3.32Å; D61-R63 IonicContact OD1-CZ 3.99Å; D61-R63 PolarHBondContact OD1-N 2.79Å; D61-R63 IonicContact OD1-NE 3.58Å; D61-R63 PolarHBondContact OD1-NE 2.89Å; D61-R63 IonicContact OD1-NH2 3.56Å; D61-R63 PolarHBondContact OD1-NH2 2.93Å; D61-R63 IonicContact OD2-CZ 3.72Å; D61-R63 IonicContact OD2-NE 3.43Å; D61-R63 IonicContact OD2-NH2 3.69Å; D61-R63 PolarHBondContact OD2-NH2 2.77Å; R63-V65 PolarHBondContact O-N 2.85Å; R63-S465 PolarHBondContact N-OG 2.81Å; R63-S465 PolarHBondContact O-OG 2.92Å
64	G	95.5	Very high	95.5	Very high	50 Å²	50	30.2 Å²	30.2	52%	0.515	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	7.5	-175	0	0	0	0	0	114.7	K468	G64-K468 PolarHBondContact O-NZ 3.07Å
65	V	97.8	Very high	95.8	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.012	17%	0.166	C	C	.	.			trans	-110.8	140.3	176.2	-171	0	0	0	0	110.3	G62 R63 A301 Q302 H335 I336 A461 I464	G62-V65 VanDerWaalsContact O-CB 3.24Å; G62-V65 WeakPolarHBondContact O-CB 3.21Å; G62-V65 PolarHBondContact O-N 3.37Å; G62-V65 VanDerWaalsContact O-N 3.1Å; R63-V65 PolarHBondContact O-N 2.85Å; V65-A301 HydrophobicContact CB-CB 4.48Å; V65-Q302 PolarHBondContact O-N 2.8Å; V65-H335 HydrophobicContact CG1-CB 3.82Å; V65-I336 HydrophobicContact CG1-CD1 4.01Å; V65-I336 HydrophobicContact CG1-CG1 4.5Å; V65-A461 HydrophobicContact CB-CB 4.32Å; V65-A461 HydrophobicContact CG1-CB 3.87Å; V65-A461 WeakPolarHBondContact CG2-O 3.47Å; V65-I464 HydrophobicContact CG1-CG2 4.37Å; V65-I464 HydrophobicContact CG2-CB 4.08Å; V65-I464 HydrophobicContact CG2-CG2 3.74Å
66	L	98.2	Very high	96	Very high	25 Å²	25	23.9 Å²	23.9	13%	0.131	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	117.6	-177.2	-175.2	60.3	0	0	0	108.9	V92 Q302 I304 V334 H335 I336	L66-V92 HydrophobicContact CD1-CG2 3.81Å; L66-Q302 HydrophobicContact CD1-CB 3.75Å; L66-I304 HydrophobicContact CD1-CD1 4.24Å; L66-I304 HydrophobicContact CD1-CG1 3.97Å; L66-I304 HydrophobicContact CD2-CD1 3.78Å; L66-I304 HydrophobicContact CD2-CG1 4.43Å; L66-I304 HydrophobicContact CG-CD1 4.19Å; L66-I304 HydrophobicContact CG-CG1 4.39Å; L66-V334 HydrophobicContact CD2-CG1 3.95Å; L66-V334 HydrophobicContact CG-CB 4.49Å; L66-V334 HydrophobicContact CG-CG1 4.19Å; L66-H335 PolarHBondContact N-ND1 3.13Å; L66-H335 PolarHBondContact O-N 3.42Å; L66-I336 PolarHBondContact O-N 3.34Å
67	I	98.1	Very high	96	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.9	-178.3	-56.3	168.3	0	0	0	108.7	V69 A284 A285 A301 Q302 I303 I304 I336 N338 A461	I67-V69 HydrophobicContact CG2-CG2 4.28Å; I67-A284 HydrophobicContact CD1-CB 4.4Å; I67-A285 HydrophobicContact CD1-CB 4.19Å; I67-A301 HydrophobicContact CD1-CB 3.76Å; I67-A301 HydrophobicContact CG1-CB 4.31Å; I67-Q302 PolarHBondContact N-O 3.02Å; I67-I303 CarbonylContact O-C 3.54Å; I67-I303 VanDerWaalsContact O-CA 3.28Å; I67-I303 WeakPolarHBondContact O-CA 3.28Å; I67-I304 PolarHBondContact O-N 3.07Å; I67-I336 CarbonylContact C-O 3.58Å; I67-I336 WeakPolarHBondContact CA-O 3.3Å; I67-I336 HydrophobicContact CG1-CB 4.3Å; I67-I336 HydrophobicContact CG1-CD1 4.34Å; I67-I336 HydrophobicContact CG2-CG2 4.41Å; I67-N338 HydrophobicContact CG2-CB 4.44Å; I67-A461 HydrophobicContact CD1-CB 3.86Å; I67-A461 HydrophobicContact CG1-CB 4.32Å
68	A	97.8	Very high	96	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	124.3	166.8	0	0	0	0	0	109.9	L70 L306 C329 V334 I336 I337 N338	A68-L70 HydrophobicContact CB-CD1 3.98Å; A68-L306 HydrophobicContact CB-CD1 4.08Å; A68-C329 VanDerWaalsContact CB-SG 3.51Å; A68-V334 HydrophobicContact CB-CB 4.33Å; A68-V334 HydrophobicContact CB-CG1 4.22Å; A68-V334 HydrophobicContact CB-CG2 4.11Å; A68-I336 PolarHBondContact N-O 3.35Å; A68-I337 HydrophobicContact CB-CG1 4.15Å; A68-N338 PolarHBondContact O-N 2.9Å
69	V	97.1	Very high	96	Very high	1 Å²	1	17 Å²	17	1%	0.006	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	103.7	175.6	178.9	0	0	0	0	108.3	I67 D71 V74 V280 A281 I303 I304 L306	I67-V69 HydrophobicContact CG2-CG2 4.28Å; V69-D71 HydrophobicContact CG1-CB 3.97Å; V69-V74 HydrophobicContact CG1-CG2 4.33Å; V69-V280 HydrophobicContact CG1-CG1 3.93Å; V69-A281 HydrophobicContact CG2-CB 4.23Å; V69-I303 HydrophobicContact CB-CG2 4.45Å; V69-I303 HydrophobicContact CG2-CG2 3.84Å; V69-I304 PolarHBondContact N-O 3.46Å; V69-L306 PolarHBondContact O-N 3.34Å
70	L	95.4	Very high	96	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	100.8	175.3	-84.2	63.6	0	0	0	108.9	A68 L306 I308 A325 I326 I337 N338 Y339	A68-L70 HydrophobicContact CB-CD1 3.98Å; L70-L306 WeakPolarHBondContact CA-O 3.34Å; L70-L306 HydrophobicContact CD1-CB 3.99Å; L70-L306 HydrophobicContact CD1-CD1 3.7Å; L70-L306 HydrophobicContact CD1-CG 4.28Å; L70-L306 HydrophobicContact CG-CB 4.21Å; L70-I308 HydrophobicContact CB-CD1 4.04Å; L70-I308 HydrophobicContact CB-CG1 4.46Å; L70-I308 HydrophobicContact CB-CG2 4.43Å; L70-I308 HydrophobicContact CG-CG2 4.28Å; L70-A325 HydrophobicContact CD2-CB 3.91Å; L70-A325 HydrophobicContact CG-CB 4.03Å; L70-I326 HydrophobicContact CD2-CD1 4.08Å; L70-I337 HydrophobicContact CD1-CG2 3.96Å; L70-I337 HydrophobicContact CD2-CG2 4.15Å; L70-N338 PolarHBondContact N-O 3.23Å; L70-Y339 HydrophobicContact CB-CD2 3.91Å; L70-Y339 HydrophobicContact CD2-CD2 4.18Å
71	D	95	Very high	96	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.005	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	-152.5	-171.4	-148.5	-71.7	0	0	0	112.5	V69 G73 H276 G277 L306 Q307 I308 G309	V69-D71 HydrophobicContact CG1-CB 3.97Å; D71-G73 PolarHBondContact O-N 3.48Å; D71-H276 IonicContact OD1-CE1 3.59Å; D71-H276 IonicContact OD1-CG 2.74Å; D71-H276 IonicContact OD1-ND1 3.64Å; D71-H276 PolarHBondContact OD1-ND1 3.2Å; D71-H276 IonicContact OD2-CE1 3.54Å; D71-H276 PolarHBondContact OD2-CE1 3.47Å; D71-H276 VanDerWaalsContact OD2-CE1 3.28Å; D71-H276 IonicContact OD2-ND1 3.72Å; D71-H276 PolarHBondContact OD2-ND1 3.32Å; D71-G277 VanDerWaalsContact CG-CA 3.42Å; D71-G277 VanDerWaalsContact OD1-CA 3.25Å; D71-G277 WeakPolarHBondContact OD1-CA 3.19Å; D71-G277 PolarHBondContact OD1-N 2.72Å; D71-L306 PolarHBondContact N-O 3.1Å; D71-L306 VanDerWaalsContact N-O 3.08Å; D71-Q307 CarbonylContact O-C 3.47Å; D71-Q307 VanDerWaalsContact O-CA 3.28Å; D71-Q307 WeakPolarHBondContact O-CA 3.25Å; D71-I308 PolarHBondContact O-N 2.82Å; D71-G309 PolarHBondContact O-N 3.33Å
72	T	95.3	Very high	96	Very high	4 Å²	4	15.9 Å²	15.9	3%	0.025	10%	0.096	C	C	.	.	S	Bend	trans	-83.2	18.8	176.2	66	0	0	0	0	114.1	T272 A273 G274 H276 G277 Q307 N315 Y341	T72-T272 CarbonylContact O-C 3.55Å; T72-T272 WeakPolarHBondContact O-CA 3.36Å; T72-A273 PolarHBondContact O-N 3.42Å; T72-G274 PolarHBondContact OG1-O 3.29Å; T72-H276 HydrophobicContact CG2-CB 4.35Å; T72-H276 PolarHBondContact OG1-N 2.92Å; T72-G277 PolarHBondContact OG1-N 2.87Å; T72-Q307 PolarHBondContact O-OE1 2.87Å; T72-Q307 VanDerWaalsContact O-OE1 3.1Å; T72-N315 HydrophobicContact CG2-CB 4.3Å; T72-Y341 HydrophobicContact CG2-CE2 4.11Å; T72-Y341 WeakPolarHBondContact CG2-OH 3.44Å
73	G	96	Very high	96	Very high	4 Å²	4	18.4 Å²	18.4	4%	0.041	11%	0.111	C	C	.	.			trans	85.6	155.5	-174.4	0	0	0	0	0	114.7	D71 G277 T278	D71-G73 PolarHBondContact O-N 3.48Å; G73-G277 CarbonylContact O-C 2.83Å; G73-G277 WeakPolarHBondContact O-CA 3.35Å; G73-T278 PolarHBondContact O-N 2.96Å
74	V	97.1	Very high	96	Very high	3 Å²	3	15.1 Å²	15.1	2%	0.018	10%	0.099	C	C	.	.			trans	-114.3	132.9	-179.9	179.7	0	0	0	0	109.2	V69 P76 M81 V91 T278 A281 S305	V69-V74 HydrophobicContact CG1-CG2 4.33Å; V74-P76 VanDerWaalsContact O-CD 3.27Å; V74-P76 WeakPolarHBondContact O-CD 3.33Å; V74-M81 HydrophobicContact CG1-CG 4.08Å; V74-M81 HydrophobicContact CG1-SD 3.97Å; V74-V91 HydrophobicContact CG1-CG2 4.38Å; V74-T278 WeakPolarHBondContact CA-OG1 3.42Å; V74-A281 HydrophobicContact CB-CB 4.45Å; V74-A281 HydrophobicContact CG1-CB 3.93Å; V74-A281 HydrophobicContact CG2-CB 3.59Å; V74-S305 WeakPolarHBondContact CB-OG 3.49Å; V74-S305 WeakPolarHBondContact CG2-OG 3.36Å; V74-S305 PolarHBondContact N-OG 2.81Å
75	D	96.6	Very high	96	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.093	C	C	.	.			trans	-85.4	106.2	174.6	-177.9	-1.8	0	0	0	109.8	S77 T78 T255 T272 T278 P436 R437	D75-S77 VanDerWaalsContact CG-OG 3.26Å; D75-S77 PolarHBondContact O-N 2.96Å; D75-S77 VanDerWaalsContact OD1-CB 3.27Å; D75-S77 WeakPolarHBondContact OD1-CB 3.49Å; D75-S77 PolarHBondContact OD1-N 3.1Å; D75-S77 PolarHBondContact OD1-OG 3.11Å; D75-S77 PolarHBondContact OD2-OG 3.4Å; D75-T78 HydrophobicContact CB-CG2 4.22Å; D75-T78 PolarHBondContact O-N 3.33Å; D75-T78 PolarHBondContact O-OG1 2.95Å; D75-T255 VanDerWaalsContact OD1-CB 3.3Å; D75-T255 WeakPolarHBondContact OD1-CB 3.44Å; D75-T255 PolarHBondContact OD1-OG1 3.44Å; D75-T255 PolarHBondContact OD2-OG1 3.12Å; D75-T272 HydrophobicContact CB-CG2 4.06Å; D75-T278 HydrophobicContact CB-CG2 4.31Å; D75-T278 PolarHBondContact N-OG1 3.39Å; D75-P436 HydrophobicContact CB-CB 3.9Å; D75-P436 HydrophobicContact CB-CG 4.27Å; D75-P436 WeakPolarHBondContact OD2-CA 3.47Å; D75-R437 PolarHBondContact OD2-N 3.07Å
76	P	96.1	Very high	95.8	Very high	5 Å²	5	18.9 Å²	18.9	3%	0.032	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-11.1	-177.8	33	-38.2	0	0	0	112.2	V74 T78 Q82 I94 Y239 Y245 T255	V74-P76 VanDerWaalsContact O-CD 3.27Å; V74-P76 WeakPolarHBondContact O-CD 3.33Å; P76-T78 PolarHBondContact O-N 3.35Å; P76-Q82 PolarHBondContact O-NE2 3.2Å; P76-I94 HydrophobicContact CB-CD1 3.83Å; P76-I94 HydrophobicContact CG-CD1 3.46Å; P76-I94 VanDerWaalsContact CG-CD1 3.46Å; P76-Y239 HydrophobicContact CB-CE2 4.33Å; P76-Y239 WeakPolarHBondContact CB-OH 3.46Å; P76-Y239 HydrophobicContact CG-CE2 4.21Å; P76-Y245 HydrophobicContact CB-CD1 4.07Å; P76-Y245 HydrophobicContact CB-CE1 4.23Å; P76-Y245 HydrophobicContact CG-CD1 3.73Å; P76-Y245 HydrophobicContact CG-CE1 4.27Å; P76-Y245 HydrophobicContact CG-CG 3.85Å; P76-T255 HydrophobicContact CG-CG2 4.15Å
77	S	94.4	Very high	95.6	Very high	14 Å²	14	20.3 Å²	20.3	10%	0.098	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-7.3	-179.4	76.8	0	0	0	0	113.6	D75 Y245 T255 R437	D75-S77 VanDerWaalsContact CG-OG 3.26Å; D75-S77 PolarHBondContact O-N 2.96Å; D75-S77 VanDerWaalsContact OD1-CB 3.27Å; D75-S77 WeakPolarHBondContact OD1-CB 3.49Å; D75-S77 PolarHBondContact OD1-N 3.1Å; D75-S77 PolarHBondContact OD1-OG 3.11Å; D75-S77 PolarHBondContact OD2-OG 3.4Å; S77-Y245 VanDerWaalsContact CB-CE2 3.48Å; S77-T255 PolarHBondContact OG-OG1 2.97Å; S77-R437 WeakPolarHBondContact OG-CD 3.3Å; S77-R437 WeakPolarHBondContact OG-CG 3.35Å
78	T	93.7	Very high	95.5	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.018	15%	0.154	C	C	.	.	S	Bend	trans	-72.3	143.1	178.5	57.6	0	0	0	0	110.7	D75 P76 G80 M81 Q82 T278 T435	D75-T78 HydrophobicContact CB-CG2 4.22Å; D75-T78 PolarHBondContact O-N 3.33Å; D75-T78 PolarHBondContact O-OG1 2.95Å; P76-T78 PolarHBondContact O-N 3.35Å; T78-G80 PolarHBondContact O-N 2.86Å; T78-G80 VanDerWaalsContact O-N 3.17Å; T78-M81 PolarHBondContact O-N 3.1Å; T78-M81 WeakPolarHBondContact OG1-CB 3.34Å; T78-M81 WeakPolarHBondContact OG1-CG 3.45Å; T78-Q82 PolarHBondContact O-NE2 2.54Å; T78-T278 HydrophobicContact CG2-CG2 3.9Å; T78-T435 WeakPolarHBondContact CG2-O 3.35Å
79	P	92.7	Very high	95.4	Very high	76 Å²	76	28 Å²	28	49%	0.494	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-58.4	-33.6	-174.5	-26.8	34.4	0	0	0	114.1	M81 F288	P79-M81 PolarHBondContact O-N 2.88Å; P79-F288 HydrophobicContact CB-CD1 4.22Å; P79-F288 HydrophobicContact CB-CE1 4.08Å
80	G	93.8	Very high	95.4	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-72.8	-9.9	178.9	0	0	0	0	0	114.8	T78 G286 C287 F288	T78-G80 PolarHBondContact O-N 2.86Å; T78-G80 VanDerWaalsContact O-N 3.17Å; G80-G286 WeakPolarHBondContact O-CA 3.27Å; G80-C287 WeakPolarHBondContact CA-O 3.41Å; G80-C287 PolarHBondContact O-N 3.31Å; G80-F288 VanDerWaalsContact CA-CE1 3.41Å; G80-F288 VanDerWaalsContact CA-CZ 3.43Å
81	M	96.4	Very high	95.6	Very high	3 Å²	3	28 Å²	28	2%	0.015	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-109.8	14.8	-173	-68.9	-63.4	122.7	0	0	113.2	V74 T78 P79 K90 V91 A281 C282 I303	V74-M81 HydrophobicContact CG1-CG 4.08Å; V74-M81 HydrophobicContact CG1-SD 3.97Å; T78-M81 PolarHBondContact O-N 3.1Å; T78-M81 WeakPolarHBondContact OG1-CB 3.34Å; T78-M81 WeakPolarHBondContact OG1-CG 3.45Å; P79-M81 PolarHBondContact O-N 2.88Å; M81-K90 WeakPolarHBondContact O-CB 3.22Å; M81-K90 HydrophobicContact SD-CG 4.13Å; M81-V91 HydrophobicContact CB-CG2 3.96Å; M81-V91 HydrophobicContact CG-CG2 4.38Å; M81-V91 HydrophobicContact SD-CG2 3.9Å; M81-A281 HydrophobicContact CE-CB 4.26Å; M81-A281 HydrophobicContact SD-CB 4.17Å; M81-C282 HydrophobicContact CE-CB 4.14Å; M81-C282 WeakPolarHBondContact CE-SG 3.35Å; M81-I303 HydrophobicContact CE-CD1 3.9Å; M81-I303 HydrophobicContact SD-CD1 3.76Å
82	Q	95.4	Very high	95.7	Very high	71 Å²	71	29.4 Å²	29.4	33%	0.332	18%	0.179	S	C	.	.	S	Bend	trans	-85.3	-65.4	-178.6	-57.4	-55.6	-54	0	0	112.1	P76 T78 K90	P76-Q82 PolarHBondContact O-NE2 3.2Å; T78-Q82 PolarHBondContact O-NE2 2.54Å; Q82-K90 WeakPolarHBondContact O-CB 3.35Å; Q82-K90 PolarHBondContact O-N 2.84Å
83	T	96.9	Very high	95.8	Very high	52 Å²	52	29.3 Å²	29.3	32%	0.319	18%	0.178	S	C	.	.	B	Isolated β-bridge	trans	-131.7	156.3	-171.2	55	0	0	0	0	112.2	H88 K90 C287	T83-H88 CarbonylContact C-O 3.55Å; T83-H88 WeakPolarHBondContact CA-O 3.46Å; T83-K90 VanDerWaalsContact O-CE 3.24Å; T83-K90 WeakPolarHBondContact O-CE 3.27Å; T83-C287 WeakPolarHBondContact O-CB 3.29Å; T83-C287 PolarHBondContact O-SG 3.1Å
84	T	97.1	Very high	95.9	Very high	4 Å²	4	29.6 Å²	29.6	3%	0.025	18%	0.179	C	C	.	.			trans	-81.3	173	167.1	54.8	0	0	0	0	110.9	D86 G87 H88 K90 G300 Q302	T84-D86 VanDerWaalsContact CB-OD1 3.24Å; T84-D86 WeakPolarHBondContact CB-OD1 3.5Å; T84-D86 PolarHBondContact O-N 2.99Å; T84-D86 PolarHBondContact OG1-OD1 3.24Å; T84-G87 PolarHBondContact O-N 2.97Å; T84-G87 VanDerWaalsContact O-N 3.09Å; T84-G87 PolarHBondContact OG1-N 3.46Å; T84-H88 HydrophobicContact CG2-CB 4.46Å; T84-H88 PolarHBondContact N-O 3.5Å; T84-H88 WeakPolarHBondContact OG1-CA 3.49Å; T84-H88 WeakPolarHBondContact OG1-CB 3.4Å; T84-H88 PolarHBondContact OG1-N 3.5Å; T84-H88 PolarHBondContact OG1-O 3.32Å; T84-K90 HydrophobicContact CG2-CD 4.36Å; T84-G300 WeakPolarHBondContact CG2-O 3.3Å; T84-Q302 HydrophobicContact CG2-CG 3.77Å
85	T	95.6	Very high	95.9	Very high	62 Å²	62	29.5 Å²	29.5	38%	0.38	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-25.8	175.9	47.5	0	0	0	0	113.8	D61 P299 G300	D61-T85 WeakPolarHBondContact OD2-CB 3.2Å; D61-T85 PolarHBondContact OD2-OG1 3.3Å; T85-P299 HydrophobicContact CG2-CB 3.85Å; T85-P299 HydrophobicContact CG2-CG 3.99Å; T85-P299 PolarHBondContact N-O 3.16Å; T85-G300 VanDerWaalsContact OG1-CA 3.26Å; T85-G300 WeakPolarHBondContact OG1-CA 3.42Å
86	D	93.7	Very high	95.8	Very high	68 Å²	68	29.5 Å²	29.5	36%	0.364	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	10.5	176.1	60.1	-4.8	0	0	0	113.6	T84 H88	T84-D86 VanDerWaalsContact CB-OD1 3.24Å; T84-D86 WeakPolarHBondContact CB-OD1 3.5Å; T84-D86 PolarHBondContact O-N 2.99Å; T84-D86 PolarHBondContact OG1-OD1 3.24Å; D86-H88 VanDerWaalsContact CG-CD2 3.42Å; D86-H88 PolarHBondContact O-N 2.49Å; D86-H88 IonicContact OD1-CD2 3.35Å; D86-H88 PolarHBondContact OD1-CD2 3.29Å; D86-H88 IonicContact OD1-CG 3.99Å; D86-H88 IonicContact OD2-CD2 3.31Å; D86-H88 PolarHBondContact OD2-CD2 2.84Å; D86-H88 VanDerWaalsContact OD2-CD2 3.31Å; D86-H88 IonicContact OD2-NE2 3.82Å
87	G	93.8	Very high	95.8	Very high	56 Å²	56	29.5 Å²	29.5	58%	0.577	18%	0.178	S	C	*	.	S	Bend	trans	83.7	4.3	170.8	0	0	0	0	0	115.7	T84	T84-G87 PolarHBondContact O-N 2.97Å; T84-G87 VanDerWaalsContact O-N 3.09Å; T84-G87 PolarHBondContact OG1-N 3.46Å
88	H	95.8	Very high	95.8	Very high	107 Å²	107	29.1 Å²	29.1	50%	0.495	18%	0.175	S	C	.	.	S	Bend	trans	-71.5	158	170.3	-64.6	-57.5	0	0	0	111.8	T83 T84 D86 K90	T83-H88 CarbonylContact C-O 3.55Å; T83-H88 WeakPolarHBondContact CA-O 3.46Å; T84-H88 HydrophobicContact CG2-CB 4.46Å; T84-H88 PolarHBondContact N-O 3.5Å; T84-H88 WeakPolarHBondContact OG1-CA 3.49Å; T84-H88 WeakPolarHBondContact OG1-CB 3.4Å; T84-H88 PolarHBondContact OG1-N 3.5Å; T84-H88 PolarHBondContact OG1-O 3.32Å; D86-H88 VanDerWaalsContact CG-CD2 3.42Å; D86-H88 PolarHBondContact O-N 2.49Å; D86-H88 IonicContact OD1-CD2 3.35Å; D86-H88 PolarHBondContact OD1-CD2 3.29Å; D86-H88 IonicContact OD1-CG 3.99Å; D86-H88 IonicContact OD2-CD2 3.31Å; D86-H88 PolarHBondContact OD2-CD2 2.84Å; D86-H88 VanDerWaalsContact OD2-CD2 3.31Å; D86-H88 IonicContact OD2-NE2 3.82Å; H88-K90 PolarHBondContact O-N 3.16Å
89	T	96.1	Very high	95.8	Very high	54 Å²	54	29.4 Å²	29.4	33%	0.331	18%	0.178	S	C	.	.	B	Isolated β-bridge	trans	-61.8	126.6	173.9	-53.9	0	0	0	0	109.9	V91 N243 Q302	T89-V91 VanDerWaalsContact CG2-O 3.3Å; T89-V91 WeakPolarHBondContact CG2-O 3.24Å; T89-N243 HydrophobicContact CG2-CB 4.31Å; T89-Q302 PolarHBondContact O-NE2 3.02Å
90	K	97.7	Very high	95.8	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	-67.9	-52.1	-177.8	176.5	58.9	59.1	168.3	0	112.2	M81 Q82 T83 T84 H88 A285 P299 A301 Q302 I303	M81-K90 WeakPolarHBondContact O-CB 3.22Å; M81-K90 HydrophobicContact SD-CG 4.13Å; Q82-K90 WeakPolarHBondContact O-CB 3.35Å; Q82-K90 PolarHBondContact O-N 2.84Å; T83-K90 VanDerWaalsContact O-CE 3.24Å; T83-K90 WeakPolarHBondContact O-CE 3.27Å; T84-K90 HydrophobicContact CG2-CD 4.36Å; H88-K90 PolarHBondContact O-N 3.16Å; K90-A285 WeakPolarHBondContact CD-O 3.28Å; K90-A285 WeakPolarHBondContact CE-O 3.46Å; K90-A285 PolarHBondContact NZ-O 2.93Å; K90-P299 PolarHBondContact NZ-O 3.44Å; K90-A301 VanDerWaalsContact CD-O 3.31Å; K90-A301 WeakPolarHBondContact CD-O 3.49Å; K90-A301 WeakPolarHBondContact CE-O 3.27Å; K90-A301 PolarHBondContact NZ-O 3.14Å; K90-Q302 CarbonylContact O-C 3.51Å; K90-Q302 WeakPolarHBondContact O-CA 3.25Å; K90-I303 HydrophobicContact CD-CD1 4.18Å; K90-I303 PolarHBondContact O-N 3.48Å
91	V	98	Very high	95.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	104.8	176.9	-177.2	0	0	0	0	108.4	V74 M81 T89 I94 Y239 I303	V74-V91 HydrophobicContact CG1-CG2 4.38Å; M81-V91 HydrophobicContact CB-CG2 3.96Å; M81-V91 HydrophobicContact CG-CG2 4.38Å; M81-V91 HydrophobicContact SD-CG2 3.9Å; T89-V91 VanDerWaalsContact CG2-O 3.3Å; T89-V91 WeakPolarHBondContact CG2-O 3.24Å; V91-I94 HydrophobicContact CG1-CD1 4.07Å; V91-I94 HydrophobicContact CG1-CG1 3.61Å; V91-Y239 HydrophobicContact CG1-CE1 4.18Å; V91-Y239 WeakPolarHBondContact O-CE1 3.28Å; V91-Y239 PolarHBondContact O-OH 3.03Å; V91-I303 CarbonylContact C-O 3.59Å; V91-I303 WeakPolarHBondContact CA-O 3.36Å
92	V	97	Very high	95.9	Very high	31 Å²	31	27.9 Å²	27.9	19%	0.188	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-26.2	-175.1	-56	0	0	0	0	112.4	L66 Q302 I303 I304	L66-V92 HydrophobicContact CD1-CG2 3.81Å; V92-Q302 HydrophobicContact CG1-CB 3.9Å; V92-Q302 HydrophobicContact CG1-CG 4.12Å; V92-I303 PolarHBondContact N-O 3.5Å; V92-I304 HydrophobicContact CG2-CD1 3.93Å; V92-I304 HydrophobicContact CG2-CG1 3.26Å
93	D	97.4	Very high	96	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.016	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	154.2	177.9	-152.7	0.3	0	0	0	113	I304 S305 Y328	D93-I304 HydrophobicContact CB-CG1 4.26Å; D93-I304 HydrophobicContact CB-CG2 4.24Å; D93-S305 PolarHBondContact O-N 2.6Å; D93-Y328 PolarHBondContact OD2-OH 3.13Å
94	I	97.8	Very high	95.9	Very high	9 Å²	9	27.5 Å²	27.5	5%	0.046	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	120.3	178.3	-56	176.5	0	0	0	108.2	P76 V91 Y239 N259 A270 S305	P76-I94 HydrophobicContact CB-CD1 3.83Å; P76-I94 HydrophobicContact CG-CD1 3.46Å; P76-I94 VanDerWaalsContact CG-CD1 3.46Å; V91-I94 HydrophobicContact CG1-CD1 4.07Å; V91-I94 HydrophobicContact CG1-CG1 3.61Å; I94-Y239 HydrophobicContact CB-CD1 4.34Å; I94-Y239 HydrophobicContact CB-CG 4.41Å; I94-Y239 HydrophobicContact CD1-CD1 4.3Å; I94-Y239 HydrophobicContact CD1-CD2 3.99Å; I94-Y239 HydrophobicContact CD1-CE1 3.97Å; I94-Y239 HydrophobicContact CD1-CE2 3.64Å; I94-Y239 HydrophobicContact CD1-CG 4.3Å; I94-Y239 HydrophobicContact CG1-CD1 3.98Å; I94-Y239 HydrophobicContact CG1-CD2 4.47Å; I94-Y239 HydrophobicContact CG1-CE1 3.82Å; I94-Y239 HydrophobicContact CG1-CE2 4.34Å; I94-Y239 HydrophobicContact CG1-CG 4.29Å; I94-N259 PolarHBondContact O-ND2 2.94Å; I94-A270 HydrophobicContact CG2-CB 3.88Å; I94-S305 WeakPolarHBondContact CA-O 3.41Å
95	V	97.1	Very high	95.9	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	133.4	-174.9	-166.7	0	0	0	0	110.9	F97 R261 E268 S305 L306 Q307 Y328	V95-F97 HydrophobicContact CB-CE1 4.29Å; V95-F97 HydrophobicContact CB-CE2 4.22Å; V95-F97 HydrophobicContact CB-CZ 3.99Å; V95-F97 HydrophobicContact CG1-CD1 3.83Å; V95-F97 HydrophobicContact CG1-CE1 3.46Å; V95-F97 VanDerWaalsContact CG1-CE1 3.46Å; V95-F97 HydrophobicContact CG1-CE2 4.23Å; V95-F97 HydrophobicContact CG1-CG 4.35Å; V95-F97 HydrophobicContact CG1-CZ 3.67Å; V95-F97 HydrophobicContact CG2-CZ 4.48Å; V95-R261 VanDerWaalsContact CG1-NH2 3.3Å; V95-E268 WeakPolarHBondContact CA-OE1 3.43Å; V95-E268 WeakPolarHBondContact CG1-OE1 3.27Å; V95-S305 PolarHBondContact N-O 2.82Å; V95-L306 HydrophobicContact CB-CD2 4.05Å; V95-L306 HydrophobicContact CG2-CD2 4.12Å; V95-Q307 PolarHBondContact O-N 3.41Å; V95-Y328 HydrophobicContact CG2-CE1 4.06Å
96	D	96.5	Very high	95.9	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	100.7	168.7	178.4	24.4	0	0	0	111	T98 A100 G101 E268 A270 Q307	D96-T98 VanDerWaalsContact C-N 3.31Å; D96-T98 PolarHBondContact O-N 3.09Å; D96-T98 WeakPolarHBondContact OD1-CB 3.37Å; D96-T98 WeakPolarHBondContact OD1-CG2 3.13Å; D96-T98 PolarHBondContact OD1-N 3.29Å; D96-T98 VanDerWaalsContact OD1-N 3.07Å; D96-T98 PolarHBondContact OD1-OG1 3.46Å; D96-T98 PolarHBondContact OD2-OG1 3.23Å; D96-A100 PolarHBondContact OD2-N 3.24Å; D96-G101 PolarHBondContact OD2-N 3.32Å; D96-E268 HydrophobicContact CB-CG 4.19Å; D96-E268 PolarHBondContact N-OE1 3.34Å; D96-A270 HydrophobicContact CB-CB 4.43Å; D96-Q307 PolarHBondContact OD1-NE2 2.87Å
97	F	95.5	Very high	96.1	Very high	5 Å²	5	26.7 Å²	26.7	2%	0.022	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-9	179.3	-71.2	-53.7	0	0	0	114.3	V95 G99 L306 Q307 A321 R324 A325 Y328	V95-F97 HydrophobicContact CB-CE1 4.29Å; V95-F97 HydrophobicContact CB-CE2 4.22Å; V95-F97 HydrophobicContact CB-CZ 3.99Å; V95-F97 HydrophobicContact CG1-CD1 3.83Å; V95-F97 HydrophobicContact CG1-CE1 3.46Å; V95-F97 VanDerWaalsContact CG1-CE1 3.46Å; V95-F97 HydrophobicContact CG1-CE2 4.23Å; V95-F97 HydrophobicContact CG1-CG 4.35Å; V95-F97 HydrophobicContact CG1-CZ 3.67Å; V95-F97 HydrophobicContact CG2-CZ 4.48Å; F97-G99 VanDerWaalsContact C-N 3.29Å; F97-G99 PolarHBondContact O-N 2.93Å; F97-L306 HydrophobicContact CD2-CB 3.99Å; F97-L306 HydrophobicContact CD2-CD2 4.25Å; F97-L306 HydrophobicContact CE2-CB 3.8Å; F97-L306 HydrophobicContact CE2-CD1 3.88Å; F97-L306 HydrophobicContact CE2-CD2 3.35Å; F97-L306 HydrophobicContact CE2-CG 3.82Å; F97-L306 HydrophobicContact CZ-CD2 3.95Å; F97-Q307 PolarHBondContact N-O 3.41Å; F97-A321 HydrophobicContact CB-CB 4.05Å; F97-R324 HydrophobicContact CB-CB 3.95Å; F97-R324 HydrophobicContact CD1-CB 3.4Å; F97-R324 VanDerWaalsContact CD1-CB 3.4Å; F97-R324 HydrophobicContact CD1-CG 4.34Å; F97-R324 HydrophobicContact CE1-CB 4Å; F97-R324 HydrophobicContact CG-CB 3.77Å; F97-R324 VanDerWaalsContact O-CD 3.27Å; F97-R324 WeakPolarHBondContact O-CD 3.41Å; F97-R324 PolarHBondContact O-NH1 3.09Å; F97-A325 HydrophobicContact CD2-CB 3.53Å; F97-A325 HydrophobicContact CE2-CB 3.77Å; F97-A325 HydrophobicContact CG-CB 4.4Å; F97-Y328 HydrophobicContact CE1-CG 4.38Å; F97-Y328 HydrophobicContact CE2-CD1 4.39Å; F97-Y328 HydrophobicContact CE2-CG 4.44Å; F97-Y328 VanDerWaalsContact CZ-CB 3.43Å; F97-Y328 AromaticContact CZ-CD1 3.79Å; F97-Y328 HydrophobicContact CZ-CD1 3.79Å; F97-Y328 HydrophobicContact CZ-CD2 4.22Å; F97-Y328 AromaticContact CZ-CG 3.56Å; F97-Y328 HydrophobicContact CZ-CG 3.56Å
98	T	94.3	Very high	96.3	Very high	6 Å²	6	27 Å²	27	4%	0.037	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-26.5	179.9	74.6	0	0	0	0	111.8	D96 A100 Q307 I308 D310 R312 A321	D96-T98 VanDerWaalsContact C-N 3.31Å; D96-T98 PolarHBondContact O-N 3.09Å; D96-T98 WeakPolarHBondContact OD1-CB 3.37Å; D96-T98 WeakPolarHBondContact OD1-CG2 3.13Å; D96-T98 PolarHBondContact OD1-N 3.29Å; D96-T98 VanDerWaalsContact OD1-N 3.07Å; D96-T98 PolarHBondContact OD1-OG1 3.46Å; D96-T98 PolarHBondContact OD2-OG1 3.23Å; T98-A100 VanDerWaalsContact OG1-CB 3.31Å; T98-A100 WeakPolarHBondContact OG1-CB 3.49Å; T98-A100 PolarHBondContact OG1-N 3.48Å; T98-A100 VanDerWaalsContact OG1-N 3.1Å; T98-Q307 HydrophobicContact CG2-CG 4.34Å; T98-I308 VanDerWaalsContact CG2-C 3.48Å; T98-I308 VanDerWaalsContact CG2-O 3.29Å; T98-I308 WeakPolarHBondContact CG2-O 3.39Å; T98-D310 HydrophobicContact CG2-CB 3.99Å; T98-R312 PolarHBondContact O-NH2 2.99Å; T98-A321 HydrophobicContact CG2-CB 4.06Å
99	G	93.1	Very high	96.3	Very high	8 Å²	8	26.4 Å²	26.4	8%	0.082	15%	0.149	C	C	.	.	S	Bend	trans	72.5	15	-171.3	0	0	0	0	0	113.3	F97 G101 D102 R312	F97-G99 VanDerWaalsContact C-N 3.29Å; F97-G99 PolarHBondContact O-N 2.93Å; G99-G101 VanDerWaalsContact C-N 3.31Å; G99-D102 WeakPolarHBondContact CA-OD2 3.28Å; G99-D102 PolarHBondContact O-N 3.04Å; G99-R312 PolarHBondContact O-NH1 2.62Å
100	A	94	Very high	96.3	Very high	5 Å²	5	30.4 Å²	30.4	4%	0.041	16%	0.164	C	C	.	.	S	Bend	trans	-69.1	-33.3	172.7	0	0	0	0	0	111.4	D96 T98 D102 K142 R312	D96-A100 PolarHBondContact OD2-N 3.24Å; T98-A100 VanDerWaalsContact OG1-CB 3.31Å; T98-A100 WeakPolarHBondContact OG1-CB 3.49Å; T98-A100 PolarHBondContact OG1-N 3.48Å; T98-A100 VanDerWaalsContact OG1-N 3.1Å; A100-D102 VanDerWaalsContact C-N 3.35Å; A100-K142 WeakPolarHBondContact O-CE 3.42Å; A100-K142 PolarHBondContact O-NZ 2.9Å; A100-R312 HydrophobicContact CB-CG 4.25Å
101	G	95.1	Very high	96	Very high	2 Å²	2	32.5 Å²	32.5	2%	0.021	18%	0.182	C	C	.	.	S	Bend	trans	-81.6	-2.9	174.7	0	0	0	0	0	115.5	D96 G99 I269	D96-G101 PolarHBondContact OD2-N 3.32Å; G99-G101 VanDerWaalsContact C-N 3.31Å; G101-I269 WeakPolarHBondContact CA-O 3.3Å; G101-I269 PolarHBondContact O-N 3.06Å
102	D	96	Very high	95.7	Very high	41 Å²	41	38 Å²	38	22%	0.219	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	138.5	-178.2	-71.1	-9.6	0	0	0	111.5	G99 A100 L267 R799	G99-D102 WeakPolarHBondContact CA-OD2 3.28Å; G99-D102 PolarHBondContact O-N 3.04Å; A100-D102 VanDerWaalsContact C-N 3.35Å; D102-L267 CarbonylContact C-O 3.54Å; D102-R799 VanDerWaalsContact CG-NH1 3.3Å; D102-R799 IonicContact OD1-CZ 2.7Å; D102-R799 IonicContact OD1-NH1 3.75Å; D102-R799 PolarHBondContact OD1-NH1 3.02Å; D102-R799 IonicContact OD2-CZ 3.09Å; D102-R799 VanDerWaalsContact OD2-CZ 3.28Å; D102-R799 IonicContact OD2-NH1 2.72Å; D102-R799 PolarHBondContact OD2-NH1 2.73Å; D102-R799 IonicContact OD2-NH2 3.18Å; D102-R799 PolarHBondContact OD2-NH2 3.06Å
103	V	97.1	Very high	95.4	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.03	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	121.1	174.8	-175	0	0	0	0	108.2	T105 K142 C209 L267 I269	V103-T105 HydrophobicContact CG1-CG2 4.19Å; V103-T105 PolarHBondContact O-N 3.15Å; V103-K142 HydrophobicContact CG2-CB 3.96Å; V103-K142 HydrophobicContact CG2-CD 4.07Å; V103-K142 HydrophobicContact CG2-CG 4.13Å; V103-C209 HydrophobicContact CG1-CB 4.3Å; V103-L267 HydrophobicContact CB-CB 4.24Å; V103-L267 PolarHBondContact N-O 3.18Å; V103-L267 PolarHBondContact O-N 3.4Å; V103-I269 HydrophobicContact CG2-CD1 3.86Å; V103-I269 HydrophobicContact CG2-CG1 4.07Å
104	D	95.7	Very high	95.1	Very high	109 Å²	109	44.7 Å²	44.7	58%	0.583	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	120.2	169.9	-178.9	5	0	0	0	109.3	S106 G140	D104-S106 WeakPolarHBondContact OD1-CB 3.45Å; D104-S106 PolarHBondContact OD1-N 2.82Å; D104-S106 PolarHBondContact OD1-OG 3.22Å; D104-S106 PolarHBondContact OD2-OG 3.37Å; D104-G140 WeakPolarHBondContact O-CA 3.47Å
105	T	97.4	Very high	95	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.269	C	S	.	.			trans	-118	16	-179.8	46.9	0	0	0	0	111.9	V103 T107 Y138 L139 V211 G264 M265 M266 L267	V103-T105 HydrophobicContact CG1-CG2 4.19Å; V103-T105 PolarHBondContact O-N 3.15Å; T105-T107 PolarHBondContact O-N 3.37Å; T105-T107 VanDerWaalsContact O-N 3.09Å; T105-Y138 VanDerWaalsContact O-CB 3.28Å; T105-Y138 WeakPolarHBondContact O-CB 3.45Å; T105-L139 WeakPolarHBondContact CA-O 3.35Å; T105-V211 HydrophobicContact CG2-CG2 3.94Å; T105-G264 PolarHBondContact OG1-O 2.98Å; T105-M265 PolarHBondContact N-O 3.46Å; T105-M265 PolarHBondContact OG1-O 3.34Å; T105-M266 PolarHBondContact OG1-N 3.1Å; T105-L267 HydrophobicContact CG2-CB 3.93Å
106	S	95.8	Very high	95	Very high	58 Å²	58	48.4 Å²	48.4	41%	0.406	27%	0.27	S	S	.	.			trans	-62.1	-16.3	-178.9	61.5	0	0	0	0	114.6	D104 V108	D104-S106 WeakPolarHBondContact OD1-CB 3.45Å; D104-S106 PolarHBondContact OD1-N 2.82Å; D104-S106 PolarHBondContact OD1-OG 3.22Å; D104-S106 PolarHBondContact OD2-OG 3.37Å; S106-V108 PolarHBondContact O-N 2.64Å
107	T	97.4	Very high	95	Very high	59 Å²	59	52.3 Å²	52.3	36%	0.362	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	112	177.1	-60.5	0	0	0	0	110.9	T105 L119 L139	T105-T107 PolarHBondContact O-N 3.37Å; T105-T107 VanDerWaalsContact O-N 3.09Å; T107-L119 HydrophobicContact CG2-CD2 3.89Å; T107-L139 PolarHBondContact O-N 3.34Å
108	V	96.9	Very high	95	Very high	64 Å²	64	52.1 Å²	52.1	39%	0.388	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.7	-178.4	-172.5	0	0	0	0	111.6	S106 K136 Y137 Y138	S106-V108 PolarHBondContact O-N 2.64Å; V108-K136 HydrophobicContact CG1-CB 3.81Å; V108-K136 HydrophobicContact CG1-CD 4.3Å; V108-K136 HydrophobicContact CG1-CG 4.13Å; V108-Y137 CarbonylContact C-O 3.53Å; V108-Y137 WeakPolarHBondContact CA-O 3.28Å; V108-Y138 HydrophobicContact CG2-CD1 3.59Å; V108-Y138 HydrophobicContact CG2-CE1 3.47Å; V108-Y138 VanDerWaalsContact CG2-CE1 3.47Å; V108-Y138 HydrophobicContact CG2-CG 4.15Å
109	R	96.8	Very high	95.1	Very high	93 Å²	93	54.9 Å²	54.9	35%	0.351	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	161.1	171.2	-63.8	-169	-178.9	171.1	-3	111.3	V116 I117 G118 Y137 L139	R109-V116 HydrophobicContact CB-CG1 4.11Å; R109-I117 WeakPolarHBondContact CD-O 3.34Å; R109-I117 PolarHBondContact NH1-O 3.09Å; R109-G118 PolarHBondContact NH1-O 2.9Å; R109-Y137 PolarHBondContact N-O 2.9Å; R109-Y137 PolarHBondContact O-N 2.91Å; R109-L139 HydrophobicContact CB-CD1 3.95Å; R109-L139 HydrophobicContact CG-CD1 3.73Å
110	Q	95.1	Very high	95.1	Very high	138 Å²	138	57 Å²	57	65%	0.645	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	153.8	169.4	-68.5	-177	-25.9	0	0	109.6
111	A	92.6	Very high	95.2	Very high	44 Å²	44	59.2 Å²	59.2	36%	0.364	34%	0.338	S	S	.	.			trans	-76.7	134.6	175.1	0	0	0	0	0	110.8	F115 V116 I126 Y137	A111-F115 CarbonylContact C-O 3.49Å; A111-F115 VanDerWaalsContact CA-O 3.26Å; A111-F115 WeakPolarHBondContact CA-O 3.46Å; A111-V116 HydrophobicContact CB-CG2 3.72Å; A111-I126 HydrophobicContact CB-CG1 4.38Å; A111-Y137 HydrophobicContact CB-CD2 4.35Å; A111-Y137 HydrophobicContact CB-CE2 3.8Å
112	D	91.4	Very high	95.1	Very high	116 Å²	116	62 Å²	62	62%	0.62	35%	0.348	S	S	*	.	B	Isolated β-bridge	trans	-112.8	123.4	169.8	178	28.6	0	0	0	108.7	G114 F115	D112-G114 PolarHBondContact O-N 2.82Å; D112-G114 VanDerWaalsContact O-N 3.13Å; D112-F115 PolarHBondContact N-O 2.76Å; D112-F115 PolarHBondContact O-N 2.7Å
113	N	90	Very high	95.1	Very high	142 Å²	142	67 Å²	67	76%	0.759	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	36.5	-177.4	-64.6	-52.8	0	0	0	114.6	F115	N113-F115 VanDerWaalsContact C-N 3.34Å; N113-F115 WeakPolarHBondContact O-CD2 3.43Å
114	G	92.2	Very high	95.1	Very high	33 Å²	33	66.9 Å²	66.9	34%	0.34	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	9.6	-179.2	0	0	0	0	0	114.8	D112 I126	D112-G114 PolarHBondContact O-N 2.82Å; D112-G114 VanDerWaalsContact O-N 3.13Å; G114-I126 WeakPolarHBondContact O-CB 3.34Å; G114-I126 PolarHBondContact O-N 3.42Å
115	F	95.9	Very high	95.2	Very high	86 Å²	86	68 Å²	68	38%	0.377	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	146.6	177.8	-64.4	-89.4	0	0	0	112.2	A111 D112 N113 K123 L124 R125	A111-F115 CarbonylContact C-O 3.49Å; A111-F115 VanDerWaalsContact CA-O 3.26Å; A111-F115 WeakPolarHBondContact CA-O 3.46Å; D112-F115 PolarHBondContact N-O 2.76Å; D112-F115 PolarHBondContact O-N 2.7Å; N113-F115 VanDerWaalsContact C-N 3.34Å; N113-F115 WeakPolarHBondContact O-CD2 3.43Å; F115-K123 HydrophobicContact CD1-CB 4.26Å; F115-L124 CarbonylContact C-O 3.29Å; F115-L124 VanDerWaalsContact CA-O 3.28Å; F115-L124 WeakPolarHBondContact CA-O 3.37Å; F115-R125 HydrophobicContact CD1-CB 4.01Å; F115-R125 HydrophobicContact CD1-CG 4.37Å; F115-R125 HydrophobicContact CE1-CB 3.68Å; F115-R125 HydrophobicContact CE1-CG 3.79Å; F115-R125 HydrophobicContact CZ-CG 4.18Å
116	V	96.1	Very high	95.1	Very high	2 Å²	2	68.6 Å²	68.6	1%	0.012	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133	168.1	177.1	0	0	0	0	108	R109 A111 G118 L124 I126 Y137 L139	R109-V116 HydrophobicContact CB-CG1 4.11Å; A111-V116 HydrophobicContact CB-CG2 3.72Å; V116-G118 PolarHBondContact O-N 3.17Å; V116-L124 PolarHBondContact N-O 3.38Å; V116-L124 WeakPolarHBondContact O-CA 3.48Å; V116-L124 VanDerWaalsContact O-CB 3.27Å; V116-L124 WeakPolarHBondContact O-CB 3.47Å; V116-L124 PolarHBondContact O-N 2.99Å; V116-I126 HydrophobicContact CB-CD1 4.23Å; V116-I126 HydrophobicContact CG2-CD1 3.83Å; V116-I126 HydrophobicContact CG2-CG1 3.93Å; V116-Y137 HydrophobicContact CG2-CD2 3.66Å; V116-Y137 HydrophobicContact CG2-CE2 4.11Å; V116-Y137 HydrophobicContact CG2-CG 4.14Å; V116-L139 HydrophobicContact CG1-CD1 3.74Å; V116-L139 HydrophobicContact CG1-CD2 3.97Å; V116-L139 HydrophobicContact CG1-CG 4.38Å
117	I	96.7	Very high	95.1	Very high	82 Å²	82	66.7 Å²	66.7	42%	0.421	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	120.8	172.2	-58.6	-173.2	0	0	0	107.8	R109 R122 K123 L139	R109-I117 WeakPolarHBondContact CD-O 3.34Å; R109-I117 PolarHBondContact NH1-O 3.09Å; I117-R122 WeakPolarHBondContact CA-O 3.28Å; I117-K123 HydrophobicContact CG1-CG 4.43Å; I117-L139 VanDerWaalsContact O-CD1 3.3Å; I117-L139 WeakPolarHBondContact O-CD1 3.32Å
118	G	95.7	Very high	94.8	Very high	1 Å²	1	71.8 Å²	71.8	1%	0.01	38%	0.377	C	S	.	.			trans	-68.5	172.7	174.4	0	0	0	0	0	112.9	R109 V116 T120 G121 R122 D208	R109-G118 PolarHBondContact NH1-O 2.9Å; V116-G118 PolarHBondContact O-N 3.17Å; G118-T120 VanDerWaalsContact C-N 3.26Å; G118-G121 PolarHBondContact O-N 3.04Å; G118-G121 VanDerWaalsContact O-N 3.14Å; G118-R122 PolarHBondContact N-O 3.25Å; G118-D208 VanDerWaalsContact C-OD1 3.31Å; G118-D208 VanDerWaalsContact CA-OD1 3.25Å; G118-D208 WeakPolarHBondContact CA-OD1 3.35Å
119	L	95.9	Very high	94.6	Very high	65 Å²	65	73.5 Å²	73.5	34%	0.34	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.7	174.7	-64.9	-171.5	0	0	0	112.2	T107 G121 L139 V141 D208	T107-L119 HydrophobicContact CG2-CD2 3.89Å; L119-G121 PolarHBondContact O-N 3.44Å; L119-L139 HydrophobicContact CD2-CB 4.35Å; L119-L139 HydrophobicContact CG-CB 4.09Å; L119-V141 HydrophobicContact CB-CB 4.19Å; L119-V141 HydrophobicContact CB-CG1 4.49Å; L119-V141 HydrophobicContact CD1-CB 4.48Å; L119-V141 HydrophobicContact CD1-CG1 4.36Å; L119-D208 PolarHBondContact N-OD1 3.05Å
120	T	93.9	Very high	94.5	Very high	51 Å²	51	70.7 Å²	70.7	31%	0.313	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-8.1	169.4	68.7	0	0	0	0	113.7	G118 R122 V141 T206 D208	G118-T120 VanDerWaalsContact C-N 3.26Å; T120-R122 PolarHBondContact OG1-N 3.36Å; T120-R122 PolarHBondContact OG1-NE 2.9Å; T120-R122 VanDerWaalsContact OG1-NE 3.1Å; T120-R122 PolarHBondContact OG1-NH2 3.3Å; T120-R122 VanDerWaalsContact OG1-NH2 3.14Å; T120-V141 HydrophobicContact CG2-CG2 3.7Å; T120-T206 HydrophobicContact CG2-CG2 3.89Å; T120-D208 WeakPolarHBondContact CG2-OD2 2.97Å; T120-D208 PolarHBondContact N-OD1 3.26Å; T120-D208 PolarHBondContact OG1-OD1 2.94Å; T120-D208 PolarHBondContact OG1-OD2 3.5Å
121	G	94.6	Very high	94.5	Very high	52 Å²	52	71.8 Å²	71.8	54%	0.536	38%	0.384	S	S	.	.	S	Bend	trans	87.4	-5.4	-174.3	0	0	0	0	0	114.7	G118 L119	G118-G121 PolarHBondContact O-N 3.04Å; G118-G121 VanDerWaalsContact O-N 3.14Å; L119-G121 PolarHBondContact O-N 3.44Å
122	R	95	Very high	94.6	Very high	60 Å²	60	70.8 Å²	70.8	23%	0.226	37%	0.372	C	S	.	.			trans	-65.9	145.5	174.4	-71.3	-178.6	-67.6	-112.5	-4.6	111.6	I117 G118 T120 L124 T206 D208 D223 F226	I117-R122 WeakPolarHBondContact CA-O 3.28Å; G118-R122 PolarHBondContact N-O 3.25Å; T120-R122 PolarHBondContact OG1-N 3.36Å; T120-R122 PolarHBondContact OG1-NE 2.9Å; T120-R122 VanDerWaalsContact OG1-NE 3.1Å; T120-R122 PolarHBondContact OG1-NH2 3.3Å; T120-R122 VanDerWaalsContact OG1-NH2 3.14Å; R122-L124 HydrophobicContact CB-CD2 4.3Å; R122-L124 PolarHBondContact O-N 2.78Å; R122-T206 PolarHBondContact NH1-O 2.89Å; R122-T206 VanDerWaalsContact NH1-O 3.09Å; R122-T206 PolarHBondContact NH2-O 3.35Å; R122-D208 IonicContact CZ-OD2 3.32Å; R122-D208 IonicContact NE-OD2 2.89Å; R122-D208 PolarHBondContact NE-OD2 2.9Å; R122-D208 IonicContact NH2-OD2 2.81Å; R122-D208 PolarHBondContact NH2-OD2 3.23Å; R122-D223 IonicContact NE-OD2 2.75Å; R122-F226 WeakPolarHBondContact CD-O 3.41Å; R122-F226 PolarHBondContact NH1-O 3.47Å
123	K	95.9	Very high	94.8	Very high	148 Å²	148	70.1 Å²	70.1	64%	0.643	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	107.4	168.4	-79.8	-172.4	176.8	-174.6	0	109.1	F115 I117	F115-K123 HydrophobicContact CD1-CB 4.26Å; I117-K123 HydrophobicContact CG1-CG 4.43Å
124	L	96.7	Very high	95	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	117.9	177.4	-49.6	179.3	0	0	0	109	F115 V116 R122 I126 D208 G228 L230	F115-L124 CarbonylContact C-O 3.29Å; F115-L124 VanDerWaalsContact CA-O 3.28Å; F115-L124 WeakPolarHBondContact CA-O 3.37Å; V116-L124 PolarHBondContact N-O 3.38Å; V116-L124 WeakPolarHBondContact O-CA 3.48Å; V116-L124 VanDerWaalsContact O-CB 3.27Å; V116-L124 WeakPolarHBondContact O-CB 3.47Å; V116-L124 PolarHBondContact O-N 2.99Å; R122-L124 HydrophobicContact CB-CD2 4.3Å; R122-L124 PolarHBondContact O-N 2.78Å; L124-I126 PolarHBondContact O-N 2.87Å; L124-D208 HydrophobicContact CD1-CB 3.85Å; L124-D208 HydrophobicContact CD2-CB 4.1Å; L124-G228 WeakPolarHBondContact CA-O 3.3Å; L124-L230 HydrophobicContact CB-CD1 4.04Å; L124-L230 HydrophobicContact CB-CG 4.43Å
125	R	96.7	Very high	95.1	Very high	133 Å²	133	66 Å²	66	50%	0.502	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	116.8	176.3	-172.4	-178.3	-177	-176.3	0.8	109.4	F115 P127 G228 E229 L230	F115-R125 HydrophobicContact CD1-CB 4.01Å; F115-R125 HydrophobicContact CD1-CG 4.37Å; F115-R125 HydrophobicContact CE1-CB 3.68Å; F115-R125 HydrophobicContact CE1-CG 3.79Å; F115-R125 HydrophobicContact CZ-CG 4.18Å; R125-P127 WeakPolarHBondContact O-CD 3.3Å; R125-G228 PolarHBondContact N-O 3.06Å; R125-E229 IonicContact NH1-OE2 3.49Å; R125-L230 WeakPolarHBondContact O-CB 3.42Å
126	I	96.4	Very high	95.1	Very high	12 Å²	12	66.6 Å²	66.6	6%	0.062	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-78.7	124.5	178.5	-53.6	-53.9	0	0	0	109.1	A111 G114 V116 L124 N128 W130 Y137 I210 L230	A111-I126 HydrophobicContact CB-CG1 4.38Å; G114-I126 WeakPolarHBondContact O-CB 3.34Å; G114-I126 PolarHBondContact O-N 3.42Å; V116-I126 HydrophobicContact CB-CD1 4.23Å; V116-I126 HydrophobicContact CG2-CD1 3.83Å; V116-I126 HydrophobicContact CG2-CG1 3.93Å; L124-I126 PolarHBondContact O-N 2.87Å; I126-N128 PolarHBondContact O-N 2.89Å; I126-W130 HydrophobicContact CG2-CE3 4.04Å; I126-Y137 HydrophobicContact CD1-CE1 4.41Å; I126-Y137 WeakPolarHBondContact CG2-OH 3.37Å; I126-I210 HydrophobicContact CD1-CD1 3.59Å; I126-L230 HydrophobicContact CD1-CD1 4.03Å
127	P	95	Very high	95.2	Very high	18 Å²	18	67.3 Å²	67.3	12%	0.117	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-64.4	134.4	175.1	-23	35.7	0	0	0	111.4	R125 S129 W130 L230	R125-P127 WeakPolarHBondContact O-CD 3.3Å; P127-S129 PolarHBondContact O-N 2.89Å; P127-W130 HydrophobicContact CB-CD2 4.44Å; P127-W130 HydrophobicContact CB-CG 4.22Å; P127-W130 HydrophobicContact CG-CD2 4.08Å; P127-W130 HydrophobicContact CG-CG 4.37Å; P127-W130 HydrophobicContact CG-CZ2 3.95Å; P127-W130 WeakPolarHBondContact O-CB 3.23Å; P127-W130 PolarHBondContact O-N 2.93Å; P127-L230 HydrophobicContact CG-CB 4.15Å
128	N	91.6	Very high	95.2	Very high	167 Å²	167	65.3 Å²	65.3	89%	0.893	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.2	178.8	-65.8	-16.8	0	0	0	113.6	I126 W130	I126-N128 PolarHBondContact O-N 2.89Å; N128-W130 VanDerWaalsContact C-N 3.29Å
129	S	93.1	Very high	95.3	Very high	99 Å²	99	65.3 Å²	65.3	69%	0.692	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-17	176.7	54.5	0	0	0	0	113.3	P127	P127-S129 PolarHBondContact O-N 2.89Å
130	W	94.7	Very high	95.4	Very high	34 Å²	34	62.2 Å²	62.2	13%	0.129	33%	0.332	C	S	.	.			trans	-76.8	129	-178.4	-69.3	10.5	0	0	0	110.7	I126 P127 N128 I210 F212 C221 L230 L235	I126-W130 HydrophobicContact CG2-CE3 4.04Å; P127-W130 HydrophobicContact CB-CD2 4.44Å; P127-W130 HydrophobicContact CB-CG 4.22Å; P127-W130 HydrophobicContact CG-CD2 4.08Å; P127-W130 HydrophobicContact CG-CG 4.37Å; P127-W130 HydrophobicContact CG-CZ2 3.95Å; P127-W130 WeakPolarHBondContact O-CB 3.23Å; P127-W130 PolarHBondContact O-N 2.93Å; N128-W130 VanDerWaalsContact C-N 3.29Å; W130-I210 HydrophobicContact CH2-CG2 3.99Å; W130-I210 HydrophobicContact CZ3-CD1 4.48Å; W130-I210 HydrophobicContact CZ3-CG2 3.88Å; W130-F212 HydrophobicContact CB-CZ 4.08Å; W130-F212 HydrophobicContact CD2-CE1 4.13Å; W130-F212 AromaticContact CD2-CZ 3.86Å; W130-F212 HydrophobicContact CD2-CZ 3.86Å; W130-F212 HydrophobicContact CE3-CD1 4.49Å; W130-F212 AromaticContact CE3-CE1 3.37Å; W130-F212 HydrophobicContact CE3-CE1 3.37Å; W130-F212 AromaticContact CE3-CZ 3.52Å; W130-F212 HydrophobicContact CE3-CZ 3.52Å; W130-F212 HydrophobicContact CG-CZ 4.13Å; W130-F212 AromaticContact CZ3-CE1 3.63Å; W130-F212 HydrophobicContact CZ3-CE1 3.63Å; W130-F212 HydrophobicContact CZ3-CZ 4.22Å; W130-C221 HydrophobicContact CH2-CB 3.49Å; W130-C221 VanDerWaalsContact CH2-CB 3.49Å; W130-C221 HydrophobicContact CZ2-CB 3.98Å; W130-C221 HydrophobicContact CZ3-CB 4.43Å; W130-L230 HydrophobicContact CH2-CB 3.99Å; W130-L230 HydrophobicContact CH2-CD1 3.75Å; W130-L230 HydrophobicContact CH2-CG 4.43Å; W130-L230 HydrophobicContact CZ2-CB 4.25Å; W130-L230 HydrophobicContact CZ3-CD1 3.92Å; W130-L235 HydrophobicContact CD2-CD1 4.31Å; W130-L235 HydrophobicContact CD2-CD2 4.13Å; W130-L235 HydrophobicContact CE3-CD1 4.46Å; W130-L235 HydrophobicContact CG-CD2 4.08Å; W130-L235 HydrophobicContact CH2-CD1 4.11Å; W130-L235 HydrophobicContact CZ2-CB 4.09Å; W130-L235 HydrophobicContact CZ2-CD1 3.95Å; W130-L235 HydrophobicContact CZ2-CG 4.46Å; W130-L235 HydrophobicContact CZ3-CD1 4.36Å
131	K	94.2	Very high	95.5	Very high	161 Å²	161	62.8 Å²	62.8	70%	0.7	34%	0.335	S	S	*	.			trans	-95.9	120.9	174.3	-65.9	-178.7	-179.9	178.5	0	108.6	F212 D214	K131-F212 VanDerWaalsContact O-CE2 3.27Å; K131-F212 WeakPolarHBondContact O-CE2 3.39Å; K131-D214 VanDerWaalsContact O-CA 3.23Å; K131-D214 WeakPolarHBondContact O-CA 3.22Å
132	N	95.6	Very high	95.6	Very high	23 Å²	23	61.1 Å²	61.1	12%	0.123	31%	0.314	C	S	.	.			trans	-137	89.8	172.6	-179.8	-2	0	0	0	109.2	S134 G135 K136 Y137 F212	N132-S134 PolarHBondContact O-N 3.05Å; N132-S134 VanDerWaalsContact O-N 3.14Å; N132-S134 PolarHBondContact OD1-N 2.5Å; N132-S134 PolarHBondContact OD1-OG 2.78Å; N132-G135 PolarHBondContact O-N 2.8Å; N132-G135 VanDerWaalsContact O-N 3.13Å; N132-G135 PolarHBondContact OD1-N 3.13Å; N132-K136 PolarHBondContact ND2-O 3Å; N132-Y137 HydrophobicContact CB-CE1 4.34Å; N132-Y137 VanDerWaalsContact ND2-CE1 3.31Å; N132-Y137 WeakPolarHBondContact ND2-CE1 3.27Å; N132-Y137 VanDerWaalsContact ND2-CZ 3.32Å; N132-F212 HydrophobicContact CB-CD2 3.64Å; N132-F212 HydrophobicContact CB-CE2 4.09Å; N132-F212 HydrophobicContact CB-CG 4.33Å; N132-F212 WeakPolarHBondContact ND2-CB 3.45Å
133	P	94.6	Very high	95.5	Very high	103 Å²	103	59.3 Å²	59.3	67%	0.669	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-27.5	-176.5	-24.4	34	0	0	0	113.9	H213	P133-H213 WeakPolarHBondContact CD-O 3.48Å
134	S	94.3	Very high	95.5	Very high	59 Å²	59	52.3 Å²	52.3	41%	0.413	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-20.3	-178.1	76.4	0	0	0	0	113.7	N132 K136	N132-S134 PolarHBondContact O-N 3.05Å; N132-S134 VanDerWaalsContact O-N 3.14Å; N132-S134 PolarHBondContact OD1-N 2.5Å; N132-S134 PolarHBondContact OD1-OG 2.78Å; S134-K136 PolarHBondContact O-N 2.8Å; S134-K136 VanDerWaalsContact O-N 3.09Å; S134-K136 PolarHBondContact OG-N 2.91Å; S134-K136 VanDerWaalsContact OG-N 3.09Å
135	G	94	Very high	95.3	Very high	29 Å²	29	52.9 Å²	52.9	30%	0.299	28%	0.283	S	S	.	.			trans	64.8	-0.4	-168.8	0	0	0	0	0	115.3	N132	N132-G135 PolarHBondContact O-N 2.8Å; N132-G135 VanDerWaalsContact O-N 3.13Å; N132-G135 PolarHBondContact OD1-N 3.13Å
136	K	96.3	Very high	95	Very high	98 Å²	98	49.9 Å²	49.9	43%	0.426	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	133.3	-179	-65.6	-179.8	-179.8	-179.1	0	110.7	V108 N132 S134 Y138	V108-K136 HydrophobicContact CG1-CB 3.81Å; V108-K136 HydrophobicContact CG1-CD 4.3Å; V108-K136 HydrophobicContact CG1-CG 4.13Å; N132-K136 PolarHBondContact ND2-O 3Å; S134-K136 PolarHBondContact O-N 2.8Å; S134-K136 VanDerWaalsContact O-N 3.09Å; S134-K136 PolarHBondContact OG-N 2.91Å; S134-K136 VanDerWaalsContact OG-N 3.09Å; K136-Y138 HydrophobicContact CB-CE2 4.36Å
137	Y	97.4	Very high	94.9	Very high	17 Å²	17	49.8 Å²	49.8	7%	0.067	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126	175.3	-65	-79.5	0	0	0	109.7	V108 R109 A111 V116 I126 N132 I210 F212	V108-Y137 CarbonylContact C-O 3.53Å; V108-Y137 WeakPolarHBondContact CA-O 3.28Å; R109-Y137 PolarHBondContact N-O 2.9Å; R109-Y137 PolarHBondContact O-N 2.91Å; A111-Y137 HydrophobicContact CB-CD2 4.35Å; A111-Y137 HydrophobicContact CB-CE2 3.8Å; V116-Y137 HydrophobicContact CG2-CD2 3.66Å; V116-Y137 HydrophobicContact CG2-CE2 4.11Å; V116-Y137 HydrophobicContact CG2-CG 4.14Å; I126-Y137 HydrophobicContact CD1-CE1 4.41Å; I126-Y137 WeakPolarHBondContact CG2-OH 3.37Å; N132-Y137 HydrophobicContact CB-CE1 4.34Å; N132-Y137 VanDerWaalsContact ND2-CE1 3.31Å; N132-Y137 WeakPolarHBondContact ND2-CE1 3.27Å; N132-Y137 VanDerWaalsContact ND2-CZ 3.32Å; Y137-I210 HydrophobicContact CD1-CD1 3.45Å; Y137-I210 VanDerWaalsContact CD1-CD1 3.45Å; Y137-I210 HydrophobicContact CD1-CG1 3.72Å; Y137-I210 HydrophobicContact CE1-CD1 4.12Å; Y137-I210 HydrophobicContact CG-CD1 3.86Å; Y137-I210 HydrophobicContact CG-CG1 4.23Å; Y137-F212 HydrophobicContact CD1-CB 3.94Å; Y137-F212 AromaticContact CD1-CD1 3.7Å; Y137-F212 HydrophobicContact CD1-CD1 3.7Å; Y137-F212 HydrophobicContact CD1-CE1 4.47Å; Y137-F212 AromaticContact CD1-CG 3.97Å; Y137-F212 HydrophobicContact CD1-CG 3.97Å; Y137-F212 HydrophobicContact CE1-CB 4.26Å; Y137-F212 AromaticContact CE1-CD1 3.7Å; Y137-F212 HydrophobicContact CE1-CD1 3.7Å; Y137-F212 HydrophobicContact CE1-CD2 4.47Å; Y137-F212 HydrophobicContact CE1-CE1 4.12Å; Y137-F212 AromaticContact CE1-CG 3.89Å; Y137-F212 HydrophobicContact CE1-CG 3.89Å
138	Y	98.2	Very high	94.9	Very high	41 Å²	41	49.6 Å²	49.6	16%	0.161	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.8	178.8	-68.4	-104.3	0	0	0	107.8	T105 V108 K136 I210 V211 W218 M265	T105-Y138 VanDerWaalsContact O-CB 3.28Å; T105-Y138 WeakPolarHBondContact O-CB 3.45Å; V108-Y138 HydrophobicContact CG2-CD1 3.59Å; V108-Y138 HydrophobicContact CG2-CE1 3.47Å; V108-Y138 VanDerWaalsContact CG2-CE1 3.47Å; V108-Y138 HydrophobicContact CG2-CG 4.15Å; K136-Y138 HydrophobicContact CB-CE2 4.36Å; Y138-I210 CarbonylContact O-C 3.53Å; Y138-I210 WeakPolarHBondContact O-CA 3.32Å; Y138-V211 WeakPolarHBondContact CB-O 3.28Å; Y138-V211 PolarHBondContact N-O 3.19Å; Y138-V211 PolarHBondContact O-N 2.79Å; Y138-W218 HydrophobicContact CD2-CH2 4.25Å; Y138-W218 AromaticContact CD2-CZ3 3.82Å; Y138-W218 HydrophobicContact CD2-CZ3 3.82Å; Y138-W218 AromaticContact CE2-CH2 3.65Å; Y138-W218 HydrophobicContact CE2-CH2 3.65Å; Y138-W218 AromaticContact CE2-CZ3 3.69Å; Y138-W218 HydrophobicContact CE2-CZ3 3.69Å; Y138-W218 AromaticContact CZ-CH2 3.93Å; Y138-M265 HydrophobicContact CD1-CG 4.43Å; Y138-M265 HydrophobicContact CE1-CG 4.22Å
139	L	98.1	Very high	95	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.4	-167.1	-59.4	178.3	0	0	0	110.9	T105 T107 R109 V116 I117 L119 C209 I210	T105-L139 WeakPolarHBondContact CA-O 3.35Å; T107-L139 PolarHBondContact O-N 3.34Å; R109-L139 HydrophobicContact CB-CD1 3.95Å; R109-L139 HydrophobicContact CG-CD1 3.73Å; V116-L139 HydrophobicContact CG1-CD1 3.74Å; V116-L139 HydrophobicContact CG1-CD2 3.97Å; V116-L139 HydrophobicContact CG1-CG 4.38Å; I117-L139 VanDerWaalsContact O-CD1 3.3Å; I117-L139 WeakPolarHBondContact O-CD1 3.32Å; L119-L139 HydrophobicContact CD2-CB 4.35Å; L119-L139 HydrophobicContact CG-CB 4.09Å; L139-C209 WeakPolarHBondContact CA-O 3.32Å; L139-I210 HydrophobicContact CD2-CB 4.21Å; L139-I210 HydrophobicContact CD2-CD1 4.16Å; L139-I210 HydrophobicContact CD2-CG1 3.88Å
140	G	97.6	Very high	94.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	175.6	174.4	0	0	0	0	0	111.3	D104 C209	D104-G140 WeakPolarHBondContact O-CA 3.47Å; G140-C209 PolarHBondContact N-O 2.92Å; G140-C209 PolarHBondContact O-N 2.95Å
141	V	96.2	Very high	94.5	Very high	62 Å²	62	45.8 Å²	45.8	38%	0.376	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	139.3	179.2	65.5	0	0	0	0	110.1	L119 T120 T206 A207	L119-V141 HydrophobicContact CB-CB 4.19Å; L119-V141 HydrophobicContact CB-CG1 4.49Å; L119-V141 HydrophobicContact CD1-CB 4.48Å; L119-V141 HydrophobicContact CD1-CG1 4.36Å; T120-V141 HydrophobicContact CG2-CG2 3.7Å; V141-T206 HydrophobicContact CG2-CG2 3.18Å; V141-A207 WeakPolarHBondContact CA-O 3.42Å; V141-A207 WeakPolarHBondContact CG2-O 3.35Å
142	K	95.4	Very high	94.5	Very high	18 Å²	18	38.1 Å²	38.1	8%	0.078	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	131.1	177.4	-166.4	55.9	163.9	175.2	0	111.4	A100 V103 I144 E146 L147 A207 I269	A100-K142 WeakPolarHBondContact O-CE 3.42Å; A100-K142 PolarHBondContact O-NZ 2.9Å; V103-K142 HydrophobicContact CG2-CB 3.96Å; V103-K142 HydrophobicContact CG2-CD 4.07Å; V103-K142 HydrophobicContact CG2-CG 4.13Å; K142-I144 PolarHBondContact O-N 3.49Å; K142-E146 IonicContact NZ-OE2 3.37Å; K142-E146 PolarHBondContact NZ-OE2 3.4Å; K142-L147 HydrophobicContact CG-CD1 4.12Å; K142-L147 HydrophobicContact CG-CD2 4.32Å; K142-L147 HydrophobicContact CG-CG 4.18Å; K142-A207 PolarHBondContact N-O 2.85Å; K142-A207 PolarHBondContact O-N 2.77Å; K142-I269 HydrophobicContact CB-CD1 4.36Å; K142-I269 HydrophobicContact CG-CD1 4.34Å
143	A	93.9	Very high	94.2	Very high	22 Å²	22	39.5 Å²	39.5	18%	0.182	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	120.3	168.8	0	0	0	0	0	109	Y145 E146	A143-Y145 VanDerWaalsContact C-N 3.29Å; A143-Y145 PolarHBondContact O-N 3.32Å; A143-E146 HydrophobicContact CB-CG 4Å; A143-E146 WeakPolarHBondContact O-CB 3.46Å; A143-E146 PolarHBondContact O-N 2.98Å; A143-E146 VanDerWaalsContact O-N 3.08Å
144	I	95.1	Very high	93.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-64.8	-34.9	-170.5	-64.6	-55.1	0	0	0	112.2	K142 E146 L147 Y148 P205 A207 L222 F226 I248	K142-I144 PolarHBondContact O-N 3.49Å; I144-E146 PolarHBondContact O-N 2.86Å; I144-E146 VanDerWaalsContact O-N 3.16Å; I144-L147 HydrophobicContact CD1-CD1 4.48Å; I144-L147 WeakPolarHBondContact O-CB 3.26Å; I144-L147 PolarHBondContact O-N 3.26Å; I144-Y148 HydrophobicContact CG2-CD1 4.33Å; I144-Y148 HydrophobicContact CG2-CE1 3.65Å; I144-Y148 HydrophobicContact CG2-CE2 4.23Å; I144-P205 HydrophobicContact CB-CG 4.06Å; I144-P205 HydrophobicContact CG1-CG 4.09Å; I144-P205 WeakPolarHBondContact CG1-O 3.5Å; I144-P205 PolarHBondContact N-O 3.03Å; I144-A207 HydrophobicContact CD1-CB 3.74Å; I144-A207 HydrophobicContact CG1-CB 4.25Å; I144-L222 HydrophobicContact CD1-CD1 4.46Å; I144-L222 HydrophobicContact CD1-CD2 4.22Å; I144-F226 HydrophobicContact CD1-CE1 4.15Å; I144-F226 HydrophobicContact CG1-CE1 3.6Å; I144-F226 HydrophobicContact CG1-CZ 4.03Å; I144-I248 HydrophobicContact CG2-CD1 4.34Å; I144-I248 HydrophobicContact CG2-CG2 3.94Å
145	Y	92.6	Very high	93.6	Very high	13 Å²	13	41.9 Å²	41.9	5%	0.051	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-67.7	-11.1	178.2	-75.8	1.4	0	0	0	114.2	A143 L147 Y148 K153 V156 Q157 D202 G204	A143-Y145 VanDerWaalsContact C-N 3.29Å; A143-Y145 PolarHBondContact O-N 3.32Å; Y145-L147 VanDerWaalsContact C-N 3.33Å; Y145-Y148 AromaticContact CD1-CD2 3.54Å; Y145-Y148 HydrophobicContact CD1-CD2 3.54Å; Y145-Y148 AromaticContact CD1-CE2 3.57Å; Y145-Y148 HydrophobicContact CD1-CE2 3.57Å; Y145-Y148 HydrophobicContact CD1-CG 4.49Å; Y145-Y148 AromaticContact CE1-CD2 3.99Å; Y145-Y148 HydrophobicContact CE1-CD2 3.99Å; Y145-Y148 AromaticContact CE1-CE2 3.66Å; Y145-Y148 HydrophobicContact CE1-CE2 3.66Å; Y145-Y148 HydrophobicContact CG-CD2 4.49Å; Y145-K153 HydrophobicContact CD2-CD 4.37Å; Y145-K153 HydrophobicContact CD2-CG 4.22Å; Y145-K153 HydrophobicContact CG-CD 4.33Å; Y145-K153 HydrophobicContact CG-CG 4.21Å; Y145-V156 HydrophobicContact CE1-CG1 4.12Å; Y145-Q157 HydrophobicContact CE2-CG 3.77Å; Y145-D202 WeakPolarHBondContact CD2-O 3.49Å; Y145-D202 HydrophobicContact CE2-CB 4.23Å; Y145-D202 VanDerWaalsContact CE2-O 3.31Å; Y145-D202 WeakPolarHBondContact CE2-O 3.3Å; Y145-D202 VanDerWaalsContact CE2-OD2 3.25Å; Y145-D202 WeakPolarHBondContact CE2-OD2 3.47Å; Y145-D202 PolarHBondContact OH-OD2 3.05Å; Y145-G204 VanDerWaalsContact CE2-N 3.32Å; Y145-G204 VanDerWaalsContact CZ-CA 3.49Å
146	E	91.8	Very high	93.4	Very high	70 Å²	70	41.6 Å²	41.6	33%	0.327	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-76.9	-23.4	169.9	-63.8	178.2	-172.3	0	0	112.3	K142 A143 I144	K142-E146 IonicContact NZ-OE2 3.37Å; K142-E146 PolarHBondContact NZ-OE2 3.4Å; A143-E146 HydrophobicContact CB-CG 4Å; A143-E146 WeakPolarHBondContact O-CB 3.46Å; A143-E146 PolarHBondContact O-N 2.98Å; A143-E146 VanDerWaalsContact O-N 3.08Å; I144-E146 PolarHBondContact O-N 2.86Å; I144-E146 VanDerWaalsContact O-N 3.16Å
147	L	94	Very high	92.8	Very high	10 Å²	10	38.5 Å²	38.5	5%	0.052	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-14.4	177.2	-58	176.2	0	0	0	112.4	K142 I144 Y145 I248 I269 C271	K142-L147 HydrophobicContact CG-CD1 4.12Å; K142-L147 HydrophobicContact CG-CD2 4.32Å; K142-L147 HydrophobicContact CG-CG 4.18Å; I144-L147 HydrophobicContact CD1-CD1 4.48Å; I144-L147 WeakPolarHBondContact O-CB 3.26Å; I144-L147 PolarHBondContact O-N 3.26Å; Y145-L147 VanDerWaalsContact C-N 3.33Å; L147-I248 HydrophobicContact CD1-CD1 4.35Å; L147-I269 HydrophobicContact CD1-CB 4.45Å; L147-I269 HydrophobicContact CD1-CD1 4.35Å; L147-I269 HydrophobicContact CD1-CG2 3.89Å; L147-I269 HydrophobicContact CD2-CB 4.32Å; L147-I269 HydrophobicContact CD2-CG2 4.4Å; L147-C271 HydrophobicContact CB-CB 4.47Å
148	Y	93.9	Very high	92.1	Very high	14 Å²	14	41.6 Å²	41.6	6%	0.055	20%	0.197	C	C	.	.	S	Bend	trans	-85	134.2	-177	-74.7	-2.8	0	0	0	112.2	I144 Y145 L152 K153 V156 I248 D252 M254	I144-Y148 HydrophobicContact CG2-CD1 4.33Å; I144-Y148 HydrophobicContact CG2-CE1 3.65Å; I144-Y148 HydrophobicContact CG2-CE2 4.23Å; Y145-Y148 AromaticContact CD1-CD2 3.54Å; Y145-Y148 HydrophobicContact CD1-CD2 3.54Å; Y145-Y148 AromaticContact CD1-CE2 3.57Å; Y145-Y148 HydrophobicContact CD1-CE2 3.57Å; Y145-Y148 HydrophobicContact CD1-CG 4.49Å; Y145-Y148 AromaticContact CE1-CD2 3.99Å; Y145-Y148 HydrophobicContact CE1-CD2 3.99Å; Y145-Y148 AromaticContact CE1-CE2 3.66Å; Y145-Y148 HydrophobicContact CE1-CE2 3.66Å; Y145-Y148 HydrophobicContact CG-CD2 4.49Å; Y148-L152 HydrophobicContact CD1-CD2 3.55Å; Y148-L152 HydrophobicContact CD1-CG 4.35Å; Y148-L152 HydrophobicContact CD2-CD2 4.15Å; Y148-L152 HydrophobicContact CD2-CG 4.07Å; Y148-L152 HydrophobicContact CE1-CD2 3.91Å; Y148-L152 HydrophobicContact CE2-CD2 4.48Å; Y148-L152 HydrophobicContact CE2-CG 4.47Å; Y148-L152 HydrophobicContact CG-CD2 3.68Å; Y148-L152 HydrophobicContact CG-CG 4.02Å; Y148-K153 HydrophobicContact CD2-CB 4.44Å; Y148-V156 HydrophobicContact CE2-CB 4.35Å; Y148-V156 HydrophobicContact CE2-CG1 4.36Å; Y148-V156 HydrophobicContact CE2-CG2 4.04Å; Y148-I248 HydrophobicContact CE1-CD1 3.95Å; Y148-D252 HydrophobicContact CE1-CB 4.28Å; Y148-D252 WeakPolarHBondContact OH-CB 3.28Å; Y148-D252 VanDerWaalsContact OH-CG 3.29Å; Y148-D252 PolarHBondContact OH-OD2 2.83Å; Y148-M254 HydrophobicContact CD1-CB 4.42Å; Y148-M254 HydrophobicContact CD1-CG 4.09Å; Y148-M254 HydrophobicContact CE1-CB 4.02Å; Y148-M254 HydrophobicContact CE1-CG 4.12Å
149	P	93	Very high	91.2	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.019	21%	0.205	C	C	.	.			trans	-55.2	150.5	160.1	-25.5	35.8	0	0	0	111.3	E151 L152 K153 T272 W438	P149-E151 VanDerWaalsContact C-N 3.27Å; P149-E151 PolarHBondContact O-N 2.87Å; P149-L152 HydrophobicContact CB-CB 4.48Å; P149-L152 WeakPolarHBondContact O-CB 3.47Å; P149-L152 PolarHBondContact O-N 3.14Å; P149-L152 VanDerWaalsContact O-N 3.08Å; P149-K153 PolarHBondContact O-N 3.46Å; P149-T272 VanDerWaalsContact CG-O 3.22Å; P149-T272 WeakPolarHBondContact CG-O 3.29Å; P149-W438 HydrophobicContact CB-CH2 3.84Å; P149-W438 HydrophobicContact CB-CZ2 4.04Å; P149-W438 HydrophobicContact CB-CZ3 4.25Å; P149-W438 HydrophobicContact CG-CD2 4.45Å; P149-W438 HydrophobicContact CG-CH2 4Å; P149-W438 HydrophobicContact CG-CZ2 3.67Å
150	Q	88.4	Confident	90.3	Very high	100 Å²	100	44.7 Å²	44.7	47%	0.467	22%	0.219	S	C	.	.	H	α-helix	trans	-61.1	-35.9	-173.9	-171.7	65.9	5.4	0	0	112.6	R154	Q150-R154 WeakPolarHBondContact O-CB 3.36Å; Q150-R154 VanDerWaalsContact O-CG 3.31Å; Q150-R154 WeakPolarHBondContact O-CG 3.44Å; Q150-R154 PolarHBondContact O-N 3.12Å
151	E	89.9	Confident	89.2	Confident	118 Å²	118	46 Å²	46	55%	0.551	23%	0.226	S	C	*	.	H	α-helix	trans	-63.9	-44.7	175.8	-63.1	79.1	-172.4	0	0	111.5	P149 R155 W438	P149-E151 VanDerWaalsContact C-N 3.27Å; P149-E151 PolarHBondContact O-N 2.87Å; E151-R155 PolarHBondContact O-N 3.38Å; E151-W438 HydrophobicContact CB-CZ3 4.23Å
152	L	93.3	Very high	88.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-48.2	176.7	176.4	60.6	0	0	0	110.9	Y148 P149 R154 R155 V156 D252 M254 W438	Y148-L152 HydrophobicContact CD1-CD2 3.55Å; Y148-L152 HydrophobicContact CD1-CG 4.35Å; Y148-L152 HydrophobicContact CD2-CD2 4.15Å; Y148-L152 HydrophobicContact CD2-CG 4.07Å; Y148-L152 HydrophobicContact CE1-CD2 3.91Å; Y148-L152 HydrophobicContact CE2-CD2 4.48Å; Y148-L152 HydrophobicContact CE2-CG 4.47Å; Y148-L152 HydrophobicContact CG-CD2 3.68Å; Y148-L152 HydrophobicContact CG-CG 4.02Å; P149-L152 HydrophobicContact CB-CB 4.48Å; P149-L152 WeakPolarHBondContact O-CB 3.47Å; P149-L152 PolarHBondContact O-N 3.14Å; P149-L152 VanDerWaalsContact O-N 3.08Å; L152-R154 VanDerWaalsContact C-N 3.3Å; L152-R154 PolarHBondContact O-N 2.9Å; L152-R155 WeakPolarHBondContact O-CB 3.25Å; L152-R155 PolarHBondContact O-N 3.05Å; L152-V156 HydrophobicContact CD1-CG2 3.87Å; L152-V156 HydrophobicContact CG-CG2 4.3Å; L152-V156 WeakPolarHBondContact O-CG2 3.49Å; L152-V156 PolarHBondContact O-N 3.11Å; L152-D252 HydrophobicContact CD1-CB 4.12Å; L152-D252 HydrophobicContact CD2-CB 4.37Å; L152-M254 HydrophobicContact CD2-CB 3.88Å; L152-M254 HydrophobicContact CD2-CG 4.04Å; L152-M254 HydrophobicContact CD2-SD 3.71Å; L152-W438 HydrophobicContact CB-CE3 3.92Å; L152-W438 HydrophobicContact CB-CZ3 4.39Å; L152-W438 HydrophobicContact CD1-CB 4.22Å; L152-W438 HydrophobicContact CD2-CB 4.06Å; L152-W438 HydrophobicContact CD2-CG 4.35Å
153	K	90.8	Very high	87.1	Confident	52 Å²	52	52.9 Å²	52.9	23%	0.226	25%	0.25	C	S	.	.	H	α-helix	trans	-55.3	-47.2	178.7	-176.4	175.1	178.7	171.7	0	111.2	Y145 Y148 P149 R155 V156 Q157	Y145-K153 HydrophobicContact CD2-CD 4.37Å; Y145-K153 HydrophobicContact CD2-CG 4.22Å; Y145-K153 HydrophobicContact CG-CD 4.33Å; Y145-K153 HydrophobicContact CG-CG 4.21Å; Y148-K153 HydrophobicContact CD2-CB 4.44Å; P149-K153 PolarHBondContact O-N 3.46Å; K153-R155 PolarHBondContact O-N 3.08Å; K153-V156 PolarHBondContact O-N 2.88Å; K153-Q157 HydrophobicContact CG-CG 4.45Å; K153-Q157 WeakPolarHBondContact O-CB 3.24Å; K153-Q157 VanDerWaalsContact O-CG 3.27Å; K153-Q157 WeakPolarHBondContact O-CG 3.46Å; K153-Q157 PolarHBondContact O-N 3.23Å
154	R	86.9	Confident	86	Confident	152 Å²	152	55.3 Å²	55.3	57%	0.574	26%	0.259	S	S	*	.	H	α-helix	trans	-59.2	-46.2	174.7	-74.9	173.8	176.9	169.6	1.6	112	Q150 L152 Q157 V158	Q150-R154 WeakPolarHBondContact O-CB 3.36Å; Q150-R154 VanDerWaalsContact O-CG 3.31Å; Q150-R154 WeakPolarHBondContact O-CG 3.44Å; Q150-R154 PolarHBondContact O-N 3.12Å; L152-R154 VanDerWaalsContact C-N 3.3Å; L152-R154 PolarHBondContact O-N 2.9Å; R154-Q157 PolarHBondContact O-N 2.93Å; R154-V158 VanDerWaalsContact O-CG2 3.28Å; R154-V158 WeakPolarHBondContact O-CG2 3.44Å; R154-V158 PolarHBondContact O-N 3.35Å
155	R	89.5	Confident	84.7	Confident	60 Å²	60	58.7 Å²	58.7	23%	0.226	28%	0.277	C	S	.	.	H	α-helix	trans	-58.1	-49.8	177.9	177.5	169.4	67.9	94.7	-7	111.3	E151 L152 K153 V158 C159 T251 D252 W438	E151-R155 PolarHBondContact O-N 3.38Å; L152-R155 WeakPolarHBondContact O-CB 3.25Å; L152-R155 PolarHBondContact O-N 3.05Å; K153-R155 PolarHBondContact O-N 3.08Å; R155-V158 PolarHBondContact O-N 2.8Å; R155-C159 PolarHBondContact O-N 3.26Å; R155-C159 PolarHBondContact O-SG 3.02Å; R155-T251 PolarHBondContact NH1-O 2.86Å; R155-D252 PolarHBondContact NH2-O 2.88Å; R155-W438 PolarHBondContact NH2-O 3.01Å
156	V	88.9	Confident	83.5	Confident	23 Å²	23	61.3 Å²	61.3	14%	0.139	31%	0.308	C	S	.	.	H	α-helix	trans	-65.3	-44.6	-178.1	175.3	0	0	0	0	111.5	Y145 Y148 L152 K153 V158 C159 L160 D252	Y145-V156 HydrophobicContact CE1-CG1 4.12Å; Y148-V156 HydrophobicContact CE2-CB 4.35Å; Y148-V156 HydrophobicContact CE2-CG1 4.36Å; Y148-V156 HydrophobicContact CE2-CG2 4.04Å; L152-V156 HydrophobicContact CD1-CG2 3.87Å; L152-V156 HydrophobicContact CG-CG2 4.3Å; L152-V156 WeakPolarHBondContact O-CG2 3.49Å; L152-V156 PolarHBondContact O-N 3.11Å; K153-V156 PolarHBondContact O-N 2.88Å; V156-V158 VanDerWaalsContact C-N 3.35Å; V156-V158 PolarHBondContact O-N 3.33Å; V156-C159 PolarHBondContact O-N 3.46Å; V156-L160 PolarHBondContact O-N 2.91Å; V156-D252 HydrophobicContact CG2-CB 4.14Å
157	Q	84.8	Confident	82	Confident	33 Å²	33	66.6 Å²	66.6	15%	0.154	33%	0.33	C	S	.	.	H	α-helix	trans	-60.7	-42.2	177.5	-74.5	177.2	-32.2	0	0	112.1	Y145 K153 R154 L160 L161 D202	Y145-Q157 HydrophobicContact CE2-CG 3.77Å; K153-Q157 HydrophobicContact CG-CG 4.45Å; K153-Q157 WeakPolarHBondContact O-CB 3.24Å; K153-Q157 VanDerWaalsContact O-CG 3.27Å; K153-Q157 WeakPolarHBondContact O-CG 3.46Å; K153-Q157 PolarHBondContact O-N 3.23Å; R154-Q157 PolarHBondContact O-N 2.93Å; Q157-L160 PolarHBondContact O-N 2.78Å; Q157-L161 WeakPolarHBondContact O-CB 3.44Å; Q157-L161 PolarHBondContact O-N 2.86Å; Q157-D202 HydrophobicContact CG-CB 4.4Å; Q157-D202 PolarHBondContact NE2-O 3.34Å
158	V	81.2	Confident	80.1	Confident	82 Å²	82	68.7 Å²	68.7	50%	0.497	35%	0.345	S	S	.	.	H	α-helix	trans	-63.9	-45.3	175.1	171	0	0	0	0	111	R154 R155 V156 L160 L161 L162	R154-V158 VanDerWaalsContact O-CG2 3.28Å; R154-V158 WeakPolarHBondContact O-CG2 3.44Å; R154-V158 PolarHBondContact O-N 3.35Å; R155-V158 PolarHBondContact O-N 2.8Å; V156-V158 VanDerWaalsContact C-N 3.35Å; V156-V158 PolarHBondContact O-N 3.33Å; V158-L160 VanDerWaalsContact C-N 3.3Å; V158-L160 PolarHBondContact O-N 3.32Å; V158-L161 PolarHBondContact O-N 3.36Å; V158-L162 HydrophobicContact CG1-CD1 4.03Å; V158-L162 HydrophobicContact CG1-CG 4.45Å; V158-L162 VanDerWaalsContact O-CG 3.32Å; V158-L162 WeakPolarHBondContact O-CG 3.37Å; V158-L162 PolarHBondContact O-N 3.15Å
159	C	80.3	Confident	78	Confident	47 Å²	47	73.4 Å²	73.4	32%	0.318	38%	0.377	S	S	.	.	H	α-helix	trans	-59.9	-40.3	176.4	-71.5	0	0	0	0	112.2	R155 V156 R163	R155-C159 PolarHBondContact O-N 3.26Å; R155-C159 PolarHBondContact O-SG 3.02Å; V156-C159 PolarHBondContact O-N 3.46Å; C159-R163 WeakPolarHBondContact O-CG 3.44Å; C159-R163 PolarHBondContact O-N 3.49Å; C159-R163 VanDerWaalsContact O-N 3.08Å
160	L	79	Confident	75.8	Confident	59 Å²	59	77.1 Å²	77.1	31%	0.309	40%	0.402	S	S	.	.	H	α-helix	trans	-66.2	-47.1	177.3	-173.6	68.5	0	0	0	111.4	V156 Q157 V158 L162 R163 I164 D202	V156-L160 PolarHBondContact O-N 2.91Å; Q157-L160 PolarHBondContact O-N 2.78Å; V158-L160 VanDerWaalsContact C-N 3.3Å; V158-L160 PolarHBondContact O-N 3.32Å; L160-L162 VanDerWaalsContact C-N 3.31Å; L160-L162 PolarHBondContact O-N 2.94Å; L160-R163 WeakPolarHBondContact O-CB 3.23Å; L160-R163 PolarHBondContact O-N 3.32Å; L160-R163 VanDerWaalsContact O-N 3.11Å; L160-I164 HydrophobicContact CG-CD1 4.09Å; L160-I164 WeakPolarHBondContact O-CG1 3.37Å; L160-I164 PolarHBondContact O-N 2.58Å; L160-D202 VanDerWaalsContact CD2-OD2 3.26Å; L160-D202 WeakPolarHBondContact CD2-OD2 3.39Å
161	L	74.1	Confident	73.7	Confident	29 Å²	29	76.3 Å²	76.3	15%	0.152	41%	0.408	C	S	.	.	H	α-helix	trans	-57.5	-45	177.3	-176.5	65.9	0	0	0	111.2	Q157 V158 R163 I164 L165 Y200	Q157-L161 WeakPolarHBondContact O-CB 3.44Å; Q157-L161 PolarHBondContact O-N 2.86Å; V158-L161 PolarHBondContact O-N 3.36Å; L161-R163 VanDerWaalsContact C-N 3.35Å; L161-R163 PolarHBondContact O-N 3.33Å; L161-I164 PolarHBondContact O-N 3.06Å; L161-L165 HydrophobicContact CD1-CD1 4.34Å; L161-L165 HydrophobicContact CD1-CG 4.42Å; L161-L165 HydrophobicContact CG-CD1 4Å; L161-L165 HydrophobicContact CG-CG 4.46Å; L161-L165 WeakPolarHBondContact O-CB 3.46Å; L161-L165 WeakPolarHBondContact O-CG 3.42Å; L161-L165 PolarHBondContact O-N 2.72Å; L161-Y200 HydrophobicContact CD1-CD1 4.42Å; L161-Y200 HydrophobicContact CD1-CD2 4.23Å; L161-Y200 HydrophobicContact CD1-CE2 4.45Å; L161-Y200 HydrophobicContact CD1-CG 4.23Å
162	L	73.4	Confident	71.6	Confident	75 Å²	75	75.6 Å²	75.6	39%	0.393	41%	0.406	S	S	.	.	H	α-helix	trans	-62	-39.5	176.1	-70.8	172.4	0	0	0	112.4	L13 V158 L160 G166	L13-L162 HydrophobicContact CD1-CD2 4.48Å; V158-L162 HydrophobicContact CG1-CD1 4.03Å; V158-L162 HydrophobicContact CG1-CG 4.45Å; V158-L162 VanDerWaalsContact O-CG 3.32Å; V158-L162 WeakPolarHBondContact O-CG 3.37Å; V158-L162 PolarHBondContact O-N 3.15Å; L160-L162 VanDerWaalsContact C-N 3.31Å; L160-L162 PolarHBondContact O-N 2.94Å; L162-G166 PolarHBondContact O-N 2.65Å
163	R	74.7	Confident	69.1	Low	148 Å²	148	82.7 Å²	82.7	56%	0.558	44%	0.444	S	S	*	.	H	α-helix	trans	-64.9	-40	175	-76	176.9	-178.4	173.3	3.2	112	C159 L160 L161 K167	C159-R163 WeakPolarHBondContact O-CG 3.44Å; C159-R163 PolarHBondContact O-N 3.49Å; C159-R163 VanDerWaalsContact O-N 3.08Å; L160-R163 WeakPolarHBondContact O-CB 3.23Å; L160-R163 PolarHBondContact O-N 3.32Å; L160-R163 VanDerWaalsContact O-N 3.11Å; L161-R163 VanDerWaalsContact C-N 3.35Å; L161-R163 PolarHBondContact O-N 3.33Å; R163-K167 WeakPolarHBondContact O-CG 3.2Å; R163-K167 PolarHBondContact O-N 3.4Å
164	I	70	Confident	67.1	Low	74 Å²	74	87.2 Å²	87.2	38%	0.379	47%	0.466	S	S	.	.	H	α-helix	trans	-66	-50.1	177.3	-66.7	167.2	0	0	0	109.9	L160 L161 G166 K167 C168 Y200	L160-I164 HydrophobicContact CG-CD1 4.09Å; L160-I164 WeakPolarHBondContact O-CG1 3.37Å; L160-I164 PolarHBondContact O-N 2.58Å; L161-I164 PolarHBondContact O-N 3.06Å; I164-G166 VanDerWaalsContact C-N 3.3Å; I164-G166 PolarHBondContact O-N 2.83Å; I164-K167 PolarHBondContact O-N 3.15Å; I164-C168 PolarHBondContact O-N 2.78Å; I164-Y200 WeakPolarHBondContact CD1-OH 3.31Å
165	L	68.1	Low	65.1	Low	71 Å²	71	85.7 Å²	85.7	37%	0.372	46%	0.463	S	S	.	.	H	α-helix	trans	-62.6	-36.2	179.2	-69.2	174.3	0	0	0	112.3	L161 K167 C168	L161-L165 HydrophobicContact CD1-CD1 4.34Å; L161-L165 HydrophobicContact CD1-CG 4.42Å; L161-L165 HydrophobicContact CG-CD1 4Å; L161-L165 HydrophobicContact CG-CG 4.46Å; L161-L165 WeakPolarHBondContact O-CB 3.46Å; L161-L165 WeakPolarHBondContact O-CG 3.42Å; L161-L165 PolarHBondContact O-N 2.72Å; L165-K167 VanDerWaalsContact C-N 3.28Å; L165-K167 PolarHBondContact O-N 3.4Å; L165-C168 PolarHBondContact O-N 2.94Å
166	G	66.6	Low	63	Low	68 Å²	68	89.9 Å²	89.9	70%	0.701	49%	0.489	S	S	*	.	H	α-helix	trans	-67.6	-25	174.7	0	0	0	0	0	114.1	L162 I164	L162-G166 PolarHBondContact O-N 2.65Å; I164-G166 VanDerWaalsContact C-N 3.3Å; I164-G166 PolarHBondContact O-N 2.83Å
167	K	62.1	Low	60.8	Low	180 Å²	180	97.7 Å²	97.7	78%	0.783	52%	0.521	S	S	*	.	H	α-helix	trans	-86.5	-16.4	174.9	-74.5	-177.7	179.7	-175.4	0	113.5	R163 I164 L165 P169	R163-K167 WeakPolarHBondContact O-CG 3.2Å; R163-K167 PolarHBondContact O-N 3.4Å; I164-K167 PolarHBondContact O-N 3.15Å; L165-K167 VanDerWaalsContact C-N 3.28Å; L165-K167 PolarHBondContact O-N 3.4Å; K167-P169 WeakPolarHBondContact O-CD 3.26Å
168	C	53.8	Low	59.3	Low	54 Å²	54	100.6 Å²	100.6	37%	0.365	54%	0.538	S	S	.	.	S	Bend	trans	-69.6	113.1	174.2	-74.3	0	0	0	0	109.3	I164 L165 C170	I164-C168 PolarHBondContact O-N 2.78Å; L165-C168 PolarHBondContact O-N 2.94Å; C168-C170 PolarHBondContact O-N 2.67Å; C168-C170 VanDerWaalsContact O-N 3.14Å
169	P	49	Very low	58.4	Low	114 Å²	114	101 Å²	101	74%	0.74	54%	0.541	S	S	*	.			trans	-62	124.3	174.3	-12.8	27.3	0	0	0	107.6	K167 S171	K167-P169 WeakPolarHBondContact O-CD 3.26Å; P169-S171 PolarHBondContact O-N 2.88Å
170	C	46.1	Very low	58	Low	81 Å²	81	108.9 Å²	108.9	55%	0.547	56%	0.564	S	S	.	*			trans	-67	67.8	169.4	-77.3	0	0	0	0	110.1	C168 I172	C168-C170 PolarHBondContact O-N 2.67Å; C168-C170 VanDerWaalsContact O-N 3.14Å; C170-I172 PolarHBondContact O-N 2.97Å
171	S	44.7	Very low	57.4	Low	82 Å²	82	112.9 Å²	112.9	57%	0.573	59%	0.585	S	S	*	*			trans	-79	56.8	167.9	66	0	0	0	0	109.7	P169	P169-S171 PolarHBondContact O-N 2.88Å
172	I	46.3	Very low	57	Low	103 Å²	103	116.9 Å²	116.9	53%	0.528	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-81	-3.4	169.6	-74.4	171.6	0	0	0	110.6	C170	C170-I172 PolarHBondContact O-N 2.97Å
173	L	41.7	Very low	56.7	Low	149 Å²	149	119.8 Å²	119.8	78%	0.78	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-85.9	-4.9	-177.1	-88.9	156.8	0	0	0	115.9
174	E	47.3	Very low	56.7	Low	148 Å²	148	119.1 Å²	119.1	69%	0.692	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-93.2	9.2	173.4	-83.4	-164.7	145.6	0	0	114.4	L176	E174-L176 PolarHBondContact O-N 2.84Å
175	F	46.3	Very low	56.9	Low	120 Å²	120	121.3 Å²	121.3	53%	0.526	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.9	-12.7	-173.1	-160.4	-100.1	0	0	0	115.3
176	L	44.2	Very low	56.8	Low	147 Å²	147	122 Å²	122	77%	0.77	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	0.4	-167	-69.3	174.9	0	0	0	116.5	E174	E174-L176 PolarHBondContact O-N 2.84Å
177	K	43.5	Very low	57.2	Low	187 Å²	187	123.2 Å²	123.2	81%	0.813	61%	0.614	S	S	*	*	S	Bend	trans	-124.3	0.7	-170.2	-80.1	-169.4	177.1	-177.6	0	119.1
178	N	53.2	Low	57.9	Low	95 Å²	95	117.9 Å²	117.9	51%	0.508	60%	0.6	S	S	.	*			trans	-148.4	158.3	-172.7	-90.5	-47.3	0	0	0	118.5	K182	N178-K182 HydrophobicContact CB-CD 3.86Å
179	T	61.9	Low	58.9	Low	90 Å²	90	116.8 Å²	116.8	55%	0.552	60%	0.597	S	S	*	*			trans	-35.3	153.6	-171.1	53.7	0	0	0	0	118.1	L181 K182 R183	T179-L181 PolarHBondContact O-N 3.31Å; T179-K182 PolarHBondContact O-N 3.48Å; T179-R183 PolarHBondContact O-N 2.95Å
180	R	71.1	Confident	60	Low	213 Å²	213	115.5 Å²	115.5	80%	0.804	58%	0.584	S	S	*	*	H	α-helix	trans	-47.1	-35.9	-178.6	-170.2	-179.6	179.5	-170.5	0.6	114.2	K184	R180-K184 PolarHBondContact O-N 3.24Å; R180-K184 VanDerWaalsContact O-N 3.08Å
181	L	68.2	Low	61.4	Low	142 Å²	142	119.2 Å²	119.2	74%	0.743	59%	0.591	S	S	*	*	H	α-helix	trans	-68.3	-42.9	177.6	-87.7	152.7	0	0	0	112.9	T179 K184 N185	T179-L181 PolarHBondContact O-N 3.31Å; L181-K184 PolarHBondContact O-N 3.43Å; L181-N185 PolarHBondContact O-N 2.97Å
182	K	65.5	Low	62.9	Low	114 Å²	114	120.6 Å²	120.6	50%	0.496	59%	0.591	S	S	.	*	H	α-helix	trans	-67.2	-36.9	177.3	-77.5	-176.1	175.1	-176.7	0	111.7	N178 T179 N185 L186	N178-K182 HydrophobicContact CB-CD 3.86Å; T179-K182 PolarHBondContact O-N 3.48Å; K182-N185 PolarHBondContact O-N 3.04Å; K182-L186 WeakPolarHBondContact O-CG 3.41Å; K182-L186 PolarHBondContact O-N 2.7Å
183	R	66.6	Low	64	Low	135 Å²	135	119.3 Å²	119.3	51%	0.509	59%	0.585	S	S	.	*	H	α-helix	trans	-61.6	-47	170.4	-91.7	-174.1	179	164.6	1.9	112.6	T179 N185 L186 D187	T179-R183 PolarHBondContact O-N 2.95Å; R183-N185 VanDerWaalsContact C-N 3.31Å; R183-N185 PolarHBondContact O-N 3.23Å; R183-L186 PolarHBondContact O-N 3.18Å; R183-D187 WeakPolarHBondContact O-CB 3.31Å; R183-D187 PolarHBondContact O-N 3.05Å
184	K	74.7	Confident	65.5	Low	135 Å²	135	118.6 Å²	118.6	59%	0.587	58%	0.575	S	S	*	*	H	α-helix	trans	-59.5	-40.8	174.9	-99.6	-170.1	174.4	-173.2	0	112.3	R180 L181 S188	R180-K184 PolarHBondContact O-N 3.24Å; R180-K184 VanDerWaalsContact O-N 3.08Å; L181-K184 PolarHBondContact O-N 3.43Å; K184-S188 VanDerWaalsContact O-CB 3.31Å; K184-S188 WeakPolarHBondContact O-CB 3.33Å; K184-S188 PolarHBondContact O-N 2.77Å; K184-S188 PolarHBondContact O-OG 2.72Å
185	N	74.1	Confident	66.7	Low	120 Å²	120	113.9 Å²	113.9	64%	0.642	56%	0.562	S	S	*	*	H	α-helix	trans	-64.1	-45.3	178.1	-167.8	30	0	0	0	111.2	L181 K182 R183 S188 G189	L181-N185 PolarHBondContact O-N 2.97Å; K182-N185 PolarHBondContact O-N 3.04Å; R183-N185 VanDerWaalsContact C-N 3.31Å; R183-N185 PolarHBondContact O-N 3.23Å; N185-S188 PolarHBondContact O-N 3.45Å; N185-G189 PolarHBondContact O-N 2.95Å
186	L	66.3	Low	67.7	Low	86 Å²	86	111.7 Å²	111.7	45%	0.45	56%	0.555	S	S	.	*	H	α-helix	trans	-64.7	-42.7	176.4	-74.6	167	0	0	0	112.6	K182 R183 S188 G189 L190	K182-L186 WeakPolarHBondContact O-CG 3.41Å; K182-L186 PolarHBondContact O-N 2.7Å; R183-L186 PolarHBondContact O-N 3.18Å; L186-S188 VanDerWaalsContact C-N 3.29Å; L186-S188 PolarHBondContact O-N 3.16Å; L186-G189 PolarHBondContact O-N 3.4Å; L186-L190 WeakPolarHBondContact O-CB 3.45Å; L186-L190 PolarHBondContact O-N 3.41Å
187	D	73.9	Confident	68.8	Low	92 Å²	92	109 Å²	109	49%	0.492	54%	0.542	S	S	.	.	H	α-helix	trans	-62.3	-38.4	173.9	-92.5	-7.5	0	0	0	111.7	R183 L190 K191	R183-D187 WeakPolarHBondContact O-CB 3.31Å; R183-D187 PolarHBondContact O-N 3.05Å; D187-L190 PolarHBondContact O-N 3.18Å; D187-K191 WeakPolarHBondContact O-CB 3.46Å; D187-K191 WeakPolarHBondContact O-CG 3.5Å; D187-K191 PolarHBondContact O-N 2.97Å
188	S	78.1	Confident	70	Confident	69 Å²	69	104.1 Å²	104.1	48%	0.483	53%	0.531	S	S	.	.	H	α-helix	trans	-67.3	-41.6	175.5	-56	0	0	0	0	110.8	K184 N185 L186 K191 L192	K184-S188 VanDerWaalsContact O-CB 3.31Å; K184-S188 WeakPolarHBondContact O-CB 3.33Å; K184-S188 PolarHBondContact O-N 2.77Å; K184-S188 PolarHBondContact O-OG 2.72Å; N185-S188 PolarHBondContact O-N 3.45Å; L186-S188 VanDerWaalsContact C-N 3.29Å; L186-S188 PolarHBondContact O-N 3.16Å; S188-K191 PolarHBondContact O-N 3.39Å; S188-L192 WeakPolarHBondContact O-CB 3.36Å; S188-L192 PolarHBondContact O-N 3.08Å
189	G	74.4	Confident	70.7	Confident	30 Å²	30	105.9 Å²	105.9	31%	0.309	54%	0.54	S	S	.	.	H	α-helix	trans	-61.8	-42.6	172.8	0	0	0	0	0	112.4	N185 L186 L192 L193	N185-G189 PolarHBondContact O-N 2.95Å; L186-G189 PolarHBondContact O-N 3.4Å; G189-L192 WeakPolarHBondContact O-CB 3.17Å; G189-L192 PolarHBondContact O-N 3.32Å; G189-L193 WeakPolarHBondContact O-CB 3.28Å; G189-L193 VanDerWaalsContact O-CG 3.31Å; G189-L193 WeakPolarHBondContact O-CG 3.5Å; G189-L193 PolarHBondContact O-N 2.88Å
190	L	72.4	Confident	70.9	Confident	87 Å²	87	104.6 Å²	104.6	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-65.6	-41.9	175.4	-171.4	75.2	0	0	0	111.6	L186 D187 L192 L193 K194	L186-L190 WeakPolarHBondContact O-CB 3.45Å; L186-L190 PolarHBondContact O-N 3.41Å; D187-L190 PolarHBondContact O-N 3.18Å; L190-L192 VanDerWaalsContact C-N 3.34Å; L190-L193 PolarHBondContact O-N 2.87Å; L190-K194 WeakPolarHBondContact O-CB 3.24Å; L190-K194 WeakPolarHBondContact O-CG 3.47Å; L190-K194 PolarHBondContact O-N 2.83Å
191	K	75.6	Confident	70.8	Confident	159 Å²	159	99.4 Å²	99.4	69%	0.691	51%	0.514	S	S	*	.	H	α-helix	trans	-62.5	-41.9	173.7	-80.5	-178.3	-179.8	-178	0	111.5	D187 S188 K194 A195	D187-K191 WeakPolarHBondContact O-CB 3.46Å; D187-K191 WeakPolarHBondContact O-CG 3.5Å; D187-K191 PolarHBondContact O-N 2.97Å; S188-K191 PolarHBondContact O-N 3.39Å; K191-K194 PolarHBondContact O-N 2.93Å; K191-A195 VanDerWaalsContact O-CB 3.26Å; K191-A195 WeakPolarHBondContact O-CB 3.39Å; K191-A195 PolarHBondContact O-N 2.95Å
192	L	74.9	Confident	71.4	Confident	112 Å²	112	94 Å²	94	59%	0.586	49%	0.486	S	S	*	.	H	α-helix	trans	-61.6	-47.4	175.6	-171.5	81.7	0	0	0	110.6	S188 G189 L190 K194 A195 L196	S188-L192 WeakPolarHBondContact O-CB 3.36Å; S188-L192 PolarHBondContact O-N 3.08Å; G189-L192 WeakPolarHBondContact O-CB 3.17Å; G189-L192 PolarHBondContact O-N 3.32Å; L190-L192 VanDerWaalsContact C-N 3.34Å; L192-K194 PolarHBondContact O-N 2.66Å; L192-A195 PolarHBondContact O-N 2.75Å; L192-L196 HydrophobicContact CD2-CD1 4.47Å; L192-L196 HydrophobicContact CG-CD1 4.19Å; L192-L196 WeakPolarHBondContact O-CB 3.36Å; L192-L196 WeakPolarHBondContact O-CG 3.48Å; L192-L196 PolarHBondContact O-N 3.22Å
193	L	70.7	Confident	72.1	Confident	75 Å²	75	91.7 Å²	91.7	39%	0.393	48%	0.483	S	S	.	.	H	α-helix	trans	-62.3	-41.4	177.3	-72.7	169.3	0	0	0	112	G189 L190 L196 D197	G189-L193 WeakPolarHBondContact O-CB 3.28Å; G189-L193 VanDerWaalsContact O-CG 3.31Å; G189-L193 WeakPolarHBondContact O-CG 3.5Å; G189-L193 PolarHBondContact O-N 2.88Å; L190-L193 PolarHBondContact O-N 2.87Å; L193-L196 PolarHBondContact O-N 3.22Å; L193-D197 WeakPolarHBondContact O-CB 3.49Å; L193-D197 PolarHBondContact O-N 2.74Å
194	K	71.9	Confident	73.1	Confident	134 Å²	134	86 Å²	86	58%	0.583	47%	0.466	S	S	*	.	H	α-helix	trans	-65.9	-38.1	173.8	-75.7	-177.6	178	-175	0	112.6	L190 K191 L192 D197 S198	L190-K194 WeakPolarHBondContact O-CB 3.24Å; L190-K194 WeakPolarHBondContact O-CG 3.47Å; L190-K194 PolarHBondContact O-N 2.83Å; K191-K194 PolarHBondContact O-N 2.93Å; L192-K194 PolarHBondContact O-N 2.66Å; K194-D197 PolarHBondContact O-N 2.81Å; K194-S198 WeakPolarHBondContact O-CB 3.1Å; K194-S198 PolarHBondContact O-N 3.03Å; K194-S198 PolarHBondContact O-OG 3.49Å
195	A	72.7	Confident	74	Confident	49 Å²	49	81.5 Å²	81.5	41%	0.405	45%	0.451	S	S	.	.	H	α-helix	trans	-68.2	-41	176.7	0	0	0	0	0	111.1	K191 L192 S198 N199	K191-A195 VanDerWaalsContact O-CB 3.26Å; K191-A195 WeakPolarHBondContact O-CB 3.39Å; K191-A195 PolarHBondContact O-N 2.95Å; L192-A195 PolarHBondContact O-N 2.75Å; A195-S198 PolarHBondContact O-N 3.27Å; A195-S198 PolarHBondContact O-OG 3.47Å; A195-N199 PolarHBondContact O-N 2.76Å
196	L	68.3	Low	74.9	Confident	75 Å²	75	78.5 Å²	78.5	39%	0.393	44%	0.438	S	S	.	.	H	α-helix	trans	-60.4	-46.4	171	-74.7	167.5	0	0	0	110.3	L192 L193 S198 Y200	L192-L196 HydrophobicContact CD2-CD1 4.47Å; L192-L196 HydrophobicContact CG-CD1 4.19Å; L192-L196 WeakPolarHBondContact O-CB 3.36Å; L192-L196 WeakPolarHBondContact O-CG 3.48Å; L192-L196 PolarHBondContact O-N 3.22Å; L193-L196 PolarHBondContact O-N 3.22Å; L196-S198 VanDerWaalsContact C-N 3.35Å; L196-S198 PolarHBondContact O-N 3.27Å; L196-Y200 HydrophobicContact CD2-CD2 4.2Å; L196-Y200 WeakPolarHBondContact O-CA 3.2Å; L196-Y200 WeakPolarHBondContact O-CB 3.32Å; L196-Y200 PolarHBondContact O-N 2.68Å
197	D	67.4	Low	76.3	Confident	90 Å²	90	74.4 Å²	74.4	48%	0.481	42%	0.416	S	S	.	.	H	α-helix	trans	-62.7	-38.1	178.5	-171.1	44.5	0	0	0	113.1	L193 K194	L193-D197 WeakPolarHBondContact O-CB 3.49Å; L193-D197 PolarHBondContact O-N 2.74Å; K194-D197 PolarHBondContact O-N 2.81Å
198	S	68.9	Low	77.5	Confident	85 Å²	85	70.1 Å²	70.1	59%	0.594	39%	0.393	S	S	*	.	H	α-helix	trans	-85.1	-26.7	-177.1	46.4	0	0	0	0	115	K194 A195 L196	K194-S198 WeakPolarHBondContact O-CB 3.1Å; K194-S198 PolarHBondContact O-N 3.03Å; K194-S198 PolarHBondContact O-OG 3.49Å; A195-S198 PolarHBondContact O-N 3.27Å; A195-S198 PolarHBondContact O-OG 3.47Å; L196-S198 VanDerWaalsContact C-N 3.35Å; L196-S198 PolarHBondContact O-N 3.27Å
199	N	66.6	Low	78.4	Confident	131 Å²	131	66.8 Å²	66.8	70%	0.701	37%	0.37	S	S	*	.	S	Bend	trans	-134.7	38.5	-177.2	-67	-37.4	0	0	0	112.1	A195 D201	A195-N199 PolarHBondContact O-N 2.76Å; N199-D201 PolarHBondContact O-N 2.7Å
200	Y	66.6	Low	79.5	Confident	64 Å²	64	65.5 Å²	65.5	25%	0.251	36%	0.356	S	S	.	.			trans	-63.9	102.4	179	-163.5	-120	0	0	0	110.4	L161 I164 L196 D202	L161-Y200 HydrophobicContact CD1-CD1 4.42Å; L161-Y200 HydrophobicContact CD1-CD2 4.23Å; L161-Y200 HydrophobicContact CD1-CE2 4.45Å; L161-Y200 HydrophobicContact CD1-CG 4.23Å; I164-Y200 WeakPolarHBondContact CD1-OH 3.31Å; L196-Y200 HydrophobicContact CD2-CD2 4.2Å; L196-Y200 WeakPolarHBondContact O-CA 3.2Å; L196-Y200 WeakPolarHBondContact O-CB 3.32Å; L196-Y200 PolarHBondContact O-N 2.68Å; Y200-D202 HydrophobicContact CD1-CB 4.1Å; Y200-D202 HydrophobicContact CE1-CB 3.51Å
201	D	70	Confident	80.8	Confident	103 Å²	103	61.3 Å²	61.3	55%	0.551	33%	0.334	S	S	*	.			trans	-106.8	87.3	172.8	-175.8	31.2	0	0	0	109.5	N199 R854	N199-D201 PolarHBondContact O-N 2.7Å; D201-R854 IonicContact OD1-NH2 3.12Å; D201-R854 IonicContact OD2-CZ 2.87Å; D201-R854 IonicContact OD2-NH1 3.78Å; D201-R854 IonicContact OD2-NH2 3.84Å; D201-R854 PolarHBondContact OD2-NH2 2.81Å
202	D	79.3	Confident	81.8	Confident	29 Å²	29	53.8 Å²	53.8	16%	0.155	30%	0.301	C	S	.	.			trans	-85.4	118.3	172.5	176.1	25.5	0	0	0	110.1	Y145 Q157 L160 Y200 G204	Y145-D202 WeakPolarHBondContact CD2-O 3.49Å; Y145-D202 HydrophobicContact CE2-CB 4.23Å; Y145-D202 VanDerWaalsContact CE2-O 3.31Å; Y145-D202 WeakPolarHBondContact CE2-O 3.3Å; Y145-D202 VanDerWaalsContact CE2-OD2 3.25Å; Y145-D202 WeakPolarHBondContact CE2-OD2 3.47Å; Y145-D202 PolarHBondContact OH-OD2 3.05Å; Q157-D202 HydrophobicContact CG-CB 4.4Å; Q157-D202 PolarHBondContact NE2-O 3.34Å; L160-D202 VanDerWaalsContact CD2-OD2 3.26Å; L160-D202 WeakPolarHBondContact CD2-OD2 3.39Å; Y200-D202 HydrophobicContact CD1-CB 4.1Å; Y200-D202 HydrophobicContact CE1-CB 3.51Å; D202-G204 PolarHBondContact O-N 2.91Å; D202-G204 PolarHBondContact OD1-N 3.19Å
203	C	80.7	Confident	82.9	Confident	65 Å²	65	51.3 Å²	51.3	44%	0.439	29%	0.287	S	S	.	.			trans	-71.7	-14.2	176.5	-59.4	0	0	0	0	112.4	R854	C203-R854 PolarHBondContact SG-NH2 3.07Å
204	G	88.1	Confident	84.1	Confident	15 Å²	15	49.1 Å²	49.1	16%	0.155	28%	0.275	C	S	.	.			trans	75.8	174.7	-177.3	0	0	0	0	0	113.1	Y145 D202	Y145-G204 VanDerWaalsContact CE2-N 3.32Å; Y145-G204 VanDerWaalsContact CZ-CA 3.49Å; D202-G204 PolarHBondContact O-N 2.91Å; D202-G204 PolarHBondContact OD1-N 3.19Å
205	P	92.3	Very high	85.2	Confident	42 Å²	42	45 Å²	45	27%	0.273	27%	0.27	S	S	.	.			trans	-70.7	148.2	176.5	29.5	-32.3	0	0	0	110.7	I144 F226	I144-P205 HydrophobicContact CB-CG 4.06Å; I144-P205 HydrophobicContact CG1-CG 4.09Å; I144-P205 WeakPolarHBondContact CG1-O 3.5Å; I144-P205 PolarHBondContact N-O 3.03Å; P205-F226 HydrophobicContact CB-CD1 3.73Å; P205-F226 HydrophobicContact CB-CD2 4.22Å; P205-F226 HydrophobicContact CB-CE1 3.86Å; P205-F226 HydrophobicContact CB-CE2 4.32Å; P205-F226 HydrophobicContact CB-CG 3.91Å; P205-F226 HydrophobicContact CB-CZ 4.15Å; P205-F226 HydrophobicContact CG-CD1 4.34Å; P205-F226 HydrophobicContact CG-CE1 3.98Å; P205-F226 HydrophobicContact CG-CE2 4.15Å; P205-F226 HydrophobicContact CG-CZ 3.87Å
206	T	93.8	Very high	86.3	Confident	57 Å²	57	47.7 Å²	47.7	35%	0.35	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.7	171	-58.9	0	0	0	0	108.2	T120 R122 V141	T120-T206 HydrophobicContact CG2-CG2 3.89Å; R122-T206 PolarHBondContact NH1-O 2.89Å; R122-T206 VanDerWaalsContact NH1-O 3.09Å; R122-T206 PolarHBondContact NH2-O 3.35Å; V141-T206 HydrophobicContact CG2-CG2 3.18Å
207	A	96.6	Very high	87.6	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.4	-179.3	0	0	0	0	0	111.4	V141 K142 I144 L222 F226	V141-A207 WeakPolarHBondContact CA-O 3.42Å; V141-A207 WeakPolarHBondContact CG2-O 3.35Å; K142-A207 PolarHBondContact N-O 2.85Å; K142-A207 PolarHBondContact O-N 2.77Å; I144-A207 HydrophobicContact CD1-CB 3.74Å; I144-A207 HydrophobicContact CG1-CB 4.25Å; A207-L222 HydrophobicContact CB-CD1 3.53Å; A207-L222 HydrophobicContact CB-CG 4.16Å; A207-F226 HydrophobicContact CB-CD1 4.22Å; A207-F226 HydrophobicContact CB-CE1 4.04Å
208	D	97.9	Very high	89	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	141.6	164.1	-67	-81.9	0	0	0	109.4	G118 L119 T120 R122 L124 D223	G118-D208 VanDerWaalsContact C-OD1 3.31Å; G118-D208 VanDerWaalsContact CA-OD1 3.25Å; G118-D208 WeakPolarHBondContact CA-OD1 3.35Å; L119-D208 PolarHBondContact N-OD1 3.05Å; T120-D208 WeakPolarHBondContact CG2-OD2 2.97Å; T120-D208 PolarHBondContact N-OD1 3.26Å; T120-D208 PolarHBondContact OG1-OD1 2.94Å; T120-D208 PolarHBondContact OG1-OD2 3.5Å; R122-D208 IonicContact CZ-OD2 3.32Å; R122-D208 IonicContact NE-OD2 2.89Å; R122-D208 PolarHBondContact NE-OD2 2.9Å; R122-D208 IonicContact NH2-OD2 2.81Å; R122-D208 PolarHBondContact NH2-OD2 3.23Å; L124-D208 HydrophobicContact CD1-CB 3.85Å; L124-D208 HydrophobicContact CD2-CB 4.1Å; D208-D223 HydrophobicContact CB-CB 4.38Å; D208-D223 WeakPolarHBondContact O-CB 3.24Å; D208-D223 PolarHBondContact O-N 3.28Å
209	C	98	Very high	90.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.6	170.9	-58.5	0	0	0	0	107.9	V103 L139 G140 L222 L267	V103-C209 HydrophobicContact CG1-CB 4.3Å; L139-C209 WeakPolarHBondContact CA-O 3.32Å; G140-C209 PolarHBondContact N-O 2.92Å; G140-C209 PolarHBondContact O-N 2.95Å; C209-L222 VanDerWaalsContact SG-CD1 3.53Å; C209-L267 HydrophobicContact CB-CD2 3.74Å
210	I	97.7	Very high	91.9	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129.1	175.7	-169.1	165.5	0	0	0	109.5	I126 W130 Y137 Y138 L139 A220 C221 L230	I126-I210 HydrophobicContact CD1-CD1 3.59Å; W130-I210 HydrophobicContact CH2-CG2 3.99Å; W130-I210 HydrophobicContact CZ3-CD1 4.48Å; W130-I210 HydrophobicContact CZ3-CG2 3.88Å; Y137-I210 HydrophobicContact CD1-CD1 3.45Å; Y137-I210 VanDerWaalsContact CD1-CD1 3.45Å; Y137-I210 HydrophobicContact CD1-CG1 3.72Å; Y137-I210 HydrophobicContact CE1-CD1 4.12Å; Y137-I210 HydrophobicContact CG-CD1 3.86Å; Y137-I210 HydrophobicContact CG-CG1 4.23Å; Y138-I210 CarbonylContact O-C 3.53Å; Y138-I210 WeakPolarHBondContact O-CA 3.32Å; L139-I210 HydrophobicContact CD2-CB 4.21Å; L139-I210 HydrophobicContact CD2-CD1 4.16Å; L139-I210 HydrophobicContact CD2-CG1 3.88Å; I210-A220 CarbonylContact O-C 3.48Å; I210-A220 VanDerWaalsContact O-CA 3.23Å; I210-A220 WeakPolarHBondContact O-CA 3.48Å; I210-C221 HydrophobicContact CG2-CB 3.68Å; I210-C221 PolarHBondContact N-O 2.83Å; I210-C221 PolarHBondContact O-N 2.8Å; I210-L230 HydrophobicContact CD1-CD1 4.47Å; I210-L230 HydrophobicContact CG2-CD1 4.17Å
211	V	98.3	Very high	93.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	138.5	-178.9	-177.7	0	0	0	0	108.9	T105 Y138 W218 V219 A220 I260 L267	T105-V211 HydrophobicContact CG2-CG2 3.94Å; Y138-V211 WeakPolarHBondContact CB-O 3.28Å; Y138-V211 PolarHBondContact N-O 3.19Å; Y138-V211 PolarHBondContact O-N 2.79Å; V211-W218 HydrophobicContact CG1-CE3 3.95Å; V211-W218 HydrophobicContact CG1-CZ3 4.41Å; V211-V219 WeakPolarHBondContact CA-O 3.25Å; V211-A220 HydrophobicContact CG2-CB 3.84Å; V211-I260 HydrophobicContact CG1-CD1 4.43Å; V211-I260 HydrophobicContact CG1-CG2 3.85Å; V211-L267 HydrophobicContact CG2-CB 4.12Å; V211-L267 HydrophobicContact CG2-CD1 4.28Å; V211-L267 HydrophobicContact CG2-CD2 4.11Å; V211-L267 HydrophobicContact CG2-CG 4.41Å
212	F	97.6	Very high	94.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	169.4	174.8	60.3	-83.1	0	0	0	110.6	W130 K131 N132 Y137 D214 V219 L235	W130-F212 HydrophobicContact CB-CZ 4.08Å; W130-F212 HydrophobicContact CD2-CE1 4.13Å; W130-F212 AromaticContact CD2-CZ 3.86Å; W130-F212 HydrophobicContact CD2-CZ 3.86Å; W130-F212 HydrophobicContact CE3-CD1 4.49Å; W130-F212 AromaticContact CE3-CE1 3.37Å; W130-F212 HydrophobicContact CE3-CE1 3.37Å; W130-F212 AromaticContact CE3-CZ 3.52Å; W130-F212 HydrophobicContact CE3-CZ 3.52Å; W130-F212 HydrophobicContact CG-CZ 4.13Å; W130-F212 AromaticContact CZ3-CE1 3.63Å; W130-F212 HydrophobicContact CZ3-CE1 3.63Å; W130-F212 HydrophobicContact CZ3-CZ 4.22Å; K131-F212 VanDerWaalsContact O-CE2 3.27Å; K131-F212 WeakPolarHBondContact O-CE2 3.39Å; N132-F212 HydrophobicContact CB-CD2 3.64Å; N132-F212 HydrophobicContact CB-CE2 4.09Å; N132-F212 HydrophobicContact CB-CG 4.33Å; N132-F212 WeakPolarHBondContact ND2-CB 3.45Å; Y137-F212 HydrophobicContact CD1-CB 3.94Å; Y137-F212 AromaticContact CD1-CD1 3.7Å; Y137-F212 HydrophobicContact CD1-CD1 3.7Å; Y137-F212 HydrophobicContact CD1-CE1 4.47Å; Y137-F212 AromaticContact CD1-CG 3.97Å; Y137-F212 HydrophobicContact CD1-CG 3.97Å; Y137-F212 HydrophobicContact CE1-CB 4.26Å; Y137-F212 AromaticContact CE1-CD1 3.7Å; Y137-F212 HydrophobicContact CE1-CD1 3.7Å; Y137-F212 HydrophobicContact CE1-CD2 4.47Å; Y137-F212 HydrophobicContact CE1-CE1 4.12Å; Y137-F212 AromaticContact CE1-CG 3.89Å; Y137-F212 HydrophobicContact CE1-CG 3.89Å; F212-D214 HydrophobicContact CE2-CB 4.39Å; F212-V219 HydrophobicContact CD1-CG2 4.23Å; F212-V219 HydrophobicContact CD2-CG2 3.81Å; F212-V219 HydrophobicContact CE1-CG2 3.94Å; F212-V219 HydrophobicContact CE2-CG2 3.48Å; F212-V219 VanDerWaalsContact CE2-CG2 3.48Å; F212-V219 HydrophobicContact CG-CG2 4.18Å; F212-V219 HydrophobicContact CZ-CG2 3.56Å; F212-V219 PolarHBondContact N-O 2.96Å; F212-V219 WeakPolarHBondContact O-CG2 3.35Å; F212-V219 PolarHBondContact O-N 3.14Å; F212-L235 HydrophobicContact CE1-CD1 3.65Å; F212-L235 HydrophobicContact CZ-CD1 3.72Å; F212-L235 HydrophobicContact CZ-CD2 3.85Å; F212-L235 HydrophobicContact CZ-CG 4.45Å
213	H	97.3	Very high	95.6	Very high	61 Å²	61	24.9 Å²	24.9	28%	0.282	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123.4	175.4	-165.7	-89.7	0	0	0	110.1	P133 G215 W218	P133-H213 WeakPolarHBondContact CD-O 3.48Å; H213-G215 VanDerWaalsContact CE1-C 3.41Å; H213-G215 WeakPolarHBondContact ND1-CA 3.29Å; H213-G215 PolarHBondContact ND1-N 2.84Å; H213-G215 VanDerWaalsContact ND1-N 3.18Å; H213-G215 PolarHBondContact O-N 2.83Å; H213-W218 HydrophobicContact CB-CD2 4.2Å; H213-W218 HydrophobicContact CB-CE3 4.18Å; H213-W218 HydrophobicContact CB-CH2 4.4Å; H213-W218 HydrophobicContact CB-CZ2 4.39Å; H213-W218 HydrophobicContact CB-CZ3 4.3Å; H213-W218 AromaticContact CD2-CD1 3.71Å; H213-W218 AromaticContact CD2-CD2 3.96Å; H213-W218 AromaticContact CD2-CE2 3.84Å; H213-W218 AromaticContact CD2-CG 3.88Å; H213-W218 AromaticContact CD2-NE1 3.67Å
214	D	96.1	Very high	96.3	Very high	28 Å²	28	23.1 Å²	23.1	15%	0.15	14%	0.141	C	C	.	.			trans	-81.6	0.6	-175.4	74.9	4.4	0	0	0	114.5	K131 F212 T216 N217 V219 R242	K131-D214 VanDerWaalsContact O-CA 3.23Å; K131-D214 WeakPolarHBondContact O-CA 3.22Å; F212-D214 HydrophobicContact CE2-CB 4.39Å; D214-T216 WeakPolarHBondContact OD1-CA 3.32Å; D214-T216 WeakPolarHBondContact OD1-CB 3.49Å; D214-T216 PolarHBondContact OD1-N 2.74Å; D214-N217 PolarHBondContact N-O 2.83Å; D214-N217 PolarHBondContact OD1-N 3.01Å; D214-N217 VanDerWaalsContact OD1-O 3.13Å; D214-V219 HydrophobicContact CB-CG1 4.31Å; D214-V219 HydrophobicContact CB-CG2 4Å; D214-R242 IonicContact OD2-CZ 3.79Å; D214-R242 IonicContact OD2-NH1 3.91Å; D214-R242 IonicContact OD2-NH2 2.81Å; D214-R242 PolarHBondContact OD2-NH2 3.29Å
215	G	94.8	Very high	96.6	Very high	47 Å²	47	24.3 Å²	24.3	49%	0.485	15%	0.147	S	C	.	.	S	Bend	trans	101.1	-19.8	-172.6	0	0	0	0	0	112.9	H213	H213-G215 VanDerWaalsContact CE1-C 3.41Å; H213-G215 WeakPolarHBondContact ND1-CA 3.29Å; H213-G215 PolarHBondContact ND1-N 2.84Å; H213-G215 VanDerWaalsContact ND1-N 3.18Å; H213-G215 PolarHBondContact O-N 2.83Å
216	T	95.3	Very high	96.7	Very high	107 Å²	107	24.9 Å²	24.9	66%	0.656	15%	0.146	S	C	*	.	S	Bend	trans	-118.1	-46.9	176.6	-44.3	0	0	0	0	111.7	D214	D214-T216 WeakPolarHBondContact OD1-CA 3.32Å; D214-T216 WeakPolarHBondContact OD1-CB 3.49Å; D214-T216 PolarHBondContact OD1-N 2.74Å
217	N	96.4	Very high	96.7	Very high	38 Å²	38	26.4 Å²	26.4	20%	0.203	16%	0.158	C	C	.	.	S	Bend	trans	-136.6	158.4	-177.8	-59.4	-76.9	0	0	0	110.9	D214	D214-N217 PolarHBondContact N-O 2.83Å; D214-N217 PolarHBondContact OD1-N 3.01Å; D214-N217 VanDerWaalsContact OD1-O 3.13Å
218	W	97.5	Very high	96.5	Very high	59 Å²	59	26.6 Å²	26.6	22%	0.223	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	134.3	159.8	-71.3	97.1	0	0	0	110.1	Y138 V211 H213 I260 N263	Y138-W218 HydrophobicContact CD2-CH2 4.25Å; Y138-W218 AromaticContact CD2-CZ3 3.82Å; Y138-W218 HydrophobicContact CD2-CZ3 3.82Å; Y138-W218 AromaticContact CE2-CH2 3.65Å; Y138-W218 HydrophobicContact CE2-CH2 3.65Å; Y138-W218 AromaticContact CE2-CZ3 3.69Å; Y138-W218 HydrophobicContact CE2-CZ3 3.69Å; Y138-W218 AromaticContact CZ-CH2 3.93Å; V211-W218 HydrophobicContact CG1-CE3 3.95Å; V211-W218 HydrophobicContact CG1-CZ3 4.41Å; H213-W218 HydrophobicContact CB-CD2 4.2Å; H213-W218 HydrophobicContact CB-CE3 4.18Å; H213-W218 HydrophobicContact CB-CH2 4.4Å; H213-W218 HydrophobicContact CB-CZ2 4.39Å; H213-W218 HydrophobicContact CB-CZ3 4.3Å; H213-W218 AromaticContact CD2-CD1 3.71Å; H213-W218 AromaticContact CD2-CD2 3.96Å; H213-W218 AromaticContact CD2-CE2 3.84Å; H213-W218 AromaticContact CD2-CG 3.88Å; H213-W218 AromaticContact CD2-NE1 3.67Å; W218-I260 VanDerWaalsContact C-CD1 3.48Å; W218-I260 HydrophobicContact CB-CB 4.17Å; W218-I260 HydrophobicContact CB-CD1 3.93Å; W218-I260 HydrophobicContact CB-CG2 3.8Å; W218-I260 HydrophobicContact CG-CG2 4.26Å; W218-I260 WeakPolarHBondContact O-CD1 3.4Å; W218-N263 WeakPolarHBondContact CH2-O 3.46Å; W218-N263 HydrophobicContact CZ2-CB 4.06Å; W218-N263 WeakPolarHBondContact CZ2-O 3.28Å
219	V	98.1	Very high	96.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	150.7	179.3	-66.7	0	0	0	0	110.2	V211 F212 D214 L235 M236 A237	V211-V219 WeakPolarHBondContact CA-O 3.25Å; F212-V219 HydrophobicContact CD1-CG2 4.23Å; F212-V219 HydrophobicContact CD2-CG2 3.81Å; F212-V219 HydrophobicContact CE1-CG2 3.94Å; F212-V219 HydrophobicContact CE2-CG2 3.48Å; F212-V219 VanDerWaalsContact CE2-CG2 3.48Å; F212-V219 HydrophobicContact CG-CG2 4.18Å; F212-V219 HydrophobicContact CZ-CG2 3.56Å; F212-V219 PolarHBondContact N-O 2.96Å; F212-V219 WeakPolarHBondContact O-CG2 3.35Å; F212-V219 PolarHBondContact O-N 3.14Å; D214-V219 HydrophobicContact CB-CG1 4.31Å; D214-V219 HydrophobicContact CB-CG2 4Å; V219-L235 HydrophobicContact CB-CD1 4.02Å; V219-L235 HydrophobicContact CB-CD2 4.48Å; V219-L235 HydrophobicContact CB-CG 4.11Å; V219-L235 HydrophobicContact CG2-CD1 3.91Å; V219-L235 HydrophobicContact CG2-CD2 4.18Å; V219-L235 HydrophobicContact CG2-CG 4.22Å; V219-M236 CarbonylContact C-O 3.58Å; V219-M236 VanDerWaalsContact CA-O 3.32Å; V219-M236 WeakPolarHBondContact CA-O 3.31Å; V219-A237 HydrophobicContact CG1-CB 4.29Å
220	A	98.2	Very high	96.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	151.9	-178.3	0	0	0	0	0	111.2	I210 V211 M236 F258 I260 L267	I210-A220 CarbonylContact O-C 3.48Å; I210-A220 VanDerWaalsContact O-CA 3.23Å; I210-A220 WeakPolarHBondContact O-CA 3.48Å; V211-A220 HydrophobicContact CG2-CB 3.84Å; A220-M236 PolarHBondContact N-O 3.35Å; A220-M236 PolarHBondContact O-N 3.39Å; A220-F258 HydrophobicContact CB-CD2 3.67Å; A220-F258 HydrophobicContact CB-CE2 3.81Å; A220-F258 HydrophobicContact CB-CG 4.16Å; A220-F258 HydrophobicContact CB-CZ 4.38Å; A220-F258 WeakPolarHBondContact O-CE2 3.37Å; A220-I260 HydrophobicContact CB-CD1 3.84Å; A220-I260 HydrophobicContact CB-CG1 4.21Å; A220-L267 HydrophobicContact CB-CD1 3.54Å; A220-L267 HydrophobicContact CB-CD2 4.24Å
221	C	97.8	Very high	96	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	132.3	172	179.7	0	0	0	0	109.2	W130 I210 C233 L235	W130-C221 HydrophobicContact CH2-CB 3.49Å; W130-C221 VanDerWaalsContact CH2-CB 3.49Å; W130-C221 HydrophobicContact CZ2-CB 3.98Å; W130-C221 HydrophobicContact CZ3-CB 4.43Å; I210-C221 HydrophobicContact CG2-CB 3.68Å; I210-C221 PolarHBondContact N-O 2.83Å; I210-C221 PolarHBondContact O-N 2.8Å; C221-C233 WeakPolarHBondContact SG-CB 3.39Å; C221-L235 HydrophobicContact CB-CD1 3.99Å
222	L	97.7	Very high	95.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.2	170.4	-179.8	68.2	0	0	0	107.9	I144 A207 C209 T224 Y256 F258 I269	I144-L222 HydrophobicContact CD1-CD1 4.46Å; I144-L222 HydrophobicContact CD1-CD2 4.22Å; A207-L222 HydrophobicContact CB-CD1 3.53Å; A207-L222 HydrophobicContact CB-CG 4.16Å; C209-L222 VanDerWaalsContact SG-CD1 3.53Å; L222-T224 VanDerWaalsContact C-N 3.27Å; L222-T224 HydrophobicContact CD2-CG2 4.16Å; L222-T224 HydrophobicContact CG-CG2 4.24Å; L222-T224 PolarHBondContact O-N 3.42Å; L222-Y256 HydrophobicContact CB-CE2 4.16Å; L222-Y256 HydrophobicContact CD2-CD2 4.48Å; L222-Y256 HydrophobicContact CD2-CE1 4.46Å; L222-Y256 HydrophobicContact CD2-CE2 4.21Å; L222-F258 HydrophobicContact CB-CE1 4.43Å; L222-F258 HydrophobicContact CB-CZ 3.85Å; L222-I269 HydrophobicContact CD1-CD1 4.07Å
223	D	97.3	Very high	95.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	24%	0.239	C	C	.	.			trans	-70.7	81.7	175.6	179.8	20.2	0	0	0	110.8	R122 D208 S225 F226 G228 L230	R122-D223 IonicContact NE-OD2 2.75Å; D208-D223 HydrophobicContact CB-CB 4.38Å; D208-D223 WeakPolarHBondContact O-CB 3.24Å; D208-D223 PolarHBondContact O-N 3.28Å; D223-S225 PolarHBondContact O-N 3.36Å; D223-S225 WeakPolarHBondContact OD1-CB 3.44Å; D223-S225 PolarHBondContact OD1-N 3.13Å; D223-S225 PolarHBondContact OD1-OG 3.43Å; D223-F226 WeakPolarHBondContact O-CD1 3.32Å; D223-F226 PolarHBondContact O-N 3.23Å; D223-F226 PolarHBondContact OD1-N 2.84Å; D223-G228 PolarHBondContact OD2-N 3.03Å; D223-G228 VanDerWaalsContact OD2-N 3.12Å; D223-L230 HydrophobicContact CB-CD2 3.92Å
224	T	95.5	Very high	95.4	Very high	28 Å²	28	39 Å²	39	17%	0.172	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-8.8	175.5	56.9	0	0	0	0	112.9	L222 F226 C233 I248 Y256	L222-T224 VanDerWaalsContact C-N 3.27Å; L222-T224 HydrophobicContact CD2-CG2 4.16Å; L222-T224 HydrophobicContact CG-CG2 4.24Å; L222-T224 PolarHBondContact O-N 3.42Å; T224-F226 VanDerWaalsContact C-N 3.31Å; T224-F226 WeakPolarHBondContact O-CD2 3.34Å; T224-F226 WeakPolarHBondContact O-CE2 3.34Å; T224-C233 PolarHBondContact N-SG 3.11Å; T224-C233 PolarHBondContact OG1-SG 2.91Å; T224-I248 WeakPolarHBondContact CB-O 3.25Å; T224-Y256 HydrophobicContact CG2-CE1 4.28Å
225	S	94.1	Very high	95.5	Very high	41 Å²	41	39.6 Å²	39.6	29%	0.287	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-26.1	171.3	82.9	0	0	0	0	112	D223 C227 G228 E229	D223-S225 PolarHBondContact O-N 3.36Å; D223-S225 WeakPolarHBondContact OD1-CB 3.44Å; D223-S225 PolarHBondContact OD1-N 3.13Å; D223-S225 PolarHBondContact OD1-OG 3.43Å; S225-C227 PolarHBondContact O-N 3.3Å; S225-C227 PolarHBondContact OG-N 3.45Å; S225-C227 PolarHBondContact OG-SG 3.2Å; S225-G228 PolarHBondContact OG-N 3.04Å; S225-E229 PolarHBondContact OG-N 2.91Å; S225-E229 VanDerWaalsContact OG-N 3.14Å
226	F	94	Very high	95.6	Very high	54 Å²	54	37.3 Å²	37.3	24%	0.237	23%	0.225	C	C	.	.	S	Bend	trans	57.4	10.6	-172.9	-46	-63.9	0	0	0	114.7	R122 I144 P205 A207 D223 T224 I248 T249	R122-F226 WeakPolarHBondContact CD-O 3.41Å; R122-F226 PolarHBondContact NH1-O 3.47Å; I144-F226 HydrophobicContact CD1-CE1 4.15Å; I144-F226 HydrophobicContact CG1-CE1 3.6Å; I144-F226 HydrophobicContact CG1-CZ 4.03Å; P205-F226 HydrophobicContact CB-CD1 3.73Å; P205-F226 HydrophobicContact CB-CD2 4.22Å; P205-F226 HydrophobicContact CB-CE1 3.86Å; P205-F226 HydrophobicContact CB-CE2 4.32Å; P205-F226 HydrophobicContact CB-CG 3.91Å; P205-F226 HydrophobicContact CB-CZ 4.15Å; P205-F226 HydrophobicContact CG-CD1 4.34Å; P205-F226 HydrophobicContact CG-CE1 3.98Å; P205-F226 HydrophobicContact CG-CE2 4.15Å; P205-F226 HydrophobicContact CG-CZ 3.87Å; A207-F226 HydrophobicContact CB-CD1 4.22Å; A207-F226 HydrophobicContact CB-CE1 4.04Å; D223-F226 WeakPolarHBondContact O-CD1 3.32Å; D223-F226 PolarHBondContact O-N 3.23Å; D223-F226 PolarHBondContact OD1-N 2.84Å; T224-F226 VanDerWaalsContact C-N 3.31Å; T224-F226 WeakPolarHBondContact O-CD2 3.34Å; T224-F226 WeakPolarHBondContact O-CE2 3.34Å; F226-I248 HydrophobicContact CZ-CG2 4.38Å; F226-T249 HydrophobicContact CE2-CG2 4.1Å
227	C	94.2	Very high	95.7	Very high	89 Å²	89	32.2 Å²	32.2	60%	0.601	19%	0.194	S	C	*	.	S	Bend	trans	-126.5	3.2	-179.5	66.3	0	0	0	0	113.4	S225	S225-C227 PolarHBondContact O-N 3.3Å; S225-C227 PolarHBondContact OG-N 3.45Å; S225-C227 PolarHBondContact OG-SG 3.2Å
228	G	93.4	Very high	95.7	Very high	3 Å²	3	31.2 Å²	31.2	3%	0.031	19%	0.189	C	C	.	.	S	Bend	trans	85.9	11.6	178.2	0	0	0	0	0	115.7	L124 R125 D223 S225 L230	L124-G228 WeakPolarHBondContact CA-O 3.3Å; R125-G228 PolarHBondContact N-O 3.06Å; D223-G228 PolarHBondContact OD2-N 3.03Å; D223-G228 VanDerWaalsContact OD2-N 3.12Å; S225-G228 PolarHBondContact OG-N 3.04Å; G228-L230 PolarHBondContact O-N 3.31Å
229	E	94.7	Very high	95.7	Very high	65 Å²	65	28.6 Å²	28.6	30%	0.304	18%	0.18	S	C	.	.	B	Isolated β-bridge	trans	-92.8	87.8	175.8	-173.3	56	-113.9	0	0	110.3	R125 S225 S231	R125-E229 IonicContact NH1-OE2 3.49Å; S225-E229 PolarHBondContact OG-N 2.91Å; S225-E229 VanDerWaalsContact OG-N 3.14Å; E229-S231 VanDerWaalsContact C-N 3.25Å; E229-S231 PolarHBondContact O-N 2.8Å; E229-S231 WeakPolarHBondContact OE1-CB 3.32Å; E229-S231 PolarHBondContact OE1-OG 2.85Å
230	L	95.4	Very high	95.6	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-74.6	-11.7	-173.9	-57.8	180	0	0	0	113.8	L124 R125 I126 P127 W130 I210 D223 G228 G232 C233	L124-L230 HydrophobicContact CB-CD1 4.04Å; L124-L230 HydrophobicContact CB-CG 4.43Å; R125-L230 WeakPolarHBondContact O-CB 3.42Å; I126-L230 HydrophobicContact CD1-CD1 4.03Å; P127-L230 HydrophobicContact CG-CB 4.15Å; W130-L230 HydrophobicContact CH2-CB 3.99Å; W130-L230 HydrophobicContact CH2-CD1 3.75Å; W130-L230 HydrophobicContact CH2-CG 4.43Å; W130-L230 HydrophobicContact CZ2-CB 4.25Å; W130-L230 HydrophobicContact CZ3-CD1 3.92Å; I210-L230 HydrophobicContact CD1-CD1 4.47Å; I210-L230 HydrophobicContact CG2-CD1 4.17Å; D223-L230 HydrophobicContact CB-CD2 3.92Å; G228-L230 PolarHBondContact O-N 3.31Å; L230-G232 PolarHBondContact O-N 2.9Å; L230-C233 WeakPolarHBondContact O-CB 3.44Å; L230-C233 PolarHBondContact O-N 2.9Å
231	S	92.9	Very high	95.5	Very high	82 Å²	82	39.2 Å²	39.2	57%	0.573	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-64	-28.5	179.3	60.6	0	0	0	0	113.5	E229	E229-S231 VanDerWaalsContact C-N 3.25Å; E229-S231 PolarHBondContact O-N 2.8Å; E229-S231 WeakPolarHBondContact OE1-CB 3.32Å; E229-S231 PolarHBondContact OE1-OG 2.85Å
232	G	89.4	Confident	95.4	Very high	71 Å²	71	43.3 Å²	43.3	73%	0.732	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-86.8	-4.2	173.3	0	0	0	0	0	114.2	L230	L230-G232 PolarHBondContact O-N 2.9Å
233	C	95.1	Very high	95.2	Very high	12 Å²	12	45.9 Å²	45.9	8%	0.081	25%	0.254	C	S	.	.	S	Bend	trans	-96.6	145.7	-178.9	-56.7	0	0	0	0	110.1	C221 T224 L230	C221-C233 WeakPolarHBondContact SG-CB 3.39Å; T224-C233 PolarHBondContact N-SG 3.11Å; T224-C233 PolarHBondContact OG1-SG 2.91Å; L230-C233 WeakPolarHBondContact O-CB 3.44Å; L230-C233 PolarHBondContact O-N 2.9Å
234	K	95.8	Very high	95.2	Very high	94 Å²	94	48.2 Å²	48.2	41%	0.409	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-85.1	121.9	-178.9	-165.3	177.2	177.6	-178.7	0	110.5	M236 Y245 A246	K234-M236 HydrophobicContact CB-CG 4.34Å; K234-M236 HydrophobicContact CD-CG 3.94Å; K234-M236 HydrophobicContact CD-SD 3.81Å; K234-M236 HydrophobicContact CG-CG 3.76Å; K234-M236 HydrophobicContact CG-SD 4.2Å; K234-Y245 PolarHBondContact NZ-O 2.89Å; K234-A246 HydrophobicContact CB-CB 4.16Å; K234-A246 HydrophobicContact CD-CB 4.01Å
235	L	97.1	Very high	95.3	Very high	39 Å²	39	49.8 Å²	49.8	20%	0.204	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-80.7	125	168.9	-174.4	71.9	0	0	0	108.9	W130 F212 V219 C221	W130-L235 HydrophobicContact CD2-CD1 4.31Å; W130-L235 HydrophobicContact CD2-CD2 4.13Å; W130-L235 HydrophobicContact CE3-CD1 4.46Å; W130-L235 HydrophobicContact CG-CD2 4.08Å; W130-L235 HydrophobicContact CH2-CD1 4.11Å; W130-L235 HydrophobicContact CZ2-CB 4.09Å; W130-L235 HydrophobicContact CZ2-CD1 3.95Å; W130-L235 HydrophobicContact CZ2-CG 4.46Å; W130-L235 HydrophobicContact CZ3-CD1 4.36Å; F212-L235 HydrophobicContact CE1-CD1 3.65Å; F212-L235 HydrophobicContact CZ-CD1 3.72Å; F212-L235 HydrophobicContact CZ-CD2 3.85Å; F212-L235 HydrophobicContact CZ-CG 4.45Å; V219-L235 HydrophobicContact CB-CD1 4.02Å; V219-L235 HydrophobicContact CB-CD2 4.48Å; V219-L235 HydrophobicContact CB-CG 4.11Å; V219-L235 HydrophobicContact CG2-CD1 3.91Å; V219-L235 HydrophobicContact CG2-CD2 4.18Å; V219-L235 HydrophobicContact CG2-CG 4.22Å; C221-L235 HydrophobicContact CB-CD1 3.99Å
236	M	97.5	Very high	95.4	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	149.1	-175.2	-60.2	-174.7	-65.5	0	0	111.7	V219 A220 K234 E244 A246 Y256 F258	V219-M236 CarbonylContact C-O 3.58Å; V219-M236 VanDerWaalsContact CA-O 3.32Å; V219-M236 WeakPolarHBondContact CA-O 3.31Å; A220-M236 PolarHBondContact N-O 3.35Å; A220-M236 PolarHBondContact O-N 3.39Å; K234-M236 HydrophobicContact CB-CG 4.34Å; K234-M236 HydrophobicContact CD-CG 3.94Å; K234-M236 HydrophobicContact CD-SD 3.81Å; K234-M236 HydrophobicContact CG-CG 3.76Å; K234-M236 HydrophobicContact CG-SD 4.2Å; M236-E244 WeakPolarHBondContact CA-OE2 3.29Å; M236-E244 HydrophobicContact CB-CB 4.17Å; M236-E244 HydrophobicContact CG-CB 3.98Å; M236-E244 HydrophobicContact SD-CB 4.01Å; M236-A246 HydrophobicContact CE-CB 3.89Å; M236-A246 HydrophobicContact SD-CB 3.94Å; M236-Y256 HydrophobicContact CE-CD2 3.87Å; M236-Y256 HydrophobicContact CE-CE2 3.27Å; M236-F258 HydrophobicContact CB-CD2 3.97Å; M236-F258 HydrophobicContact CB-CE2 4.33Å; M236-F258 HydrophobicContact CE-CD2 3.81Å; M236-F258 HydrophobicContact CE-CE2 3.6Å; M236-F258 HydrophobicContact CE-CZ 4.27Å
237	A	97.6	Very high	95.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-176.4	167.9	0	0	0	0	0	111	V219 Y239 I241 R242 E244	V219-A237 HydrophobicContact CG1-CB 4.29Å; A237-Y239 PolarHBondContact O-N 2.75Å; A237-I241 HydrophobicContact CB-CB 4.38Å; A237-R242 HydrophobicContact CB-CB 4.44Å; A237-R242 HydrophobicContact CB-CG 3.89Å; A237-E244 PolarHBondContact N-OE2 2.88Å
238	S	97.2	Very high	95.5	Very high	16 Å²	16	44.1 Å²	44.1	11%	0.112	24%	0.235	C	C	.	.			trans	-57.8	139.1	166.2	-60.6	0	0	0	0	110	R240 I241 F258 I260	S238-R240 VanDerWaalsContact C-N 3.28Å; S238-R240 PolarHBondContact O-N 3.06Å; S238-I241 WeakPolarHBondContact O-CB 3.44Å; S238-I241 PolarHBondContact O-N 3.11Å; S238-F258 CarbonylContact C-O 3.53Å; S238-F258 VanDerWaalsContact CA-O 3.23Å; S238-F258 WeakPolarHBondContact CA-O 3.48Å; S238-I260 PolarHBondContact OG-N 3.18Å
239	Y	97.5	Very high	95.5	Very high	5 Å²	5	45.9 Å²	45.9	2%	0.02	25%	0.245	C	C	.	.	H	α-helix	trans	-54.3	-45	-171.3	-176.1	-87.6	0	0	0	111.7	P76 V91 I94 A237 I241 R242 N243 E244 Y245 F258	P76-Y239 HydrophobicContact CB-CE2 4.33Å; P76-Y239 WeakPolarHBondContact CB-OH 3.46Å; P76-Y239 HydrophobicContact CG-CE2 4.21Å; V91-Y239 HydrophobicContact CG1-CE1 4.18Å; V91-Y239 WeakPolarHBondContact O-CE1 3.28Å; V91-Y239 PolarHBondContact O-OH 3.03Å; I94-Y239 HydrophobicContact CB-CD1 4.34Å; I94-Y239 HydrophobicContact CB-CG 4.41Å; I94-Y239 HydrophobicContact CD1-CD1 4.3Å; I94-Y239 HydrophobicContact CD1-CD2 3.99Å; I94-Y239 HydrophobicContact CD1-CE1 3.97Å; I94-Y239 HydrophobicContact CD1-CE2 3.64Å; I94-Y239 HydrophobicContact CD1-CG 4.3Å; I94-Y239 HydrophobicContact CG1-CD1 3.98Å; I94-Y239 HydrophobicContact CG1-CD2 4.47Å; I94-Y239 HydrophobicContact CG1-CE1 3.82Å; I94-Y239 HydrophobicContact CG1-CE2 4.34Å; I94-Y239 HydrophobicContact CG1-CG 4.29Å; A237-Y239 PolarHBondContact O-N 2.75Å; Y239-I241 PolarHBondContact O-N 3.19Å; Y239-R242 PolarHBondContact O-N 2.58Å; Y239-N243 WeakPolarHBondContact O-CA 3.46Å; Y239-N243 PolarHBondContact O-N 3.42Å; Y239-E244 WeakPolarHBondContact CD2-O 3.39Å; Y239-Y245 HydrophobicContact CE2-CD1 4.17Å; Y239-F258 PolarHBondContact N-O 3.2Å
240	R	95.2	Very high	95.3	Very high	137 Å²	137	50.8 Å²	50.8	52%	0.517	27%	0.268	S	S	.	.	H	α-helix	trans	-53.8	-25.7	176.8	-170.6	175.7	170.8	-153.2	-6.5	115.2	S238	S238-R240 VanDerWaalsContact C-N 3.28Å; S238-R240 PolarHBondContact O-N 3.06Å
241	I	95.6	Very high	95	Very high	85 Å²	85	53.5 Å²	53.5	44%	0.436	29%	0.285	S	S	.	.	H	α-helix	trans	-86.3	-42.9	-175.4	-57.4	177.5	0	0	0	111.4	A237 S238 Y239	A237-I241 HydrophobicContact CB-CB 4.38Å; S238-I241 WeakPolarHBondContact O-CB 3.44Å; S238-I241 PolarHBondContact O-N 3.11Å; Y239-I241 PolarHBondContact O-N 3.19Å
242	R	95.3	Very high	95	Very high	87 Å²	87	49.6 Å²	49.6	33%	0.328	26%	0.257	S	S	.	.	H	α-helix	trans	-123.2	-4	-172.3	-64.9	-172.2	-179.4	162.3	3.1	115	D214 A237 Y239 E244	D214-R242 IonicContact OD2-CZ 3.79Å; D214-R242 IonicContact OD2-NH1 3.91Å; D214-R242 IonicContact OD2-NH2 2.81Å; D214-R242 PolarHBondContact OD2-NH2 3.29Å; A237-R242 HydrophobicContact CB-CB 4.44Å; A237-R242 HydrophobicContact CB-CG 3.89Å; Y239-R242 PolarHBondContact O-N 2.58Å; R242-E244 HydrophobicContact CB-CB 4.39Å; R242-E244 VanDerWaalsContact CB-CD 3.5Å; R242-E244 HydrophobicContact CB-CG 3.72Å; R242-E244 WeakPolarHBondContact CD-OE2 3.46Å; R242-E244 PolarHBondContact O-N 2.58Å
243	N	95.3	Very high	95.2	Very high	54 Å²	54	48.2 Å²	48.2	29%	0.289	23%	0.233	S	C	.	.			trans	51.8	34	-173.4	-56	106	0	0	0	113.2	T89 Y239	T89-N243 HydrophobicContact CG2-CB 4.31Å; Y239-N243 WeakPolarHBondContact O-CA 3.46Å; Y239-N243 PolarHBondContact O-N 3.42Å
244	E	96.3	Very high	95.3	Very high	48 Å²	48	47.7 Å²	47.7	22%	0.224	23%	0.229	C	C	.	.			trans	-92.4	132.4	-175.7	-73.6	168.8	162.6	0	0	111.7	M236 A237 Y239 R242	M236-E244 WeakPolarHBondContact CA-OE2 3.29Å; M236-E244 HydrophobicContact CB-CB 4.17Å; M236-E244 HydrophobicContact CG-CB 3.98Å; M236-E244 HydrophobicContact SD-CB 4.01Å; A237-E244 PolarHBondContact N-OE2 2.88Å; Y239-E244 WeakPolarHBondContact CD2-O 3.39Å; R242-E244 HydrophobicContact CB-CB 4.39Å; R242-E244 VanDerWaalsContact CB-CD 3.5Å; R242-E244 HydrophobicContact CB-CG 3.72Å; R242-E244 WeakPolarHBondContact CD-OE2 3.46Å; R242-E244 PolarHBondContact O-N 2.58Å
245	Y	96.8	Very high	95.3	Very high	62 Å²	62	43.5 Å²	43.5	24%	0.243	21%	0.211	C	C	.	.			trans	-132.6	166.1	168.7	59.2	-91.5	0	0	0	110.5	P76 S77 K234 Y239 T255 Y256	P76-Y245 HydrophobicContact CB-CD1 4.07Å; P76-Y245 HydrophobicContact CB-CE1 4.23Å; P76-Y245 HydrophobicContact CG-CD1 3.73Å; P76-Y245 HydrophobicContact CG-CE1 4.27Å; P76-Y245 HydrophobicContact CG-CG 3.85Å; S77-Y245 VanDerWaalsContact CB-CE2 3.48Å; K234-Y245 PolarHBondContact NZ-O 2.89Å; Y239-Y245 HydrophobicContact CE2-CD1 4.17Å; Y245-T255 HydrophobicContact CD2-CG2 3.73Å; Y245-T255 HydrophobicContact CG-CG2 4.07Å; Y245-Y256 WeakPolarHBondContact CA-O 3.44Å; Y245-Y256 WeakPolarHBondContact CB-O 3.43Å
246	A	96.9	Very high	95.4	Very high	14 Å²	14	41.8 Å²	41.8	12%	0.116	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	172.6	175.6	0	0	0	0	0	110.7	K234 M236 T255 Y256	K234-A246 HydrophobicContact CB-CB 4.16Å; K234-A246 HydrophobicContact CD-CB 4.01Å; M236-A246 HydrophobicContact CE-CB 3.89Å; M236-A246 HydrophobicContact SD-CB 3.94Å; A246-T255 CarbonylContact O-C 3.59Å; A246-T255 VanDerWaalsContact O-CA 3.29Å; A246-T255 WeakPolarHBondContact O-CA 3.38Å; A246-Y256 HydrophobicContact CB-CD1 4.19Å; A246-Y256 HydrophobicContact CB-CE1 3.51Å; A246-Y256 HydrophobicContact CB-CE2 4.35Å; A246-Y256 PolarHBondContact N-O 3.05Å; A246-Y256 WeakPolarHBondContact O-CD1 3.44Å; A246-Y256 PolarHBondContact O-N 3.27Å
247	T	95.8	Very high	95.4	Very high	45 Å²	45	42 Å²	42	28%	0.276	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	139.1	173.6	-51.1	0	0	0	0	109.1	T249 M254	T247-T249 VanDerWaalsContact CG2-O 3.31Å; T247-T249 WeakPolarHBondContact CG2-O 3.42Å; T247-M254 CarbonylContact C-O 3.54Å; T247-M254 WeakPolarHBondContact CA-O 3.22Å
248	I	95.3	Very high	95.4	Very high	5 Å²	5	42 Å²	42	3%	0.026	20%	0.203	C	C	.	.	S	Bend	trans	-64.1	-55.9	179.1	-63.1	178.2	0	0	0	110.2	I144 L147 Y148 T224 F226 M254 Y256	I144-I248 HydrophobicContact CG2-CD1 4.34Å; I144-I248 HydrophobicContact CG2-CG2 3.94Å; L147-I248 HydrophobicContact CD1-CD1 4.35Å; Y148-I248 HydrophobicContact CE1-CD1 3.95Å; T224-I248 WeakPolarHBondContact CB-O 3.25Å; F226-I248 HydrophobicContact CZ-CG2 4.38Å; I248-M254 HydrophobicContact CB-CB 4.48Å; I248-M254 HydrophobicContact CD1-CB 4.19Å; I248-M254 HydrophobicContact CD1-CG 3.98Å; I248-M254 HydrophobicContact CG1-CB 4.4Å; I248-M254 PolarHBondContact N-O 3.23Å; I248-Y256 HydrophobicContact CG1-CD1 3.55Å; I248-Y256 HydrophobicContact CG1-CE1 4.08Å; I248-Y256 HydrophobicContact CG1-CG 4.29Å
249	T	92.9	Very high	95.4	Very high	41 Å²	41	41.7 Å²	41.7	25%	0.252	20%	0.201	S	C	.	.			trans	-141.7	155	168.4	71.4	0	0	0	0	111.3	F226 T247 T251 D252 M253	F226-T249 HydrophobicContact CE2-CG2 4.1Å; T247-T249 VanDerWaalsContact CG2-O 3.31Å; T247-T249 WeakPolarHBondContact CG2-O 3.42Å; T249-T251 PolarHBondContact O-N 2.86Å; T249-T251 VanDerWaalsContact O-N 3.11Å; T249-T251 PolarHBondContact OG1-N 2.8Å; T249-D252 WeakPolarHBondContact CB-OD2 3.36Å; T249-D252 PolarHBondContact N-OD1 2.84Å; T249-D252 PolarHBondContact N-OD2 2.98Å; T249-D252 PolarHBondContact O-N 3.32Å; T249-D252 PolarHBondContact OG1-N 3.49Å; T249-D252 VanDerWaalsContact OG1-N 3.15Å; T249-D252 PolarHBondContact OG1-OD2 2.84Å; T249-M253 PolarHBondContact O-N 3.26Å
250	E	90	Very high	95.4	Very high	168 Å²	168	42.5 Å²	42.5	79%	0.785	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.2	173	-66.7	-63.8	164.4	0	0	113.3
251	T	88.4	Confident	95.3	Very high	58 Å²	58	38.6 Å²	38.6	36%	0.356	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-39.1	180	-54.7	0	0	0	0	112.1	R155 T249	R155-T251 PolarHBondContact NH1-O 2.86Å; T249-T251 PolarHBondContact O-N 2.86Å; T249-T251 VanDerWaalsContact O-N 3.11Å; T249-T251 PolarHBondContact OG1-N 2.8Å
252	D	93.5	Very high	95	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-33.3	179.3	61.7	47.4	0	0	0	112.6	Y148 L152 R155 V156 T249 M254 W438	Y148-D252 HydrophobicContact CE1-CB 4.28Å; Y148-D252 WeakPolarHBondContact OH-CB 3.28Å; Y148-D252 VanDerWaalsContact OH-CG 3.29Å; Y148-D252 PolarHBondContact OH-OD2 2.83Å; L152-D252 HydrophobicContact CD1-CB 4.12Å; L152-D252 HydrophobicContact CD2-CB 4.37Å; R155-D252 PolarHBondContact NH2-O 2.88Å; V156-D252 HydrophobicContact CG2-CB 4.14Å; T249-D252 WeakPolarHBondContact CB-OD2 3.36Å; T249-D252 PolarHBondContact N-OD1 2.84Å; T249-D252 PolarHBondContact N-OD2 2.98Å; T249-D252 PolarHBondContact O-N 3.32Å; T249-D252 PolarHBondContact OG1-N 3.49Å; T249-D252 VanDerWaalsContact OG1-N 3.15Å; T249-D252 PolarHBondContact OG1-OD2 2.84Å; D252-M254 HydrophobicContact CB-CB 4.31Å; D252-M254 PolarHBondContact O-N 3.47Å; D252-M254 VanDerWaalsContact OD1-CB 3.32Å; D252-M254 WeakPolarHBondContact OD1-CB 3.37Å; D252-M254 PolarHBondContact OD1-N 2.91Å; D252-W438 WeakPolarHBondContact O-CA 3.37Å; D252-W438 WeakPolarHBondContact O-CB 3.46Å
253	M	94.5	Very high	94.9	Very high	43 Å²	43	38.8 Å²	38.8	21%	0.212	20%	0.199	C	C	.	.			trans	55.4	29.1	-172	-56.9	-175.6	77.6	0	0	113.4	T249 T255 R437 W438 L440	T249-M253 PolarHBondContact O-N 3.26Å; M253-T255 PolarHBondContact O-N 2.53Å; M253-R437 HydrophobicContact CB-CB 4.27Å; M253-R437 HydrophobicContact CE-CB 4.15Å; M253-W438 PolarHBondContact O-N 3.38Å; M253-L440 HydrophobicContact SD-CD2 3.53Å; M253-L440 VanDerWaalsContact SD-CD2 3.53Å
254	M	96.1	Very high	94.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.			trans	-84.5	107.7	179.1	-169.8	63.5	-165.8	0	0	110.1	Y148 L152 T247 I248 D252 C271 T272 W438	Y148-M254 HydrophobicContact CD1-CB 4.42Å; Y148-M254 HydrophobicContact CD1-CG 4.09Å; Y148-M254 HydrophobicContact CE1-CB 4.02Å; Y148-M254 HydrophobicContact CE1-CG 4.12Å; L152-M254 HydrophobicContact CD2-CB 3.88Å; L152-M254 HydrophobicContact CD2-CG 4.04Å; L152-M254 HydrophobicContact CD2-SD 3.71Å; T247-M254 CarbonylContact C-O 3.54Å; T247-M254 WeakPolarHBondContact CA-O 3.22Å; I248-M254 HydrophobicContact CB-CB 4.48Å; I248-M254 HydrophobicContact CD1-CB 4.19Å; I248-M254 HydrophobicContact CD1-CG 3.98Å; I248-M254 HydrophobicContact CG1-CB 4.4Å; I248-M254 PolarHBondContact N-O 3.23Å; D252-M254 HydrophobicContact CB-CB 4.31Å; D252-M254 PolarHBondContact O-N 3.47Å; D252-M254 VanDerWaalsContact OD1-CB 3.32Å; D252-M254 WeakPolarHBondContact OD1-CB 3.37Å; D252-M254 PolarHBondContact OD1-N 2.91Å; M254-C271 HydrophobicContact CE-CB 3.45Å; M254-C271 VanDerWaalsContact CE-CB 3.45Å; M254-T272 VanDerWaalsContact CE-O 3.31Å; M254-T272 WeakPolarHBondContact CE-O 3.44Å; M254-W438 HydrophobicContact SD-CB 4.19Å; M254-W438 HydrophobicContact SD-CG 3.82Å
255	T	97.1	Very high	94.7	Very high	7 Å²	7	38.4 Å²	38.4	4%	0.043	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	137.9	173.5	-50.2	0	0	0	0	110.8	D75 P76 S77 Y245 A246 M253	D75-T255 VanDerWaalsContact OD1-CB 3.3Å; D75-T255 WeakPolarHBondContact OD1-CB 3.44Å; D75-T255 PolarHBondContact OD1-OG1 3.44Å; D75-T255 PolarHBondContact OD2-OG1 3.12Å; P76-T255 HydrophobicContact CG-CG2 4.15Å; S77-T255 PolarHBondContact OG-OG1 2.97Å; Y245-T255 HydrophobicContact CD2-CG2 3.73Å; Y245-T255 HydrophobicContact CG-CG2 4.07Å; A246-T255 CarbonylContact O-C 3.59Å; A246-T255 VanDerWaalsContact O-CA 3.29Å; A246-T255 WeakPolarHBondContact O-CA 3.38Å; M253-T255 PolarHBondContact O-N 2.53Å
256	Y	97.7	Very high	94.6	Very high	3 Å²	3	37.2 Å²	37.2	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	155.3	171.4	75	-83.9	0	0	0	111.7	L222 T224 M236 Y245 A246 I248 F258 I269 A270 C271	L222-Y256 HydrophobicContact CB-CE2 4.16Å; L222-Y256 HydrophobicContact CD2-CD2 4.48Å; L222-Y256 HydrophobicContact CD2-CE1 4.46Å; L222-Y256 HydrophobicContact CD2-CE2 4.21Å; T224-Y256 HydrophobicContact CG2-CE1 4.28Å; M236-Y256 HydrophobicContact CE-CD2 3.87Å; M236-Y256 HydrophobicContact CE-CE2 3.27Å; Y245-Y256 WeakPolarHBondContact CA-O 3.44Å; Y245-Y256 WeakPolarHBondContact CB-O 3.43Å; A246-Y256 HydrophobicContact CB-CD1 4.19Å; A246-Y256 HydrophobicContact CB-CE1 3.51Å; A246-Y256 HydrophobicContact CB-CE2 4.35Å; A246-Y256 PolarHBondContact N-O 3.05Å; A246-Y256 WeakPolarHBondContact O-CD1 3.44Å; A246-Y256 PolarHBondContact O-N 3.27Å; I248-Y256 HydrophobicContact CG1-CD1 3.55Å; I248-Y256 HydrophobicContact CG1-CE1 4.08Å; I248-Y256 HydrophobicContact CG1-CG 4.29Å; Y256-F258 HydrophobicContact CD2-CD1 4.44Å; Y256-F258 AromaticContact CD2-CE1 3.86Å; Y256-F258 HydrophobicContact CD2-CE1 3.86Å; Y256-F258 AromaticContact CD2-CZ 3.97Å; Y256-F258 HydrophobicContact CD2-CZ 3.97Å; Y256-F258 AromaticContact CE2-CE1 3.81Å; Y256-F258 HydrophobicContact CE2-CE1 3.81Å; Y256-F258 AromaticContact CE2-CE2 3.95Å; Y256-F258 HydrophobicContact CE2-CE2 3.95Å; Y256-F258 AromaticContact CE2-CZ 3.42Å; Y256-F258 HydrophobicContact CE2-CZ 3.42Å; Y256-F258 VanDerWaalsContact CE2-CZ 3.42Å; Y256-I269 HydrophobicContact CD2-CG2 4.24Å; Y256-A270 WeakPolarHBondContact CA-O 3.34Å; Y256-C271 WeakPolarHBondContact CB-SG 3.33Å
257	S	97.9	Very high	94.7	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.021	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	172.9	171.4	62.7	0	0	0	0	110	A270	S257-A270 PolarHBondContact N-O 3.35Å; S257-A270 PolarHBondContact O-N 2.86Å
258	F	98.1	Very high	94.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	150.7	-178.5	-63.3	-47.3	0	0	0	112.7	A220 L222 M236 S238 Y239 Y256 L267 E268 I269	A220-F258 HydrophobicContact CB-CD2 3.67Å; A220-F258 HydrophobicContact CB-CE2 3.81Å; A220-F258 HydrophobicContact CB-CG 4.16Å; A220-F258 HydrophobicContact CB-CZ 4.38Å; A220-F258 WeakPolarHBondContact O-CE2 3.37Å; L222-F258 HydrophobicContact CB-CE1 4.43Å; L222-F258 HydrophobicContact CB-CZ 3.85Å; M236-F258 HydrophobicContact CB-CD2 3.97Å; M236-F258 HydrophobicContact CB-CE2 4.33Å; M236-F258 HydrophobicContact CE-CD2 3.81Å; M236-F258 HydrophobicContact CE-CE2 3.6Å; M236-F258 HydrophobicContact CE-CZ 4.27Å; S238-F258 CarbonylContact C-O 3.53Å; S238-F258 VanDerWaalsContact CA-O 3.23Å; S238-F258 WeakPolarHBondContact CA-O 3.48Å; Y239-F258 PolarHBondContact N-O 3.2Å; Y256-F258 HydrophobicContact CD2-CD1 4.44Å; Y256-F258 AromaticContact CD2-CE1 3.86Å; Y256-F258 HydrophobicContact CD2-CE1 3.86Å; Y256-F258 AromaticContact CD2-CZ 3.97Å; Y256-F258 HydrophobicContact CD2-CZ 3.97Å; Y256-F258 AromaticContact CE2-CE1 3.81Å; Y256-F258 HydrophobicContact CE2-CE1 3.81Å; Y256-F258 AromaticContact CE2-CE2 3.95Å; Y256-F258 HydrophobicContact CE2-CE2 3.95Å; Y256-F258 AromaticContact CE2-CZ 3.42Å; Y256-F258 HydrophobicContact CE2-CZ 3.42Å; Y256-F258 VanDerWaalsContact CE2-CZ 3.42Å; F258-L267 HydrophobicContact CB-CD1 3.95Å; F258-L267 HydrophobicContact CD1-CD1 3.69Å; F258-L267 HydrophobicContact CD1-CD2 4.28Å; F258-L267 HydrophobicContact CD1-CG 4.18Å; F258-L267 HydrophobicContact CE1-CD1 4.3Å; F258-L267 HydrophobicContact CE1-CD2 4.08Å; F258-L267 HydrophobicContact CE1-CG 4.47Å; F258-L267 HydrophobicContact CG-CD1 3.84Å; F258-E268 CarbonylContact C-O 3.52Å; F258-E268 VanDerWaalsContact CA-O 3.3Å; F258-E268 WeakPolarHBondContact CA-O 3.38Å; F258-I269 HydrophobicContact CD1-CB 4.46Å; F258-I269 HydrophobicContact CD1-CG1 4.04Å; F258-I269 HydrophobicContact CD1-CG2 4.43Å; F258-I269 HydrophobicContact CE1-CB 4.45Å; F258-I269 HydrophobicContact CE1-CD1 4.18Å; F258-I269 HydrophobicContact CE1-CG1 3.84Å; F258-I269 HydrophobicContact CE1-CG2 4.19Å
259	N	97.3	Very high	94.9	Very high	11 Å²	11	34.2 Å²	34.2	6%	0.059	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.6	153.8	-64.5	-54.2	0	0	0	108.7	I94 E268	I94-N259 PolarHBondContact O-ND2 2.94Å; N259-E268 HydrophobicContact CB-CB 4.08Å; N259-E268 PolarHBondContact N-O 3.04Å; N259-E268 PolarHBondContact ND2-OE1 3.4Å; N259-E268 WeakPolarHBondContact O-CB 3.45Å; N259-E268 PolarHBondContact O-N 3.24Å
260	I	96.7	Very high	95.1	Very high	22 Å²	22	32.5 Å²	32.5	11%	0.113	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	121.1	-177.6	-55.5	164	0	0	0	108	V211 W218 A220 S238 L267	V211-I260 HydrophobicContact CG1-CD1 4.43Å; V211-I260 HydrophobicContact CG1-CG2 3.85Å; W218-I260 VanDerWaalsContact C-CD1 3.48Å; W218-I260 HydrophobicContact CB-CB 4.17Å; W218-I260 HydrophobicContact CB-CD1 3.93Å; W218-I260 HydrophobicContact CB-CG2 3.8Å; W218-I260 HydrophobicContact CG-CG2 4.26Å; W218-I260 WeakPolarHBondContact O-CD1 3.4Å; A220-I260 HydrophobicContact CB-CD1 3.84Å; A220-I260 HydrophobicContact CB-CG1 4.21Å; S238-I260 PolarHBondContact OG-N 3.18Å; I260-L267 HydrophobicContact CG1-CD1 3.84Å
261	R	93.1	Very high	95.4	Very high	54 Å²	54	25 Å²	25	20%	0.204	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	168.8	-172.5	-58.4	179.1	-176.5	-81.6	-0.6	110.6	V95 N263 G264 M265 M266 E268	V95-R261 VanDerWaalsContact CG1-NH2 3.3Å; R261-N263 VanDerWaalsContact C-N 3.29Å; R261-N263 PolarHBondContact O-N 2.83Å; R261-G264 PolarHBondContact O-N 3.44Å; R261-M265 PolarHBondContact O-N 3Å; R261-M266 HydrophobicContact CB-CB 4.23Å; R261-M266 HydrophobicContact CB-SD 4.25Å; R261-M266 PolarHBondContact N-O 2.96Å; R261-M266 PolarHBondContact O-N 3.26Å; R261-E268 IonicContact CZ-OE2 2.99Å; R261-E268 VanDerWaalsContact CZ-OE2 3.27Å; R261-E268 IonicContact NE-OE2 3.89Å; R261-E268 PolarHBondContact NE-OE2 2.85Å; R261-E268 IonicContact NH2-OE2 2.62Å; R261-E268 PolarHBondContact NH2-OE2 3.4Å
262	D	90.8	Very high	95.7	Very high	57 Å²	57	22.6 Å²	22.6	31%	0.305	12%	0.115	S	C	.	.	G	3₁₀ helix	trans	49.5	47.6	172.8	-54.9	-27.4	0	0	0	113.2	G264 M265 M266	D262-G264 VanDerWaalsContact C-N 3.27Å; D262-G264 PolarHBondContact O-N 3.32Å; D262-M265 HydrophobicContact CB-CB 4.33Å; D262-M265 HydrophobicContact CB-CE 4.17Å; D262-M265 WeakPolarHBondContact O-CB 3.45Å; D262-M265 VanDerWaalsContact O-CE 3.28Å; D262-M265 WeakPolarHBondContact O-CE 3.43Å; D262-M265 WeakPolarHBondContact O-CG 3.24Å; D262-M265 PolarHBondContact O-N 3.01Å; D262-M266 WeakPolarHBondContact OD2-CE 3.41Å
263	N	91.8	Very high	95.8	Very high	120 Å²	120	22.8 Å²	22.8	64%	0.642	12%	0.117	S	C	*	.	G	3₁₀ helix	trans	52	44.7	-177.8	-59.5	-44.3	0	0	0	113.1	W218 R261 M265	W218-N263 WeakPolarHBondContact CH2-O 3.46Å; W218-N263 HydrophobicContact CZ2-CB 4.06Å; W218-N263 WeakPolarHBondContact CZ2-O 3.28Å; R261-N263 VanDerWaalsContact C-N 3.29Å; R261-N263 PolarHBondContact O-N 2.83Å; N263-M265 VanDerWaalsContact C-N 3.35Å; N263-M265 PolarHBondContact O-N 3.31Å
264	G	93.1	Very high	95.7	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	82.2	6.7	175.8	0	0	0	0	0	115.1	T105 R261 D262	T105-G264 PolarHBondContact OG1-O 2.98Å; R261-G264 PolarHBondContact O-N 3.44Å; D262-G264 VanDerWaalsContact C-N 3.27Å; D262-G264 PolarHBondContact O-N 3.32Å
265	M	94.7	Very high	95.6	Very high	94 Å²	94	23.3 Å²	23.3	46%	0.463	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-16.8	177.5	-62.5	-171.7	-66	0	0	113.4	T105 Y138 R261 D262 N263	T105-M265 PolarHBondContact N-O 3.46Å; T105-M265 PolarHBondContact OG1-O 3.34Å; Y138-M265 HydrophobicContact CD1-CG 4.43Å; Y138-M265 HydrophobicContact CE1-CG 4.22Å; R261-M265 PolarHBondContact O-N 3Å; D262-M265 HydrophobicContact CB-CB 4.33Å; D262-M265 HydrophobicContact CB-CE 4.17Å; D262-M265 WeakPolarHBondContact O-CB 3.45Å; D262-M265 VanDerWaalsContact O-CE 3.28Å; D262-M265 WeakPolarHBondContact O-CE 3.43Å; D262-M265 WeakPolarHBondContact O-CG 3.24Å; D262-M265 PolarHBondContact O-N 3.01Å; N263-M265 VanDerWaalsContact C-N 3.35Å; N263-M265 PolarHBondContact O-N 3.31Å
266	M	95.2	Very high	95.5	Very high	36 Å²	36	24.9 Å²	24.9	18%	0.177	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	124.1	173.8	-178.2	-162.3	-61.7	0	0	109.8	T105 R261 D262	T105-M266 PolarHBondContact OG1-N 3.1Å; R261-M266 HydrophobicContact CB-CB 4.23Å; R261-M266 HydrophobicContact CB-SD 4.25Å; R261-M266 PolarHBondContact N-O 2.96Å; R261-M266 PolarHBondContact O-N 3.26Å; D262-M266 WeakPolarHBondContact OD2-CE 3.41Å
267	L	98	Very high	95.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124	169.7	177.6	68.2	0	0	0	108.9	D102 V103 T105 C209 V211 A220 F258 I260 I269	D102-L267 CarbonylContact C-O 3.54Å; V103-L267 HydrophobicContact CB-CB 4.24Å; V103-L267 PolarHBondContact N-O 3.18Å; V103-L267 PolarHBondContact O-N 3.4Å; T105-L267 HydrophobicContact CG2-CB 3.93Å; C209-L267 HydrophobicContact CB-CD2 3.74Å; V211-L267 HydrophobicContact CG2-CB 4.12Å; V211-L267 HydrophobicContact CG2-CD1 4.28Å; V211-L267 HydrophobicContact CG2-CD2 4.11Å; V211-L267 HydrophobicContact CG2-CG 4.41Å; A220-L267 HydrophobicContact CB-CD1 3.54Å; A220-L267 HydrophobicContact CB-CD2 4.24Å; F258-L267 HydrophobicContact CB-CD1 3.95Å; F258-L267 HydrophobicContact CD1-CD1 3.69Å; F258-L267 HydrophobicContact CD1-CD2 4.28Å; F258-L267 HydrophobicContact CD1-CG 4.18Å; F258-L267 HydrophobicContact CE1-CD1 4.3Å; F258-L267 HydrophobicContact CE1-CD2 4.08Å; F258-L267 HydrophobicContact CE1-CG 4.47Å; F258-L267 HydrophobicContact CG-CD1 3.84Å; I260-L267 HydrophobicContact CG1-CD1 3.84Å; L267-I269 HydrophobicContact CD2-CD1 4.4Å; L267-I269 HydrophobicContact CD2-CG1 4.2Å; L267-I269 HydrophobicContact CG-CG1 4.21Å
268	E	97.6	Very high	95.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.9	171.9	-179.6	-164	121.2	0	0	108.1	V95 D96 F258 N259 R261	V95-E268 WeakPolarHBondContact CA-OE1 3.43Å; V95-E268 WeakPolarHBondContact CG1-OE1 3.27Å; D96-E268 HydrophobicContact CB-CG 4.19Å; D96-E268 PolarHBondContact N-OE1 3.34Å; F258-E268 CarbonylContact C-O 3.52Å; F258-E268 VanDerWaalsContact CA-O 3.3Å; F258-E268 WeakPolarHBondContact CA-O 3.38Å; N259-E268 HydrophobicContact CB-CB 4.08Å; N259-E268 PolarHBondContact N-O 3.04Å; N259-E268 PolarHBondContact ND2-OE1 3.4Å; N259-E268 WeakPolarHBondContact O-CB 3.45Å; N259-E268 PolarHBondContact O-N 3.24Å; R261-E268 IonicContact CZ-OE2 2.99Å; R261-E268 VanDerWaalsContact CZ-OE2 3.27Å; R261-E268 IonicContact NE-OE2 3.89Å; R261-E268 PolarHBondContact NE-OE2 2.85Å; R261-E268 IonicContact NH2-OE2 2.62Å; R261-E268 PolarHBondContact NH2-OE2 3.4Å
269	I	98	Very high	95.2	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	104.5	175	-50	-173.8	0	0	0	108.4	G101 V103 K142 L147 L222 Y256 F258 L267	G101-I269 WeakPolarHBondContact CA-O 3.3Å; G101-I269 PolarHBondContact O-N 3.06Å; V103-I269 HydrophobicContact CG2-CD1 3.86Å; V103-I269 HydrophobicContact CG2-CG1 4.07Å; K142-I269 HydrophobicContact CB-CD1 4.36Å; K142-I269 HydrophobicContact CG-CD1 4.34Å; L147-I269 HydrophobicContact CD1-CB 4.45Å; L147-I269 HydrophobicContact CD1-CD1 4.35Å; L147-I269 HydrophobicContact CD1-CG2 3.89Å; L147-I269 HydrophobicContact CD2-CB 4.32Å; L147-I269 HydrophobicContact CD2-CG2 4.4Å; L222-I269 HydrophobicContact CD1-CD1 4.07Å; Y256-I269 HydrophobicContact CD2-CG2 4.24Å; F258-I269 HydrophobicContact CD1-CB 4.46Å; F258-I269 HydrophobicContact CD1-CG1 4.04Å; F258-I269 HydrophobicContact CD1-CG2 4.43Å; F258-I269 HydrophobicContact CE1-CB 4.45Å; F258-I269 HydrophobicContact CE1-CD1 4.18Å; F258-I269 HydrophobicContact CE1-CG1 3.84Å; F258-I269 HydrophobicContact CE1-CG2 4.19Å; L267-I269 HydrophobicContact CD2-CD1 4.4Å; L267-I269 HydrophobicContact CD2-CG1 4.2Å; L267-I269 HydrophobicContact CG-CG1 4.21Å
270	A	97.4	Very high	95.1	Very high	6 Å²	6	24.1 Å²	24.1	5%	0.05	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.2	-179.2	0	0	0	0	0	110.8	I94 D96 Y256 S257	I94-A270 HydrophobicContact CG2-CB 3.88Å; D96-A270 HydrophobicContact CB-CB 4.43Å; Y256-A270 WeakPolarHBondContact CA-O 3.34Å; S257-A270 PolarHBondContact N-O 3.35Å; S257-A270 PolarHBondContact O-N 2.86Å
271	C	96.4	Very high	95.1	Very high	11 Å²	11	23 Å²	23	7%	0.074	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	139.6	-176.9	-83.1	0	0	0	0	107.8	L147 M254 Y256 A273 Q307	L147-C271 HydrophobicContact CB-CB 4.47Å; M254-C271 HydrophobicContact CE-CB 3.45Å; M254-C271 VanDerWaalsContact CE-CB 3.45Å; Y256-C271 WeakPolarHBondContact CB-SG 3.33Å; C271-A273 PolarHBondContact O-N 3.05Å; C271-Q307 PolarHBondContact O-NE2 3.01Å; C271-Q307 PolarHBondContact O-OE1 3.28Å
272	T	95.4	Very high	95.2	Very high	7 Å²	7	20.5 Å²	20.5	4%	0.043	11%	0.109	C	C	.	.			trans	-63.5	120.9	178.2	61.8	0	0	0	0	111.3	T72 D75 P149 M254 G274 P436 W438	T72-T272 CarbonylContact O-C 3.55Å; T72-T272 WeakPolarHBondContact O-CA 3.36Å; D75-T272 HydrophobicContact CB-CG2 4.06Å; P149-T272 VanDerWaalsContact CG-O 3.22Å; P149-T272 WeakPolarHBondContact CG-O 3.29Å; M254-T272 VanDerWaalsContact CE-O 3.31Å; M254-T272 WeakPolarHBondContact CE-O 3.44Å; T272-G274 PolarHBondContact O-N 2.96Å; T272-P436 HydrophobicContact CG2-CG 4.45Å; T272-W438 PolarHBondContact OG1-NE1 3.37Å
273	A	94.1	Very high	95.5	Very high	3 Å²	3	17.8 Å²	17.8	3%	0.025	10%	0.095	C	C	.	.	S	Bend	trans	-70.4	-18.3	175.2	0	0	0	0	0	113.5	T72 C271 G309 N315	T72-A273 PolarHBondContact O-N 3.42Å; C271-A273 PolarHBondContact O-N 3.05Å; A273-G309 WeakPolarHBondContact CB-O 3.48Å; A273-N315 WeakPolarHBondContact CB-OD1 3.45Å; A273-N315 PolarHBondContact O-ND2 3.14Å; A273-N315 PolarHBondContact O-OD1 3.39Å
274	G	93.4	Very high	95.6	Very high	6 Å²	6	12.1 Å²	12.1	6%	0.062	6%	0.064	C	C	.	.	S	Bend	trans	-164.4	171.5	-179.2	0	0	0	0	0	112.6	T72 T272 H276	T72-G274 PolarHBondContact OG1-O 3.29Å; T272-G274 PolarHBondContact O-N 2.96Å; G274-H276 VanDerWaalsContact C-N 3.26Å; G274-H276 PolarHBondContact O-N 3.29Å
275	L	93.9	Very high	95.8	Very high	49 Å²	49	12.1 Å²	12.1	26%	0.257	6%	0.064	S	C	.	.	S	Bend	trans	-74.2	-17.7	-177.9	65.9	83.7	0	0	0	114.2	T435 P436 W438 T439 L446	L275-T435 HydrophobicContact CB-CG2 4.47Å; L275-T435 HydrophobicContact CD1-CG2 4.38Å; L275-P436 HydrophobicContact CB-CG 4.43Å; L275-W438 HydrophobicContact CB-CH2 4.4Å; L275-W438 HydrophobicContact CB-CZ2 4.31Å; L275-T439 HydrophobicContact CB-CG2 3.82Å; L275-T439 HydrophobicContact CD2-CG2 4.47Å; L275-L446 HydrophobicContact CD1-CD1 3.58Å; L275-L446 HydrophobicContact CD1-CD2 4.34Å
276	H	94.4	Very high	95.9	Very high	40 Å²	40	7.6 Å²	7.6	19%	0.185	4%	0.042	C	C	.	.	H	α-helix	trans	-67.9	-49.4	-163.3	-172.7	-96.8	0	0	0	112.6	D71 T72 G274 T278 H279 V280 S450 M451	D71-H276 IonicContact OD1-CE1 3.59Å; D71-H276 IonicContact OD1-CG 2.74Å; D71-H276 IonicContact OD1-ND1 3.64Å; D71-H276 PolarHBondContact OD1-ND1 3.2Å; D71-H276 IonicContact OD2-CE1 3.54Å; D71-H276 PolarHBondContact OD2-CE1 3.47Å; D71-H276 VanDerWaalsContact OD2-CE1 3.28Å; D71-H276 IonicContact OD2-ND1 3.72Å; D71-H276 PolarHBondContact OD2-ND1 3.32Å; T72-H276 HydrophobicContact CG2-CB 4.35Å; T72-H276 PolarHBondContact OG1-N 2.92Å; G274-H276 VanDerWaalsContact C-N 3.26Å; G274-H276 PolarHBondContact O-N 3.29Å; H276-T278 VanDerWaalsContact C-N 3.3Å; H276-T278 PolarHBondContact O-N 3.41Å; H276-H279 WeakPolarHBondContact O-CB 3.42Å; H276-H279 PolarHBondContact O-N 2.99Å; H276-H279 VanDerWaalsContact O-N 3.07Å; H276-V280 WeakPolarHBondContact O-CG2 3.28Å; H276-V280 PolarHBondContact O-N 2.62Å; H276-S450 VanDerWaalsContact CE1-CB 3.49Å; H276-S450 WeakPolarHBondContact CE1-CB 3.33Å; H276-S450 WeakPolarHBondContact NE2-CB 3.44Å; H276-M451 WeakPolarHBondContact NE2-CE 3.46Å
277	G	95.3	Very high	96	Very high	0 Å²	0	6 Å²	6	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-59.6	-35.7	-176.5	0	0	0	0	0	114.7	D71 T72 G73 V280 A281	D71-G277 VanDerWaalsContact CG-CA 3.42Å; D71-G277 VanDerWaalsContact OD1-CA 3.25Å; D71-G277 WeakPolarHBondContact OD1-CA 3.19Å; D71-G277 PolarHBondContact OD1-N 2.72Å; T72-G277 PolarHBondContact OG1-N 2.87Å; G73-G277 CarbonylContact O-C 2.83Å; G73-G277 WeakPolarHBondContact O-CA 3.35Å; G277-V280 PolarHBondContact O-N 2.92Å; G277-A281 WeakPolarHBondContact O-CB 3.44Å; G277-A281 PolarHBondContact O-N 3.36Å
278	T	96.7	Very high	95.8	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-69.3	-40.3	176.5	-57.2	0	0	0	0	112	G73 V74 D75 T78 H276 A281 C282 P436	G73-T278 PolarHBondContact O-N 2.96Å; V74-T278 WeakPolarHBondContact CA-OG1 3.42Å; D75-T278 HydrophobicContact CB-CG2 4.31Å; D75-T278 PolarHBondContact N-OG1 3.39Å; T78-T278 HydrophobicContact CG2-CG2 3.9Å; H276-T278 VanDerWaalsContact C-N 3.3Å; H276-T278 PolarHBondContact O-N 3.41Å; T278-A281 PolarHBondContact O-N 3.3Å; T278-C282 WeakPolarHBondContact O-CB 3.4Å; T278-C282 PolarHBondContact O-N 3.07Å; T278-P436 WeakPolarHBondContact OG1-CG 3.36Å
279	H	95.5	Very high	95.6	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-63.1	-45.8	176	-169.2	-85	0	0	0	110.9	H276 A281 C282 I283 A431 T433 S434 Q444 L446	H276-H279 WeakPolarHBondContact O-CB 3.42Å; H276-H279 PolarHBondContact O-N 2.99Å; H276-H279 VanDerWaalsContact O-N 3.07Å; H279-A281 PolarHBondContact O-N 3.41Å; H279-C282 PolarHBondContact O-N 2.77Å; H279-I283 WeakPolarHBondContact O-CG1 3.07Å; H279-I283 PolarHBondContact O-N 2.75Å; H279-A431 PolarHBondContact CE1-O 2.99Å; H279-A431 PolarHBondContact NE2-O 3.22Å; H279-T433 HydrophobicContact CB-CG2 4.4Å; H279-T433 VanDerWaalsContact CD2-CG2 3.49Å; H279-T433 WeakPolarHBondContact CD2-CG2 3.17Å; H279-T433 WeakPolarHBondContact O-CG2 3.44Å; H279-S434 WeakPolarHBondContact CA-O 3.4Å; H279-Q444 PolarHBondContact CD2-O 3.19Å; H279-Q444 PolarHBondContact NE2-O 3.25Å; H279-L446 HydrophobicContact CB-CD1 3.89Å
280	V	95.5	Very high	95.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-57.1	-49.9	174.8	169.1	0	0	0	0	111.5	V69 H276 G277 C282 I283 A284 N338 M451 P454	V69-V280 HydrophobicContact CG1-CG1 3.93Å; H276-V280 WeakPolarHBondContact O-CG2 3.28Å; H276-V280 PolarHBondContact O-N 2.62Å; G277-V280 PolarHBondContact O-N 2.92Å; V280-C282 VanDerWaalsContact C-N 3.34Å; V280-C282 PolarHBondContact O-N 2.93Å; V280-I283 PolarHBondContact O-N 3.44Å; V280-A284 PolarHBondContact O-N 2.87Å; V280-A284 VanDerWaalsContact O-N 3.13Å; V280-N338 WeakPolarHBondContact CG1-ND2 3.32Å; V280-M451 HydrophobicContact CG2-CE 4Å; V280-P454 HydrophobicContact CB-CB 4.45Å; V280-P454 HydrophobicContact CB-CG 4.26Å; V280-P454 HydrophobicContact CG1-CB 3.7Å; V280-P454 HydrophobicContact CG1-CG 3.82Å; V280-P454 HydrophobicContact CG2-CG 4.34Å; V280-P454 WeakPolarHBondContact O-CB 3.48Å
281	A	97.2	Very high	94.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-40.8	178.7	0	0	0	0	0	112.6	V69 V74 M81 G277 T278 H279 A284 A285 I303	V69-A281 HydrophobicContact CG2-CB 4.23Å; V74-A281 HydrophobicContact CB-CB 4.45Å; V74-A281 HydrophobicContact CG1-CB 3.93Å; V74-A281 HydrophobicContact CG2-CB 3.59Å; M81-A281 HydrophobicContact CE-CB 4.26Å; M81-A281 HydrophobicContact SD-CB 4.17Å; G277-A281 WeakPolarHBondContact O-CB 3.44Å; G277-A281 PolarHBondContact O-N 3.36Å; T278-A281 PolarHBondContact O-N 3.3Å; H279-A281 PolarHBondContact O-N 3.41Å; A281-A284 PolarHBondContact O-N 2.66Å; A281-A285 PolarHBondContact O-N 3.26Å; A281-I303 HydrophobicContact CB-CD1 3.97Å
282	C	96.1	Very high	94.5	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.1	-35.5	177.4	-81.1	0	0	0	0	113.1	M81 T278 H279 V280 G286 G296 T433	M81-C282 HydrophobicContact CE-CB 4.14Å; M81-C282 WeakPolarHBondContact CE-SG 3.35Å; T278-C282 WeakPolarHBondContact O-CB 3.4Å; T278-C282 PolarHBondContact O-N 3.07Å; H279-C282 PolarHBondContact O-N 2.77Å; V280-C282 VanDerWaalsContact C-N 3.34Å; V280-C282 PolarHBondContact O-N 2.93Å; C282-G286 PolarHBondContact O-N 3.39Å; C282-G296 WeakPolarHBondContact O-CA 3.35Å; C282-T433 HydrophobicContact CB-CG2 3.69Å; C282-T433 VanDerWaalsContact CB-OG1 3.28Å; C282-T433 WeakPolarHBondContact CB-OG1 3.11Å
283	I	95.2	Very high	94	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-62.2	-47.6	172.5	-66.2	165.6	0	0	0	110	H279 V280 G296 V297 A431 T433 M451 P454 N455	H279-I283 WeakPolarHBondContact O-CG1 3.07Å; H279-I283 PolarHBondContact O-N 2.75Å; V280-I283 PolarHBondContact O-N 3.44Å; I283-G296 CarbonylContact O-C 3.28Å; I283-G296 WeakPolarHBondContact O-CA 3.42Å; I283-V297 PolarHBondContact O-N 3.17Å; I283-A431 HydrophobicContact CD1-CB 3.75Å; I283-A431 HydrophobicContact CG1-CB 3.75Å; I283-T433 HydrophobicContact CG1-CG2 3.83Å; I283-M451 HydrophobicContact CD1-CB 3.78Å; I283-M451 HydrophobicContact CD1-CG 3.52Å; I283-P454 HydrophobicContact CB-CB 4.08Å; I283-P454 HydrophobicContact CB-CG 4.05Å; I283-P454 HydrophobicContact CD1-CG 4.06Å; I283-P454 HydrophobicContact CG2-CB 4.1Å; I283-P454 HydrophobicContact CG2-CG 4.01Å; I283-N455 HydrophobicContact CG2-CB 3.97Å
284	A	95.8	Very high	93.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.5	-51.3	-176	0	0	0	0	0	112.1	I67 V280 A281 V297 A298 P454 G458	I67-A284 HydrophobicContact CD1-CB 4.4Å; V280-A284 PolarHBondContact O-N 2.87Å; V280-A284 VanDerWaalsContact O-N 3.13Å; A281-A284 PolarHBondContact O-N 2.66Å; A284-V297 PolarHBondContact O-N 3.16Å; A284-A298 PolarHBondContact O-N 2.89Å; A284-P454 WeakPolarHBondContact CA-O 3.45Å; A284-P454 HydrophobicContact CB-CB 3.96Å; A284-P454 WeakPolarHBondContact CB-O 3.43Å; A284-G458 WeakPolarHBondContact O-CA 3.35Å
285	A	97.1	Very high	93.8	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-148.3	19.6	-167.2	0	0	0	0	0	115.6	I67 K90 A281 C287 A298 A301 I303	I67-A285 HydrophobicContact CD1-CB 4.19Å; K90-A285 WeakPolarHBondContact CD-O 3.28Å; K90-A285 WeakPolarHBondContact CE-O 3.46Å; K90-A285 PolarHBondContact NZ-O 2.93Å; A281-A285 PolarHBondContact O-N 3.26Å; A285-C287 PolarHBondContact O-N 3.01Å; A285-A298 VanDerWaalsContact CA-O 3.28Å; A285-A298 WeakPolarHBondContact CA-O 3.24Å; A285-A298 WeakPolarHBondContact CB-O 3.31Å; A285-A301 HydrophobicContact CB-CB 4.05Å; A285-I303 HydrophobicContact CB-CD1 3.8Å; A285-I303 HydrophobicContact CB-CG1 4.08Å
286	G	96.4	Very high	93.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.148	C	C	.	.			trans	-55.9	136	175.7	0	0	0	0	0	112.2	G80 C282 N295 G296	G80-G286 WeakPolarHBondContact O-CA 3.27Å; C282-G286 PolarHBondContact O-N 3.39Å; G286-N295 CarbonylContact O-C 3.59Å; G286-N295 WeakPolarHBondContact O-CA 3.44Å; G286-G296 PolarHBondContact O-N 2.71Å
287	C	96.5	Very high	93.8	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.02	14%	0.14	C	C	.	.			trans	-128.8	120.4	-179.1	178.7	0	0	0	0	110.4	G80 T83 A285 N295 P299	G80-C287 WeakPolarHBondContact CA-O 3.41Å; G80-C287 PolarHBondContact O-N 3.31Å; T83-C287 WeakPolarHBondContact O-CB 3.29Å; T83-C287 PolarHBondContact O-SG 3.1Å; A285-C287 PolarHBondContact O-N 3.01Å; C287-N295 WeakPolarHBondContact CA-OD1 3.29Å; C287-P299 HydrophobicContact CB-CB 4Å
288	F	95	Very high	93.9	Very high	9 Å²	9	26.9 Å²	26.9	4%	0.039	14%	0.14	C	C	.	.			trans	-123.1	88.9	-176.5	-61.9	-88.5	0	0	0	108.5	P79 G80 E290 D291 P292 R294 N295	P79-F288 HydrophobicContact CB-CD1 4.22Å; P79-F288 HydrophobicContact CB-CE1 4.08Å; G80-F288 VanDerWaalsContact CA-CE1 3.41Å; G80-F288 VanDerWaalsContact CA-CZ 3.43Å; F288-E290 PolarHBondContact O-N 3.46Å; F288-D291 WeakPolarHBondContact CB-O 3.18Å; F288-D291 CarbonylContact O-C 3.46Å; F288-D291 PolarHBondContact O-N 2.74Å; F288-P292 WeakPolarHBondContact O-CA 3.24Å; F288-R294 HydrophobicContact CB-CB 4.21Å; F288-R294 VanDerWaalsContact CD2-C 3.49Å; F288-R294 HydrophobicContact CD2-CB 3.59Å; F288-R294 VanDerWaalsContact CD2-O 3.24Å; F288-R294 WeakPolarHBondContact CD2-O 3.12Å; F288-R294 HydrophobicContact CE2-CB 4.01Å; F288-R294 WeakPolarHBondContact CE2-O 3.34Å; F288-R294 HydrophobicContact CG-CB 3.87Å; F288-N295 PolarHBondContact N-OD1 3.01Å
289	P	92	Very high	93.9	Very high	91 Å²	91	27.5 Å²	27.5	59%	0.591	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-34.6	-175.7	-26.9	35.5	0	0	0	114.1	D291	P289-D291 VanDerWaalsContact C-N 3.33Å
290	E	90.5	Very high	94	Very high	199 Å²	199	27.6 Å²	27.6	93%	0.93	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-17.5	179.1	-61.1	-176.4	172	0	0	113.3	F288	F288-E290 PolarHBondContact O-N 3.46Å
291	D	89.4	Confident	94.1	Very high	45 Å²	45	27.6 Å²	27.6	24%	0.241	15%	0.145	C	C	.	.			trans	-148.7	72.5	-175.5	-172.2	-10.3	0	0	0	110.2	F288 P289 H293 R294	F288-D291 WeakPolarHBondContact CB-O 3.18Å; F288-D291 CarbonylContact O-C 3.46Å; F288-D291 PolarHBondContact O-N 2.74Å; P289-D291 VanDerWaalsContact C-N 3.33Å; D291-H293 PolarHBondContact O-N 3.08Å; D291-H293 VanDerWaalsContact O-N 3.1Å; D291-R294 WeakPolarHBondContact O-CB 3.24Å; D291-R294 PolarHBondContact O-N 3.34Å; D291-R294 WeakPolarHBondContact OD2-CD 3.34Å; D291-R294 IonicContact OD2-NH1 3.18Å
292	P	89.2	Confident	94.2	Very high	72 Å²	72	30.2 Å²	30.2	47%	0.468	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-61.4	-22.2	-171.3	-25.7	36	0	0	0	114.4	F288 R294 N295	F288-P292 WeakPolarHBondContact O-CA 3.24Å; P292-R294 PolarHBondContact O-N 3.03Å; P292-N295 WeakPolarHBondContact O-CB 3.47Å; P292-N295 PolarHBondContact O-N 2.92Å; P292-N295 PolarHBondContact O-ND2 2.84Å; P292-N295 VanDerWaalsContact O-ND2 3.16Å
293	H	85.3	Confident	94.3	Very high	76 Å²	76	30.2 Å²	30.2	35%	0.352	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-59.4	-29.4	174.6	-68.9	-60.9	0	0	0	112.2	D39 D40 D291 N295	D39-H293 HydrophobicContact CB-CB 3.61Å; D39-H293 WeakPolarHBondContact O-CB 3.38Å; D39-H293 WeakPolarHBondContact OD1-CB 3.33Å; D39-H293 IonicContact OD1-CD2 2.68Å; D39-H293 PolarHBondContact OD1-CD2 2.88Å; D39-H293 IonicContact OD1-CG 3.86Å; D40-H293 IonicContact OD1-CE1 3.18Å; D40-H293 PolarHBondContact OD1-CE1 3.11Å; D40-H293 IonicContact OD1-CG 3.28Å; D40-H293 IonicContact OD1-ND1 3.13Å; D40-H293 PolarHBondContact OD1-ND1 2.93Å; D40-H293 IonicContact OD2-CE1 2.97Å; D40-H293 IonicContact OD2-ND1 2.76Å; D291-H293 PolarHBondContact O-N 3.08Å; D291-H293 VanDerWaalsContact O-N 3.1Å; H293-N295 VanDerWaalsContact C-N 3.28Å; H293-N295 PolarHBondContact O-N 2.96Å
294	R	89	Confident	94.4	Very high	47 Å²	47	30.3 Å²	30.3	18%	0.177	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-79.7	-4.4	175.6	-68.3	170.4	59.3	-170.4	-4.4	114.7	F288 D291 P292	F288-R294 HydrophobicContact CB-CB 4.21Å; F288-R294 VanDerWaalsContact CD2-C 3.49Å; F288-R294 HydrophobicContact CD2-CB 3.59Å; F288-R294 VanDerWaalsContact CD2-O 3.24Å; F288-R294 WeakPolarHBondContact CD2-O 3.12Å; F288-R294 HydrophobicContact CE2-CB 4.01Å; F288-R294 WeakPolarHBondContact CE2-O 3.34Å; F288-R294 HydrophobicContact CG-CB 3.87Å; D291-R294 WeakPolarHBondContact O-CB 3.24Å; D291-R294 PolarHBondContact O-N 3.34Å; D291-R294 WeakPolarHBondContact OD2-CD 3.34Å; D291-R294 IonicContact OD2-NH1 3.18Å; P292-R294 PolarHBondContact O-N 3.03Å
295	N	93.4	Very high	94.5	Very high	19 Å²	19	30.3 Å²	30.3	10%	0.102	16%	0.158	C	C	.	.			trans	-55.1	146.7	-179	-74	-16.9	0	0	0	111.5	N43 K45 G286 C287 F288 P292 H293 P299	N43-N295 PolarHBondContact ND2-O 2.68Å; K45-N295 VanDerWaalsContact CE-O 3.29Å; K45-N295 WeakPolarHBondContact CE-O 3.27Å; K45-N295 PolarHBondContact NZ-O 3.36Å; G286-N295 CarbonylContact O-C 3.59Å; G286-N295 WeakPolarHBondContact O-CA 3.44Å; C287-N295 WeakPolarHBondContact CA-OD1 3.29Å; F288-N295 PolarHBondContact N-OD1 3.01Å; P292-N295 WeakPolarHBondContact O-CB 3.47Å; P292-N295 PolarHBondContact O-N 2.92Å; P292-N295 PolarHBondContact O-ND2 2.84Å; P292-N295 VanDerWaalsContact O-ND2 3.16Å; H293-N295 VanDerWaalsContact C-N 3.28Å; H293-N295 PolarHBondContact O-N 2.96Å; N295-P299 HydrophobicContact CB-CB 3.96Å; N295-P299 HydrophobicContact CB-CG 4.13Å
296	G	94.5	Very high	94.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.			trans	-61.4	-173.3	161.8	0	0	0	0	0	111.4	K45 C282 I283 G286	K45-G296 VanDerWaalsContact CE-O 3.24Å; K45-G296 WeakPolarHBondContact CE-O 3.45Å; K45-G296 PolarHBondContact NZ-O 2.81Å; K45-G296 VanDerWaalsContact NZ-O 3.07Å; C282-G296 WeakPolarHBondContact O-CA 3.35Å; I283-G296 CarbonylContact O-C 3.28Å; I283-G296 WeakPolarHBondContact O-CA 3.42Å; G286-G296 PolarHBondContact O-N 2.71Å
297	V	95.1	Very high	94.5	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.012	16%	0.16	C	C	.	.	S	Bend	trans	-69.1	-42.6	-178.8	179.3	0	0	0	0	111.3	V50 I283 A284 P299 G458 A459 L462	V50-V297 HydrophobicContact CG1-CG1 4.07Å; V50-V297 HydrophobicContact CG2-CG1 3.86Å; I283-V297 PolarHBondContact O-N 3.17Å; A284-V297 PolarHBondContact O-N 3.16Å; V297-P299 WeakPolarHBondContact O-CD 3.11Å; V297-G458 VanDerWaalsContact CG1-C 3.45Å; V297-A459 HydrophobicContact CG1-CB 3.91Å; V297-L462 HydrophobicContact CG1-CD1 3.99Å
298	A	96.6	Very high	94.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.159	C	C	.	.			trans	-121.1	76.5	179.4	0	0	0	0	0	113	D61 A284 A285 G300 A301 G458 A461 L462	D61-A298 CarbonylContact O-C 3.47Å; D61-A298 VanDerWaalsContact O-C 3.28Å; D61-A298 WeakPolarHBondContact O-CA 3.37Å; A284-A298 PolarHBondContact O-N 2.89Å; A285-A298 VanDerWaalsContact CA-O 3.28Å; A285-A298 WeakPolarHBondContact CA-O 3.24Å; A285-A298 WeakPolarHBondContact CB-O 3.31Å; A298-G300 PolarHBondContact O-N 2.84Å; A298-G300 VanDerWaalsContact O-N 3.15Å; A298-A301 HydrophobicContact CB-CB 4.04Å; A298-A301 WeakPolarHBondContact O-CB 3.31Å; A298-A301 PolarHBondContact O-N 2.97Å; A298-G458 WeakPolarHBondContact CB-O 3.28Å; A298-A461 HydrophobicContact CB-CB 3.8Å; A298-L462 HydrophobicContact CB-CD2 3.81Å; A298-L462 HydrophobicContact CB-CG 4.14Å
299	P	96.9	Very high	94.3	Very high	14 Å²	14	30.2 Å²	30.2	9%	0.091	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-11.9	-176.5	29.6	-36.5	0	0	0	114.4	T85 K90 C287 N295 V297	T85-P299 HydrophobicContact CG2-CB 3.85Å; T85-P299 HydrophobicContact CG2-CG 3.99Å; T85-P299 PolarHBondContact N-O 3.16Å; K90-P299 PolarHBondContact NZ-O 3.44Å; C287-P299 HydrophobicContact CB-CB 4Å; N295-P299 HydrophobicContact CB-CB 3.96Å; N295-P299 HydrophobicContact CB-CG 4.13Å; V297-P299 WeakPolarHBondContact O-CD 3.11Å
300	G	97.3	Very high	94.3	Very high	2 Å²	2	26 Å²	26	2%	0.021	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-17.6	170.7	0	0	0	0	0	114.4	D61 G62 T84 T85 A298	D61-G300 WeakPolarHBondContact O-CA 2.93Å; D61-G300 PolarHBondContact O-N 2.84Å; G62-G300 VanDerWaalsContact C-C 3.48Å; G62-G300 CarbonylContact O-C 3.54Å; T84-G300 WeakPolarHBondContact CG2-O 3.3Å; T85-G300 VanDerWaalsContact OG1-CA 3.26Å; T85-G300 WeakPolarHBondContact OG1-CA 3.42Å; A298-G300 PolarHBondContact O-N 2.84Å; A298-G300 VanDerWaalsContact O-N 3.15Å
301	A	98.3	Very high	94.3	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.096	C	C	.	.			trans	-75	146.3	-176.7	0	0	0	0	0	112.7	G62 V65 I67 K90 A285 A298 A461	G62-A301 WeakPolarHBondContact O-CA 3.49Å; G62-A301 PolarHBondContact O-N 3Å; V65-A301 HydrophobicContact CB-CB 4.48Å; I67-A301 HydrophobicContact CD1-CB 3.76Å; I67-A301 HydrophobicContact CG1-CB 4.31Å; K90-A301 VanDerWaalsContact CD-O 3.31Å; K90-A301 WeakPolarHBondContact CD-O 3.49Å; K90-A301 WeakPolarHBondContact CE-O 3.27Å; K90-A301 PolarHBondContact NZ-O 3.14Å; A285-A301 HydrophobicContact CB-CB 4.05Å; A298-A301 HydrophobicContact CB-CB 4.04Å; A298-A301 WeakPolarHBondContact O-CB 3.31Å; A298-A301 PolarHBondContact O-N 2.97Å; A301-A461 HydrophobicContact CB-CB 4.26Å
302	Q	98.5	Very high	94.4	Very high	55 Å²	55	19.4 Å²	19.4	26%	0.257	10%	0.098	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	154.9	172.3	-69	-176.3	-68.3	0	0	111.1	V65 L66 I67 T84 T89 K90 V92	V65-Q302 PolarHBondContact O-N 2.8Å; L66-Q302 HydrophobicContact CD1-CB 3.75Å; I67-Q302 PolarHBondContact N-O 3.02Å; T84-Q302 HydrophobicContact CG2-CG 3.77Å; T89-Q302 PolarHBondContact O-NE2 3.02Å; K90-Q302 CarbonylContact O-C 3.51Å; K90-Q302 WeakPolarHBondContact O-CA 3.25Å; V92-Q302 HydrophobicContact CG1-CB 3.9Å; V92-Q302 HydrophobicContact CG1-CG 4.12Å
303	I	98.3	Very high	94.5	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.7	-177.1	-68.3	161.8	0	0	0	110.8	I67 V69 M81 K90 V91 V92 A281 A285	I67-I303 CarbonylContact O-C 3.54Å; I67-I303 VanDerWaalsContact O-CA 3.28Å; I67-I303 WeakPolarHBondContact O-CA 3.28Å; V69-I303 HydrophobicContact CB-CG2 4.45Å; V69-I303 HydrophobicContact CG2-CG2 3.84Å; M81-I303 HydrophobicContact CE-CD1 3.9Å; M81-I303 HydrophobicContact SD-CD1 3.76Å; K90-I303 HydrophobicContact CD-CD1 4.18Å; K90-I303 PolarHBondContact O-N 3.48Å; V91-I303 CarbonylContact C-O 3.59Å; V91-I303 WeakPolarHBondContact CA-O 3.36Å; V92-I303 PolarHBondContact N-O 3.5Å; A281-I303 HydrophobicContact CB-CD1 3.97Å; A285-I303 HydrophobicContact CB-CD1 3.8Å; A285-I303 HydrophobicContact CB-CG1 4.08Å
304	I	97.9	Very high	94.5	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.01	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.1	159.1	-70.3	176.9	0	0	0	108.4	L66 I67 V69 V92 D93 L306 Y328 K332 V334	L66-I304 HydrophobicContact CD1-CD1 4.24Å; L66-I304 HydrophobicContact CD1-CG1 3.97Å; L66-I304 HydrophobicContact CD2-CD1 3.78Å; L66-I304 HydrophobicContact CD2-CG1 4.43Å; L66-I304 HydrophobicContact CG-CD1 4.19Å; L66-I304 HydrophobicContact CG-CG1 4.39Å; I67-I304 PolarHBondContact O-N 3.07Å; V69-I304 PolarHBondContact N-O 3.46Å; V92-I304 HydrophobicContact CG2-CD1 3.93Å; V92-I304 HydrophobicContact CG2-CG1 3.26Å; D93-I304 HydrophobicContact CB-CG1 4.26Å; D93-I304 HydrophobicContact CB-CG2 4.24Å; I304-L306 HydrophobicContact CG2-CD1 4.22Å; I304-L306 HydrophobicContact CG2-CD2 3.24Å; I304-L306 HydrophobicContact CG2-CG 3.66Å; I304-Y328 HydrophobicContact CG2-CE1 4.37Å; I304-K332 HydrophobicContact CD1-CB 4.15Å; I304-K332 HydrophobicContact CD1-CG 4.26Å; I304-V334 HydrophobicContact CD1-CG1 3.99Å
305	S	98	Very high	94.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	113.5	175.4	-175.9	0	0	0	0	111.2	V74 D93 I94 V95	V74-S305 WeakPolarHBondContact CB-OG 3.49Å; V74-S305 WeakPolarHBondContact CG2-OG 3.36Å; V74-S305 PolarHBondContact N-OG 2.81Å; D93-S305 PolarHBondContact O-N 2.6Å; I94-S305 WeakPolarHBondContact CA-O 3.41Å; V95-S305 PolarHBondContact N-O 2.82Å
306	L	97.4	Very high	94.1	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	100.8	-179.9	-56.5	-175	0	0	0	109.2	A68 V69 L70 D71 V95 F97 I304 I308 A325 Y328 C329	A68-L306 HydrophobicContact CB-CD1 4.08Å; V69-L306 PolarHBondContact O-N 3.34Å; L70-L306 WeakPolarHBondContact CA-O 3.34Å; L70-L306 HydrophobicContact CD1-CB 3.99Å; L70-L306 HydrophobicContact CD1-CD1 3.7Å; L70-L306 HydrophobicContact CD1-CG 4.28Å; L70-L306 HydrophobicContact CG-CB 4.21Å; D71-L306 PolarHBondContact N-O 3.1Å; D71-L306 VanDerWaalsContact N-O 3.08Å; V95-L306 HydrophobicContact CB-CD2 4.05Å; V95-L306 HydrophobicContact CG2-CD2 4.12Å; F97-L306 HydrophobicContact CD2-CB 3.99Å; F97-L306 HydrophobicContact CD2-CD2 4.25Å; F97-L306 HydrophobicContact CE2-CB 3.8Å; F97-L306 HydrophobicContact CE2-CD1 3.88Å; F97-L306 HydrophobicContact CE2-CD2 3.35Å; F97-L306 HydrophobicContact CE2-CG 3.82Å; F97-L306 HydrophobicContact CZ-CD2 3.95Å; I304-L306 HydrophobicContact CG2-CD1 4.22Å; I304-L306 HydrophobicContact CG2-CD2 3.24Å; I304-L306 HydrophobicContact CG2-CG 3.66Å; L306-I308 PolarHBondContact O-N 3.45Å; L306-A325 HydrophobicContact CB-CB 4.45Å; L306-A325 HydrophobicContact CD1-CB 4.29Å; L306-Y328 HydrophobicContact CD1-CD1 4.42Å; L306-Y328 HydrophobicContact CD2-CD1 3.89Å; L306-Y328 HydrophobicContact CD2-CE1 4.22Å; L306-C329 WeakPolarHBondContact CD1-SG 3.42Å
307	Q	96.4	Very high	93.6	Very high	9 Å²	9	19.5 Å²	19.5	4%	0.042	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	118.9	178.7	175	170.1	-65.6	0	0	110.3	D71 T72 V95 D96 F97 T98 C271	D71-Q307 CarbonylContact O-C 3.47Å; D71-Q307 VanDerWaalsContact O-CA 3.28Å; D71-Q307 WeakPolarHBondContact O-CA 3.25Å; T72-Q307 PolarHBondContact O-OE1 2.87Å; T72-Q307 VanDerWaalsContact O-OE1 3.1Å; V95-Q307 PolarHBondContact O-N 3.41Å; D96-Q307 PolarHBondContact OD1-NE2 2.87Å; F97-Q307 PolarHBondContact N-O 3.41Å; T98-Q307 HydrophobicContact CG2-CG 4.34Å; C271-Q307 PolarHBondContact O-NE2 3.01Å; C271-Q307 PolarHBondContact O-OE1 3.28Å
308	I	94.4	Very high	93	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.096	C	C	.	.			trans	-113.3	-22.2	175.7	59.1	164.6	0	0	0	112.6	L70 D71 T98 L306 D310 E317 A321 L322 A325 Y339 Y341	L70-I308 HydrophobicContact CB-CD1 4.04Å; L70-I308 HydrophobicContact CB-CG1 4.46Å; L70-I308 HydrophobicContact CB-CG2 4.43Å; L70-I308 HydrophobicContact CG-CG2 4.28Å; D71-I308 PolarHBondContact O-N 2.82Å; T98-I308 VanDerWaalsContact CG2-C 3.48Å; T98-I308 VanDerWaalsContact CG2-O 3.29Å; T98-I308 WeakPolarHBondContact CG2-O 3.39Å; L306-I308 PolarHBondContact O-N 3.45Å; I308-D310 PolarHBondContact O-N 3.37Å; I308-E317 HydrophobicContact CB-CB 4.47Å; I308-E317 HydrophobicContact CD1-CB 4.11Å; I308-E317 HydrophobicContact CG1-CB 4.39Å; I308-E317 VanDerWaalsContact O-CA 3.3Å; I308-E317 WeakPolarHBondContact O-CA 3.39Å; I308-A321 HydrophobicContact CB-CB 4.09Å; I308-A321 HydrophobicContact CG2-CB 4.2Å; I308-L322 HydrophobicContact CD1-CD2 3.76Å; I308-L322 HydrophobicContact CG2-CD2 4.37Å; I308-A325 HydrophobicContact CG2-CB 3.96Å; I308-Y339 HydrophobicContact CD1-CD2 4.04Å; I308-Y339 HydrophobicContact CD1-CE2 3.42Å; I308-Y339 VanDerWaalsContact CD1-CE2 3.42Å; I308-Y341 HydrophobicContact CD1-CD2 4.41Å; I308-Y341 HydrophobicContact CD1-CG 4.38Å
309	G	92.4	Very high	92.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	113.4	177	0	0	0	0	0	111.3	D71 A273 S311	D71-G309 PolarHBondContact O-N 3.33Å; A273-G309 WeakPolarHBondContact CB-O 3.48Å; G309-S311 PolarHBondContact O-N 3.46Å
310	D	92.1	Very high	91.9	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.011	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	116.6	-176.7	-169.4	-34.7	0	0	0	110.9	T98 I308 R312 L313 K314 N315 L316 T318	T98-D310 HydrophobicContact CG2-CB 3.99Å; I308-D310 PolarHBondContact O-N 3.37Å; D310-R312 PolarHBondContact O-N 2.87Å; D310-R312 WeakPolarHBondContact OD1-CA 3.48Å; D310-R312 WeakPolarHBondContact OD1-CB 3.31Å; D310-R312 WeakPolarHBondContact OD1-CG 3.41Å; D310-R312 IonicContact OD1-CZ 2.66Å; D310-R312 PolarHBondContact OD1-N 3.02Å; D310-R312 IonicContact OD1-NE 3.69Å; D310-R312 PolarHBondContact OD1-NE 2.85Å; D310-R312 IonicContact OD1-NH2 3.46Å; D310-R312 IonicContact OD2-CZ 3.68Å; D310-R312 IonicContact OD2-NE 2.71Å; D310-R312 PolarHBondContact OD2-NE 3.08Å; D310-R312 IonicContact OD2-NH2 3.79Å; D310-R312 PolarHBondContact OD2-NH2 3.18Å; D310-L313 HydrophobicContact CB-CB 4.14Å; D310-L313 HydrophobicContact CB-CD1 4.21Å; D310-L313 HydrophobicContact CB-CG 4.19Å; D310-L313 CarbonylContact O-C 3.58Å; D310-L313 WeakPolarHBondContact O-CA 3.45Å; D310-L313 PolarHBondContact O-N 3.49Å; D310-K314 PolarHBondContact O-N 2.97Å; D310-N315 VanDerWaalsContact O-CA 3.3Å; D310-N315 WeakPolarHBondContact O-CA 3.35Å; D310-N315 PolarHBondContact O-N 2.74Å; D310-L316 WeakPolarHBondContact CB-O 3.4Å; D310-L316 PolarHBondContact N-O 3.31Å; D310-T318 HydrophobicContact CB-CG2 4.28Å
311	S	90.8	Very high	91.6	Very high	34 Å²	34	21.1 Å²	21.1	24%	0.238	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-60.3	-28.3	-179.7	63.6	0	0	0	0	112.6	G309 L313	G309-S311 PolarHBondContact O-N 3.46Å; S311-L313 PolarHBondContact O-N 2.89Å
312	R	91.3	Very high	91.1	Very high	72 Å²	72	21.7 Å²	21.7	27%	0.272	11%	0.111	S	C	.	.	G	3₁₀ helix	trans	-70.1	-24.2	176	-53	169.9	-70.4	-159.8	-1.3	111.7	T98 G99 A100 D310	T98-R312 PolarHBondContact O-NH2 2.99Å; G99-R312 PolarHBondContact O-NH1 2.62Å; A100-R312 HydrophobicContact CB-CG 4.25Å; D310-R312 PolarHBondContact O-N 2.87Å; D310-R312 WeakPolarHBondContact OD1-CA 3.48Å; D310-R312 WeakPolarHBondContact OD1-CB 3.31Å; D310-R312 WeakPolarHBondContact OD1-CG 3.41Å; D310-R312 IonicContact OD1-CZ 2.66Å; D310-R312 PolarHBondContact OD1-N 3.02Å; D310-R312 IonicContact OD1-NE 3.69Å; D310-R312 PolarHBondContact OD1-NE 2.85Å; D310-R312 IonicContact OD1-NH2 3.46Å; D310-R312 IonicContact OD2-CZ 3.68Å; D310-R312 IonicContact OD2-NE 2.71Å; D310-R312 PolarHBondContact OD2-NE 3.08Å; D310-R312 IonicContact OD2-NH2 3.79Å; D310-R312 PolarHBondContact OD2-NH2 3.18Å
313	L	90.6	Very high	90.5	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-108	22	-175.8	-60.2	-177.9	0	0	0	113.8	D310 S311 N315 L316 T318 L845 G859 Y866	D310-L313 HydrophobicContact CB-CB 4.14Å; D310-L313 HydrophobicContact CB-CD1 4.21Å; D310-L313 HydrophobicContact CB-CG 4.19Å; D310-L313 CarbonylContact O-C 3.58Å; D310-L313 WeakPolarHBondContact O-CA 3.45Å; D310-L313 PolarHBondContact O-N 3.49Å; S311-L313 PolarHBondContact O-N 2.89Å; L313-N315 VanDerWaalsContact C-N 3.33Å; L313-L316 HydrophobicContact CB-CB 3.98Å; L313-L316 WeakPolarHBondContact O-CB 3.28Å; L313-L316 PolarHBondContact O-N 3.1Å; L313-T318 HydrophobicContact CD1-CG2 3.56Å; L313-L845 HydrophobicContact CD1-CD1 3.98Å; L313-L845 HydrophobicContact CD2-CD1 3.72Å; L313-L845 HydrophobicContact CG-CD1 4.05Å; L313-G859 VanDerWaalsContact CD2-C 3.46Å; L313-G859 VanDerWaalsContact CD2-CA 3.46Å; L313-Y866 HydrophobicContact CB-CE1 4.34Å; L313-Y866 HydrophobicContact CD2-CE1 4.06Å; L313-Y866 PolarHBondContact O-OH 2.74Å; L313-Y866 VanDerWaalsContact O-OH 3.13Å
314	K	86.3	Confident	90.2	Very high	150 Å²	150	21.3 Å²	21.3	65%	0.652	11%	0.11	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.4	42.1	-175.4	-54.1	173.7	179.3	170.9	0	112.1	D310 L316 R865	D310-K314 PolarHBondContact O-N 2.97Å; K314-L316 PolarHBondContact O-N 2.96Å; K314-R865 PolarHBondContact NZ-O 2.71Å
315	N	86.7	Confident	89.9	Confident	42 Å²	42	21.2 Å²	21.2	23%	0.225	11%	0.109	C	C	.	.	S	Bend	trans	63.8	24.6	-179.9	-54.3	-20.6	0	0	0	113.7	T72 A273 D310 L313 Y341	T72-N315 HydrophobicContact CG2-CB 4.3Å; A273-N315 WeakPolarHBondContact CB-OD1 3.45Å; A273-N315 PolarHBondContact O-ND2 3.14Å; A273-N315 PolarHBondContact O-OD1 3.39Å; D310-N315 VanDerWaalsContact O-CA 3.3Å; D310-N315 WeakPolarHBondContact O-CA 3.35Å; D310-N315 PolarHBondContact O-N 2.74Å; L313-N315 VanDerWaalsContact C-N 3.33Å; N315-Y341 WeakPolarHBondContact O-CE1 3.29Å; N315-Y341 PolarHBondContact O-OH 3.09Å
316	L	86	Confident	89.6	Confident	17 Å²	17	21.9 Å²	21.9	9%	0.089	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	132.2	166.1	-166.7	74.9	0	0	0	108.4	D310 L313 K314	D310-L316 WeakPolarHBondContact CB-O 3.4Å; D310-L316 PolarHBondContact N-O 3.31Å; L313-L316 HydrophobicContact CB-CB 3.98Å; L313-L316 WeakPolarHBondContact O-CB 3.28Å; L313-L316 PolarHBondContact O-N 3.1Å; K314-L316 PolarHBondContact O-N 2.96Å
317	E	84.1	Confident	89.2	Confident	6 Å²	6	23.2 Å²	23.2	3%	0.028	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	158.9	165.2	68.4	-53.6	121.8	0	0	112.6	I308 L322 Y341 E343	I308-E317 HydrophobicContact CB-CB 4.47Å; I308-E317 HydrophobicContact CD1-CB 4.11Å; I308-E317 HydrophobicContact CG1-CB 4.39Å; I308-E317 VanDerWaalsContact O-CA 3.3Å; I308-E317 WeakPolarHBondContact O-CA 3.39Å; E317-L322 HydrophobicContact CG-CD1 4.3Å; E317-Y341 HydrophobicContact CB-CD1 4.36Å; E317-Y341 HydrophobicContact CG-CD1 4.32Å; E317-Y341 WeakPolarHBondContact OE2-CD1 3.19Å; E317-Y341 WeakPolarHBondContact OE2-CE1 3.41Å; E317-E343 HydrophobicContact CG-CB 3.91Å; E317-E343 HydrophobicContact CG-CG 3.61Å; E317-E343 WeakPolarHBondContact OE1-CG 3.42Å
318	T	83.7	Confident	89.1	Confident	11 Å²	11	23.9 Å²	23.9	7%	0.067	12%	0.123	C	C	.	.			trans	-132.4	148	178	60.9	0	0	0	0	109.3	D310 L313 T320 A321 L322	D310-T318 HydrophobicContact CB-CG2 4.28Å; L313-T318 HydrophobicContact CD1-CG2 3.56Å; T318-T320 PolarHBondContact O-N 2.94Å; T318-A321 PolarHBondContact O-N 3.3Å; T318-A321 VanDerWaalsContact OG1-CB 3.31Å; T318-A321 WeakPolarHBondContact OG1-CB 3.4Å; T318-A321 PolarHBondContact OG1-N 3.36Å; T318-A321 VanDerWaalsContact OG1-N 3.14Å; T318-L322 WeakPolarHBondContact O-CG 3.4Å; T318-L322 PolarHBondContact O-N 3.47Å
319	G	81.8	Confident	89.1	Confident	28 Å²	28	23.9 Å²	23.9	29%	0.289	12%	0.123	S	C	.	.	H	α-helix	trans	-52.5	-37.4	172.6	0	0	0	0	0	112	A321 L322 L323 C842	G319-A321 PolarHBondContact O-N 3.42Å; G319-L322 PolarHBondContact O-N 3.21Å; G319-L323 VanDerWaalsContact O-CB 3.31Å; G319-L323 WeakPolarHBondContact O-CB 3.43Å; G319-L323 PolarHBondContact O-N 2.91Å; G319-C842 CarbonylContact C-O 3.58Å; G319-C842 WeakPolarHBondContact CA-O 3.5Å
320	T	87.5	Confident	89.1	Confident	14 Å²	14	24.9 Å²	24.9	9%	0.086	13%	0.128	C	C	.	.	H	α-helix	trans	-58.6	-50.3	175.3	-56.9	0	0	0	0	111.6	T318 R324 C842 G843	T318-T320 PolarHBondContact O-N 2.94Å; T320-R324 WeakPolarHBondContact O-CD 3.49Å; T320-R324 VanDerWaalsContact O-CG 3.29Å; T320-R324 WeakPolarHBondContact O-CG 3.36Å; T320-R324 PolarHBondContact O-N 2.85Å; T320-R324 VanDerWaalsContact O-N 3.16Å; T320-C842 PolarHBondContact N-O 3.12Å; T320-G843 WeakPolarHBondContact OG1-CA 3.44Å
321	A	91.6	Very high	89.1	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68.2	-39.4	-177.4	0	0	0	0	0	111.7	F97 T98 I308 T318 G319 A325	F97-A321 HydrophobicContact CB-CB 4.05Å; T98-A321 HydrophobicContact CG2-CB 4.06Å; I308-A321 HydrophobicContact CB-CB 4.09Å; I308-A321 HydrophobicContact CG2-CB 4.2Å; T318-A321 PolarHBondContact O-N 3.3Å; T318-A321 VanDerWaalsContact OG1-CB 3.31Å; T318-A321 WeakPolarHBondContact OG1-CB 3.4Å; T318-A321 PolarHBondContact OG1-N 3.36Å; T318-A321 VanDerWaalsContact OG1-N 3.14Å; G319-A321 PolarHBondContact O-N 3.42Å; A321-A325 VanDerWaalsContact O-CB 3.25Å; A321-A325 WeakPolarHBondContact O-CB 3.24Å; A321-A325 PolarHBondContact O-N 3.04Å
322	L	87.9	Confident	89.3	Confident	11 Å²	11	30.7 Å²	30.7	6%	0.058	15%	0.151	C	C	.	.	H	α-helix	trans	-63.2	-48.2	176.8	-68.9	168.8	0	0	0	111.8	I308 E317 T318 G319 R324 A325 I326 Y339 V345	I308-L322 HydrophobicContact CD1-CD2 3.76Å; I308-L322 HydrophobicContact CG2-CD2 4.37Å; E317-L322 HydrophobicContact CG-CD1 4.3Å; T318-L322 WeakPolarHBondContact O-CG 3.4Å; T318-L322 PolarHBondContact O-N 3.47Å; G319-L322 PolarHBondContact O-N 3.21Å; L322-R324 PolarHBondContact O-N 3.25Å; L322-A325 PolarHBondContact O-N 3.32Å; L322-I326 WeakPolarHBondContact O-CG1 3.37Å; L322-I326 PolarHBondContact O-N 2.78Å; L322-Y339 HydrophobicContact CD2-CE2 3.59Å; L322-V345 HydrophobicContact CB-CG1 4.47Å; L322-V345 HydrophobicContact CD1-CG2 3.97Å; L322-V345 HydrophobicContact CD2-CG1 4.47Å; L322-V345 HydrophobicContact CD2-CG2 3.76Å; L322-V345 HydrophobicContact CG-CG2 4.38Å
323	L	85.4	Confident	89.4	Confident	34 Å²	34	37.2 Å²	37.2	18%	0.178	18%	0.176	C	C	.	.	H	α-helix	trans	-58	-48.7	178.7	176.2	67.1	0	0	0	111.5	G319 A325 I326 T327 Y802	G319-L323 VanDerWaalsContact O-CB 3.31Å; G319-L323 WeakPolarHBondContact O-CB 3.43Å; G319-L323 PolarHBondContact O-N 2.91Å; L323-A325 VanDerWaalsContact C-N 3.33Å; L323-A325 PolarHBondContact O-N 3.45Å; L323-I326 PolarHBondContact O-N 2.99Å; L323-T327 WeakPolarHBondContact O-CB 3.38Å; L323-T327 PolarHBondContact O-N 2.83Å; L323-T327 PolarHBondContact O-OG1 2.98Å; L323-Y802 HydrophobicContact CD1-CD1 3.79Å; L323-Y802 HydrophobicContact CD1-CE1 3.39Å; L323-Y802 HydrophobicContact CD1-CE2 4.45Å; L323-Y802 HydrophobicContact CD1-CG 4.47Å; L323-Y802 HydrophobicContact CD2-CD2 4.33Å; L323-Y802 HydrophobicContact CD2-CE1 4.05Å; L323-Y802 HydrophobicContact CD2-CE2 3.65Å; L323-Y802 VanDerWaalsContact CD2-CZ 3.49Å; L323-Y802 HydrophobicContact CG-CE1 4.36Å
324	R	91.2	Very high	89.7	Confident	14 Å²	14	37.4 Å²	37.4	5%	0.053	18%	0.177	C	C	.	.	H	α-helix	trans	-60.5	-43.8	176.8	-70.2	167.8	172.2	175.1	-3.4	111.3	F97 T320 L322 T327 Y328 R799 D800	F97-R324 HydrophobicContact CB-CB 3.95Å; F97-R324 HydrophobicContact CD1-CB 3.4Å; F97-R324 VanDerWaalsContact CD1-CB 3.4Å; F97-R324 HydrophobicContact CD1-CG 4.34Å; F97-R324 HydrophobicContact CE1-CB 4Å; F97-R324 HydrophobicContact CG-CB 3.77Å; F97-R324 VanDerWaalsContact O-CD 3.27Å; F97-R324 WeakPolarHBondContact O-CD 3.41Å; F97-R324 PolarHBondContact O-NH1 3.09Å; T320-R324 WeakPolarHBondContact O-CD 3.49Å; T320-R324 VanDerWaalsContact O-CG 3.29Å; T320-R324 WeakPolarHBondContact O-CG 3.36Å; T320-R324 PolarHBondContact O-N 2.85Å; T320-R324 VanDerWaalsContact O-N 3.16Å; L322-R324 PolarHBondContact O-N 3.25Å; R324-T327 PolarHBondContact O-N 3.21Å; R324-Y328 WeakPolarHBondContact O-CB 3.47Å; R324-Y328 PolarHBondContact O-N 3.24Å; R324-R799 VanDerWaalsContact NH2-NH2 3.11Å; R324-D800 IonicContact CZ-OD1 3.62Å; R324-D800 IonicContact NE-OD1 3.93Å; R324-D800 PolarHBondContact NE-OD1 3.04Å; R324-D800 VanDerWaalsContact NH2-CG 3.31Å; R324-D800 IonicContact NH2-OD1 2.79Å; R324-D800 PolarHBondContact NH2-OD1 3.49Å; R324-D800 IonicContact NH2-OD2 2.6Å; R324-D800 PolarHBondContact NH2-OD2 2.77Å
325	A	93.4	Very high	90.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-47.5	179.9	0	0	0	0	0	112.8	L70 F97 L306 I308 A321 L322 L323 Y328 C329	L70-A325 HydrophobicContact CD2-CB 3.91Å; L70-A325 HydrophobicContact CG-CB 4.03Å; F97-A325 HydrophobicContact CD2-CB 3.53Å; F97-A325 HydrophobicContact CE2-CB 3.77Å; F97-A325 HydrophobicContact CG-CB 4.4Å; L306-A325 HydrophobicContact CB-CB 4.45Å; L306-A325 HydrophobicContact CD1-CB 4.29Å; I308-A325 HydrophobicContact CG2-CB 3.96Å; A321-A325 VanDerWaalsContact O-CB 3.25Å; A321-A325 WeakPolarHBondContact O-CB 3.24Å; A321-A325 PolarHBondContact O-N 3.04Å; L322-A325 PolarHBondContact O-N 3.32Å; L323-A325 VanDerWaalsContact C-N 3.33Å; L323-A325 PolarHBondContact O-N 3.45Å; A325-Y328 PolarHBondContact O-N 2.94Å; A325-C329 PolarHBondContact O-N 3.33Å; A325-C329 PolarHBondContact O-SG 3.1Å
326	I	90.1	Very high	90.5	Very high	13 Å²	13	30.2 Å²	30.2	7%	0.067	14%	0.144	C	C	.	.	H	α-helix	trans	-65.3	-43.8	179.6	-63.6	-57.4	0	0	0	111	L70 L322 L323 Y328 C329 I330 I337 V345 I347 A350	L70-I326 HydrophobicContact CD2-CD1 4.08Å; L322-I326 WeakPolarHBondContact O-CG1 3.37Å; L322-I326 PolarHBondContact O-N 2.78Å; L323-I326 PolarHBondContact O-N 2.99Å; I326-Y328 VanDerWaalsContact C-N 3.26Å; I326-Y328 PolarHBondContact O-N 3.3Å; I326-C329 WeakPolarHBondContact O-CB 3.26Å; I326-C329 PolarHBondContact O-N 2.88Å; I326-I330 HydrophobicContact CG2-CD1 4.21Å; I326-I330 WeakPolarHBondContact O-CG1 3.48Å; I326-I330 PolarHBondContact O-N 3.41Å; I326-I337 HydrophobicContact CD1-CD1 3.88Å; I326-V345 HydrophobicContact CD1-CG1 4.09Å; I326-V345 HydrophobicContact CG1-CG1 3.8Å; I326-I347 HydrophobicContact CD1-CG2 4.06Å; I326-A350 HydrophobicContact CG2-CB 3.9Å
327	T	90.4	Very high	90.9	Very high	29 Å²	29	29.5 Å²	29.5	18%	0.178	14%	0.14	C	C	.	.	H	α-helix	trans	-58.5	-42.1	175.4	-55.8	0	0	0	0	111	L323 R324 I330 E331 N803	L323-T327 WeakPolarHBondContact O-CB 3.38Å; L323-T327 PolarHBondContact O-N 2.83Å; L323-T327 PolarHBondContact O-OG1 2.98Å; R324-T327 PolarHBondContact O-N 3.21Å; T327-I330 PolarHBondContact O-N 3.35Å; T327-E331 PolarHBondContact O-N 3.27Å; T327-N803 HydrophobicContact CG2-CB 4.21Å
328	Y	93.9	Very high	91.3	Very high	24 Å²	24	29.2 Å²	29.2	9%	0.094	14%	0.139	C	C	.	.	H	α-helix	trans	-67.4	-39.4	177.4	-164.2	-110.5	0	0	0	113.2	D93 V95 F97 I304 L306 R324 A325 I326 I330 E331 K332	D93-Y328 PolarHBondContact OD2-OH 3.13Å; V95-Y328 HydrophobicContact CG2-CE1 4.06Å; F97-Y328 HydrophobicContact CE1-CG 4.38Å; F97-Y328 HydrophobicContact CE2-CD1 4.39Å; F97-Y328 HydrophobicContact CE2-CG 4.44Å; F97-Y328 VanDerWaalsContact CZ-CB 3.43Å; F97-Y328 AromaticContact CZ-CD1 3.79Å; F97-Y328 HydrophobicContact CZ-CD1 3.79Å; F97-Y328 HydrophobicContact CZ-CD2 4.22Å; F97-Y328 AromaticContact CZ-CG 3.56Å; F97-Y328 HydrophobicContact CZ-CG 3.56Å; I304-Y328 HydrophobicContact CG2-CE1 4.37Å; L306-Y328 HydrophobicContact CD1-CD1 4.42Å; L306-Y328 HydrophobicContact CD2-CD1 3.89Å; L306-Y328 HydrophobicContact CD2-CE1 4.22Å; R324-Y328 WeakPolarHBondContact O-CB 3.47Å; R324-Y328 PolarHBondContact O-N 3.24Å; A325-Y328 PolarHBondContact O-N 2.94Å; I326-Y328 VanDerWaalsContact C-N 3.26Å; I326-Y328 PolarHBondContact O-N 3.3Å; Y328-I330 VanDerWaalsContact C-N 3.3Å; Y328-I330 PolarHBondContact O-N 2.84Å; Y328-E331 PolarHBondContact O-N 3.28Å; Y328-K332 HydrophobicContact CD1-CG 3.98Å; Y328-K332 HydrophobicContact CD2-CG 4.49Å; Y328-K332 HydrophobicContact CE1-CD 4.29Å; Y328-K332 HydrophobicContact CE1-CG 3.73Å; Y328-K332 HydrophobicContact CE2-CG 4.24Å; Y328-K332 HydrophobicContact CG-CG 4.37Å; Y328-K332 WeakPolarHBondContact O-CB 3.16Å; Y328-K332 VanDerWaalsContact O-CG 3.28Å; Y328-K332 WeakPolarHBondContact O-CG 3.38Å; Y328-K332 PolarHBondContact O-N 3.38Å; Y328-K332 WeakPolarHBondContact OH-CE 3.37Å
329	C	94.7	Very high	91.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.1	-43.3	174.1	-75.4	0	0	0	0	111.8	A68 L306 A325 I326 K332 R333 V334 I337 I356	A68-C329 VanDerWaalsContact CB-SG 3.51Å; L306-C329 WeakPolarHBondContact CD1-SG 3.42Å; A325-C329 PolarHBondContact O-N 3.33Å; A325-C329 PolarHBondContact O-SG 3.1Å; I326-C329 WeakPolarHBondContact O-CB 3.26Å; I326-C329 PolarHBondContact O-N 2.88Å; C329-K332 PolarHBondContact O-N 3.49Å; C329-R333 PolarHBondContact O-N 2.93Å; C329-V334 HydrophobicContact CB-CG2 3.53Å; C329-V334 PolarHBondContact O-N 3.27Å; C329-V334 VanDerWaalsContact O-N 3.13Å; C329-I337 HydrophobicContact CB-CD1 3.8Å; C329-I337 HydrophobicContact CB-CG1 4.22Å; C329-I356 HydrophobicContact CB-CD1 4.34Å
330	I	92.4	Very high	91.7	Very high	20 Å²	20	27.5 Å²	27.5	10%	0.103	12%	0.123	C	C	.	.	H	α-helix	trans	-62.7	-51.1	175.3	-68.9	168	0	0	0	110.4	I326 T327 Y328 K332 R333 A350 H354 I356	I326-I330 HydrophobicContact CG2-CD1 4.21Å; I326-I330 WeakPolarHBondContact O-CG1 3.48Å; I326-I330 PolarHBondContact O-N 3.41Å; T327-I330 PolarHBondContact O-N 3.35Å; Y328-I330 VanDerWaalsContact C-N 3.3Å; Y328-I330 PolarHBondContact O-N 2.84Å; I330-K332 PolarHBondContact O-N 3.26Å; I330-R333 PolarHBondContact O-N 2.93Å; I330-A350 HydrophobicContact CD1-CB 4.09Å; I330-A350 HydrophobicContact CG1-CB 4.06Å; I330-H354 HydrophobicContact CG1-CB 4.4Å; I330-H354 VanDerWaalsContact CG2-CE1 3.45Å; I330-H354 WeakPolarHBondContact CG2-CE1 3.41Å; I330-H354 WeakPolarHBondContact CG2-NE2 3.47Å; I330-I356 HydrophobicContact CG1-CD1 4.17Å
331	E	92	Very high	91.3	Very high	122 Å²	122	28.6 Å²	28.6	57%	0.57	13%	0.126	S	C	*	.	H	α-helix	trans	-57.4	-38.9	179.5	-167.9	-155.3	133.2	0	0	112	T327 Y328 R333	T327-E331 PolarHBondContact O-N 3.27Å; Y328-E331 PolarHBondContact O-N 3.28Å; E331-R333 VanDerWaalsContact C-N 3.34Å
332	K	94	Very high	90.1	Very high	36 Å²	36	30.3 Å²	30.3	16%	0.157	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-4.6	-179.2	-65.7	-74.9	158.2	-89.1	0	113.9	I304 Y328 C329 I330 V334	I304-K332 HydrophobicContact CD1-CB 4.15Å; I304-K332 HydrophobicContact CD1-CG 4.26Å; Y328-K332 HydrophobicContact CD1-CG 3.98Å; Y328-K332 HydrophobicContact CD2-CG 4.49Å; Y328-K332 HydrophobicContact CE1-CD 4.29Å; Y328-K332 HydrophobicContact CE1-CG 3.73Å; Y328-K332 HydrophobicContact CE2-CG 4.24Å; Y328-K332 HydrophobicContact CG-CG 4.37Å; Y328-K332 WeakPolarHBondContact O-CB 3.16Å; Y328-K332 VanDerWaalsContact O-CG 3.28Å; Y328-K332 WeakPolarHBondContact O-CG 3.38Å; Y328-K332 PolarHBondContact O-N 3.38Å; Y328-K332 WeakPolarHBondContact OH-CE 3.37Å; C329-K332 PolarHBondContact O-N 3.49Å; I330-K332 PolarHBondContact O-N 3.26Å; K332-V334 VanDerWaalsContact C-N 3.28Å; K332-V334 HydrophobicContact CB-CG1 4Å; K332-V334 PolarHBondContact O-N 3.41Å
333	R	93.8	Very high	88.9	Confident	210 Å²	210	30.4 Å²	30.4	79%	0.792	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	48.2	-176.9	-56.8	-179.9	-179.7	177.6	-1.7	111.8	C329 I330 E331	C329-R333 PolarHBondContact O-N 2.93Å; I330-R333 PolarHBondContact O-N 2.93Å; E331-R333 VanDerWaalsContact C-N 3.34Å
334	V	96.1	Very high	87.6	Confident	5 Å²	5	30.7 Å²	30.7	3%	0.03	14%	0.144	C	C	.	.			trans	-65.2	149.6	176.5	-54.4	0	0	0	0	109.8	L66 A68 I304 C329 K332 I337 I356	L66-V334 HydrophobicContact CD2-CG1 3.95Å; L66-V334 HydrophobicContact CG-CB 4.49Å; L66-V334 HydrophobicContact CG-CG1 4.19Å; A68-V334 HydrophobicContact CB-CB 4.33Å; A68-V334 HydrophobicContact CB-CG1 4.22Å; A68-V334 HydrophobicContact CB-CG2 4.11Å; I304-V334 HydrophobicContact CD1-CG1 3.99Å; C329-V334 HydrophobicContact CB-CG2 3.53Å; C329-V334 PolarHBondContact O-N 3.27Å; C329-V334 VanDerWaalsContact O-N 3.13Å; K332-V334 VanDerWaalsContact C-N 3.28Å; K332-V334 HydrophobicContact CB-CG1 4Å; K332-V334 PolarHBondContact O-N 3.41Å; V334-I337 HydrophobicContact CG2-CG1 3.99Å; V334-I356 HydrophobicContact CG2-CD1 4.01Å; V334-I356 HydrophobicContact CG2-CG2 3.96Å; V334-I356 WeakPolarHBondContact O-CG1 3.35Å
335	H	95.5	Very high	86.3	Confident	41 Å²	41	30.6 Å²	30.6	19%	0.19	15%	0.145	C	C	.	.	S	Bend	trans	-89.3	-37.5	-176.9	-57.1	91.8	0	0	0	111.3	V65 L66 V357 I464 K468	V65-H335 HydrophobicContact CG1-CB 3.82Å; L66-H335 PolarHBondContact N-ND1 3.13Å; L66-H335 PolarHBondContact O-N 3.42Å; H335-V357 PolarHBondContact O-N 3.18Å; H335-I464 HydrophobicContact CB-CD1 4.42Å; H335-K468 PolarHBondContact CD2-NZ 2.98Å; H335-K468 PolarHBondContact CE1-NZ 2.77Å; H335-K468 VanDerWaalsContact CE1-NZ 3.34Å; H335-K468 PolarHBondContact NE2-NZ 2.86Å
336	I	94.9	Very high	85.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	134.1	-176.2	-59.6	167.9	0	0	0	109.1	V65 L66 I67 A68 V357 I359 A457 V460 A461 I464	V65-I336 HydrophobicContact CG1-CD1 4.01Å; V65-I336 HydrophobicContact CG1-CG1 4.5Å; L66-I336 PolarHBondContact O-N 3.34Å; I67-I336 CarbonylContact C-O 3.58Å; I67-I336 WeakPolarHBondContact CA-O 3.3Å; I67-I336 HydrophobicContact CG1-CB 4.3Å; I67-I336 HydrophobicContact CG1-CD1 4.34Å; I67-I336 HydrophobicContact CG2-CG2 4.41Å; A68-I336 PolarHBondContact N-O 3.35Å; I336-V357 CarbonylContact C-O 3.5Å; I336-V357 VanDerWaalsContact CA-O 3.22Å; I336-V357 WeakPolarHBondContact CA-O 3.47Å; I336-V357 HydrophobicContact CG1-CB 4.27Å; I336-I359 HydrophobicContact CG2-CD1 3.98Å; I336-A457 WeakPolarHBondContact CD1-O 3.16Å; I336-A457 HydrophobicContact CG2-CB 4.01Å; I336-V460 HydrophobicContact CD1-CB 4.22Å; I336-V460 HydrophobicContact CD1-CG1 3.91Å; I336-V460 HydrophobicContact CG1-CG1 4.35Å; I336-A461 HydrophobicContact CD1-CB 3.66Å; I336-I464 HydrophobicContact CD1-CD1 3.92Å; I336-I464 HydrophobicContact CG1-CD1 3.77Å
337	I	94.2	Very high	84.5	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	117.7	164.4	-70.6	166.5	0	0	0	107.6	A68 L70 I326 C329 V334 I356 V357 F358 I359	A68-I337 HydrophobicContact CB-CG1 4.15Å; L70-I337 HydrophobicContact CD1-CG2 3.96Å; L70-I337 HydrophobicContact CD2-CG2 4.15Å; I326-I337 HydrophobicContact CD1-CD1 3.88Å; C329-I337 HydrophobicContact CB-CD1 3.8Å; C329-I337 HydrophobicContact CB-CG1 4.22Å; V334-I337 HydrophobicContact CG2-CG1 3.99Å; I337-I356 HydrophobicContact CB-CG2 4.44Å; I337-I356 HydrophobicContact CD1-CG2 3.7Å; I337-I356 HydrophobicContact CG1-CG2 3.74Å; I337-V357 PolarHBondContact N-O 2.99Å; I337-F358 HydrophobicContact CB-CD2 3.84Å; I337-F358 HydrophobicContact CB-CE2 4.49Å; I337-F358 HydrophobicContact CD1-CD2 4.47Å; I337-F358 HydrophobicContact CG2-CD2 3.48Å; I337-F358 VanDerWaalsContact CG2-CD2 3.48Å; I337-F358 HydrophobicContact CG2-CE2 3.64Å; I337-I359 PolarHBondContact O-N 3.11Å
338	N	93.8	Very high	83.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	124.6	165.1	177.2	81.9	0	0	0	109.8	I67 A68 L70 V280 S340 I359 S453 P454 A457	I67-N338 HydrophobicContact CG2-CB 4.44Å; A68-N338 PolarHBondContact O-N 2.9Å; L70-N338 PolarHBondContact N-O 3.23Å; V280-N338 WeakPolarHBondContact CG1-ND2 3.32Å; N338-S340 PolarHBondContact ND2-OG 3.5Å; N338-S340 VanDerWaalsContact ND2-OG 3.09Å; N338-I359 WeakPolarHBondContact CA-O 3.35Å; N338-S453 WeakPolarHBondContact OD1-CB 3.44Å; N338-S453 PolarHBondContact OD1-O 3.23Å; N338-S453 PolarHBondContact OD1-OG 2.85Å; N338-P454 VanDerWaalsContact OD1-CA 3.29Å; N338-P454 WeakPolarHBondContact OD1-CA 3.4Å; N338-A457 HydrophobicContact CB-CB 3.96Å
339	Y	89.6	Confident	83.1	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	95.4	179.5	-175.4	-99.6	0	0	0	111.3	L70 I308 L322 Y341 E343 V345 F358 I359 G360 S361 P375	L70-Y339 HydrophobicContact CB-CD2 3.91Å; L70-Y339 HydrophobicContact CD2-CD2 4.18Å; I308-Y339 HydrophobicContact CD1-CD2 4.04Å; I308-Y339 HydrophobicContact CD1-CE2 3.42Å; I308-Y339 VanDerWaalsContact CD1-CE2 3.42Å; L322-Y339 HydrophobicContact CD2-CE2 3.59Å; Y339-Y341 VanDerWaalsContact C-N 3.28Å; Y339-Y341 VanDerWaalsContact CE1-C 3.45Å; Y339-Y341 VanDerWaalsContact CE1-O 3.26Å; Y339-Y341 WeakPolarHBondContact CE1-O 3.46Å; Y339-Y341 VanDerWaalsContact CZ-CB 3.41Å; Y339-Y341 PolarHBondContact O-N 2.85Å; Y339-Y341 WeakPolarHBondContact OH-CB 3.34Å; Y339-E343 WeakPolarHBondContact OH-CB 3.34Å; Y339-E343 PolarHBondContact OH-N 3.45Å; Y339-V345 HydrophobicContact CE1-CG2 4.16Å; Y339-V345 HydrophobicContact CE2-CG2 3.97Å; Y339-F358 AromaticContact CD1-CZ 3.94Å; Y339-F358 HydrophobicContact CD1-CZ 3.94Å; Y339-F358 HydrophobicContact CG-CE2 4.22Å; Y339-F358 AromaticContact CG-CZ 3.72Å; Y339-F358 HydrophobicContact CG-CZ 3.72Å; Y339-I359 PolarHBondContact N-O 3.15Å; Y339-G360 WeakPolarHBondContact O-CA 3.31Å; Y339-S361 PolarHBondContact O-N 3Å; Y339-P375 HydrophobicContact CD1-CB 4.46Å; Y339-P375 HydrophobicContact CD1-CG 3.65Å; Y339-P375 HydrophobicContact CE1-CG 4.07Å
340	S	83.6	Confident	82.6	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.028	20%	0.201	C	C	.	.			trans	-94.7	34.3	-177.5	-66.5	0	0	0	0	113.3	N338 S450	N338-S340 PolarHBondContact ND2-OG 3.5Å; N338-S340 VanDerWaalsContact ND2-OG 3.09Å; S340-S450 PolarHBondContact O-OG 2.92Å; S340-S450 PolarHBondContact OG-O 2.75Å
341	Y	78.7	Confident	82.2	Confident	36 Å²	36	39.7 Å²	39.7	14%	0.141	20%	0.2	C	C	.	.	S	Bend	trans	-122	175.3	179.7	-100.4	-97.6	0	0	0	110.9	T72 I308 N315 E317 Y339	T72-Y341 HydrophobicContact CG2-CE2 4.11Å; T72-Y341 WeakPolarHBondContact CG2-OH 3.44Å; I308-Y341 HydrophobicContact CD1-CD2 4.41Å; I308-Y341 HydrophobicContact CD1-CG 4.38Å; N315-Y341 WeakPolarHBondContact O-CE1 3.29Å; N315-Y341 PolarHBondContact O-OH 3.09Å; E317-Y341 HydrophobicContact CB-CD1 4.36Å; E317-Y341 HydrophobicContact CG-CD1 4.32Å; E317-Y341 WeakPolarHBondContact OE2-CD1 3.19Å; E317-Y341 WeakPolarHBondContact OE2-CE1 3.41Å; Y339-Y341 VanDerWaalsContact C-N 3.28Å; Y339-Y341 VanDerWaalsContact CE1-C 3.45Å; Y339-Y341 VanDerWaalsContact CE1-O 3.26Å; Y339-Y341 WeakPolarHBondContact CE1-O 3.46Å; Y339-Y341 VanDerWaalsContact CZ-CB 3.41Å; Y339-Y341 PolarHBondContact O-N 2.85Å; Y339-Y341 WeakPolarHBondContact OH-CB 3.34Å
342	A	66.2	Low	81.4	Confident	36 Å²	36	37.1 Å²	37.1	30%	0.298	19%	0.185	S	C	.	.			trans	-117.1	29.9	-163.3	0	0	0	0	0	115.1	S374	A342-S374 CarbonylContact C-O 3.54Å; A342-S374 VanDerWaalsContact CA-O 3.31Å; A342-S374 WeakPolarHBondContact CA-O 3.38Å
343	E	64	Low	80.7	Confident	14 Å²	14	37.1 Å²	37.1	7%	0.065	19%	0.187	C	C	.	.	S	Bend	trans	-127.2	149.1	-167.7	-55.1	-116.9	142.1	0	0	113.1	E317 Y339 V345 S374 L836 Y837	E317-E343 HydrophobicContact CG-CB 3.91Å; E317-E343 HydrophobicContact CG-CG 3.61Å; E317-E343 WeakPolarHBondContact OE1-CG 3.42Å; Y339-E343 WeakPolarHBondContact OH-CB 3.34Å; Y339-E343 PolarHBondContact OH-N 3.45Å; E343-V345 PolarHBondContact O-N 3.07Å; E343-S374 PolarHBondContact N-O 3.43Å; E343-S374 WeakPolarHBondContact O-CB 3.4Å; E343-L836 WeakPolarHBondContact OE1-CD2 3.18Å; E343-L836 WeakPolarHBondContact OE2-CD2 3.37Å; E343-L836 WeakPolarHBondContact OE2-CG 3.42Å; E343-Y837 HydrophobicContact CB-CE1 3.7Å; E343-Y837 HydrophobicContact CG-CE1 3.71Å; E343-Y837 VanDerWaalsContact OE1-CE1 3.28Å; E343-Y837 WeakPolarHBondContact OE1-CE1 3.48Å; E343-Y837 VanDerWaalsContact OE1-CZ 3.22Å; E343-Y837 PolarHBondContact OE1-OH 2.79Å; E343-Y837 WeakPolarHBondContact OE2-CE1 3.48Å
344	P	57.3	Low	80.3	Confident	40 Å²	40	30.6 Å²	30.6	26%	0.26	17%	0.166	S	C	.	.			trans	-67.6	129.4	178.3	10.1	-5.1	0	0	0	108.7	S374 S378 Y837	P344-S374 WeakPolarHBondContact CA-OG 3.38Å; P344-S374 VanDerWaalsContact CB-OG 3.24Å; P344-S374 WeakPolarHBondContact CB-OG 3.38Å; P344-S374 WeakPolarHBondContact CD-OG 3.41Å; P344-S374 WeakPolarHBondContact CG-OG 3.09Å; P344-S378 WeakPolarHBondContact CB-OG 3.43Å; P344-Y837 HydrophobicContact CG-CD1 3.27Å; P344-Y837 HydrophobicContact CG-CD2 4.4Å; P344-Y837 HydrophobicContact CG-CE1 3.9Å; P344-Y837 HydrophobicContact CG-CG 3.49Å; P344-Y837 VanDerWaalsContact CG-CG 3.49Å
345	V	63.8	Low	79.8	Confident	11 Å²	11	31.6 Å²	31.6	7%	0.067	18%	0.177	C	C	.	.			trans	-125.2	129.4	176.5	-171.9	0	0	0	0	106.1	L322 I326 Y339 E343 I347	L322-V345 HydrophobicContact CB-CG1 4.47Å; L322-V345 HydrophobicContact CD1-CG2 3.97Å; L322-V345 HydrophobicContact CD2-CG1 4.47Å; L322-V345 HydrophobicContact CD2-CG2 3.76Å; L322-V345 HydrophobicContact CG-CG2 4.38Å; I326-V345 HydrophobicContact CD1-CG1 4.09Å; I326-V345 HydrophobicContact CG1-CG1 3.8Å; Y339-V345 HydrophobicContact CE1-CG2 4.16Å; Y339-V345 HydrophobicContact CE2-CG2 3.97Å; E343-V345 PolarHBondContact O-N 3.07Å; V345-I347 HydrophobicContact CB-CG2 3.74Å; V345-I347 HydrophobicContact CG1-CG2 3.48Å; V345-I347 VanDerWaalsContact CG1-CG2 3.48Å; V345-I347 PolarHBondContact O-N 3.02Å
346	T	69.4	Low	79.5	Confident	127 Å²	127	29.8 Å²	29.8	78%	0.779	17%	0.169	S	C	*	.			trans	-74.3	94.7	170.8	-51.9	0	0	0	0	108.2
347	I	76.9	Confident	79.3	Confident	3 Å²	3	30 Å²	30	2%	0.015	17%	0.17	C	C	.	.			trans	-108.2	-3.8	-177.1	61.4	170.2	0	0	0	113.2	I326 V345 D349 A350 V351 F358 C379 A381	I326-I347 HydrophobicContact CD1-CG2 4.06Å; V345-I347 HydrophobicContact CB-CG2 3.74Å; V345-I347 HydrophobicContact CG1-CG2 3.48Å; V345-I347 VanDerWaalsContact CG1-CG2 3.48Å; V345-I347 PolarHBondContact O-N 3.02Å; I347-D349 VanDerWaalsContact C-N 3.25Å; I347-D349 PolarHBondContact O-N 3.46Å; I347-A350 WeakPolarHBondContact O-CB 3.38Å; I347-A350 PolarHBondContact O-N 3.32Å; I347-V351 HydrophobicContact CB-CG2 4.22Å; I347-V351 HydrophobicContact CD1-CG2 3.93Å; I347-V351 HydrophobicContact CG1-CG2 4.13Å; I347-V351 WeakPolarHBondContact O-CG2 3.2Å; I347-V351 PolarHBondContact O-N 3.04Å; I347-F358 HydrophobicContact CB-CD2 4.32Å; I347-F358 HydrophobicContact CD1-CB 3.71Å; I347-F358 HydrophobicContact CD1-CD1 3.44Å; I347-F358 VanDerWaalsContact CD1-CD1 3.44Å; I347-F358 HydrophobicContact CD1-CD2 3.73Å; I347-F358 HydrophobicContact CD1-CE1 3.86Å; I347-F358 HydrophobicContact CD1-CE2 4.15Å; I347-F358 HydrophobicContact CD1-CG 3.34Å; I347-F358 HydrophobicContact CD1-CZ 4.19Å; I347-F358 HydrophobicContact CG2-CD2 3.78Å; I347-F358 HydrophobicContact CG2-CE2 3.66Å; I347-F358 HydrophobicContact CG2-CZ 4.27Å; I347-C379 HydrophobicContact CD1-CB 3.65Å; I347-C379 VanDerWaalsContact CD1-SG 3.59Å; I347-C379 HydrophobicContact CG1-CB 3.89Å; I347-A381 HydrophobicContact CD1-CB 3.63Å
348	N	75.3	Confident	79	Confident	82 Å²	82	30.2 Å²	30.2	44%	0.439	17%	0.171	S	C	.	.	H	α-helix	trans	-54.4	-45.8	-170.9	-70.6	-14	0	0	0	111.1	V351 Y352	N348-V351 PolarHBondContact O-N 2.59Å; N348-Y352 HydrophobicContact CB-CD2 3.98Å; N348-Y352 HydrophobicContact CB-CE2 4.35Å; N348-Y352 VanDerWaalsContact O-CB 3.25Å; N348-Y352 WeakPolarHBondContact O-CB 3.28Å; N348-Y352 VanDerWaalsContact O-CD2 3.28Å; N348-Y352 WeakPolarHBondContact O-CD2 3.32Å; N348-Y352 PolarHBondContact O-N 2.64Å
349	D	79	Confident	78.8	Confident	53 Å²	53	30.4 Å²	30.4	28%	0.283	17%	0.172	S	C	.	.	I	π-helix	trans	-62.3	-47.4	178.2	-174.7	54.2	0	0	0	112.6	I347 V351 N353 H354 N803	I347-D349 VanDerWaalsContact C-N 3.25Å; I347-D349 PolarHBondContact O-N 3.46Å; D349-V351 VanDerWaalsContact C-N 3.29Å; D349-V351 PolarHBondContact O-N 3.07Å; D349-N353 WeakPolarHBondContact O-CA 3.47Å; D349-N353 VanDerWaalsContact O-CB 3.28Å; D349-N353 WeakPolarHBondContact O-CB 3.48Å; D349-N353 PolarHBondContact O-N 3.28Å; D349-N353 WeakPolarHBondContact OD1-CB 3.32Å; D349-N353 PolarHBondContact OD1-ND2 2.97Å; D349-H354 PolarHBondContact O-N 2.94Å; D349-H354 IonicContact OD2-CD2 3.41Å; D349-H354 IonicContact OD2-NE2 2.93Å; D349-N803 PolarHBondContact OD2-ND2 3.38Å
350	A	84.5	Confident	78.7	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.008	17%	0.172	C	C	.	.	I	π-helix	trans	-57.5	-39.2	175.1	0	0	0	0	0	113.1	I326 I330 I347 H354 G355 I356	I326-A350 HydrophobicContact CG2-CB 3.9Å; I330-A350 HydrophobicContact CD1-CB 4.09Å; I330-A350 HydrophobicContact CG1-CB 4.06Å; I347-A350 WeakPolarHBondContact O-CB 3.38Å; I347-A350 PolarHBondContact O-N 3.32Å; A350-H354 CarbonylContact O-C 3.02Å; A350-H354 WeakPolarHBondContact O-CB 3.31Å; A350-G355 PolarHBondContact O-N 3.49Å; A350-I356 HydrophobicContact CB-CD1 4.24Å; A350-I356 VanDerWaalsContact O-CB 3.31Å; A350-I356 WeakPolarHBondContact O-CB 3.22Å; A350-I356 WeakPolarHBondContact O-CG1 3.35Å; A350-I356 PolarHBondContact O-N 2.87Å
351	V	82.8	Confident	78.7	Confident	12 Å²	12	30.3 Å²	30.3	7%	0.073	17%	0.171	C	C	.	.	I	π-helix	trans	-81.8	-55.7	-177.7	179.1	0	0	0	0	111.8	I347 N348 D349 G355 I356 F358 P476 F477	I347-V351 HydrophobicContact CB-CG2 4.22Å; I347-V351 HydrophobicContact CD1-CG2 3.93Å; I347-V351 HydrophobicContact CG1-CG2 4.13Å; I347-V351 WeakPolarHBondContact O-CG2 3.2Å; I347-V351 PolarHBondContact O-N 3.04Å; N348-V351 PolarHBondContact O-N 2.59Å; D349-V351 VanDerWaalsContact C-N 3.29Å; D349-V351 PolarHBondContact O-N 3.07Å; V351-G355 VanDerWaalsContact O-CA 3.32Å; V351-G355 WeakPolarHBondContact O-CA 3.36Å; V351-G355 PolarHBondContact O-N 2.82Å; V351-G355 VanDerWaalsContact O-N 3.17Å; V351-I356 WeakPolarHBondContact CA-O 3.47Å; V351-I356 WeakPolarHBondContact CG2-O 3.22Å; V351-F358 HydrophobicContact CG2-CB 3.8Å; V351-P476 HydrophobicContact CG1-CB 3.73Å; V351-P476 HydrophobicContact CG1-CG 4.06Å; V351-F477 HydrophobicContact CG1-CE1 4.32Å; V351-F477 HydrophobicContact CG1-CZ 4.02Å
352	Y	77.2	Confident	78.9	Confident	67 Å²	67	28.6 Å²	28.6	26%	0.263	17%	0.165	S	C	.	.	I	π-helix	trans	-70.1	-49.9	-175.3	-77	-86.1	0	0	0	111.8	N348 F477 N547	N348-Y352 HydrophobicContact CB-CD2 3.98Å; N348-Y352 HydrophobicContact CB-CE2 4.35Å; N348-Y352 VanDerWaalsContact O-CB 3.25Å; N348-Y352 WeakPolarHBondContact O-CB 3.28Å; N348-Y352 VanDerWaalsContact O-CD2 3.28Å; N348-Y352 WeakPolarHBondContact O-CD2 3.32Å; N348-Y352 PolarHBondContact O-N 2.64Å; Y352-F477 AromaticContact CD1-CE1 3.91Å; Y352-F477 HydrophobicContact CD1-CE1 3.91Å; Y352-F477 AromaticContact CD1-CE2 3.78Å; Y352-F477 HydrophobicContact CD1-CE2 3.78Å; Y352-F477 AromaticContact CD1-CZ 3.14Å; Y352-F477 HydrophobicContact CD1-CZ 3.14Å; Y352-F477 HydrophobicContact CD2-CZ 4.11Å; Y352-F477 AromaticContact CE1-CE1 3.43Å; Y352-F477 HydrophobicContact CE1-CE1 3.43Å; Y352-F477 VanDerWaalsContact CE1-CE1 3.43Å; Y352-F477 HydrophobicContact CE1-CE2 4.08Å; Y352-F477 AromaticContact CE1-CZ 3.19Å; Y352-F477 HydrophobicContact CE1-CZ 3.19Å; Y352-F477 HydrophobicContact CE2-CE1 4.27Å; Y352-F477 HydrophobicContact CE2-CZ 4.17Å; Y352-F477 HydrophobicContact CG-CE1 4.47Å; Y352-F477 HydrophobicContact CG-CE2 4.38Å; Y352-F477 AromaticContact CG-CZ 3.62Å; Y352-F477 HydrophobicContact CG-CZ 3.62Å; Y352-F477 AromaticContact CZ-CE1 3.63Å; Y352-F477 AromaticContact CZ-CZ 3.73Å; Y352-N547 PolarHBondContact O-ND2 3.08Å
353	N	79	Confident	79.7	Confident	37 Å²	37	27 Å²	27	20%	0.198	15%	0.152	C	C	.	.	I	π-helix	trans	-90.3	-34.5	-170.5	-74.5	-21.8	0	0	0	112.8	D349	D349-N353 WeakPolarHBondContact O-CA 3.47Å; D349-N353 VanDerWaalsContact O-CB 3.28Å; D349-N353 WeakPolarHBondContact O-CB 3.48Å; D349-N353 PolarHBondContact O-N 3.28Å; D349-N353 WeakPolarHBondContact OD1-CB 3.32Å; D349-N353 PolarHBondContact OD1-ND2 2.97Å
354	H	85.2	Confident	80.6	Confident	73 Å²	73	29 Å²	29	34%	0.338	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	0.1	-179	-64.1	-72	0	0	0	114.6	I330 D349 A350 I356	I330-H354 HydrophobicContact CG1-CB 4.4Å; I330-H354 VanDerWaalsContact CG2-CE1 3.45Å; I330-H354 WeakPolarHBondContact CG2-CE1 3.41Å; I330-H354 WeakPolarHBondContact CG2-NE2 3.47Å; D349-H354 PolarHBondContact O-N 2.94Å; D349-H354 IonicContact OD2-CD2 3.41Å; D349-H354 IonicContact OD2-NE2 2.93Å; A350-H354 CarbonylContact O-C 3.02Å; A350-H354 WeakPolarHBondContact O-CB 3.31Å; H354-I356 HydrophobicContact CB-CD1 4.25Å; H354-I356 HydrophobicContact CB-CG1 4.1Å; H354-I356 PolarHBondContact O-N 2.89Å
355	G	85	Confident	81.7	Confident	26 Å²	26	29.1 Å²	29.1	27%	0.268	16%	0.161	S	C	.	.			trans	66.1	21.9	173.5	0	0	0	0	0	114.3	A350 V351 P476	A350-G355 PolarHBondContact O-N 3.49Å; V351-G355 VanDerWaalsContact O-CA 3.32Å; V351-G355 WeakPolarHBondContact O-CA 3.36Å; V351-G355 PolarHBondContact O-N 2.82Å; V351-G355 VanDerWaalsContact O-N 3.17Å; G355-P476 WeakPolarHBondContact O-CG 3.29Å
356	I	90.1	Very high	82.4	Confident	3 Å²	3	28.6 Å²	28.6	2%	0.015	16%	0.158	C	C	.	.			trans	-80.6	126.9	-178.6	-54.6	-177.8	0	0	0	109.5	C329 I330 V334 I337 A350 V351 H354 F358 P476	C329-I356 HydrophobicContact CB-CD1 4.34Å; I330-I356 HydrophobicContact CG1-CD1 4.17Å; V334-I356 HydrophobicContact CG2-CD1 4.01Å; V334-I356 HydrophobicContact CG2-CG2 3.96Å; V334-I356 WeakPolarHBondContact O-CG1 3.35Å; I337-I356 HydrophobicContact CB-CG2 4.44Å; I337-I356 HydrophobicContact CD1-CG2 3.7Å; I337-I356 HydrophobicContact CG1-CG2 3.74Å; A350-I356 HydrophobicContact CB-CD1 4.24Å; A350-I356 VanDerWaalsContact O-CB 3.31Å; A350-I356 WeakPolarHBondContact O-CB 3.22Å; A350-I356 WeakPolarHBondContact O-CG1 3.35Å; A350-I356 PolarHBondContact O-N 2.87Å; V351-I356 WeakPolarHBondContact CA-O 3.47Å; V351-I356 WeakPolarHBondContact CG2-O 3.22Å; H354-I356 HydrophobicContact CB-CD1 4.25Å; H354-I356 HydrophobicContact CB-CG1 4.1Å; H354-I356 PolarHBondContact O-N 2.89Å; I356-F358 PolarHBondContact O-N 3.33Å; I356-P476 WeakPolarHBondContact O-CG 3.38Å
357	V	90	Very high	83.1	Confident	5 Å²	5	22.5 Å²	22.5	3%	0.03	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	114.2	175.4	-171.7	0	0	0	0	109.3	H335 I336 I337 I359 V460 I464 P476 I479	H335-V357 PolarHBondContact O-N 3.18Å; I336-V357 CarbonylContact C-O 3.5Å; I336-V357 VanDerWaalsContact CA-O 3.22Å; I336-V357 WeakPolarHBondContact CA-O 3.47Å; I336-V357 HydrophobicContact CG1-CB 4.27Å; I337-V357 PolarHBondContact N-O 2.99Å; V357-I359 HydrophobicContact CG1-CD1 4.34Å; V357-I359 HydrophobicContact CG1-CG1 4.25Å; V357-V460 HydrophobicContact CG1-CG1 4.13Å; V357-I464 HydrophobicContact CG2-CD1 3.94Å; V357-P476 HydrophobicContact CG2-CB 4.27Å; V357-P476 HydrophobicContact CG2-CG 4.21Å; V357-I479 HydrophobicContact CG2-CD1 3.74Å
358	F	88.6	Confident	83.4	Confident	5 Å²	5	22.6 Å²	22.6	2%	0.022	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	129	176.4	-177.1	-80.4	0	0	0	110.8	I337 Y339 I347 V351 I356 P375 A381 C382	I337-F358 HydrophobicContact CB-CD2 3.84Å; I337-F358 HydrophobicContact CB-CE2 4.49Å; I337-F358 HydrophobicContact CD1-CD2 4.47Å; I337-F358 HydrophobicContact CG2-CD2 3.48Å; I337-F358 VanDerWaalsContact CG2-CD2 3.48Å; I337-F358 HydrophobicContact CG2-CE2 3.64Å; Y339-F358 AromaticContact CD1-CZ 3.94Å; Y339-F358 HydrophobicContact CD1-CZ 3.94Å; Y339-F358 HydrophobicContact CG-CE2 4.22Å; Y339-F358 AromaticContact CG-CZ 3.72Å; Y339-F358 HydrophobicContact CG-CZ 3.72Å; I347-F358 HydrophobicContact CB-CD2 4.32Å; I347-F358 HydrophobicContact CD1-CB 3.71Å; I347-F358 HydrophobicContact CD1-CD1 3.44Å; I347-F358 VanDerWaalsContact CD1-CD1 3.44Å; I347-F358 HydrophobicContact CD1-CD2 3.73Å; I347-F358 HydrophobicContact CD1-CE1 3.86Å; I347-F358 HydrophobicContact CD1-CE2 4.15Å; I347-F358 HydrophobicContact CD1-CG 3.34Å; I347-F358 HydrophobicContact CD1-CZ 4.19Å; I347-F358 HydrophobicContact CG2-CD2 3.78Å; I347-F358 HydrophobicContact CG2-CE2 3.66Å; I347-F358 HydrophobicContact CG2-CZ 4.27Å; V351-F358 HydrophobicContact CG2-CB 3.8Å; I356-F358 PolarHBondContact O-N 3.33Å; F358-P375 HydrophobicContact CE1-CB 3.77Å; F358-P375 HydrophobicContact CE1-CG 3.55Å; F358-P375 HydrophobicContact CZ-CB 3.98Å; F358-P375 HydrophobicContact CZ-CG 3.86Å; F358-A381 HydrophobicContact CB-CB 3.76Å; F358-A381 HydrophobicContact CD1-CB 3.48Å; F358-A381 VanDerWaalsContact CD1-CB 3.48Å; F358-A381 HydrophobicContact CE1-CB 4.45Å; F358-A381 HydrophobicContact CG-CB 4.02Å; F358-C382 PolarHBondContact O-N 3.43Å
359	I	89.1	Confident	84	Confident	3 Å²	3	18.7 Å²	18.7	2%	0.015	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	116.2	178.8	-64.7	168.3	0	0	0	108.1	I336 I337 N338 Y339 V357 C382 S453 A456 A457 V460	I336-I359 HydrophobicContact CG2-CD1 3.98Å; I337-I359 PolarHBondContact O-N 3.11Å; N338-I359 WeakPolarHBondContact CA-O 3.35Å; Y339-I359 PolarHBondContact N-O 3.15Å; V357-I359 HydrophobicContact CG1-CD1 4.34Å; V357-I359 HydrophobicContact CG1-CG1 4.25Å; I359-C382 WeakPolarHBondContact CA-O 2.83Å; I359-C382 HydrophobicContact CG1-CB 4.46Å; I359-S453 WeakPolarHBondContact CG2-O 3.5Å; I359-S453 PolarHBondContact O-OG 3.25Å; I359-A456 HydrophobicContact CG2-CB 4.02Å; I359-A457 HydrophobicContact CB-CB 4.45Å; I359-A457 VanDerWaalsContact CD1-CA 3.44Å; I359-A457 HydrophobicContact CD1-CB 3.99Å; I359-A457 HydrophobicContact CG2-CB 4.43Å; I359-V460 HydrophobicContact CD1-CB 3.87Å; I359-V460 HydrophobicContact CD1-CG1 4.27Å; I359-V460 HydrophobicContact CD1-CG2 3.82Å
360	G	86.5	Confident	84.2	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	162.9	-177.7	0	0	0	0	0	112.7	Y339 C382 L383 G384	Y339-G360 WeakPolarHBondContact O-CA 3.31Å; G360-C382 PolarHBondContact N-O 2.99Å; G360-C382 VanDerWaalsContact N-O 3.09Å; G360-L383 VanDerWaalsContact O-CA 3.24Å; G360-L383 WeakPolarHBondContact O-CA 3.08Å; G360-G384 PolarHBondContact O-N 2.82Å
361	S	85.3	Confident	84.1	Confident	3 Å²	3	16.5 Å²	16.5	2%	0.021	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	142.3	170.5	88	0	0	0	0	111.9	Y339 G363 L383 T449	Y339-S361 PolarHBondContact O-N 3Å; S361-G363 VanDerWaalsContact C-N 3.27Å; S361-G363 PolarHBondContact O-N 3.06Å; S361-L383 WeakPolarHBondContact O-CD2 3.31Å; S361-T449 WeakPolarHBondContact CB-O 2.93Å; S361-T449 WeakPolarHBondContact CB-OG1 3.47Å; S361-T449 PolarHBondContact OG-OG1 3.31Å
362	S	81.6	Confident	84	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.089	C	C	.	.			trans	-73.7	-17.8	178.4	62.7	0	0	0	0	114	T373 S412 T449	S362-T373 PolarHBondContact O-N 3.43Å; S362-S412 WeakPolarHBondContact O-CB 3.21Å; S362-T449 WeakPolarHBondContact OG-CG2 3.02Å
363	G	82.3	Confident	83.7	Confident	3 Å²	3	14.4 Å²	14.4	3%	0.031	8%	0.084	C	C	.	.			trans	105	164.4	-179.9	0	0	0	0	0	113.9	S361 S412 T449	S361-G363 VanDerWaalsContact C-N 3.27Å; S361-G363 PolarHBondContact O-N 3.06Å; G363-S412 VanDerWaalsContact O-CB 3.26Å; G363-S412 WeakPolarHBondContact O-CB 3.25Å; G363-S412 PolarHBondContact O-N 2.84Å; G363-S412 PolarHBondContact O-OG 2.86Å; G363-T449 WeakPolarHBondContact CA-OG1 3.32Å; G363-T449 PolarHBondContact N-OG1 3.2Å; G363-T449 VanDerWaalsContact O-CG2 3.25Å; G363-T449 WeakPolarHBondContact O-CG2 3.4Å
364	N	84	Confident	83.3	Confident	55 Å²	55	13.5 Å²	13.5	29%	0.294	8%	0.08	S	C	.	.	S	Bend	trans	-111.8	34.9	-175.8	-57.5	-45.7	0	0	0	112.1	W410 T449 K692	N364-W410 CarbonylContact C-O 3.6Å; N364-W410 VanDerWaalsContact CA-O 3.23Å; N364-W410 WeakPolarHBondContact CA-O 3.16Å; N364-W410 HydrophobicContact CB-CE3 3.91Å; N364-W410 HydrophobicContact CB-CZ3 4.4Å; N364-W410 WeakPolarHBondContact OD1-CZ3 3.49Å; N364-T449 PolarHBondContact OD1-N 2.75Å; N364-T449 PolarHBondContact OD1-OG1 2.86Å; N364-T449 VanDerWaalsContact OD1-OG1 3.04Å; N364-K692 PolarHBondContact O-NZ 2.7Å
365	N	79.5	Confident	82.5	Confident	42 Å²	42	10 Å²	10	23%	0.225	6%	0.064	C	C	.	.			trans	-107.2	4.3	-171.3	-68.3	-58.7	0	0	0	115.2	T371 W410 S412 R690	N365-T371 WeakPolarHBondContact O-CB 3.39Å; N365-T371 VanDerWaalsContact O-CG2 3.22Å; N365-T371 WeakPolarHBondContact O-CG2 3.49Å; N365-W410 PolarHBondContact N-O 3.09Å; N365-W410 VanDerWaalsContact N-O 3.13Å; N365-S412 WeakPolarHBondContact CB-OG 3.45Å; N365-S412 PolarHBondContact N-OG 2.88Å; N365-R690 PolarHBondContact ND2-NH1 3.07Å; N365-R690 PolarHBondContact OD1-NH1 2.83Å; N365-R690 VanDerWaalsContact OD1-NH1 3.16Å
366	G	79.8	Confident	81.4	Confident	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.051	C	C	.	.			trans	-62.9	178	172.5	0	0	0	0	0	113	P409 W410 S411	G366-P409 CarbonylContact C-O 3.56Å; G366-W410 PolarHBondContact N-O 2.66Å; G366-S411 WeakPolarHBondContact CA-O 3.4Å
367	P	82.6	Confident	79.9	Confident	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.062	C	C	.	.	S	Bend	cis	-87.9	-5.5	7	33.8	-39.2	0	0	0	118.6	P409 R413 R656 Y679 C718 A720	P367-P409 WeakPolarHBondContact CA-O 3.35Å; P367-P409 VanDerWaalsContact CB-O 3.29Å; P367-P409 WeakPolarHBondContact CB-O 3.42Å; P367-P409 WeakPolarHBondContact CD-O 3.38Å; P367-R413 VanDerWaalsContact CA-CZ 3.43Å; P367-R413 WeakPolarHBondContact O-CD 3.22Å; P367-R413 PolarHBondContact O-NE 3.25Å; P367-R656 PolarHBondContact O-NH1 2.85Å; P367-R656 PolarHBondContact O-NH2 3.05Å; P367-Y679 VanDerWaalsContact CD-CD1 3.49Å; P367-Y679 HydrophobicContact CG-CD1 4.35Å; P367-Y679 HydrophobicContact CG-CD2 3.2Å; P367-Y679 HydrophobicContact CG-CE2 3.45Å; P367-Y679 VanDerWaalsContact CG-CE2 3.45Å; P367-Y679 HydrophobicContact CG-CG 3.67Å; P367-C718 HydrophobicContact CG-CB 4.37Å; P367-C718 VanDerWaalsContact CG-SG 3.57Å; P367-A720 HydrophobicContact CG-CB 4.29Å
368	C	85	Confident	78.4	Confident	4 Å²	4	11.8 Å²	11.8	3%	0.027	8%	0.076	C	C	.	.	S	Bend	trans	-57.3	152.7	177.5	-72.4	0	0	0	0	113.2	T371 Y679 R680 E716	C368-T371 HydrophobicContact CB-CG2 3.8Å; C368-T371 WeakPolarHBondContact O-CB 3.41Å; C368-T371 WeakPolarHBondContact O-CG2 3.41Å; C368-T371 PolarHBondContact O-OG1 3.24Å; C368-Y679 VanDerWaalsContact SG-CB 3.57Å; C368-Y679 PolarHBondContact SG-O 3.02Å; C368-R680 VanDerWaalsContact SG-C 3.57Å; C368-E716 WeakPolarHBondContact CA-OE1 3.5Å; C368-E716 WeakPolarHBondContact CA-OE2 3.45Å; C368-E716 WeakPolarHBondContact CB-OE2 3.22Å
369	L	87.1	Confident	77.1	Confident	1 Å²	1	11.8 Å²	11.8	1%	0.005	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	163.4	169.1	-58.9	-174.3	0	0	0	110.1	T371 R413 G414 F496 V604 F658 E716	L369-T371 PolarHBondContact O-N 3.37Å; L369-R413 HydrophobicContact CD2-CB 4.32Å; L369-G414 WeakPolarHBondContact CB-O 3.31Å; L369-G414 VanDerWaalsContact CD2-O 3.22Å; L369-G414 WeakPolarHBondContact CD2-O 3.41Å; L369-F496 HydrophobicContact CD2-CB 4.01Å; L369-F496 HydrophobicContact CD2-CD2 4.25Å; L369-F496 HydrophobicContact CD2-CG 4.11Å; L369-V604 HydrophobicContact CD1-CB 4.28Å; L369-V604 HydrophobicContact CD1-CG1 4.48Å; L369-V604 HydrophobicContact CD1-CG2 4.03Å; L369-F658 HydrophobicContact CD1-CE1 4.14Å; L369-F658 HydrophobicContact CD1-CZ 3.69Å; L369-F658 HydrophobicContact CG-CZ 4.34Å; L369-E716 VanDerWaalsContact N-CD 3.33Å; L369-E716 PolarHBondContact N-OE1 2.84Å; L369-E716 PolarHBondContact N-OE2 2.79Å
370	S	84.1	Confident	75.7	Confident	4 Å²	4	13 Å²	13	3%	0.028	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	30.5	-176.9	-46	0	0	0	0	113.7	R413 P415 Y525 R527 L683 I688	S370-R413 PolarHBondContact N-O 3.25Å; S370-R413 VanDerWaalsContact N-O 3.14Å; S370-P415 WeakPolarHBondContact CA-O 3.43Å; S370-P415 VanDerWaalsContact CB-O 3.28Å; S370-P415 WeakPolarHBondContact CB-O 3.45Å; S370-P415 PolarHBondContact N-O 2.98Å; S370-P415 PolarHBondContact OG-O 3.16Å; S370-Y525 WeakPolarHBondContact OG-CE1 3.27Å; S370-Y525 PolarHBondContact OG-OH 2.88Å; S370-R527 PolarHBondContact OG-NH1 3.01Å; S370-L683 WeakPolarHBondContact OG-CD1 3.48Å; S370-I688 WeakPolarHBondContact O-CD1 3.22Å
371	T	82.1	Confident	74.1	Confident	3 Å²	3	13.6 Å²	13.6	2%	0.018	9%	0.091	C	C	.	.			trans	-99.9	-6.7	179	51.8	0	0	0	0	113	N365 C368 L369 T373 S412 R413	N365-T371 WeakPolarHBondContact O-CB 3.39Å; N365-T371 VanDerWaalsContact O-CG2 3.22Å; N365-T371 WeakPolarHBondContact O-CG2 3.49Å; C368-T371 HydrophobicContact CB-CG2 3.8Å; C368-T371 WeakPolarHBondContact O-CB 3.41Å; C368-T371 WeakPolarHBondContact O-CG2 3.41Å; C368-T371 PolarHBondContact O-OG1 3.24Å; L369-T371 PolarHBondContact O-N 3.37Å; T371-T373 PolarHBondContact O-N 3.33Å; T371-T373 VanDerWaalsContact O-N 3.16Å; T371-S412 VanDerWaalsContact O-CB 3.26Å; T371-S412 WeakPolarHBondContact O-CB 3.47Å; T371-S412 PolarHBondContact O-OG 3.16Å; T371-S412 WeakPolarHBondContact OG1-CA 3.37Å; T371-R413 PolarHBondContact N-O 3.45Å; T371-R413 PolarHBondContact OG1-N 3.07Å; T371-R413 PolarHBondContact OG1-O 3.39Å
372	V	79.8	Confident	73	Confident	13 Å²	13	13.9 Å²	13.9	8%	0.079	9%	0.092	C	C	.	.			trans	-60.1	118.2	168.9	176.4	0	0	0	0	108.2	R413 T423	V372-R413 VanDerWaalsContact CG2-C 3.47Å; V372-R413 PolarHBondContact N-O 3.13Å; V372-T423 HydrophobicContact CG2-CG2 3.73Å
373	T	71.7	Confident	72	Confident	23 Å²	23	14 Å²	14	14%	0.141	9%	0.093	C	C	.	.			trans	-93.8	-178.1	173.6	53.8	0	0	0	0	108.8	S362 T371 G376 G377	S362-T373 PolarHBondContact O-N 3.43Å; T371-T373 PolarHBondContact O-N 3.33Å; T371-T373 VanDerWaalsContact O-N 3.16Å; T373-G376 WeakPolarHBondContact O-CA 3.47Å; T373-G376 PolarHBondContact O-N 3.22Å; T373-G377 PolarHBondContact O-N 3.2Å
374	S	70.4	Confident	70.9	Confident	18 Å²	18	13.9 Å²	13.9	13%	0.126	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	153.7	166	-66.4	0	0	0	0	112.4	A342 E343 P344 S378	A342-S374 CarbonylContact C-O 3.54Å; A342-S374 VanDerWaalsContact CA-O 3.31Å; A342-S374 WeakPolarHBondContact CA-O 3.38Å; E343-S374 PolarHBondContact N-O 3.43Å; E343-S374 WeakPolarHBondContact O-CB 3.4Å; P344-S374 WeakPolarHBondContact CA-OG 3.38Å; P344-S374 VanDerWaalsContact CB-OG 3.24Å; P344-S374 WeakPolarHBondContact CB-OG 3.38Å; P344-S374 WeakPolarHBondContact CD-OG 3.41Å; P344-S374 WeakPolarHBondContact CG-OG 3.09Å; S374-S378 VanDerWaalsContact CB-OG 3.24Å; S374-S378 WeakPolarHBondContact CB-OG 3.44Å; S374-S378 WeakPolarHBondContact OG-CB 3.42Å; S374-S378 PolarHBondContact OG-OG 2.59Å
375	P	67.2	Low	70	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	cis	-76.1	-9	3.3	33.1	-32.9	0	0	0	112.5	Y339 F358 G377 S378 C379 L383	Y339-P375 HydrophobicContact CD1-CB 4.46Å; Y339-P375 HydrophobicContact CD1-CG 3.65Å; Y339-P375 HydrophobicContact CE1-CG 4.07Å; F358-P375 HydrophobicContact CE1-CB 3.77Å; F358-P375 HydrophobicContact CE1-CG 3.55Å; F358-P375 HydrophobicContact CZ-CB 3.98Å; F358-P375 HydrophobicContact CZ-CG 3.86Å; P375-G377 PolarHBondContact O-N 2.98Å; P375-S378 CarbonylContact O-C 3.6Å; P375-S378 PolarHBondContact O-N 3.1Å; P375-S378 PolarHBondContact O-OG 3.13Å; P375-C379 PolarHBondContact O-N 3.14Å; P375-C379 PolarHBondContact O-SG 2.77Å; P375-L383 HydrophobicContact CG-CD2 3.86Å
376	G	61.9	Low	69.8	Low	0 Å²	0	9.3 Å²	9.3	0%	0	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-26.7	-172.8	0	0	0	0	0	117.7	T373 L383 G422	T373-G376 WeakPolarHBondContact O-CA 3.47Å; T373-G376 PolarHBondContact O-N 3.22Å; G376-L383 VanDerWaalsContact N-CD2 3.26Å; G376-G422 VanDerWaalsContact O-CA 3.31Å; G376-G422 WeakPolarHBondContact O-CA 3.41Å
377	G	59	Low	69.9	Low	24 Å²	24	10.2 Å²	10.2	25%	0.247	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-8.3	169.8	0	0	0	0	0	115	T373 P375 C416	T373-G377 PolarHBondContact O-N 3.2Å; P375-G377 PolarHBondContact O-N 2.98Å; G377-C416 WeakPolarHBondContact CA-SG 3.21Å
378	S	59.5	Low	69.7	Low	46 Å²	46	10.2 Å²	10.2	32%	0.322	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122	-15.1	-173.5	45.8	0	0	0	0	114.3	P344 S374 P375	P344-S378 WeakPolarHBondContact CB-OG 3.43Å; S374-S378 VanDerWaalsContact CB-OG 3.24Å; S374-S378 WeakPolarHBondContact CB-OG 3.44Å; S374-S378 WeakPolarHBondContact OG-CB 3.42Å; S374-S378 PolarHBondContact OG-OG 2.59Å; P375-S378 CarbonylContact O-C 3.6Å; P375-S378 PolarHBondContact O-N 3.1Å; P375-S378 PolarHBondContact O-OG 3.13Å
379	C	61.6	Low	69.5	Low	6 Å²	6	10 Å²	10	4%	0.041	7%	0.07	C	C	.	.			trans	-134	151.3	176.1	78.6	0	0	0	0	110.7	I347 P375 A381	I347-C379 HydrophobicContact CD1-CB 3.65Å; I347-C379 VanDerWaalsContact CD1-SG 3.59Å; I347-C379 HydrophobicContact CG1-CB 3.89Å; P375-C379 PolarHBondContact O-N 3.14Å; P375-C379 PolarHBondContact O-SG 2.77Å; C379-A381 HydrophobicContact CB-CB 4.49Å; C379-A381 PolarHBondContact O-N 2.99Å; C379-A381 VanDerWaalsContact SG-CB 3.58Å
380	S	57.9	Low	69	Low	28 Å²	28	11.5 Å²	11.5	20%	0.196	8%	0.08	C	C	.	.			trans	-79.6	2.9	174.3	-51.2	0	0	0	0	112.6	R480	S380-R480 WeakPolarHBondContact O-CD 3.46Å; S380-R480 PolarHBondContact O-NE 3.17Å; S380-R480 VanDerWaalsContact O-NE 3.07Å; S380-R480 PolarHBondContact O-NH1 3.38Å
381	A	53.5	Low	68.6	Low	13 Å²	13	14.7 Å²	14.7	11%	0.107	9%	0.094	C	C	.	.	S	Bend	trans	-70.6	151.6	-174.8	0	0	0	0	0	112.2	I347 F358 C379 L383	I347-A381 HydrophobicContact CD1-CB 3.63Å; F358-A381 HydrophobicContact CB-CB 3.76Å; F358-A381 HydrophobicContact CD1-CB 3.48Å; F358-A381 VanDerWaalsContact CD1-CB 3.48Å; F358-A381 HydrophobicContact CE1-CB 4.45Å; F358-A381 HydrophobicContact CG-CB 4.02Å; C379-A381 HydrophobicContact CB-CB 4.49Å; C379-A381 PolarHBondContact O-N 2.99Å; C379-A381 VanDerWaalsContact SG-CB 3.58Å; A381-L383 WeakPolarHBondContact O-CD1 3.07Å; A381-L383 WeakPolarHBondContact O-CG 3.31Å; A381-L383 PolarHBondContact O-N 3.44Å
382	C	61.7	Low	68.5	Low	8 Å²	8	14.7 Å²	14.7	5%	0.054	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	120.9	-169.5	-91.2	0	0	0	0	112.7	F358 I359 G360 R480	F358-C382 PolarHBondContact O-N 3.43Å; I359-C382 WeakPolarHBondContact CA-O 2.83Å; I359-C382 HydrophobicContact CG1-CB 4.46Å; G360-C382 PolarHBondContact N-O 2.99Å; G360-C382 VanDerWaalsContact N-O 3.09Å; C382-R480 WeakPolarHBondContact SG-CG 3.32Å
383	L	60.5	Low	68.4	Low	2 Å²	2	14 Å²	14	1%	0.01	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.2	175.4	-55.9	112.8	0	0	0	111.7	G360 S361 P375 G376 A381 G422 A424 I425	G360-L383 VanDerWaalsContact O-CA 3.24Å; G360-L383 WeakPolarHBondContact O-CA 3.08Å; S361-L383 WeakPolarHBondContact O-CD2 3.31Å; P375-L383 HydrophobicContact CG-CD2 3.86Å; G376-L383 VanDerWaalsContact N-CD2 3.26Å; A381-L383 WeakPolarHBondContact O-CD1 3.07Å; A381-L383 WeakPolarHBondContact O-CG 3.31Å; A381-L383 PolarHBondContact O-N 3.44Å; L383-G422 WeakPolarHBondContact CD1-O 3.39Å; L383-A424 PolarHBondContact O-N 3.12Å; L383-I425 PolarHBondContact O-N 3.09Å
384	G	60.9	Low	68.6	Low	1 Å²	1	15 Å²	15	1%	0.01	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	117.3	178.3	0	0	0	0	0	111.5	G360 I425 S452	G360-G384 PolarHBondContact O-N 2.82Å; G384-I425 CarbonylContact C-O 3.57Å; G384-I425 VanDerWaalsContact CA-O 3.26Å; G384-I425 WeakPolarHBondContact CA-O 3.42Å; G384-S452 PolarHBondContact O-OG 3.04Å
385	V	64.2	Low	68.9	Low	1 Å²	1	18.7 Å²	18.7	1%	0.006	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	144.6	164.8	174.5	0	0	0	0	109.3	Y387 L407 T423 I425 C426 A427 E497	V385-Y387 PolarHBondContact O-N 3.02Å; V385-L407 HydrophobicContact CG1-CD1 4.5Å; V385-L407 HydrophobicContact CG1-CD2 3.96Å; V385-T423 HydrophobicContact CG2-CG2 3.4Å; V385-I425 PolarHBondContact N-O 2.72Å; V385-C426 HydrophobicContact CB-CB 4.45Å; V385-C426 WeakPolarHBondContact O-CA 3.46Å; V385-A427 PolarHBondContact O-N 3.17Å; V385-E497 WeakPolarHBondContact CG1-O 3.43Å; V385-E497 WeakPolarHBondContact CG2-O 3.31Å
386	A	75.2	Confident	69.6	Low	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	102.1	179	0	0	0	0	0	112.1	F408 W410 T449	A386-F408 HydrophobicContact CB-CD2 3.73Å; A386-F408 HydrophobicContact CB-CE2 4.47Å; A386-F408 PolarHBondContact O-N 2.85Å; A386-W410 HydrophobicContact CB-CH2 4.32Å; A386-W410 HydrophobicContact CB-CZ3 4.31Å; A386-T449 HydrophobicContact CB-CG2 3.96Å
387	Y	81.6	Confident	70.6	Confident	19 Å²	19	20.9 Å²	20.9	8%	0.075	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	148.4	171.9	173.5	-98.5	0	0	0	111.8	E47 V385 A389 P405 L407 A427 P428 G429 V490 L502	E47-Y387 HydrophobicContact CB-CE1 4.25Å; E47-Y387 HydrophobicContact CG-CE1 4.25Å; V385-Y387 PolarHBondContact O-N 3.02Å; Y387-A389 HydrophobicContact CE1-CB 3.89Å; Y387-P405 HydrophobicContact CE2-CB 3.89Å; Y387-P405 WeakPolarHBondContact OH-CB 3.33Å; Y387-L407 HydrophobicContact CD2-CD2 4.04Å; Y387-A427 PolarHBondContact N-O 3.21Å; Y387-P428 CarbonylContact O-C 3.54Å; Y387-P428 WeakPolarHBondContact O-CA 3.41Å; Y387-G429 PolarHBondContact O-N 2.96Å; Y387-V490 HydrophobicContact CD2-CG1 4.29Å; Y387-V490 HydrophobicContact CD2-CG2 4.22Å; Y387-V490 HydrophobicContact CE2-CG1 4.09Å; Y387-V490 HydrophobicContact CE2-CG2 4.32Å; Y387-L502 HydrophobicContact CD1-CD1 3.7Å; Y387-L502 HydrophobicContact CD1-CD2 4.08Å; Y387-L502 HydrophobicContact CD2-CD1 4.49Å; Y387-L502 HydrophobicContact CE1-CD1 4.28Å; Y387-L502 HydrophobicContact CE1-CD2 3.8Å; Y387-L502 HydrophobicContact CG-CD1 3.81Å
388	L	79.5	Confident	71.7	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	112.1	177.8	-166.5	67.7	0	0	0	110.9	M392 R393 Y397 M406 F408 A430 W723	L388-M392 HydrophobicContact CD1-CB 3.87Å; L388-M392 HydrophobicContact CD1-CE 4.16Å; L388-M392 HydrophobicContact CD1-SD 4.41Å; L388-R393 HydrophobicContact CD2-CG 3.13Å; L388-R393 HydrophobicContact CG-CG 3.61Å; L388-Y397 HydrophobicContact CD1-CE2 4.05Å; L388-Y397 HydrophobicContact CD2-CE2 3.99Å; L388-M406 HydrophobicContact CB-CG 4.34Å; L388-M406 PolarHBondContact N-O 2.84Å; L388-M406 PolarHBondContact O-N 3.27Å; L388-M406 VanDerWaalsContact O-N 3.08Å; L388-F408 HydrophobicContact CB-CD2 4.45Å; L388-F408 HydrophobicContact CB-CE2 3.98Å; L388-F408 HydrophobicContact CB-CZ 4.25Å; L388-F408 HydrophobicContact CD1-CE2 4.08Å; L388-F408 HydrophobicContact CD1-CZ 3.94Å; L388-F408 HydrophobicContact CD2-CE1 3.78Å; L388-F408 HydrophobicContact CD2-CE2 4.07Å; L388-F408 HydrophobicContact CD2-CZ 3.49Å; L388-F408 VanDerWaalsContact CD2-CZ 3.49Å; L388-F408 HydrophobicContact CG-CE2 4.28Å; L388-F408 HydrophobicContact CG-CZ 4.12Å; L388-A430 HydrophobicContact CD1-CB 3.81Å; L388-W723 HydrophobicContact CD2-CE3 4.49Å; L388-W723 HydrophobicContact CD2-CZ3 4.48Å
389	A	81	Confident	72.4	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.135	C	C	.	.			trans	-69.6	156.5	179.2	0	0	0	0	0	111.9	E47 Y387 Q391 M392 R393	E47-A389 HydrophobicContact CG-CB 3.83Å; E47-A389 WeakPolarHBondContact OE1-CB 2.99Å; Y387-A389 HydrophobicContact CE1-CB 3.89Å; A389-Q391 VanDerWaalsContact C-N 3.31Å; A389-Q391 PolarHBondContact O-N 2.87Å; A389-M392 HydrophobicContact CB-CB 4.27Å; A389-M392 HydrophobicContact CB-CG 3.92Å; A389-M392 HydrophobicContact CB-SD 3.88Å; A389-M392 PolarHBondContact O-N 3.46Å; A389-R393 PolarHBondContact O-N 3.32Å; A389-R393 VanDerWaalsContact O-N 3.09Å
390	P	75.9	Confident	73	Confident	33 Å²	33	35.8 Å²	35.8	21%	0.214	18%	0.178	C	C	.	.	H	α-helix	trans	-54.7	-45.9	177.3	-27.3	38	0	0	0	112.9	R393 T394 I403 P405	P390-R393 WeakPolarHBondContact O-CB 3.15Å; P390-R393 PolarHBondContact O-N 3.04Å; P390-T394 PolarHBondContact O-N 2.87Å; P390-T394 PolarHBondContact O-OG1 3.13Å; P390-I403 WeakPolarHBondContact CA-O 3.26Å; P390-I403 VanDerWaalsContact CB-O 3.29Å; P390-I403 WeakPolarHBondContact CB-O 3.47Å; P390-P405 HydrophobicContact CG-CB 4.14Å; P390-P405 HydrophobicContact CG-CG 4.42Å
391	Q	75.6	Confident	73.6	Confident	70 Å²	70	40.2 Å²	40.2	33%	0.327	20%	0.196	S	C	.	.	H	α-helix	trans	-68.3	-43	-177.5	-66.2	170	-8	0	0	111.5	E41 A389 R393 T394 K395	E41-Q391 WeakPolarHBondContact OE2-CB 3.37Å; E41-Q391 PolarHBondContact OE2-OE1 3.39Å; A389-Q391 VanDerWaalsContact C-N 3.31Å; A389-Q391 PolarHBondContact O-N 2.87Å; Q391-R393 PolarHBondContact O-N 3.04Å; Q391-T394 PolarHBondContact O-N 2.93Å; Q391-K395 WeakPolarHBondContact O-CB 3.36Å; Q391-K395 PolarHBondContact O-N 2.82Å
392	M	79.8	Confident	74.4	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.015	22%	0.22	C	C	.	.	H	α-helix	trans	-56.3	-38.5	173.5	-67.6	176.3	78.4	0	0	111.4	L388 A389 L396 P428 A430	L388-M392 HydrophobicContact CD1-CB 3.87Å; L388-M392 HydrophobicContact CD1-CE 4.16Å; L388-M392 HydrophobicContact CD1-SD 4.41Å; A389-M392 HydrophobicContact CB-CB 4.27Å; A389-M392 HydrophobicContact CB-CG 3.92Å; A389-M392 HydrophobicContact CB-SD 3.88Å; A389-M392 PolarHBondContact O-N 3.46Å; M392-L396 HydrophobicContact CB-CD1 4.03Å; M392-L396 HydrophobicContact CB-CG 4.4Å; M392-L396 HydrophobicContact CE-CD1 3.83Å; M392-L396 HydrophobicContact CG-CD1 4.42Å; M392-L396 WeakPolarHBondContact O-CA 3.37Å; M392-L396 WeakPolarHBondContact O-CB 2.96Å; M392-L396 VanDerWaalsContact O-CG 3.26Å; M392-L396 WeakPolarHBondContact O-CG 3.42Å; M392-L396 PolarHBondContact O-N 3.41Å; M392-P428 HydrophobicContact CE-CB 4.04Å; M392-P428 HydrophobicContact SD-CB 4.16Å; M392-A430 HydrophobicContact CE-CB 4.24Å; M392-A430 WeakPolarHBondContact CE-O 3.34Å
393	R	77.8	Confident	74.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.3	-50.3	177.4	-91.4	-163.4	-57.9	-170.2	-5.5	113.6	L388 A389 P390 Q391 Y397 L399 I403 G404 M406	L388-R393 HydrophobicContact CD2-CG 3.13Å; L388-R393 HydrophobicContact CG-CG 3.61Å; A389-R393 PolarHBondContact O-N 3.32Å; A389-R393 VanDerWaalsContact O-N 3.09Å; P390-R393 WeakPolarHBondContact O-CB 3.15Å; P390-R393 PolarHBondContact O-N 3.04Å; Q391-R393 PolarHBondContact O-N 3.04Å; R393-Y397 PolarHBondContact O-N 3.5Å; R393-L399 HydrophobicContact CB-CD1 3.88Å; R393-L399 HydrophobicContact CG-CD1 4.27Å; R393-L399 WeakPolarHBondContact O-CG 3.47Å; R393-I403 VanDerWaalsContact NH2-CB 3.31Å; R393-I403 PolarHBondContact NH2-O 3.2Å; R393-G404 PolarHBondContact NH2-O 2.59Å; R393-M406 PolarHBondContact NH1-SD 2.98Å
394	T	75.7	Confident	75.5	Confident	43 Å²	43	46.7 Å²	46.7	26%	0.264	25%	0.246	S	C	.	.	H	α-helix	trans	-62.3	-47	-179.6	-54.4	0	0	0	0	110.5	P390 Q391 S398 L399 S402	P390-T394 PolarHBondContact O-N 2.87Å; P390-T394 PolarHBondContact O-OG1 3.13Å; Q391-T394 PolarHBondContact O-N 2.93Å; T394-S398 CarbonylContact O-C 3.46Å; T394-S398 WeakPolarHBondContact O-CA 3.42Å; T394-S398 PolarHBondContact O-N 2.8Å; T394-S398 VanDerWaalsContact O-N 3.12Å; T394-L399 PolarHBondContact O-N 2.87Å; T394-S402 WeakPolarHBondContact OG1-CA 3.22Å
395	K	77.9	Confident	76.4	Confident	96 Å²	96	48.8 Å²	48.8	42%	0.417	26%	0.259	S	S	.	.	H	α-helix	trans	-78.3	-51.5	-173.7	-69.7	-177.5	178.2	175	0	113.5	M38 E41 Q391 Y397	M38-K395 HydrophobicContact CE-CB 3.92Å; E41-K395 IonicContact OE1-NZ 3.69Å; E41-K395 PolarHBondContact OE1-NZ 2.86Å; E41-K395 WeakPolarHBondContact OE2-CD 3.43Å; E41-K395 WeakPolarHBondContact OE2-CE 3.33Å; E41-K395 IonicContact OE2-NZ 2.74Å; E41-K395 PolarHBondContact OE2-NZ 3.17Å; Q391-K395 WeakPolarHBondContact O-CB 3.36Å; Q391-K395 PolarHBondContact O-N 2.82Å; K395-Y397 PolarHBondContact O-N 2.86Å
396	L	81.5	Confident	77.2	Confident	11 Å²	11	48.9 Å²	48.9	6%	0.058	26%	0.26	C	S	.	.	H	α-helix	trans	-71.9	-32.4	-173.9	-57.9	-178.8	0	0	0	112.4	M392 A430 I432 L445	M392-L396 HydrophobicContact CB-CD1 4.03Å; M392-L396 HydrophobicContact CB-CG 4.4Å; M392-L396 HydrophobicContact CE-CD1 3.83Å; M392-L396 HydrophobicContact CG-CD1 4.42Å; M392-L396 WeakPolarHBondContact O-CA 3.37Å; M392-L396 WeakPolarHBondContact O-CB 2.96Å; M392-L396 VanDerWaalsContact O-CG 3.26Å; M392-L396 WeakPolarHBondContact O-CG 3.42Å; M392-L396 PolarHBondContact O-N 3.41Å; L396-A430 HydrophobicContact CD1-CB 3.96Å; L396-I432 HydrophobicContact CD2-CD1 3.62Å; L396-I432 HydrophobicContact CD2-CG1 3.88Å; L396-L445 HydrophobicContact CB-CD1 4.03Å; L396-L445 HydrophobicContact CB-CD2 4.48Å; L396-L445 HydrophobicContact CD1-CD1 4.28Å; L396-L445 WeakPolarHBondContact O-CD2 3.43Å
397	Y	81.9	Confident	77.6	Confident	34 Å²	34	49.8 Å²	49.8	13%	0.133	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	9.5	-177	-56.4	-77.8	0	0	0	113.8	L388 R393 K395 L399 F408 A430 L445 S447 W723	L388-Y397 HydrophobicContact CD1-CE2 4.05Å; L388-Y397 HydrophobicContact CD2-CE2 3.99Å; R393-Y397 PolarHBondContact O-N 3.5Å; K395-Y397 PolarHBondContact O-N 2.86Å; Y397-L399 PolarHBondContact O-N 3.34Å; Y397-L399 VanDerWaalsContact O-N 3.14Å; Y397-F408 WeakPolarHBondContact OH-CZ 3.29Å; Y397-A430 HydrophobicContact CE2-CB 4.42Å; Y397-A430 VanDerWaalsContact OH-CB 3.27Å; Y397-A430 WeakPolarHBondContact OH-CB 3.41Å; Y397-L445 HydrophobicContact CD1-CD2 3.64Å; Y397-L445 HydrophobicContact CE1-CD1 4.43Å; Y397-L445 HydrophobicContact CE1-CD2 3.57Å; Y397-L445 HydrophobicContact CE1-CG 4.23Å; Y397-S447 VanDerWaalsContact OH-CB 3.28Å; Y397-S447 WeakPolarHBondContact OH-CB 3.21Å; Y397-S447 PolarHBondContact OH-OG 2.82Å; Y397-W723 AromaticContact CD1-CH2 3.38Å; Y397-W723 HydrophobicContact CD1-CH2 3.38Å; Y397-W723 HydrophobicContact CD1-CZ2 4.35Å; Y397-W723 HydrophobicContact CD1-CZ3 4.1Å; Y397-W723 AromaticContact CD2-CH2 3.91Å; Y397-W723 HydrophobicContact CD2-CH2 3.91Å; Y397-W723 AromaticContact CD2-CZ3 3.79Å; Y397-W723 HydrophobicContact CD2-CZ3 3.79Å; Y397-W723 AromaticContact CE1-CH2 3.33Å; Y397-W723 HydrophobicContact CE1-CH2 3.33Å; Y397-W723 HydrophobicContact CE1-CZ2 4.04Å; Y397-W723 HydrophobicContact CE1-CZ3 4.17Å; Y397-W723 AromaticContact CE2-CH2 3.91Å; Y397-W723 HydrophobicContact CE2-CH2 3.91Å; Y397-W723 AromaticContact CE2-CZ3 3.9Å; Y397-W723 HydrophobicContact CE2-CZ3 3.9Å; Y397-W723 AromaticContact CG-CH2 3.62Å; Y397-W723 HydrophobicContact CG-CH2 3.62Å; Y397-W723 AromaticContact CG-CZ3 3.86Å; Y397-W723 HydrophobicContact CG-CZ3 3.86Å; Y397-W723 AromaticContact CZ-CH2 3.6Å
398	S	81.5	Confident	77.6	Confident	107 Å²	107	48.9 Å²	48.9	75%	0.748	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	38.6	178.8	-53.1	0	0	0	0	112.7	T394	T394-S398 CarbonylContact O-C 3.46Å; T394-S398 WeakPolarHBondContact O-CA 3.42Å; T394-S398 PolarHBondContact O-N 2.8Å; T394-S398 VanDerWaalsContact O-N 3.12Å
399	L	75.4	Confident	77.6	Confident	31 Å²	31	49.2 Å²	49.2	16%	0.162	26%	0.263	C	S	.	.			trans	-68.9	142.1	178.6	-60.7	-175.9	0	0	0	109.8	R393 T394 Y397 E401 I403	R393-L399 HydrophobicContact CB-CD1 3.88Å; R393-L399 HydrophobicContact CG-CD1 4.27Å; R393-L399 WeakPolarHBondContact O-CG 3.47Å; T394-L399 PolarHBondContact O-N 2.87Å; Y397-L399 PolarHBondContact O-N 3.34Å; Y397-L399 VanDerWaalsContact O-N 3.14Å; L399-E401 VanDerWaalsContact C-N 3.26Å; L399-E401 PolarHBondContact O-N 3.44Å; L399-I403 HydrophobicContact CD1-CD1 4.07Å
400	R	73.5	Confident	77.5	Confident	251 Å²	251	50.9 Å²	50.9	95%	0.947	27%	0.269	S	S	*	.	S	Bend	trans	-65.8	-30.4	-178.6	-67.2	-178.4	-176	170.9	1.1	113
401	E	71.5	Confident	77.9	Confident	122 Å²	122	49.4 Å²	49.4	57%	0.57	26%	0.26	S	S	*	.	S	Bend	trans	-126.1	149.9	-174.5	-66.3	176.9	-178.3	0	0	110.2	L399 I403	L399-E401 VanDerWaalsContact C-N 3.26Å; L399-E401 PolarHBondContact O-N 3.44Å; E401-I403 PolarHBondContact O-N 2.68Å
402	S	69.3	Low	78.4	Confident	86 Å²	86	46.1 Å²	46.1	60%	0.601	24%	0.244	S	C	*	.			trans	-82.7	110.4	170.7	-163.8	0	0	0	0	109	T394	T394-S402 WeakPolarHBondContact OG1-CA 3.22Å
403	I	71.5	Confident	78.7	Confident	26 Å²	26	46.4 Å²	46.4	13%	0.133	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-93.2	149	176.7	-52	168.9	0	0	0	106.5	P390 R393 L399 E401 V651	P390-I403 WeakPolarHBondContact CA-O 3.26Å; P390-I403 VanDerWaalsContact CB-O 3.29Å; P390-I403 WeakPolarHBondContact CB-O 3.47Å; R393-I403 VanDerWaalsContact NH2-CB 3.31Å; R393-I403 PolarHBondContact NH2-O 3.2Å; L399-I403 HydrophobicContact CD1-CD1 4.07Å; E401-I403 PolarHBondContact O-N 2.68Å; I403-V651 HydrophobicContact CG2-CG1 4.04Å
404	G	75	Confident	79	Confident	47 Å²	47	46.4 Å²	46.4	49%	0.485	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-78.2	150.5	179.6	0	0	0	0	0	114.8	R393	R393-G404 PolarHBondContact NH2-O 2.59Å
405	P	79.1	Confident	79.5	Confident	44 Å²	44	44.3 Å²	44.3	29%	0.286	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-49.1	151.6	-155.4	24.9	-35.4	0	0	0	114.7	Y387 P390	Y387-P405 HydrophobicContact CE2-CB 3.89Å; Y387-P405 WeakPolarHBondContact OH-CB 3.33Å; P390-P405 HydrophobicContact CG-CB 4.14Å; P390-P405 HydrophobicContact CG-CG 4.42Å
406	M	81	Confident	79.6	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	159.8	177.2	74.6	178.6	-59.3	0	0	114	L388 R393 W723	L388-M406 HydrophobicContact CB-CG 4.34Å; L388-M406 PolarHBondContact N-O 2.84Å; L388-M406 PolarHBondContact O-N 3.27Å; L388-M406 VanDerWaalsContact O-N 3.08Å; R393-M406 PolarHBondContact NH1-SD 2.98Å; M406-W723 HydrophobicContact CE-CB 3.61Å; M406-W723 HydrophobicContact SD-CB 4Å
407	L	83.3	Confident	79.3	Confident	19 Å²	19	43.2 Å²	43.2	10%	0.099	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	142.7	160.8	-60.6	172.8	0	0	0	108.5	V385 Y387 V490 E497 A498	V385-L407 HydrophobicContact CG1-CD1 4.5Å; V385-L407 HydrophobicContact CG1-CD2 3.96Å; Y387-L407 HydrophobicContact CD2-CD2 4.04Å; L407-V490 HydrophobicContact CG-CG1 4.49Å; L407-E497 HydrophobicContact CD1-CB 3.65Å; L407-A498 HydrophobicContact CD1-CB 3.83Å
408	F	82	Confident	79	Confident	1 Å²	1	44.2 Å²	44.2	0%	0.004	25%	0.246	C	C	.	.			trans	-63.2	131.6	177.8	-79.1	-75.9	0	0	0	111.1	A386 L388 Y397 W410 S411 A430 W723	A386-F408 HydrophobicContact CB-CD2 3.73Å; A386-F408 HydrophobicContact CB-CE2 4.47Å; A386-F408 PolarHBondContact O-N 2.85Å; L388-F408 HydrophobicContact CB-CD2 4.45Å; L388-F408 HydrophobicContact CB-CE2 3.98Å; L388-F408 HydrophobicContact CB-CZ 4.25Å; L388-F408 HydrophobicContact CD1-CE2 4.08Å; L388-F408 HydrophobicContact CD1-CZ 3.94Å; L388-F408 HydrophobicContact CD2-CE1 3.78Å; L388-F408 HydrophobicContact CD2-CE2 4.07Å; L388-F408 HydrophobicContact CD2-CZ 3.49Å; L388-F408 VanDerWaalsContact CD2-CZ 3.49Å; L388-F408 HydrophobicContact CG-CE2 4.28Å; L388-F408 HydrophobicContact CG-CZ 4.12Å; Y397-F408 WeakPolarHBondContact OH-CZ 3.29Å; F408-W410 HydrophobicContact CB-CD2 3.84Å; F408-W410 HydrophobicContact CB-CE3 4.06Å; F408-W410 HydrophobicContact CB-CG 4.49Å; F408-W410 HydrophobicContact CB-CH2 3.72Å; F408-W410 HydrophobicContact CB-CZ2 3.57Å; F408-W410 HydrophobicContact CB-CZ3 3.96Å; F408-W410 AromaticContact CD1-CE2 3.49Å; F408-W410 VanDerWaalsContact CD1-CE2 3.49Å; F408-W410 HydrophobicContact CD1-CH2 4.02Å; F408-W410 AromaticContact CD1-CZ2 3.2Å; F408-W410 HydrophobicContact CD1-CZ2 3.2Å; F408-W410 AromaticContact CD1-NE1 3.54Å; F408-W410 AromaticContact CD2-CH2 3.59Å; F408-W410 HydrophobicContact CD2-CH2 3.59Å; F408-W410 AromaticContact CD2-CZ2 3.66Å; F408-W410 HydrophobicContact CD2-CZ2 3.66Å; F408-W410 HydrophobicContact CD2-CZ3 4.46Å; F408-W410 HydrophobicContact CE1-CH2 4.48Å; F408-W410 AromaticContact CE1-CZ2 3.63Å; F408-W410 HydrophobicContact CE1-CZ2 3.63Å; F408-W410 HydrophobicContact CE2-CH2 4.09Å; F408-W410 HydrophobicContact CE2-CZ2 4.04Å; F408-W410 HydrophobicContact CG-CD2 4.38Å; F408-W410 AromaticContact CG-CE2 3.62Å; F408-W410 AromaticContact CG-CH2 3.52Å; F408-W410 HydrophobicContact CG-CH2 3.52Å; F408-W410 AromaticContact CG-CZ2 3.18Å; F408-W410 HydrophobicContact CG-CZ2 3.18Å; F408-W410 HydrophobicContact CG-CZ3 4.26Å; F408-W410 HydrophobicContact CZ-CH2 4.48Å; F408-W410 HydrophobicContact CZ-CZ2 4Å; F408-W410 PolarHBondContact O-N 2.89Å; F408-S411 VanDerWaalsContact O-CB 3.27Å; F408-S411 WeakPolarHBondContact O-CB 3.24Å; F408-S411 PolarHBondContact O-N 3.03Å; F408-A430 HydrophobicContact CE2-CB 4.44Å; F408-A430 HydrophobicContact CZ-CB 4.34Å; F408-W723 HydrophobicContact CD1-CD2 4.18Å; F408-W723 HydrophobicContact CD1-CG 4.2Å; F408-W723 AromaticContact CE1-CD2 3.92Å; F408-W723 HydrophobicContact CE1-CD2 3.92Å; F408-W723 HydrophobicContact CE1-CE3 4.02Å; F408-W723 HydrophobicContact CE1-CG 4.41Å; F408-W723 HydrophobicContact CE1-CH2 4.5Å; F408-W723 HydrophobicContact CE1-CZ2 4.37Å; F408-W723 HydrophobicContact CE1-CZ3 4.33Å
409	P	78.7	Confident	78.9	Confident	7 Å²	7	39.1 Å²	39.1	5%	0.045	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-19	-175.9	28.3	-35.7	0	0	0	112.4	G366 P367 R413 W723	G366-P409 CarbonylContact C-O 3.56Å; P367-P409 WeakPolarHBondContact CA-O 3.35Å; P367-P409 VanDerWaalsContact CB-O 3.29Å; P367-P409 WeakPolarHBondContact CB-O 3.42Å; P367-P409 WeakPolarHBondContact CD-O 3.38Å; P409-R413 PolarHBondContact O-NH1 3.36Å; P409-W723 HydrophobicContact CG-CB 3.8Å; P409-W723 HydrophobicContact CG-CG 4.47Å
410	W	79	Confident	79.2	Confident	34 Å²	34	38.9 Å²	38.9	13%	0.129	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-7.9	172.3	44.9	-102.3	0	0	0	113.1	N364 N365 G366 A386 F408 S412 W723	N364-W410 CarbonylContact C-O 3.6Å; N364-W410 VanDerWaalsContact CA-O 3.23Å; N364-W410 WeakPolarHBondContact CA-O 3.16Å; N364-W410 HydrophobicContact CB-CE3 3.91Å; N364-W410 HydrophobicContact CB-CZ3 4.4Å; N364-W410 WeakPolarHBondContact OD1-CZ3 3.49Å; N365-W410 PolarHBondContact N-O 3.09Å; N365-W410 VanDerWaalsContact N-O 3.13Å; G366-W410 PolarHBondContact N-O 2.66Å; A386-W410 HydrophobicContact CB-CH2 4.32Å; A386-W410 HydrophobicContact CB-CZ3 4.31Å; F408-W410 HydrophobicContact CB-CD2 3.84Å; F408-W410 HydrophobicContact CB-CE3 4.06Å; F408-W410 HydrophobicContact CB-CG 4.49Å; F408-W410 HydrophobicContact CB-CH2 3.72Å; F408-W410 HydrophobicContact CB-CZ2 3.57Å; F408-W410 HydrophobicContact CB-CZ3 3.96Å; F408-W410 AromaticContact CD1-CE2 3.49Å; F408-W410 VanDerWaalsContact CD1-CE2 3.49Å; F408-W410 HydrophobicContact CD1-CH2 4.02Å; F408-W410 AromaticContact CD1-CZ2 3.2Å; F408-W410 HydrophobicContact CD1-CZ2 3.2Å; F408-W410 AromaticContact CD1-NE1 3.54Å; F408-W410 AromaticContact CD2-CH2 3.59Å; F408-W410 HydrophobicContact CD2-CH2 3.59Å; F408-W410 AromaticContact CD2-CZ2 3.66Å; F408-W410 HydrophobicContact CD2-CZ2 3.66Å; F408-W410 HydrophobicContact CD2-CZ3 4.46Å; F408-W410 HydrophobicContact CE1-CH2 4.48Å; F408-W410 AromaticContact CE1-CZ2 3.63Å; F408-W410 HydrophobicContact CE1-CZ2 3.63Å; F408-W410 HydrophobicContact CE2-CH2 4.09Å; F408-W410 HydrophobicContact CE2-CZ2 4.04Å; F408-W410 HydrophobicContact CG-CD2 4.38Å; F408-W410 AromaticContact CG-CE2 3.62Å; F408-W410 AromaticContact CG-CH2 3.52Å; F408-W410 HydrophobicContact CG-CH2 3.52Å; F408-W410 AromaticContact CG-CZ2 3.18Å; F408-W410 HydrophobicContact CG-CZ2 3.18Å; F408-W410 HydrophobicContact CG-CZ3 4.26Å; F408-W410 HydrophobicContact CZ-CH2 4.48Å; F408-W410 HydrophobicContact CZ-CZ2 4Å; F408-W410 PolarHBondContact O-N 2.89Å; W410-S412 PolarHBondContact O-N 3.23Å; W410-W723 AromaticContact NE1-CD1 3.84Å; W410-W723 AromaticContact NE1-NE1 3.85Å
411	S	85.3	Confident	79.5	Confident	3 Å²	3	27.5 Å²	27.5	2%	0.021	17%	0.165	C	C	.	.	S	Bend	trans	-63.8	132.1	174.2	-166.7	0	0	0	0	109.7	G366 F408 R413 T449	G366-S411 WeakPolarHBondContact CA-O 3.4Å; F408-S411 VanDerWaalsContact O-CB 3.27Å; F408-S411 WeakPolarHBondContact O-CB 3.24Å; F408-S411 PolarHBondContact O-N 3.03Å; S411-R413 PolarHBondContact O-NH1 3.48Å; S411-T449 WeakPolarHBondContact OG-CG2 3.21Å
412	S	86.1	Confident	79.8	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	14%	0.138	C	C	.	.			trans	-60.4	146.5	-179.5	-79.1	0	0	0	0	111.7	S362 G363 N365 T371 W410	S362-S412 WeakPolarHBondContact O-CB 3.21Å; G363-S412 VanDerWaalsContact O-CB 3.26Å; G363-S412 WeakPolarHBondContact O-CB 3.25Å; G363-S412 PolarHBondContact O-N 2.84Å; G363-S412 PolarHBondContact O-OG 2.86Å; N365-S412 WeakPolarHBondContact CB-OG 3.45Å; N365-S412 PolarHBondContact N-OG 2.88Å; T371-S412 VanDerWaalsContact O-CB 3.26Å; T371-S412 WeakPolarHBondContact O-CB 3.47Å; T371-S412 PolarHBondContact O-OG 3.16Å; T371-S412 WeakPolarHBondContact OG1-CA 3.37Å; W410-S412 PolarHBondContact O-N 3.23Å
413	R	86	Confident	80.3	Confident	9 Å²	9	17.8 Å²	17.8	3%	0.034	11%	0.11	C	C	.	.			trans	-126.2	142.3	-174.4	-70.6	150.3	166.1	99	-21.4	111.8	P367 L369 S370 T371 V372 P409 S411 F496 E497	P367-R413 VanDerWaalsContact CA-CZ 3.43Å; P367-R413 WeakPolarHBondContact O-CD 3.22Å; P367-R413 PolarHBondContact O-NE 3.25Å; L369-R413 HydrophobicContact CD2-CB 4.32Å; S370-R413 PolarHBondContact N-O 3.25Å; S370-R413 VanDerWaalsContact N-O 3.14Å; T371-R413 PolarHBondContact N-O 3.45Å; T371-R413 PolarHBondContact OG1-N 3.07Å; T371-R413 PolarHBondContact OG1-O 3.39Å; V372-R413 VanDerWaalsContact CG2-C 3.47Å; V372-R413 PolarHBondContact N-O 3.13Å; P409-R413 PolarHBondContact O-NH1 3.36Å; S411-R413 PolarHBondContact O-NH1 3.48Å; R413-F496 VanDerWaalsContact CA-O 3.28Å; R413-F496 WeakPolarHBondContact CA-O 3.23Å; R413-E497 HydrophobicContact CG-CB 4.48Å; R413-E497 HydrophobicContact CG-CG 3.66Å; R413-E497 IonicContact CZ-OE1 2.68Å; R413-E497 IonicContact NE-OE1 3.48Å; R413-E497 PolarHBondContact NE-OE1 3.36Å; R413-E497 VanDerWaalsContact NE-OE1 3.07Å; R413-E497 IonicContact NH2-OE1 2.77Å; R413-E497 PolarHBondContact NH2-OE1 2.87Å
414	G	84.3	Confident	80.8	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.11	C	C	.	.	S	Bend	trans	-67.3	-178.5	171.1	0	0	0	0	0	113	L369 L421 F496	L369-G414 WeakPolarHBondContact CB-O 3.31Å; L369-G414 VanDerWaalsContact CD2-O 3.22Å; L369-G414 WeakPolarHBondContact CD2-O 3.41Å; G414-L421 WeakPolarHBondContact CA-O 3.31Å; G414-F496 PolarHBondContact N-O 3.21Å
415	P	86	Confident	81.3	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.088	C	C	.	.			cis	-75.8	152.4	-15.2	35.9	-36.8	0	0	0	110.7	S370 W420 Y525 T627	S370-P415 WeakPolarHBondContact CA-O 3.43Å; S370-P415 VanDerWaalsContact CB-O 3.28Å; S370-P415 WeakPolarHBondContact CB-O 3.45Å; S370-P415 PolarHBondContact N-O 2.98Å; S370-P415 PolarHBondContact OG-O 3.16Å; P415-W420 CarbonylContact C-O 3.57Å; P415-W420 WeakPolarHBondContact CA-O 3.34Å; P415-W420 WeakPolarHBondContact CB-O 3.31Å; P415-Y525 HydrophobicContact CG-CD1 4.04Å; P415-Y525 HydrophobicContact CG-CD2 3.83Å; P415-Y525 HydrophobicContact CG-CE1 4.01Å; P415-Y525 HydrophobicContact CG-CE2 3.78Å; P415-Y525 HydrophobicContact CG-CG 3.96Å; P415-T627 HydrophobicContact CG-CG2 3.84Å
416	C	79.8	Confident	81.8	Confident	3 Å²	3	13.1 Å²	13.1	2%	0.02	8%	0.075	C	C	.	.			trans	-55.7	167.2	164.1	-61.5	0	0	0	0	111.7	G377 D418 G419 W420	G377-C416 WeakPolarHBondContact CA-SG 3.21Å; C416-D418 WeakPolarHBondContact CB-OD1 3.26Å; C416-D418 PolarHBondContact O-N 3.08Å; C416-G419 PolarHBondContact O-N 2.99Å; C416-W420 HydrophobicContact CB-CB 4.3Å; C416-W420 WeakPolarHBondContact CB-O 3.19Å; C416-W420 PolarHBondContact N-O 2.88Å
417	S	75.3	Confident	82.2	Confident	80 Å²	80	13 Å²	13	56%	0.559	7%	0.074	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.3	-177.3	48.7	0	0	0	0	114	G419	S417-G419 VanDerWaalsContact C-N 3.34Å
418	D	75	Confident	82.5	Confident	56 Å²	56	12.2 Å²	12.2	30%	0.299	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	0.7	175.4	65.3	-12.9	0	0	0	113.4	C416 W420 R522	C416-D418 WeakPolarHBondContact CB-OD1 3.26Å; C416-D418 PolarHBondContact O-N 3.08Å; D418-W420 WeakPolarHBondContact OD1-CB 2.89Å; D418-W420 PolarHBondContact OD1-N 3.29Å; D418-W420 VanDerWaalsContact OD1-N 3.11Å; D418-R522 WeakPolarHBondContact OD2-CD 3.44Å
419	G	80.5	Confident	82.9	Confident	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.07	C	C	.	.	S	Bend	trans	86.9	2.3	-178.5	0	0	0	0	0	115.9	C416 S417 R522 Y525	C416-G419 PolarHBondContact O-N 2.99Å; S417-G419 VanDerWaalsContact C-N 3.34Å; G419-R522 CarbonylContact C-O 3.52Å; G419-R522 VanDerWaalsContact C-O 3.29Å; G419-Y525 VanDerWaalsContact CA-CB 3.46Å
420	W	80.3	Confident	83.4	Confident	25 Å²	25	11.9 Å²	11.9	10%	0.095	7%	0.068	C	C	.	.			trans	-69.2	145.7	171.9	-172.7	-127.4	0	0	0	110.8	P415 C416 D418 G422 R522 P625	P415-W420 CarbonylContact C-O 3.57Å; P415-W420 WeakPolarHBondContact CA-O 3.34Å; P415-W420 WeakPolarHBondContact CB-O 3.31Å; C416-W420 HydrophobicContact CB-CB 4.3Å; C416-W420 WeakPolarHBondContact CB-O 3.19Å; C416-W420 PolarHBondContact N-O 2.88Å; D418-W420 WeakPolarHBondContact OD1-CB 2.89Å; D418-W420 PolarHBondContact OD1-N 3.29Å; D418-W420 VanDerWaalsContact OD1-N 3.11Å; W420-G422 VanDerWaalsContact C-N 3.25Å; W420-G422 PolarHBondContact O-N 3.28Å; W420-R522 WeakPolarHBondContact CA-O 3.49Å; W420-R522 HydrophobicContact CB-CB 4.15Å; W420-R522 WeakPolarHBondContact CB-O 3.44Å; W420-R522 HydrophobicContact CG-CB 4.5Å; W420-R522 PolarHBondContact N-O 3.35Å; W420-P625 HydrophobicContact CE3-CG 3.79Å; W420-P625 HydrophobicContact CZ3-CG 4.07Å
421	L	81.6	Confident	83.9	Confident	12 Å²	12	10.4 Å²	10.4	6%	0.063	6%	0.063	C	C	.	.			trans	-62	-39.1	174.9	-77.3	176.3	0	0	0	111.2	G414 T423 V495 F496 Y606 P625	G414-L421 WeakPolarHBondContact CA-O 3.31Å; L421-T423 PolarHBondContact O-N 3.18Å; L421-V495 HydrophobicContact CD1-CB 4.42Å; L421-V495 HydrophobicContact CD2-CB 4.44Å; L421-V495 HydrophobicContact CD2-CG2 4.13Å; L421-F496 HydrophobicContact CD2-CD1 3.81Å; L421-F496 HydrophobicContact CD2-CE1 4.09Å; L421-Y606 WeakPolarHBondContact CD1-OH 3.25Å; L421-Y606 HydrophobicContact CD2-CE2 3.94Å; L421-P625 HydrophobicContact CG-CB 4.03Å; L421-P625 HydrophobicContact CG-CG 4.34Å
422	G	76.9	Confident	84.1	Confident	1 Å²	1	12 Å²	12	1%	0.01	7%	0.071	C	C	.	.			trans	64.8	-9.8	-176	0	0	0	0	0	115	G376 L383 W420	G376-G422 VanDerWaalsContact O-CA 3.31Å; G376-G422 WeakPolarHBondContact O-CA 3.41Å; L383-G422 WeakPolarHBondContact CD1-O 3.39Å; W420-G422 VanDerWaalsContact C-N 3.25Å; W420-G422 PolarHBondContact O-N 3.28Å
423	T	80.5	Confident	84.5	Confident	3 Å²	3	12.1 Å²	12.1	2%	0.018	7%	0.072	C	C	.	.			trans	-111.1	112.2	169.1	45.7	0	0	0	0	108.1	V372 V385 L421 V495 F496 G499	V372-T423 HydrophobicContact CG2-CG2 3.73Å; V385-T423 HydrophobicContact CG2-CG2 3.4Å; L421-T423 PolarHBondContact O-N 3.18Å; T423-V495 PolarHBondContact OG1-O 3.43Å; T423-F496 PolarHBondContact OG1-O 2.96Å; T423-G499 WeakPolarHBondContact O-CA 3.49Å
424	A	80.7	Confident	84.8	Confident	16 Å²	16	11.8 Å²	11.8	13%	0.132	7%	0.071	C	C	.	.			trans	-91.2	-48.9	-176.1	0	0	0	0	0	111.4	L383 R500	L383-A424 PolarHBondContact O-N 3.12Å; A424-R500 WeakPolarHBondContact O-CB 3.44Å; A424-R500 PolarHBondContact O-N 3.28Å
425	I	86.3	Confident	85.3	Confident	4 Å²	4	12 Å²	12	2%	0.021	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	167.3	-173.6	54.1	171.2	0	0	0	110.3	L383 G384 V385 L483 G501 M503	L383-I425 PolarHBondContact O-N 3.09Å; G384-I425 CarbonylContact C-O 3.57Å; G384-I425 VanDerWaalsContact CA-O 3.26Å; G384-I425 WeakPolarHBondContact CA-O 3.42Å; V385-I425 PolarHBondContact N-O 2.72Å; I425-L483 HydrophobicContact CD1-CD1 4.15Å; I425-L483 HydrophobicContact CG2-CB 4.37Å; I425-G501 CarbonylContact C-O 3.52Å; I425-M503 HydrophobicContact CD1-CB 4.34Å; I425-M503 HydrophobicContact CD1-SD 4.43Å
426	C	88.8	Confident	85.7	Confident	0 Å²	0	12 Å²	12	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	149.5	170.5	-66.4	0	0	0	0	111.2	V385 A498 G501 L502 M503	V385-C426 HydrophobicContact CB-CB 4.45Å; V385-C426 WeakPolarHBondContact O-CA 3.46Å; C426-A498 WeakPolarHBondContact SG-CA 3.38Å; C426-A498 PolarHBondContact SG-O 3.18Å; C426-G501 PolarHBondContact N-O 2.86Å; C426-L502 HydrophobicContact CB-CB 4.5Å; C426-L502 HydrophobicContact CB-CD1 4.12Å; C426-M503 PolarHBondContact O-N 2.99Å; C426-M503 VanDerWaalsContact O-N 3.08Å
427	A	89.9	Confident	86.4	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	158.2	168.1	0	0	0	0	0	110.3	V385 Y387 G429 S452 N455 A456 M503	V385-A427 PolarHBondContact O-N 3.17Å; Y387-A427 PolarHBondContact N-O 3.21Å; A427-G429 PolarHBondContact O-N 3.34Å; A427-S452 VanDerWaalsContact O-CB 3.25Å; A427-S452 WeakPolarHBondContact O-CB 3.09Å; A427-N455 HydrophobicContact CB-CB 4.43Å; A427-A456 HydrophobicContact CB-CB 3.99Å; A427-M503 HydrophobicContact CB-SD 3.87Å
428	P	90.4	Very high	87.3	Confident	2 Å²	2	14.2 Å²	14.2	1%	0.013	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.7	122.5	176.3	-27.5	31.5	0	0	0	113.4	G44 T48 Y387 M392 S452 N455	G44-P428 VanDerWaalsContact O-CG 3.27Å; G44-P428 WeakPolarHBondContact O-CG 3.42Å; T48-P428 HydrophobicContact CG2-CG 4.08Å; Y387-P428 CarbonylContact O-C 3.54Å; Y387-P428 WeakPolarHBondContact O-CA 3.41Å; M392-P428 HydrophobicContact CE-CB 4.04Å; M392-P428 HydrophobicContact SD-CB 4.16Å; P428-S452 WeakPolarHBondContact O-CA 3.24Å; P428-S452 PolarHBondContact O-N 3.31Å; P428-N455 WeakPolarHBondContact CD-OD1 3.25Å
429	G	89.2	Confident	88.2	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.06	C	C	.	.			trans	-107.7	18.3	-170.9	0	0	0	0	0	115.7	Y387 A427 S447 G448	Y387-G429 PolarHBondContact O-N 2.96Å; A427-G429 PolarHBondContact O-N 3.34Å; G429-S447 WeakPolarHBondContact O-CA 3.44Å; G429-G448 PolarHBondContact O-N 3.08Å
430	A	89	Confident	88.7	Confident	2 Å²	2	17.4 Å²	17.4	2%	0.017	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142.6	176.4	0	0	0	0	0	110.5	L388 M392 L396 Y397 F408 L446	L388-A430 HydrophobicContact CD1-CB 3.81Å; M392-A430 HydrophobicContact CE-CB 4.24Å; M392-A430 WeakPolarHBondContact CE-O 3.34Å; L396-A430 HydrophobicContact CD1-CB 3.96Å; Y397-A430 HydrophobicContact CE2-CB 4.42Å; Y397-A430 VanDerWaalsContact OH-CB 3.27Å; Y397-A430 WeakPolarHBondContact OH-CB 3.41Å; F408-A430 HydrophobicContact CE2-CB 4.44Å; F408-A430 HydrophobicContact CZ-CB 4.34Å; A430-L446 WeakPolarHBondContact CA-O 3.47Å
431	A	89.5	Confident	89.1	Confident	2 Å²	2	20 Å²	20	2%	0.017	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	149.1	179.2	0	0	0	0	0	112.7	N42 N43 H279 I283 L445 L446	N42-A431 WeakPolarHBondContact O-CA 3.43Å; N43-A431 VanDerWaalsContact OD1-CB 3.28Å; N43-A431 WeakPolarHBondContact OD1-CB 3.25Å; H279-A431 PolarHBondContact CE1-O 2.99Å; H279-A431 PolarHBondContact NE2-O 3.22Å; I283-A431 HydrophobicContact CD1-CB 3.75Å; I283-A431 HydrophobicContact CG1-CB 3.75Å; A431-L445 WeakPolarHBondContact O-CA 3.28Å; A431-L446 PolarHBondContact N-O 2.86Å; A431-L446 VanDerWaalsContact N-O 3.11Å; A431-L446 PolarHBondContact O-N 3.42Å; A431-L446 VanDerWaalsContact O-N 3.13Å
432	I	90.9	Very high	89.2	Confident	36 Å²	36	24.4 Å²	24.4	19%	0.185	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	100.1	168.1	-62.7	171	0	0	0	109	L396 R443 Q444 L445	L396-I432 HydrophobicContact CD2-CD1 3.62Å; L396-I432 HydrophobicContact CD2-CG1 3.88Å; I432-R443 HydrophobicContact CG2-CB 3.99Å; I432-R443 PolarHBondContact O-NH2 3.28Å; I432-Q444 WeakPolarHBondContact CA-O 3.33Å; I432-L445 HydrophobicContact CD1-CB 4.41Å; I432-L445 HydrophobicContact CD1-CD1 4.46Å; I432-L445 HydrophobicContact CG1-CB 3.77Å; I432-L445 HydrophobicContact CG1-CD1 3.75Å; I432-L445 HydrophobicContact CG1-CG 4.29Å
433	T	92.9	Very high	89.8	Confident	4 Å²	4	28 Å²	28	3%	0.025	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	-179	-179.9	-159.9	0	0	0	0	112.3	H279 C282 I283 R443 Q444	H279-T433 HydrophobicContact CB-CG2 4.4Å; H279-T433 VanDerWaalsContact CD2-CG2 3.49Å; H279-T433 WeakPolarHBondContact CD2-CG2 3.17Å; H279-T433 WeakPolarHBondContact O-CG2 3.44Å; C282-T433 HydrophobicContact CB-CG2 3.69Å; C282-T433 VanDerWaalsContact CB-OG1 3.28Å; C282-T433 WeakPolarHBondContact CB-OG1 3.11Å; I283-T433 HydrophobicContact CG1-CG2 3.83Å; T433-R443 CarbonylContact O-C 3.6Å; T433-R443 WeakPolarHBondContact O-CA 3.36Å; T433-Q444 PolarHBondContact N-O 2.86Å; T433-Q444 PolarHBondContact O-N 3.07Å
434	S	93.5	Very high	90.2	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.014	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	147.1	-170.9	-69	0	0	0	0	113.8	H279 N442	H279-S434 WeakPolarHBondContact CA-O 3.4Å; S434-N442 WeakPolarHBondContact CA-O 3.49Å
435	T	93.5	Very high	90.7	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.018	16%	0.156	C	C	.	.			trans	-122.1	162.8	173.5	41.4	0	0	0	0	109.6	T78 L275 T439 N441 Q444	T78-T435 WeakPolarHBondContact CG2-O 3.35Å; L275-T435 HydrophobicContact CB-CG2 4.47Å; L275-T435 HydrophobicContact CD1-CG2 4.38Å; T435-T439 PolarHBondContact OG1-OG1 3.5Å; T435-N441 PolarHBondContact OG1-O 3.5Å; T435-Q444 HydrophobicContact CG2-CB 3.7Å
436	P	95.4	Very high	90.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.163	C	C	.	.			trans	-58	149.5	178	-25.6	35.4	0	0	0	112.8	D75 T272 L275 T278 W438 T439	D75-P436 HydrophobicContact CB-CB 3.9Å; D75-P436 HydrophobicContact CB-CG 4.27Å; D75-P436 WeakPolarHBondContact OD2-CA 3.47Å; T272-P436 HydrophobicContact CG2-CG 4.45Å; L275-P436 HydrophobicContact CB-CG 4.43Å; T278-P436 WeakPolarHBondContact OG1-CG 3.36Å; P436-W438 VanDerWaalsContact C-N 3.28Å; P436-W438 VanDerWaalsContact CB-CD1 3.46Å; P436-W438 HydrophobicContact CB-CD2 4.49Å; P436-W438 HydrophobicContact CB-CG 4.26Å; P436-W438 HydrophobicContact CG-CZ2 4.45Å; P436-W438 PolarHBondContact O-N 3.04Å; P436-T439 HydrophobicContact CB-CG2 4.37Å; P436-T439 WeakPolarHBondContact O-CB 3.23Å; P436-T439 WeakPolarHBondContact O-CG2 3.27Å; P436-T439 PolarHBondContact O-N 2.86Å; P436-T439 PolarHBondContact O-OG1 3.35Å
437	R	94.3	Very high	90.9	Very high	121 Å²	121	35.9 Å²	35.9	46%	0.457	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-62.1	-32.7	-174.8	-65.3	-170.9	76.6	-172.2	3.4	113.6	D75 S77 M253 T439 L440	D75-R437 PolarHBondContact OD2-N 3.07Å; S77-R437 WeakPolarHBondContact OG-CD 3.3Å; S77-R437 WeakPolarHBondContact OG-CG 3.35Å; M253-R437 HydrophobicContact CB-CB 4.27Å; M253-R437 HydrophobicContact CE-CB 4.15Å; R437-T439 PolarHBondContact O-N 2.77Å; R437-T439 VanDerWaalsContact O-N 3.11Å; R437-L440 PolarHBondContact O-N 3.47Å
438	W	94.9	Very high	90.7	Very high	10 Å²	10	36 Å²	36	4%	0.038	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-62.4	-17.6	177.1	65.5	-102.3	0	0	0	114	P149 E151 L152 R155 D252 M253 M254 T272 L275 P436 L440	P149-W438 HydrophobicContact CB-CH2 3.84Å; P149-W438 HydrophobicContact CB-CZ2 4.04Å; P149-W438 HydrophobicContact CB-CZ3 4.25Å; P149-W438 HydrophobicContact CG-CD2 4.45Å; P149-W438 HydrophobicContact CG-CH2 4Å; P149-W438 HydrophobicContact CG-CZ2 3.67Å; E151-W438 HydrophobicContact CB-CZ3 4.23Å; L152-W438 HydrophobicContact CB-CE3 3.92Å; L152-W438 HydrophobicContact CB-CZ3 4.39Å; L152-W438 HydrophobicContact CD1-CB 4.22Å; L152-W438 HydrophobicContact CD2-CB 4.06Å; L152-W438 HydrophobicContact CD2-CG 4.35Å; R155-W438 PolarHBondContact NH2-O 3.01Å; D252-W438 WeakPolarHBondContact O-CA 3.37Å; D252-W438 WeakPolarHBondContact O-CB 3.46Å; M253-W438 PolarHBondContact O-N 3.38Å; M254-W438 HydrophobicContact SD-CB 4.19Å; M254-W438 HydrophobicContact SD-CG 3.82Å; T272-W438 PolarHBondContact OG1-NE1 3.37Å; L275-W438 HydrophobicContact CB-CH2 4.4Å; L275-W438 HydrophobicContact CB-CZ2 4.31Å; P436-W438 VanDerWaalsContact C-N 3.28Å; P436-W438 VanDerWaalsContact CB-CD1 3.46Å; P436-W438 HydrophobicContact CB-CD2 4.49Å; P436-W438 HydrophobicContact CB-CG 4.26Å; P436-W438 HydrophobicContact CG-CZ2 4.45Å; P436-W438 PolarHBondContact O-N 3.04Å; W438-L440 PolarHBondContact O-N 2.8Å
439	T	93.8	Very high	90.5	Very high	22 Å²	22	35.9 Å²	35.9	14%	0.135	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-72.1	-16.8	174.7	66.9	0	0	0	0	112.5	L275 T435 P436 R437 N441	L275-T439 HydrophobicContact CB-CG2 3.82Å; L275-T439 HydrophobicContact CD2-CG2 4.47Å; T435-T439 PolarHBondContact OG1-OG1 3.5Å; P436-T439 HydrophobicContact CB-CG2 4.37Å; P436-T439 WeakPolarHBondContact O-CB 3.23Å; P436-T439 WeakPolarHBondContact O-CG2 3.27Å; P436-T439 PolarHBondContact O-N 2.86Å; P436-T439 PolarHBondContact O-OG1 3.35Å; R437-T439 PolarHBondContact O-N 2.77Å; R437-T439 VanDerWaalsContact O-N 3.11Å; T439-N441 PolarHBondContact O-N 3.4Å; T439-N441 VanDerWaalsContact O-N 3.14Å; T439-N441 PolarHBondContact OG1-N 3.03Å; T439-N441 PolarHBondContact OG1-O 3.28Å
440	L	91.3	Very high	90.4	Very high	101 Å²	101	36.6 Å²	36.6	53%	0.529	18%	0.184	S	C	.	.	S	Bend	trans	58.6	12.2	-169.6	-52.4	-179.6	0	0	0	114.2	M253 R437 W438	M253-L440 HydrophobicContact SD-CD2 3.53Å; M253-L440 VanDerWaalsContact SD-CD2 3.53Å; R437-L440 PolarHBondContact O-N 3.47Å; W438-L440 PolarHBondContact O-N 2.8Å
441	N	88.1	Confident	90.5	Very high	78 Å²	78	36.7 Å²	36.7	42%	0.417	18%	0.184	S	C	.	.			trans	-105.2	124.7	172.1	-65.7	-36.1	0	0	0	108.3	T435 T439	T435-N441 PolarHBondContact OG1-O 3.5Å; T439-N441 PolarHBondContact O-N 3.4Å; T439-N441 VanDerWaalsContact O-N 3.14Å; T439-N441 PolarHBondContact OG1-N 3.03Å; T439-N441 PolarHBondContact OG1-O 3.28Å
442	N	84	Confident	90.5	Very high	105 Å²	105	36.6 Å²	36.6	56%	0.561	18%	0.183	S	C	*	.	S	Bend	trans	-67.8	-42	173.4	-178.8	13.9	0	0	0	110.7	S434	S434-N442 WeakPolarHBondContact CA-O 3.49Å
443	R	89.1	Confident	90.5	Very high	77 Å²	77	34.9 Å²	34.9	29%	0.291	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	149.2	-179.2	-62.1	171	66.6	-175.4	-1.3	109.6	N42 I432 T433	N42-R443 PolarHBondContact ND2-NH2 2.96Å; I432-R443 HydrophobicContact CG2-CB 3.99Å; I432-R443 PolarHBondContact O-NH2 3.28Å; T433-R443 CarbonylContact O-C 3.6Å; T433-R443 WeakPolarHBondContact O-CA 3.36Å
444	Q	90	Very high	90.5	Very high	59 Å²	59	34.7 Å²	34.7	28%	0.276	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.7	176.8	-168.5	168.5	-9.9	0	0	111.3	H279 I432 T433 T435 L446	H279-Q444 PolarHBondContact CD2-O 3.19Å; H279-Q444 PolarHBondContact NE2-O 3.25Å; I432-Q444 WeakPolarHBondContact CA-O 3.33Å; T433-Q444 PolarHBondContact N-O 2.86Å; T433-Q444 PolarHBondContact O-N 3.07Å; T435-Q444 HydrophobicContact CG2-CB 3.7Å; Q444-L446 HydrophobicContact CG-CD2 4.17Å
445	L	91.2	Very high	90.5	Very high	51 Å²	51	34.7 Å²	34.7	27%	0.267	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	119.6	167.6	177.8	58.5	0	0	0	109.3	L396 Y397 A431 I432	L396-L445 HydrophobicContact CB-CD1 4.03Å; L396-L445 HydrophobicContact CB-CD2 4.48Å; L396-L445 HydrophobicContact CD1-CD1 4.28Å; L396-L445 WeakPolarHBondContact O-CD2 3.43Å; Y397-L445 HydrophobicContact CD1-CD2 3.64Å; Y397-L445 HydrophobicContact CE1-CD1 4.43Å; Y397-L445 HydrophobicContact CE1-CD2 3.57Å; Y397-L445 HydrophobicContact CE1-CG 4.23Å; A431-L445 WeakPolarHBondContact O-CA 3.28Å; I432-L445 HydrophobicContact CD1-CB 4.41Å; I432-L445 HydrophobicContact CD1-CD1 4.46Å; I432-L445 HydrophobicContact CG1-CB 3.77Å; I432-L445 HydrophobicContact CG1-CD1 3.75Å; I432-L445 HydrophobicContact CG1-CG 4.29Å
446	L	90.3	Very high	90.5	Very high	31 Å²	31	34.6 Å²	34.6	16%	0.162	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	153.4	167.4	-56.7	179.1	0	0	0	109.9	L275 H279 A430 A431 Q444 M451	L275-L446 HydrophobicContact CD1-CD1 3.58Å; L275-L446 HydrophobicContact CD1-CD2 4.34Å; H279-L446 HydrophobicContact CB-CD1 3.89Å; A430-L446 WeakPolarHBondContact CA-O 3.47Å; A431-L446 PolarHBondContact N-O 2.86Å; A431-L446 VanDerWaalsContact N-O 3.11Å; A431-L446 PolarHBondContact O-N 3.42Å; A431-L446 VanDerWaalsContact O-N 3.13Å; Q444-L446 HydrophobicContact CG-CD2 4.17Å; L446-M451 HydrophobicContact CB-CE 4.15Å; L446-M451 HydrophobicContact CB-CG 4.35Å; L446-M451 HydrophobicContact CB-SD 3.77Å; L446-M451 HydrophobicContact CD1-CE 4.17Å
447	S	87.9	Confident	90.4	Very high	48 Å²	48	34.6 Å²	34.6	34%	0.336	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	133.3	-177.1	-30.1	0	0	0	0	109.2	Y397 G429	Y397-S447 VanDerWaalsContact OH-CB 3.28Å; Y397-S447 WeakPolarHBondContact OH-CB 3.21Å; Y397-S447 PolarHBondContact OH-OG 2.82Å; G429-S447 WeakPolarHBondContact O-CA 3.44Å
448	G	86.1	Confident	90.4	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.01	15%	0.151	C	C	.	.	S	Bend	trans	171	161.2	-175.1	0	0	0	0	0	111.5	G429 S450 M451 S452	G429-G448 PolarHBondContact O-N 3.08Å; G448-S450 PolarHBondContact O-N 3.35Å; G448-S450 VanDerWaalsContact O-N 3.17Å; G448-M451 PolarHBondContact O-N 3.43Å; G448-S452 PolarHBondContact O-N 3.2Å
449	T	85.8	Confident	90.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.4	-21.4	159.9	57.1	0	0	0	0	111.5	S361 S362 G363 N364 A386 S411 M451 S452 S453	S361-T449 WeakPolarHBondContact CB-O 2.93Å; S361-T449 WeakPolarHBondContact CB-OG1 3.47Å; S361-T449 PolarHBondContact OG-OG1 3.31Å; S362-T449 WeakPolarHBondContact OG-CG2 3.02Å; G363-T449 WeakPolarHBondContact CA-OG1 3.32Å; G363-T449 PolarHBondContact N-OG1 3.2Å; G363-T449 VanDerWaalsContact O-CG2 3.25Å; G363-T449 WeakPolarHBondContact O-CG2 3.4Å; N364-T449 PolarHBondContact OD1-N 2.75Å; N364-T449 PolarHBondContact OD1-OG1 2.86Å; N364-T449 VanDerWaalsContact OD1-OG1 3.04Å; A386-T449 HydrophobicContact CB-CG2 3.96Å; S411-T449 WeakPolarHBondContact OG-CG2 3.21Å; T449-M451 PolarHBondContact O-N 3.37Å; T449-S452 VanDerWaalsContact CA-OG 3.23Å; T449-S452 WeakPolarHBondContact CA-OG 3.2Å; T449-S452 PolarHBondContact O-N 2.63Å; T449-S452 PolarHBondContact O-OG 3.41Å; T449-S453 PolarHBondContact O-N 2.74Å
450	S	86.3	Confident	90.4	Very high	15 Å²	15	27.4 Å²	27.4	11%	0.105	14%	0.143	C	C	.	.	H	α-helix	trans	-63.7	-20.2	172	-55.7	0	0	0	0	114.4	H276 S340 G448 P454	H276-S450 VanDerWaalsContact CE1-CB 3.49Å; H276-S450 WeakPolarHBondContact CE1-CB 3.33Å; H276-S450 WeakPolarHBondContact NE2-CB 3.44Å; S340-S450 PolarHBondContact O-OG 2.92Å; S340-S450 PolarHBondContact OG-O 2.75Å; G448-S450 PolarHBondContact O-N 3.35Å; G448-S450 VanDerWaalsContact O-N 3.17Å; S450-P454 WeakPolarHBondContact O-CD 3.27Å; S450-P454 VanDerWaalsContact O-CG 3.31Å; S450-P454 WeakPolarHBondContact O-CG 3.48Å
451	M	91.2	Very high	90.6	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.02	12%	0.118	C	C	.	.	H	α-helix	trans	-96.7	-27.1	173.8	-74.7	68.6	-117.1	0	0	111.8	H276 V280 I283 L446 G448 T449 P454 N455	H276-M451 WeakPolarHBondContact NE2-CE 3.46Å; V280-M451 HydrophobicContact CG2-CE 4Å; I283-M451 HydrophobicContact CD1-CB 3.78Å; I283-M451 HydrophobicContact CD1-CG 3.52Å; L446-M451 HydrophobicContact CB-CE 4.15Å; L446-M451 HydrophobicContact CB-CG 4.35Å; L446-M451 HydrophobicContact CB-SD 3.77Å; L446-M451 HydrophobicContact CD1-CE 4.17Å; G448-M451 PolarHBondContact O-N 3.43Å; T449-M451 PolarHBondContact O-N 3.37Å; M451-P454 WeakPolarHBondContact O-CD 3.39Å; M451-P454 VanDerWaalsContact O-CG 3.31Å; M451-P454 WeakPolarHBondContact O-CG 3.47Å; M451-N455 WeakPolarHBondContact O-CB 3.49Å; M451-N455 PolarHBondContact O-N 3.05Å
452	S	90.5	Very high	91	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-70.7	-36.8	173	58.5	0	0	0	0	112.6	G384 A427 P428 G448 T449 N455 A456	G384-S452 PolarHBondContact O-OG 3.04Å; A427-S452 VanDerWaalsContact O-CB 3.25Å; A427-S452 WeakPolarHBondContact O-CB 3.09Å; P428-S452 WeakPolarHBondContact O-CA 3.24Å; P428-S452 PolarHBondContact O-N 3.31Å; G448-S452 PolarHBondContact O-N 3.2Å; T449-S452 VanDerWaalsContact CA-OG 3.23Å; T449-S452 WeakPolarHBondContact CA-OG 3.2Å; T449-S452 PolarHBondContact O-N 2.63Å; T449-S452 PolarHBondContact O-OG 3.41Å; S452-N455 PolarHBondContact O-N 3.11Å; S452-A456 WeakPolarHBondContact O-CB 3.35Å; S452-A456 PolarHBondContact O-N 3.28Å
453	S	90.9	Very high	91.5	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-55.6	-55.4	174.8	-174	0	0	0	0	112.9	N338 I359 T449 N455 A456 A457	N338-S453 WeakPolarHBondContact OD1-CB 3.44Å; N338-S453 PolarHBondContact OD1-O 3.23Å; N338-S453 PolarHBondContact OD1-OG 2.85Å; I359-S453 WeakPolarHBondContact CG2-O 3.5Å; I359-S453 PolarHBondContact O-OG 3.25Å; T449-S453 PolarHBondContact O-N 2.74Å; S453-N455 VanDerWaalsContact C-N 3.3Å; S453-N455 PolarHBondContact O-N 2.98Å; S453-A456 PolarHBondContact O-N 3.32Å; S453-A457 WeakPolarHBondContact O-CB 3.5Å; S453-A457 PolarHBondContact O-N 2.96Å
454	P	93.1	Very high	91.8	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-68.9	-28.6	179.4	24.7	-34.5	0	0	0	113	V280 I283 A284 N338 S450 M451 A457 G458	V280-P454 HydrophobicContact CB-CB 4.45Å; V280-P454 HydrophobicContact CB-CG 4.26Å; V280-P454 HydrophobicContact CG1-CB 3.7Å; V280-P454 HydrophobicContact CG1-CG 3.82Å; V280-P454 HydrophobicContact CG2-CG 4.34Å; V280-P454 WeakPolarHBondContact O-CB 3.48Å; I283-P454 HydrophobicContact CB-CB 4.08Å; I283-P454 HydrophobicContact CB-CG 4.05Å; I283-P454 HydrophobicContact CD1-CG 4.06Å; I283-P454 HydrophobicContact CG2-CB 4.1Å; I283-P454 HydrophobicContact CG2-CG 4.01Å; A284-P454 WeakPolarHBondContact CA-O 3.45Å; A284-P454 HydrophobicContact CB-CB 3.96Å; A284-P454 WeakPolarHBondContact CB-O 3.43Å; N338-P454 VanDerWaalsContact OD1-CA 3.29Å; N338-P454 WeakPolarHBondContact OD1-CA 3.4Å; S450-P454 WeakPolarHBondContact O-CD 3.27Å; S450-P454 VanDerWaalsContact O-CG 3.31Å; S450-P454 WeakPolarHBondContact O-CG 3.48Å; M451-P454 WeakPolarHBondContact O-CD 3.39Å; M451-P454 VanDerWaalsContact O-CG 3.31Å; M451-P454 WeakPolarHBondContact O-CG 3.47Å; P454-A457 PolarHBondContact O-N 3.37Å; P454-G458 PolarHBondContact O-N 2.92Å
455	N	93.1	Very high	92.1	Very high	2 Å²	2	7.4 Å²	7.4	1%	0.011	5%	0.045	C	C	.	.	H	α-helix	trans	-62	-50.7	172.8	-170	-73.9	0	0	0	110.6	N43 I283 A427 P428 M451 S452 S453 A457 G458 A459	N43-N455 PolarHBondContact O-ND2 2.86Å; I283-N455 HydrophobicContact CG2-CB 3.97Å; A427-N455 HydrophobicContact CB-CB 4.43Å; P428-N455 WeakPolarHBondContact CD-OD1 3.25Å; M451-N455 WeakPolarHBondContact O-CB 3.49Å; M451-N455 PolarHBondContact O-N 3.05Å; S452-N455 PolarHBondContact O-N 3.11Å; S453-N455 VanDerWaalsContact C-N 3.3Å; S453-N455 PolarHBondContact O-N 2.98Å; N455-A457 VanDerWaalsContact C-N 3.3Å; N455-A457 PolarHBondContact O-N 2.97Å; N455-G458 PolarHBondContact O-N 2.79Å; N455-A459 WeakPolarHBondContact O-CB 3.42Å; N455-A459 PolarHBondContact O-N 3.14Å
456	A	92.4	Very high	92.3	Very high	1 Å²	1	5 Å²	5	1%	0.008	3%	0.032	C	C	.	.	H	α-helix	trans	-60.9	-39	173.9	0	0	0	0	0	112	I359 A427 S452 S453 A459 V460 M503	I359-A456 HydrophobicContact CG2-CB 4.02Å; A427-A456 HydrophobicContact CB-CB 3.99Å; S452-A456 WeakPolarHBondContact O-CB 3.35Å; S452-A456 PolarHBondContact O-N 3.28Å; S453-A456 PolarHBondContact O-N 3.32Å; A456-A459 PolarHBondContact O-N 3.32Å; A456-V460 WeakPolarHBondContact O-CB 3.03Å; A456-V460 VanDerWaalsContact O-CG2 3.32Å; A456-V460 WeakPolarHBondContact O-CG2 2.79Å; A456-V460 PolarHBondContact O-N 2.89Å; A456-M503 HydrophobicContact CB-CE 4.44Å; A456-M503 HydrophobicContact CB-SD 3.78Å
457	A	93.4	Very high	92.5	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-63.3	-44	177.2	0	0	0	0	0	113	I336 N338 I359 S453 P454 N455 A461	I336-A457 WeakPolarHBondContact CD1-O 3.16Å; I336-A457 HydrophobicContact CG2-CB 4.01Å; N338-A457 HydrophobicContact CB-CB 3.96Å; I359-A457 HydrophobicContact CB-CB 4.45Å; I359-A457 VanDerWaalsContact CD1-CA 3.44Å; I359-A457 HydrophobicContact CD1-CB 3.99Å; I359-A457 HydrophobicContact CG2-CB 4.43Å; S453-A457 WeakPolarHBondContact O-CB 3.5Å; S453-A457 PolarHBondContact O-N 2.96Å; P454-A457 PolarHBondContact O-N 3.37Å; N455-A457 VanDerWaalsContact C-N 3.3Å; N455-A457 PolarHBondContact O-N 2.97Å; A457-A461 WeakPolarHBondContact O-CB 3.24Å; A457-A461 PolarHBondContact O-N 3.47Å
458	G	94.8	Very high	92.8	Very high	0 Å²	0	5 Å²	5	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-64.6	-42	172.5	0	0	0	0	0	111.8	A284 V297 A298 P454 N455 V460 A461 L462	A284-G458 WeakPolarHBondContact O-CA 3.35Å; V297-G458 VanDerWaalsContact CG1-C 3.45Å; A298-G458 WeakPolarHBondContact CB-O 3.28Å; P454-G458 PolarHBondContact O-N 2.92Å; N455-G458 PolarHBondContact O-N 2.79Å; G458-V460 VanDerWaalsContact C-N 3.34Å; G458-V460 PolarHBondContact O-N 2.69Å; G458-A461 WeakPolarHBondContact O-CA 3.34Å; G458-A461 VanDerWaalsContact O-CB 3.28Å; G458-A461 WeakPolarHBondContact O-CB 3.47Å; G458-A461 PolarHBondContact O-N 2.71Å; G458-L462 PolarHBondContact O-N 3.19Å
459	A	94.2	Very high	93.1	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-63.7	-40	-179.8	0	0	0	0	0	112	V50 V297 N455 A456 A461 L462 L463 M503 I505	V50-A459 HydrophobicContact CG2-CB 4.2Å; V297-A459 HydrophobicContact CG1-CB 3.91Å; N455-A459 WeakPolarHBondContact O-CB 3.42Å; N455-A459 PolarHBondContact O-N 3.14Å; A456-A459 PolarHBondContact O-N 3.32Å; A459-A461 VanDerWaalsContact C-N 3.32Å; A459-L462 WeakPolarHBondContact O-CB 3.43Å; A459-L462 PolarHBondContact O-N 3.08Å; A459-L463 PolarHBondContact O-N 3.17Å; A459-M503 HydrophobicContact CB-CE 3.44Å; A459-M503 VanDerWaalsContact CB-CE 3.44Å; A459-M503 HydrophobicContact CB-SD 4.15Å; A459-I505 HydrophobicContact CB-CD1 3.78Å; A459-I505 HydrophobicContact CB-CG1 3.77Å; A459-I505 WeakPolarHBondContact O-CD1 3.23Å
460	V	94.1	Very high	93.4	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.012	7%	0.069	C	C	.	.	H	α-helix	trans	-68.4	-30.4	171.6	172.9	0	0	0	0	111.9	I336 V357 I359 A456 G458 L462 L463 I464 I479 L483 M503	I336-V460 HydrophobicContact CD1-CB 4.22Å; I336-V460 HydrophobicContact CD1-CG1 3.91Å; I336-V460 HydrophobicContact CG1-CG1 4.35Å; V357-V460 HydrophobicContact CG1-CG1 4.13Å; I359-V460 HydrophobicContact CD1-CB 3.87Å; I359-V460 HydrophobicContact CD1-CG1 4.27Å; I359-V460 HydrophobicContact CD1-CG2 3.82Å; A456-V460 WeakPolarHBondContact O-CB 3.03Å; A456-V460 VanDerWaalsContact O-CG2 3.32Å; A456-V460 WeakPolarHBondContact O-CG2 2.79Å; A456-V460 PolarHBondContact O-N 2.89Å; G458-V460 VanDerWaalsContact C-N 3.34Å; G458-V460 PolarHBondContact O-N 2.69Å; V460-L462 VanDerWaalsContact C-N 3.33Å; V460-L463 WeakPolarHBondContact O-CB 3.35Å; V460-L463 PolarHBondContact O-N 2.92Å; V460-I464 HydrophobicContact CG1-CD1 3.97Å; V460-I464 HydrophobicContact CG1-CG1 4.22Å; V460-I464 WeakPolarHBondContact O-CG1 3.24Å; V460-I464 PolarHBondContact O-N 3.13Å; V460-I479 HydrophobicContact CG1-CG2 4.03Å; V460-I479 HydrophobicContact CG2-CG2 4.42Å; V460-L483 HydrophobicContact CG2-CD1 3.81Å; V460-M503 HydrophobicContact CG2-CE 4.43Å
461	A	96.3	Very high	93.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.9	-37.8	173.7	0	0	0	0	0	112.1	V65 I67 A298 A301 I336 A457 G458 A459 L463 S465	V65-A461 HydrophobicContact CB-CB 4.32Å; V65-A461 HydrophobicContact CG1-CB 3.87Å; V65-A461 WeakPolarHBondContact CG2-O 3.47Å; I67-A461 HydrophobicContact CD1-CB 3.86Å; I67-A461 HydrophobicContact CG1-CB 4.32Å; A298-A461 HydrophobicContact CB-CB 3.8Å; A301-A461 HydrophobicContact CB-CB 4.26Å; I336-A461 HydrophobicContact CD1-CB 3.66Å; A457-A461 WeakPolarHBondContact O-CB 3.24Å; A457-A461 PolarHBondContact O-N 3.47Å; G458-A461 WeakPolarHBondContact O-CA 3.34Å; G458-A461 VanDerWaalsContact O-CB 3.28Å; G458-A461 WeakPolarHBondContact O-CB 3.47Å; G458-A461 PolarHBondContact O-N 2.71Å; A459-A461 VanDerWaalsContact C-N 3.32Å; A461-L463 VanDerWaalsContact C-N 3.35Å; A461-S465 VanDerWaalsContact O-CB 3.25Å; A461-S465 WeakPolarHBondContact O-CB 3.42Å; A461-S465 PolarHBondContact O-N 3.14Å
462	L	96.6	Very high	93.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.4	-46.8	171.8	-57.8	175.3	0	0	0	111	V50 F53 Y60 V297 A298 G458 A459 V460 S465 G466	V50-L462 HydrophobicContact CB-CD1 4.24Å; V50-L462 HydrophobicContact CG1-CD1 3.57Å; V50-L462 HydrophobicContact CG2-CD1 3.96Å; F53-L462 HydrophobicContact CD1-CB 4.09Å; F53-L462 HydrophobicContact CD1-CD1 4.49Å; F53-L462 HydrophobicContact CE1-CB 3.82Å; Y60-L462 VanDerWaalsContact O-CD2 3.23Å; Y60-L462 WeakPolarHBondContact O-CD2 3.08Å; V297-L462 HydrophobicContact CG1-CD1 3.99Å; A298-L462 HydrophobicContact CB-CD2 3.81Å; A298-L462 HydrophobicContact CB-CG 4.14Å; G458-L462 PolarHBondContact O-N 3.19Å; A459-L462 WeakPolarHBondContact O-CB 3.43Å; A459-L462 PolarHBondContact O-N 3.08Å; V460-L462 VanDerWaalsContact C-N 3.33Å; L462-S465 WeakPolarHBondContact O-CB 3.47Å; L462-S465 PolarHBondContact O-N 3.22Å; L462-G466 PolarHBondContact O-N 2.63Å
463	L	94.3	Very high	93.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-59.2	-49.7	178.6	-171.7	69.2	0	0	0	111.9	A459 V460 A461 S465 G466 L467 I479 A508 F509 L512	A459-L463 PolarHBondContact O-N 3.17Å; V460-L463 WeakPolarHBondContact O-CB 3.35Å; V460-L463 PolarHBondContact O-N 2.92Å; A461-L463 VanDerWaalsContact C-N 3.35Å; L463-S465 VanDerWaalsContact C-N 3.32Å; L463-S465 PolarHBondContact O-N 2.77Å; L463-G466 PolarHBondContact O-N 3.45Å; L463-L467 HydrophobicContact CG-CD1 4.17Å; L463-L467 VanDerWaalsContact O-CG 3.26Å; L463-L467 WeakPolarHBondContact O-CG 3.41Å; L463-L467 PolarHBondContact O-N 3.46Å; L463-I479 HydrophobicContact CD2-CG1 4.48Å; L463-I479 HydrophobicContact CD2-CG2 4.13Å; L463-A508 HydrophobicContact CD1-CB 4.41Å; L463-A508 HydrophobicContact CD2-CB 4.47Å; L463-F509 VanDerWaalsContact CD1-CA 3.43Å; L463-F509 HydrophobicContact CD1-CB 3.56Å; L463-F509 HydrophobicContact CD1-CD2 3.9Å; L463-F509 HydrophobicContact CD1-CG 4.23Å; L463-L512 HydrophobicContact CD1-CD1 4.16Å; L463-L512 HydrophobicContact CD2-CD1 3.66Å; L463-L512 HydrophobicContact CG-CD1 4Å
464	I	95.3	Very high	93	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.8	-40	177	-68.5	177	0	0	0	111.1	V65 H335 I336 V357 V460 L467 K468 Y474 I479	V65-I464 HydrophobicContact CG1-CG2 4.37Å; V65-I464 HydrophobicContact CG2-CB 4.08Å; V65-I464 HydrophobicContact CG2-CG2 3.74Å; H335-I464 HydrophobicContact CB-CD1 4.42Å; I336-I464 HydrophobicContact CD1-CD1 3.92Å; I336-I464 HydrophobicContact CG1-CD1 3.77Å; V357-I464 HydrophobicContact CG2-CD1 3.94Å; V460-I464 HydrophobicContact CG1-CD1 3.97Å; V460-I464 HydrophobicContact CG1-CG1 4.22Å; V460-I464 WeakPolarHBondContact O-CG1 3.24Å; V460-I464 PolarHBondContact O-N 3.13Å; I464-L467 PolarHBondContact O-N 2.83Å; I464-K468 HydrophobicContact CG2-CD 4.2Å; I464-K468 HydrophobicContact CG2-CG 4.41Å; I464-K468 WeakPolarHBondContact O-CB 2.87Å; I464-K468 WeakPolarHBondContact O-CG 3Å; I464-K468 PolarHBondContact O-N 2.85Å; I464-Y474 HydrophobicContact CD1-CE2 4.12Å; I464-Y474 HydrophobicContact CG1-CE2 4.15Å; I464-Y474 HydrophobicContact CG2-CE1 3.88Å; I464-Y474 HydrophobicContact CG2-CE2 4.31Å; I464-Y474 VanDerWaalsContact CG2-OH 3.32Å; I464-Y474 WeakPolarHBondContact CG2-OH 3.3Å; I464-I479 HydrophobicContact CD1-CD1 4.01Å; I464-I479 HydrophobicContact CG1-CD1 3.73Å
465	S	96.8	Very high	92.5	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.007	16%	0.163	C	C	.	.	H	α-helix	trans	-60	-47.3	177.3	-170.9	0	0	0	0	110.9	G62 R63 A461 L462 L463 K468 M469	G62-S465 PolarHBondContact N-OG 3.13Å; R63-S465 PolarHBondContact N-OG 2.81Å; R63-S465 PolarHBondContact O-OG 2.92Å; A461-S465 VanDerWaalsContact O-CB 3.25Å; A461-S465 WeakPolarHBondContact O-CB 3.42Å; A461-S465 PolarHBondContact O-N 3.14Å; L462-S465 WeakPolarHBondContact O-CB 3.47Å; L462-S465 PolarHBondContact O-N 3.22Å; L463-S465 VanDerWaalsContact C-N 3.32Å; L463-S465 PolarHBondContact O-N 2.77Å; S465-K468 PolarHBondContact O-N 2.81Å; S465-M469 WeakPolarHBondContact O-CG 3.42Å; S465-M469 PolarHBondContact O-N 2.89Å; S465-M469 VanDerWaalsContact O-N 3.1Å
466	G	95.6	Very high	92	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.5	-45.9	174.6	0	0	0	0	0	113.2	Y60 L462 L463 K468 M469 E470	Y60-G466 VanDerWaalsContact CG-CA 3.44Å; L462-G466 PolarHBondContact O-N 2.63Å; L463-G466 PolarHBondContact O-N 3.45Å; G466-K468 VanDerWaalsContact C-N 3.28Å; G466-K468 PolarHBondContact O-N 2.86Å; G466-M469 PolarHBondContact O-N 2.6Å; G466-M469 VanDerWaalsContact O-N 3.11Å; G466-E470 WeakPolarHBondContact O-CG 3.04Å; G466-E470 PolarHBondContact O-N 2.69Å
467	L	93.7	Very high	91.5	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-61.7	-37.3	179.7	-69.3	165.5	0	0	0	112.3	L463 I464 E470 E471 V472 Y474 F509 L512 L513	L463-L467 HydrophobicContact CG-CD1 4.17Å; L463-L467 VanDerWaalsContact O-CG 3.26Å; L463-L467 WeakPolarHBondContact O-CG 3.41Å; L463-L467 PolarHBondContact O-N 3.46Å; I464-L467 PolarHBondContact O-N 2.83Å; L467-E470 PolarHBondContact O-N 2.86Å; L467-E471 PolarHBondContact O-N 2.91Å; L467-E471 VanDerWaalsContact O-N 3.13Å; L467-V472 HydrophobicContact CD2-CB 4Å; L467-V472 HydrophobicContact CD2-CG1 3.97Å; L467-V472 PolarHBondContact O-N 2.94Å; L467-Y474 HydrophobicContact CB-CD1 4.15Å; L467-Y474 HydrophobicContact CD1-CD1 4.3Å; L467-Y474 HydrophobicContact CD1-CG 4.25Å; L467-F509 HydrophobicContact CD2-CD2 4.2Å; L467-F509 HydrophobicContact CD2-CE2 4.09Å; L467-F509 HydrophobicContact CG-CD2 4.29Å; L467-F509 HydrophobicContact CG-CE2 4.2Å; L467-L512 HydrophobicContact CD1-CD1 3.66Å; L467-L512 HydrophobicContact CD2-CB 3.85Å; L467-L512 HydrophobicContact CD2-CD1 4.49Å; L467-L513 HydrophobicContact CD2-CD2 4.48Å
468	K	94.6	Very high	90.9	Very high	77 Å²	77	33.2 Å²	33.2	34%	0.335	17%	0.169	S	C	.	.	H	α-helix	trans	-66.1	-40.8	174.1	-75.3	180	171.5	-159.7	0	112.5	G64 H335 I464 S465 G466 E470 E471 Y474	G64-K468 PolarHBondContact O-NZ 3.07Å; H335-K468 PolarHBondContact CD2-NZ 2.98Å; H335-K468 PolarHBondContact CE1-NZ 2.77Å; H335-K468 VanDerWaalsContact CE1-NZ 3.34Å; H335-K468 PolarHBondContact NE2-NZ 2.86Å; I464-K468 HydrophobicContact CG2-CD 4.2Å; I464-K468 HydrophobicContact CG2-CG 4.41Å; I464-K468 WeakPolarHBondContact O-CB 2.87Å; I464-K468 WeakPolarHBondContact O-CG 3Å; I464-K468 PolarHBondContact O-N 2.85Å; S465-K468 PolarHBondContact O-N 2.81Å; G466-K468 VanDerWaalsContact C-N 3.28Å; G466-K468 PolarHBondContact O-N 2.86Å; K468-E470 VanDerWaalsContact C-N 3.31Å; K468-E471 PolarHBondContact O-N 3.32Å; K468-E471 VanDerWaalsContact O-N 3.17Å; K468-Y474 HydrophobicContact CG-CE1 4.24Å
469	M	92.6	Very high	90.6	Very high	106 Å²	106	33.3 Å²	33.3	52%	0.522	17%	0.17	S	C	.	.	H	α-helix	trans	-66.3	-34.3	177.9	-71.7	-63.2	-58.4	0	0	112.3	Y60 S465 G466 E471	Y60-M469 HydrophobicContact CD1-CB 4.02Å; Y60-M469 HydrophobicContact CD1-CG 3.85Å; Y60-M469 HydrophobicContact CE1-CB 3.49Å; Y60-M469 VanDerWaalsContact CE1-CB 3.49Å; Y60-M469 HydrophobicContact CE1-CG 3.74Å; S465-M469 WeakPolarHBondContact O-CG 3.42Å; S465-M469 PolarHBondContact O-N 2.89Å; S465-M469 VanDerWaalsContact O-N 3.1Å; G466-M469 PolarHBondContact O-N 2.6Å; G466-M469 VanDerWaalsContact O-N 3.11Å; M469-E471 VanDerWaalsContact C-N 3.27Å
470	E	92.4	Very high	90.1	Very high	89 Å²	89	34.5 Å²	34.5	42%	0.416	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	3.3	174.3	-60.9	-63.1	160.6	0	0	113.3	Y60 G466 L467 K468 V472 F509 L513	Y60-E470 PolarHBondContact OH-OE1 2.91Å; G466-E470 WeakPolarHBondContact O-CG 3.04Å; G466-E470 PolarHBondContact O-N 2.69Å; L467-E470 PolarHBondContact O-N 2.86Å; K468-E470 VanDerWaalsContact C-N 3.31Å; E470-V472 HydrophobicContact CB-CG2 4.01Å; E470-V472 PolarHBondContact O-N 2.91Å; E470-F509 HydrophobicContact CG-CZ 3.8Å; E470-L513 HydrophobicContact CB-CD2 4.23Å; E470-L513 HydrophobicContact CG-CD2 4.28Å
471	E	90.9	Very high	89.5	Confident	183 Å²	183	35.1 Å²	35.1	86%	0.855	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	31.5	-177.3	-57.1	-174.5	164.6	0	0	114.2	L467 K468 M469	L467-E471 PolarHBondContact O-N 2.91Å; L467-E471 VanDerWaalsContact O-N 3.13Å; K468-E471 PolarHBondContact O-N 3.32Å; K468-E471 VanDerWaalsContact O-N 3.17Å; M469-E471 VanDerWaalsContact C-N 3.27Å
472	V	87.1	Confident	89	Confident	40 Å²	40	35.1 Å²	35.1	24%	0.242	18%	0.177	C	C	.	.			trans	-91.9	121.9	178.1	178.6	0	0	0	0	110.4	L467 E470 L513	L467-V472 HydrophobicContact CD2-CB 4Å; L467-V472 HydrophobicContact CD2-CG1 3.97Å; L467-V472 PolarHBondContact O-N 2.94Å; E470-V472 HydrophobicContact CB-CG2 4.01Å; E470-V472 PolarHBondContact O-N 2.91Å; V472-L513 HydrophobicContact CG2-CD2 3.73Å
473	S	84.9	Confident	88.7	Confident	93 Å²	93	35.1 Å²	35.1	65%	0.65	18%	0.178	S	C	*	.			trans	-64.4	139.8	173.5	60.8	0	0	0	0	111.3	V516	S473-V516 WeakPolarHBondContact O-CG2 3.42Å
474	Y	86.6	Confident	88.3	Confident	61 Å²	61	36.3 Å²	36.3	24%	0.239	19%	0.187	C	C	.	.			trans	-136.7	161.4	178.4	65.3	-93.2	0	0	0	111.1	I464 L467 K468 I479	I464-Y474 HydrophobicContact CD1-CE2 4.12Å; I464-Y474 HydrophobicContact CG1-CE2 4.15Å; I464-Y474 HydrophobicContact CG2-CE1 3.88Å; I464-Y474 HydrophobicContact CG2-CE2 4.31Å; I464-Y474 VanDerWaalsContact CG2-OH 3.32Å; I464-Y474 WeakPolarHBondContact CG2-OH 3.3Å; L467-Y474 HydrophobicContact CB-CD1 4.15Å; L467-Y474 HydrophobicContact CD1-CD1 4.3Å; L467-Y474 HydrophobicContact CD1-CG 4.25Å; K468-Y474 HydrophobicContact CG-CE1 4.24Å; Y474-I479 HydrophobicContact CD2-CD1 3.52Å; Y474-I479 HydrophobicContact CD2-CG1 4.4Å; Y474-I479 HydrophobicContact CE2-CD1 4.12Å; Y474-I479 HydrophobicContact CG-CD1 4.17Å
475	S	83.3	Confident	87.9	Confident	18 Å²	18	38.9 Å²	38.9	13%	0.126	20%	0.201	C	C	.	.			trans	-131.1	162	168.3	74	0	0	0	0	110.3	F477 S478 I479	S475-F477 PolarHBondContact O-N 2.84Å; S475-F477 PolarHBondContact OG-N 3.2Å; S475-S478 PolarHBondContact N-OG 3.29Å; S475-S478 PolarHBondContact O-N 3.32Å; S475-S478 PolarHBondContact O-OG 3.23Å; S475-S478 VanDerWaalsContact O-OG 3.06Å; S475-S478 PolarHBondContact OG-N 2.97Å; S475-S478 VanDerWaalsContact OG-N 3.11Å; S475-I479 WeakPolarHBondContact O-CG1 3.45Å; S475-I479 PolarHBondContact O-N 3.01Å
476	P	83.3	Confident	87.6	Confident	12 Å²	12	40.1 Å²	40.1	8%	0.078	21%	0.208	C	C	.	.	H	α-helix	trans	-54.5	-33.8	172.1	-27.8	36.9	0	0	0	113.1	V351 G355 I356 V357 R480	V351-P476 HydrophobicContact CG1-CB 3.73Å; V351-P476 HydrophobicContact CG1-CG 4.06Å; G355-P476 WeakPolarHBondContact O-CG 3.29Å; I356-P476 WeakPolarHBondContact O-CG 3.38Å; V357-P476 HydrophobicContact CG2-CB 4.27Å; V357-P476 HydrophobicContact CG2-CG 4.21Å; P476-R480 VanDerWaalsContact O-CB 3.29Å; P476-R480 WeakPolarHBondContact O-CB 3.49Å; P476-R480 PolarHBondContact O-N 2.96Å
477	F	80.2	Confident	87.4	Confident	13 Å²	13	41 Å²	41	6%	0.057	22%	0.216	C	C	.	.	H	α-helix	trans	-73.2	-42.6	179.6	-48	-72.1	0	0	0	112.2	V351 Y352 S475 R480 L481 E518	V351-F477 HydrophobicContact CG1-CE1 4.32Å; V351-F477 HydrophobicContact CG1-CZ 4.02Å; Y352-F477 AromaticContact CD1-CE1 3.91Å; Y352-F477 HydrophobicContact CD1-CE1 3.91Å; Y352-F477 AromaticContact CD1-CE2 3.78Å; Y352-F477 HydrophobicContact CD1-CE2 3.78Å; Y352-F477 AromaticContact CD1-CZ 3.14Å; Y352-F477 HydrophobicContact CD1-CZ 3.14Å; Y352-F477 HydrophobicContact CD2-CZ 4.11Å; Y352-F477 AromaticContact CE1-CE1 3.43Å; Y352-F477 HydrophobicContact CE1-CE1 3.43Å; Y352-F477 VanDerWaalsContact CE1-CE1 3.43Å; Y352-F477 HydrophobicContact CE1-CE2 4.08Å; Y352-F477 AromaticContact CE1-CZ 3.19Å; Y352-F477 HydrophobicContact CE1-CZ 3.19Å; Y352-F477 HydrophobicContact CE2-CE1 4.27Å; Y352-F477 HydrophobicContact CE2-CZ 4.17Å; Y352-F477 HydrophobicContact CG-CE1 4.47Å; Y352-F477 HydrophobicContact CG-CE2 4.38Å; Y352-F477 AromaticContact CG-CZ 3.62Å; Y352-F477 HydrophobicContact CG-CZ 3.62Å; Y352-F477 AromaticContact CZ-CE1 3.63Å; Y352-F477 AromaticContact CZ-CZ 3.73Å; S475-F477 PolarHBondContact O-N 2.84Å; S475-F477 PolarHBondContact OG-N 3.2Å; F477-R480 PolarHBondContact O-N 2.78Å; F477-L481 WeakPolarHBondContact O-CB 3.47Å; F477-L481 PolarHBondContact O-N 3Å; F477-E518 HydrophobicContact CB-CB 4.11Å; F477-E518 HydrophobicContact CB-CG 4.13Å; F477-E518 HydrophobicContact CD2-CB 4.37Å; F477-E518 HydrophobicContact CD2-CG 3.93Å; F477-E518 HydrophobicContact CG-CB 4.27Å; F477-E518 HydrophobicContact CG-CG 4.25Å
478	S	82.2	Confident	87.3	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.014	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-41.5	177.5	71.2	0	0	0	0	111.3	S475 R480 L481 A482 L512 L517	S475-S478 PolarHBondContact N-OG 3.29Å; S475-S478 PolarHBondContact O-N 3.32Å; S475-S478 PolarHBondContact O-OG 3.23Å; S475-S478 VanDerWaalsContact O-OG 3.06Å; S475-S478 PolarHBondContact OG-N 2.97Å; S475-S478 VanDerWaalsContact OG-N 3.11Å; S478-R480 VanDerWaalsContact C-N 3.34Å; S478-R480 PolarHBondContact O-N 3.07Å; S478-L481 PolarHBondContact O-N 2.9Å; S478-A482 WeakPolarHBondContact O-CB 3.36Å; S478-A482 PolarHBondContact O-N 3.4Å; S478-L512 WeakPolarHBondContact O-CD2 3.18Å; S478-L517 PolarHBondContact N-O 3.25Å
479	I	87.1	Confident	87	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-58.9	-48.2	174.3	-72	170.8	0	0	0	110.2	V357 V460 L463 I464 Y474 S475 L481 A482 L483 L512	V357-I479 HydrophobicContact CG2-CD1 3.74Å; V460-I479 HydrophobicContact CG1-CG2 4.03Å; V460-I479 HydrophobicContact CG2-CG2 4.42Å; L463-I479 HydrophobicContact CD2-CG1 4.48Å; L463-I479 HydrophobicContact CD2-CG2 4.13Å; I464-I479 HydrophobicContact CD1-CD1 4.01Å; I464-I479 HydrophobicContact CG1-CD1 3.73Å; Y474-I479 HydrophobicContact CD2-CD1 3.52Å; Y474-I479 HydrophobicContact CD2-CG1 4.4Å; Y474-I479 HydrophobicContact CE2-CD1 4.12Å; Y474-I479 HydrophobicContact CG-CD1 4.17Å; S475-I479 WeakPolarHBondContact O-CG1 3.45Å; S475-I479 PolarHBondContact O-N 3.01Å; I479-L481 PolarHBondContact O-N 3.01Å; I479-A482 PolarHBondContact O-N 3.35Å; I479-L483 HydrophobicContact CG2-CD1 3.87Å; I479-L483 HydrophobicContact CG2-CG 4.45Å; I479-L483 VanDerWaalsContact O-CG 3.26Å; I479-L483 WeakPolarHBondContact O-CG 3.14Å; I479-L483 PolarHBondContact O-N 2.93Å; I479-L512 HydrophobicContact CG1-CD1 4.08Å
480	R	84.5	Confident	86.6	Confident	26 Å²	26	47 Å²	47	10%	0.098	24%	0.24	C	C	.	.	H	α-helix	trans	-60.5	-44.6	177.9	174.2	161.5	176.8	-113.9	-19.6	112.3	S380 C382 P476 F477 S478 L483 A484 D519	S380-R480 WeakPolarHBondContact O-CD 3.46Å; S380-R480 PolarHBondContact O-NE 3.17Å; S380-R480 VanDerWaalsContact O-NE 3.07Å; S380-R480 PolarHBondContact O-NH1 3.38Å; C382-R480 WeakPolarHBondContact SG-CG 3.32Å; P476-R480 VanDerWaalsContact O-CB 3.29Å; P476-R480 WeakPolarHBondContact O-CB 3.49Å; P476-R480 PolarHBondContact O-N 2.96Å; F477-R480 PolarHBondContact O-N 2.78Å; S478-R480 VanDerWaalsContact C-N 3.34Å; S478-R480 PolarHBondContact O-N 3.07Å; R480-L483 PolarHBondContact O-N 3.1Å; R480-A484 VanDerWaalsContact O-CB 3.24Å; R480-A484 WeakPolarHBondContact O-CB 3.31Å; R480-A484 PolarHBondContact O-N 2.8Å; R480-D519 IonicContact CZ-OD2 3.49Å; R480-D519 VanDerWaalsContact CZ-OD2 3.3Å; R480-D519 IonicContact NH1-OD2 3.61Å; R480-D519 PolarHBondContact NH1-OD2 3.27Å; R480-D519 IonicContact NH2-OD2 2.82Å; R480-D519 PolarHBondContact NH2-OD2 2.91Å
481	L	81.6	Confident	86	Confident	14 Å²	14	49 Å²	49	7%	0.073	25%	0.253	C	S	.	.	H	α-helix	trans	-62.2	-45	178.7	-177.1	65.1	0	0	0	111.3	F477 S478 I479 A484 N485 L517 P620	F477-L481 WeakPolarHBondContact O-CB 3.47Å; F477-L481 PolarHBondContact O-N 3Å; S478-L481 PolarHBondContact O-N 2.9Å; I479-L481 PolarHBondContact O-N 3.01Å; L481-A484 PolarHBondContact O-N 3.39Å; L481-N485 WeakPolarHBondContact CD1-ND2 3.33Å; L481-N485 WeakPolarHBondContact O-CB 3.31Å; L481-N485 PolarHBondContact O-N 2.63Å; L481-L517 HydrophobicContact CD2-CB 4.12Å; L481-P620 WeakPolarHBondContact CD1-O 3.43Å
482	A	86.5	Confident	85.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-59.4	-52.4	176.9	0	0	0	0	0	111	S478 I479 A484 N485 T486 A508 Y511 L512	S478-A482 WeakPolarHBondContact O-CB 3.36Å; S478-A482 PolarHBondContact O-N 3.4Å; I479-A482 PolarHBondContact O-N 3.35Å; A482-A484 VanDerWaalsContact C-N 3.27Å; A482-A484 PolarHBondContact O-N 3.41Å; A482-N485 PolarHBondContact O-N 3.2Å; A482-T486 WeakPolarHBondContact O-CG2 3.3Å; A482-T486 PolarHBondContact O-N 3.3Å; A482-T486 PolarHBondContact O-OG1 2.87Å; A482-A508 HydrophobicContact CB-CB 4.42Å; A482-Y511 HydrophobicContact CB-CD1 3.53Å; A482-Y511 HydrophobicContact CB-CE1 4.11Å; A482-Y511 HydrophobicContact CB-CG 4.23Å; A482-L512 HydrophobicContact CB-CD1 3.99Å; A482-L512 HydrophobicContact CB-CD2 3.74Å; A482-L512 HydrophobicContact CB-CG 3.53Å
483	L	88.9	Confident	85.1	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-38.9	177.9	-67.6	170.8	0	0	0	112.4	I425 V460 I479 R480 A487 M503 I505 A508	I425-L483 HydrophobicContact CD1-CD1 4.15Å; I425-L483 HydrophobicContact CG2-CB 4.37Å; V460-L483 HydrophobicContact CG2-CD1 3.81Å; I479-L483 HydrophobicContact CG2-CD1 3.87Å; I479-L483 HydrophobicContact CG2-CG 4.45Å; I479-L483 VanDerWaalsContact O-CG 3.26Å; I479-L483 WeakPolarHBondContact O-CG 3.14Å; I479-L483 PolarHBondContact O-N 2.93Å; R480-L483 PolarHBondContact O-N 3.1Å; L483-A487 VanDerWaalsContact O-CB 3.3Å; L483-A487 WeakPolarHBondContact O-CB 2.85Å; L483-A487 PolarHBondContact O-N 3.46Å; L483-A487 VanDerWaalsContact O-N 3.13Å; L483-M503 HydrophobicContact CD2-CB 4.35Å; L483-M503 HydrophobicContact CD2-CE 3.98Å; L483-I505 HydrophobicContact CD2-CD1 4.11Å; L483-A508 HydrophobicContact CD2-CB 3.89Å
484	A	85.4	Confident	85.2	Confident	25 Å²	25	46.2 Å²	46.2	21%	0.207	24%	0.235	C	C	.	.	H	α-helix	trans	-67.6	-41.6	178.9	0	0	0	0	0	112.7	R480 L481 A482 R500	R480-A484 VanDerWaalsContact O-CB 3.24Å; R480-A484 WeakPolarHBondContact O-CB 3.31Å; R480-A484 PolarHBondContact O-N 2.8Å; L481-A484 PolarHBondContact O-N 3.39Å; A482-A484 VanDerWaalsContact C-N 3.27Å; A482-A484 PolarHBondContact O-N 3.41Å; A484-R500 HydrophobicContact CB-CG 3.88Å; A484-R500 WeakPolarHBondContact O-CB 3.01Å
485	N	87	Confident	85.3	Confident	53 Å²	53	45.2 Å²	45.2	28%	0.283	24%	0.235	S	C	.	.	H	α-helix	trans	-82.5	-19.7	-176.6	-75.8	-26.1	0	0	0	113.3	L481 A482 Y511 L618 P620	L481-N485 WeakPolarHBondContact CD1-ND2 3.33Å; L481-N485 WeakPolarHBondContact O-CB 3.31Å; L481-N485 PolarHBondContact O-N 2.63Å; A482-N485 PolarHBondContact O-N 3.2Å; N485-Y511 HydrophobicContact CB-CE2 4.11Å; N485-Y511 PolarHBondContact ND2-OH 2.93Å; N485-L618 PolarHBondContact ND2-O 3.09Å; N485-P620 PolarHBondContact ND2-O 3.49Å
486	T	91	Very high	85.5	Confident	27 Å²	27	44.7 Å²	44.7	17%	0.166	23%	0.23	C	C	.	.	H	α-helix	trans	-103.4	-4.8	177.9	66.7	0	0	0	0	114	A482 K488 Q507 Y511	A482-T486 WeakPolarHBondContact O-CG2 3.3Å; A482-T486 PolarHBondContact O-N 3.3Å; A482-T486 PolarHBondContact O-OG1 2.87Å; T486-K488 PolarHBondContact O-N 2.79Å; T486-Q507 HydrophobicContact CG2-CB 4.01Å; T486-Y511 HydrophobicContact CG2-CD2 4.22Å; T486-Y511 HydrophobicContact CG2-CG 4.27Å
487	A	90.6	Very high	85.6	Confident	20 Å²	20	45.4 Å²	45.4	17%	0.165	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-58.7	136.4	-179.4	0	0	0	0	0	112.5	L483 R500 L502	L483-A487 VanDerWaalsContact O-CB 3.3Å; L483-A487 WeakPolarHBondContact O-CB 2.85Å; L483-A487 PolarHBondContact O-N 3.46Å; L483-A487 VanDerWaalsContact O-N 3.13Å; A487-R500 HydrophobicContact CB-CB 3.9Å; A487-R500 WeakPolarHBondContact CB-O 3.32Å; A487-L502 CarbonylContact C-O 3.4Å; A487-L502 WeakPolarHBondContact CA-O 3.36Å
488	K	91.8	Very high	85.9	Confident	133 Å²	133	44.9 Å²	44.9	58%	0.578	23%	0.231	S	C	*	.	B	Isolated β-bridge	trans	-80.8	120.5	174.8	-178.3	177.3	-179.9	176.6	0	109.9	T486 V490 G501 L502 Q504	T486-K488 PolarHBondContact O-N 2.79Å; K488-V490 PolarHBondContact O-N 2.81Å; K488-G501 CarbonylContact O-C 3.59Å; K488-G501 WeakPolarHBondContact O-CA 3.31Å; K488-L502 PolarHBondContact N-O 3.3Å; K488-L502 PolarHBondContact O-N 2.98Å; K488-Q504 HydrophobicContact CB-CG 3.86Å
489	K	88.9	Confident	86.1	Confident	166 Å²	166	45 Å²	45	72%	0.722	23%	0.232	S	C	*	.	P	Polyproline II helix	trans	-58	133.5	176.3	-166.1	174.6	-177	178.2	0	110.5
490	V	84.7	Confident	86.1	Confident	10 Å²	10	48.2 Å²	48.2	6%	0.061	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-88.8	127	177.6	178.5	0	0	0	0	109	Y387 L407 K488 S493 L502	Y387-V490 HydrophobicContact CD2-CG1 4.29Å; Y387-V490 HydrophobicContact CD2-CG2 4.22Å; Y387-V490 HydrophobicContact CE2-CG1 4.09Å; Y387-V490 HydrophobicContact CE2-CG2 4.32Å; L407-V490 HydrophobicContact CG-CG1 4.49Å; K488-V490 PolarHBondContact O-N 2.81Å; V490-S493 WeakPolarHBondContact CB-OG 3.15Å; V490-S493 PolarHBondContact O-N 2.89Å; V490-S493 PolarHBondContact O-OG 3.42Å; V490-L502 HydrophobicContact CG2-CB 4.09Å
491	D	79.7	Confident	86.4	Confident	130 Å²	130	47 Å²	47	70%	0.695	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	143.6	-178.9	-66.3	-29.5	0	0	0	112	S493	D491-S493 PolarHBondContact O-N 2.71Å
492	Q	76.1	Confident	86.8	Confident	170 Å²	170	46.7 Å²	46.7	79%	0.794	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	14.9	179.3	-54.7	-179.9	-15.5	0	0	115.4
493	S	82.6	Confident	87	Confident	22 Å²	22	46.7 Å²	46.7	15%	0.154	24%	0.238	C	C	.	.			trans	-105.9	152.4	177	74.5	0	0	0	0	112.5	V490 D491 A498	V490-S493 WeakPolarHBondContact CB-OG 3.15Å; V490-S493 PolarHBondContact O-N 2.89Å; V490-S493 PolarHBondContact O-OG 3.42Å; D491-S493 PolarHBondContact O-N 2.71Å; S493-A498 WeakPolarHBondContact OG-CB 3.45Å
494	T	87	Confident	87.2	Confident	66 Å²	66	47.3 Å²	47.3	41%	0.405	24%	0.241	S	C	.	.			trans	-96.2	162.7	170.8	61.5	0	0	0	0	111.2	F496 E497 A498	T494-F496 PolarHBondContact O-N 3.3Å; T494-E497 PolarHBondContact N-OE2 2.64Å; T494-E497 VanDerWaalsContact N-OE2 3.12Å; T494-E497 PolarHBondContact O-N 3.05Å; T494-E497 PolarHBondContact OG1-OE2 2.98Å; T494-E497 VanDerWaalsContact OG1-OE2 3.05Å; T494-A498 PolarHBondContact O-N 3.31Å
495	V	87.9	Confident	87.6	Confident	41 Å²	41	46.1 Å²	46.1	25%	0.248	23%	0.231	C	C	.	.	H	α-helix	trans	-59.1	-28.2	172.9	-67.2	0	0	0	0	113	L421 T423 E497 G499 Y606	L421-V495 HydrophobicContact CD1-CB 4.42Å; L421-V495 HydrophobicContact CD2-CB 4.44Å; L421-V495 HydrophobicContact CD2-CG2 4.13Å; T423-V495 PolarHBondContact OG1-O 3.43Å; V495-E497 PolarHBondContact O-N 3.26Å; V495-G499 VanDerWaalsContact O-CA 3.23Å; V495-G499 WeakPolarHBondContact O-CA 3.34Å; V495-G499 PolarHBondContact O-N 3.04Å; V495-Y606 HydrophobicContact CB-CE1 4.38Å; V495-Y606 HydrophobicContact CG1-CE1 4.28Å; V495-Y606 HydrophobicContact CG2-CD1 3.72Å; V495-Y606 HydrophobicContact CG2-CD2 4.16Å; V495-Y606 HydrophobicContact CG2-CE1 3.54Å; V495-Y606 HydrophobicContact CG2-CE2 3.99Å; V495-Y606 HydrophobicContact CG2-CG 4.01Å
496	F	87.8	Confident	87.8	Confident	7 Å²	7	44 Å²	44	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-31.2	176	-53.6	-58.7	0	0	0	112.1	L369 R413 G414 L421 T423 T494 V604 Y606 T627	L369-F496 HydrophobicContact CD2-CB 4.01Å; L369-F496 HydrophobicContact CD2-CD2 4.25Å; L369-F496 HydrophobicContact CD2-CG 4.11Å; R413-F496 VanDerWaalsContact CA-O 3.28Å; R413-F496 WeakPolarHBondContact CA-O 3.23Å; G414-F496 PolarHBondContact N-O 3.21Å; L421-F496 HydrophobicContact CD2-CD1 3.81Å; L421-F496 HydrophobicContact CD2-CE1 4.09Å; T423-F496 PolarHBondContact OG1-O 2.96Å; T494-F496 PolarHBondContact O-N 3.3Å; F496-V604 HydrophobicContact CE2-CG1 4.02Å; F496-V604 HydrophobicContact CE2-CG2 3.75Å; F496-V604 HydrophobicContact CZ-CG2 3.74Å; F496-Y606 AromaticContact CE1-CD2 3.67Å; F496-Y606 HydrophobicContact CE1-CD2 3.67Å; F496-Y606 HydrophobicContact CE1-CE2 4.07Å; F496-Y606 HydrophobicContact CE1-CG 4.48Å; F496-Y606 AromaticContact CZ-CD2 3.55Å; F496-Y606 HydrophobicContact CZ-CD2 3.55Å; F496-Y606 HydrophobicContact CZ-CE2 4.38Å; F496-Y606 AromaticContact CZ-CG 4Å; F496-Y606 HydrophobicContact CZ-CG 4Å; F496-T627 HydrophobicContact CE1-CG2 3.79Å; F496-T627 WeakPolarHBondContact CE1-OG1 3.29Å; F496-T627 HydrophobicContact CZ-CG2 3.7Å
497	E	85.8	Confident	87.9	Confident	26 Å²	26	45.9 Å²	45.9	12%	0.121	23%	0.227	C	C	.	.	H	α-helix	trans	-90.1	-47	-179	-71.3	162.9	154.7	0	0	111	V385 L407 R413 T494 V495 R656	V385-E497 WeakPolarHBondContact CG1-O 3.43Å; V385-E497 WeakPolarHBondContact CG2-O 3.31Å; L407-E497 HydrophobicContact CD1-CB 3.65Å; R413-E497 HydrophobicContact CG-CB 4.48Å; R413-E497 HydrophobicContact CG-CG 3.66Å; R413-E497 IonicContact CZ-OE1 2.68Å; R413-E497 IonicContact NE-OE1 3.48Å; R413-E497 PolarHBondContact NE-OE1 3.36Å; R413-E497 VanDerWaalsContact NE-OE1 3.07Å; R413-E497 IonicContact NH2-OE1 2.77Å; R413-E497 PolarHBondContact NH2-OE1 2.87Å; T494-E497 PolarHBondContact N-OE2 2.64Å; T494-E497 VanDerWaalsContact N-OE2 3.12Å; T494-E497 PolarHBondContact O-N 3.05Å; T494-E497 PolarHBondContact OG1-OE2 2.98Å; T494-E497 VanDerWaalsContact OG1-OE2 3.05Å; V495-E497 PolarHBondContact O-N 3.26Å; E497-R656 IonicContact OE1-NH2 2.68Å
498	A	86.3	Confident	87.9	Confident	2 Å²	2	45 Å²	45	2%	0.017	22%	0.219	C	C	.	.	H	α-helix	trans	-104	-7.4	-169.3	0	0	0	0	0	115.2	L407 C426 S493 T494 R500 G501	L407-A498 HydrophobicContact CD1-CB 3.83Å; C426-A498 WeakPolarHBondContact SG-CA 3.38Å; C426-A498 PolarHBondContact SG-O 3.18Å; S493-A498 WeakPolarHBondContact OG-CB 3.45Å; T494-A498 PolarHBondContact O-N 3.31Å; A498-R500 PolarHBondContact O-N 2.84Å; A498-G501 PolarHBondContact O-N 2.87Å
499	G	86.7	Confident	87.8	Confident	5 Å²	5	38.8 Å²	38.8	5%	0.052	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	-127.4	-163.3	0	0	0	0	0	110.6	T423 V495 G501	T423-G499 WeakPolarHBondContact O-CA 3.49Å; V495-G499 VanDerWaalsContact O-CA 3.23Å; V495-G499 WeakPolarHBondContact O-CA 3.34Å; V495-G499 PolarHBondContact O-N 3.04Å; G499-G501 VanDerWaalsContact C-N 3.29Å
500	R	87.1	Confident	87.8	Confident	68 Å²	68	34.6 Å²	34.6	26%	0.257	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-11.3	174.1	-65.2	-60.8	-166.4	-146.9	10	114.4	A424 A484 A487 A498 E608 C623	A424-R500 WeakPolarHBondContact O-CB 3.44Å; A424-R500 PolarHBondContact O-N 3.28Å; A484-R500 HydrophobicContact CB-CG 3.88Å; A484-R500 WeakPolarHBondContact O-CB 3.01Å; A487-R500 HydrophobicContact CB-CB 3.9Å; A487-R500 WeakPolarHBondContact CB-O 3.32Å; A498-R500 PolarHBondContact O-N 2.84Å; R500-E608 IonicContact CZ-OE1 2.68Å; R500-E608 IonicContact CZ-OE2 3.39Å; R500-E608 IonicContact NH1-OE1 3.81Å; R500-E608 PolarHBondContact NH1-OE1 3.49Å; R500-E608 IonicContact NH1-OE2 3.82Å; R500-E608 PolarHBondContact NH1-OE2 3.12Å; R500-E608 IonicContact NH2-OE1 3.69Å; R500-E608 IonicContact NH2-OE2 3.07Å; R500-E608 PolarHBondContact NH2-OE2 3.2Å; R500-C623 PolarHBondContact NH2-SG 2.98Å
501	G	90.3	Very high	87.9	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.01	18%	0.178	C	C	.	.			trans	115.3	-168.5	-178.8	0	0	0	0	0	113	I425 C426 K488 A498 G499 M503	I425-G501 CarbonylContact C-O 3.52Å; C426-G501 PolarHBondContact N-O 2.86Å; K488-G501 CarbonylContact O-C 3.59Å; K488-G501 WeakPolarHBondContact O-CA 3.31Å; A498-G501 PolarHBondContact O-N 2.87Å; G499-G501 VanDerWaalsContact C-N 3.29Å; G501-M503 PolarHBondContact O-N 3.19Å
502	L	90.4	Very high	88	Confident	7 Å²	7	29.5 Å²	29.5	4%	0.037	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	-71.7	125.6	-178.9	-171.6	65.9	0	0	0	110.7	E47 T48 Y387 C426 A487 K488 V490	E47-L502 HydrophobicContact CB-CD2 3.82Å; E47-L502 VanDerWaalsContact O-CD2 3.23Å; E47-L502 WeakPolarHBondContact O-CD2 3.25Å; T48-L502 HydrophobicContact CG2-CD1 4.12Å; T48-L502 HydrophobicContact CG2-CG 4.37Å; Y387-L502 HydrophobicContact CD1-CD1 3.7Å; Y387-L502 HydrophobicContact CD1-CD2 4.08Å; Y387-L502 HydrophobicContact CD2-CD1 4.49Å; Y387-L502 HydrophobicContact CE1-CD1 4.28Å; Y387-L502 HydrophobicContact CE1-CD2 3.8Å; Y387-L502 HydrophobicContact CG-CD1 3.81Å; C426-L502 HydrophobicContact CB-CB 4.5Å; C426-L502 HydrophobicContact CB-CD1 4.12Å; A487-L502 CarbonylContact C-O 3.4Å; A487-L502 WeakPolarHBondContact CA-O 3.36Å; K488-L502 PolarHBondContact N-O 3.3Å; K488-L502 PolarHBondContact O-N 2.98Å; V490-L502 HydrophobicContact CG2-CB 4.09Å
503	M	91.3	Very high	87.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.			trans	-59.5	143.3	179.5	65.8	-173.6	-61.8	0	0	112.1	T48 I425 C426 A427 A456 A459 V460 L483 G501 I505	T48-M503 WeakPolarHBondContact CA-O 3.26Å; T48-M503 HydrophobicContact CG2-CG 3.69Å; T48-M503 HydrophobicContact CG2-SD 4.49Å; I425-M503 HydrophobicContact CD1-CB 4.34Å; I425-M503 HydrophobicContact CD1-SD 4.43Å; C426-M503 PolarHBondContact O-N 2.99Å; C426-M503 VanDerWaalsContact O-N 3.08Å; A427-M503 HydrophobicContact CB-SD 3.87Å; A456-M503 HydrophobicContact CB-CE 4.44Å; A456-M503 HydrophobicContact CB-SD 3.78Å; A459-M503 HydrophobicContact CB-CE 3.44Å; A459-M503 VanDerWaalsContact CB-CE 3.44Å; A459-M503 HydrophobicContact CB-SD 4.15Å; V460-M503 HydrophobicContact CG2-CE 4.43Å; L483-M503 HydrophobicContact CD2-CB 4.35Å; L483-M503 HydrophobicContact CD2-CE 3.98Å; G501-M503 PolarHBondContact O-N 3.19Å; M503-I505 HydrophobicContact CE-CD1 3.45Å; M503-I505 VanDerWaalsContact CE-CD1 3.45Å; M503-I505 HydrophobicContact CE-CG1 4.16Å
504	Q	93	Very high	87	Confident	14 Å²	14	31.2 Å²	31.2	7%	0.065	15%	0.147	C	C	.	.			trans	-129	108.7	178.4	-59.4	-65	-90.2	0	0	109.6	E47 E49 K488 A508	E47-Q504 PolarHBondContact O-NE2 3.17Å; E49-Q504 HydrophobicContact CG-CB 4.24Å; E49-Q504 PolarHBondContact OE1-OE1 3Å; E49-Q504 WeakPolarHBondContact OE2-CB 3.35Å; K488-Q504 HydrophobicContact CB-CG 3.86Å; Q504-A508 VanDerWaalsContact O-CB 3.24Å; Q504-A508 WeakPolarHBondContact O-CB 3.45Å; Q504-A508 PolarHBondContact O-N 3.49Å; Q504-A508 VanDerWaalsContact O-N 3.1Å
505	I	92.8	Very high	85.1	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-73.9	-39.9	-168.8	-70.7	-55.9	0	0	0	112.9	T48 V50 F53 A459 L483 M503 A508 F509	T48-I505 PolarHBondContact O-N 2.97Å; V50-I505 HydrophobicContact CG2-CG1 4.22Å; F53-I505 HydrophobicContact CB-CG2 4.11Å; F53-I505 HydrophobicContact CD1-CG2 4Å; F53-I505 HydrophobicContact CD2-CG2 3.86Å; F53-I505 HydrophobicContact CE1-CG2 4.39Å; F53-I505 HydrophobicContact CE2-CG2 4.28Å; F53-I505 HydrophobicContact CG-CG2 3.71Å; A459-I505 HydrophobicContact CB-CD1 3.78Å; A459-I505 HydrophobicContact CB-CG1 3.77Å; A459-I505 WeakPolarHBondContact O-CD1 3.23Å; L483-I505 HydrophobicContact CD2-CD1 4.11Å; M503-I505 HydrophobicContact CE-CD1 3.45Å; M503-I505 VanDerWaalsContact CE-CD1 3.45Å; M503-I505 HydrophobicContact CE-CG1 4.16Å; I505-A508 PolarHBondContact O-N 3.43Å; I505-F509 PolarHBondContact O-N 2.89Å
506	Q	92.4	Very high	82.8	Confident	8 Å²	8	31.9 Å²	31.9	4%	0.037	15%	0.146	C	C	.	.	H	α-helix	trans	-65	-48	-178.5	178.3	66.8	34.5	0	0	110.2	E49 F53 A508 F509 E510	E49-Q506 HydrophobicContact CB-CB 4.22Å; E49-Q506 VanDerWaalsContact OE2-CB 3.29Å; E49-Q506 WeakPolarHBondContact OE2-CB 3.35Å; E49-Q506 PolarHBondContact OE2-N 3.24Å; F53-Q506 VanDerWaalsContact CD2-OE1 3.28Å; Q506-A508 PolarHBondContact O-N 3.22Å; Q506-F509 PolarHBondContact O-N 3.4Å; Q506-E510 PolarHBondContact NE2-OE1 2.9Å; Q506-E510 PolarHBondContact O-N 3.38Å; Q506-E510 VanDerWaalsContact O-N 3.15Å
507	Q	92	Very high	80.6	Confident	68 Å²	68	34.3 Å²	34.3	32%	0.318	16%	0.159	S	C	.	.	H	α-helix	trans	-66.1	-36.5	176.7	-69.2	97.3	45.4	0	0	113	E49 T486 F509 E510 Y511	E49-Q507 VanDerWaalsContact CD-OE1 3.25Å; E49-Q507 VanDerWaalsContact OE1-CD 3.23Å; E49-Q507 PolarHBondContact OE1-NE2 2.89Å; E49-Q507 PolarHBondContact OE1-OE1 3.03Å; E49-Q507 VanDerWaalsContact OE1-OE1 3.06Å; E49-Q507 PolarHBondContact OE2-N 3.06Å; E49-Q507 PolarHBondContact OE2-NE2 3.08Å; E49-Q507 VanDerWaalsContact OE2-NE2 3.09Å; E49-Q507 PolarHBondContact OE2-OE1 2.95Å; T486-Q507 HydrophobicContact CG2-CB 4.01Å; Q507-F509 VanDerWaalsContact C-N 3.3Å; Q507-F509 PolarHBondContact O-N 3.35Å; Q507-E510 PolarHBondContact O-N 3.24Å; Q507-Y511 WeakPolarHBondContact O-CB 3.23Å; Q507-Y511 PolarHBondContact O-N 2.81Å
508	A	90.4	Very high	78.5	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.3	-38.6	176.8	0	0	0	0	0	111.9	L463 A482 L483 Q504 I505 Q506 Y511 L512	L463-A508 HydrophobicContact CD1-CB 4.41Å; L463-A508 HydrophobicContact CD2-CB 4.47Å; A482-A508 HydrophobicContact CB-CB 4.42Å; L483-A508 HydrophobicContact CD2-CB 3.89Å; Q504-A508 VanDerWaalsContact O-CB 3.24Å; Q504-A508 WeakPolarHBondContact O-CB 3.45Å; Q504-A508 PolarHBondContact O-N 3.49Å; Q504-A508 VanDerWaalsContact O-N 3.1Å; I505-A508 PolarHBondContact O-N 3.43Å; Q506-A508 PolarHBondContact O-N 3.22Å; A508-Y511 PolarHBondContact O-N 2.87Å; A508-L512 WeakPolarHBondContact O-CG 3.25Å; A508-L512 PolarHBondContact O-N 3.29Å
509	F	90.8	Very high	76.5	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.018	18%	0.178	C	C	.	.	H	α-helix	trans	-63.1	-49.9	174.9	-175.9	-115.1	0	0	0	111.7	F53 Y60 L463 L467 E470 I505 Q506 Q507 Y511 L512 L513	F53-F509 HydrophobicContact CD2-CB 4.47Å; F53-F509 HydrophobicContact CE2-CB 3.74Å; F53-F509 AromaticContact CE2-CD1 3.8Å; F53-F509 HydrophobicContact CE2-CD1 3.8Å; F53-F509 HydrophobicContact CE2-CD2 4.23Å; F53-F509 HydrophobicContact CE2-CE1 4.43Å; F53-F509 AromaticContact CE2-CG 3.66Å; F53-F509 HydrophobicContact CE2-CG 3.66Å; F53-F509 HydrophobicContact CZ-CD2 4.41Å; F53-F509 HydrophobicContact CZ-CG 4.28Å; Y60-F509 HydrophobicContact CD2-CZ 4.21Å; Y60-F509 HydrophobicContact CE2-CE1 4.22Å; Y60-F509 AromaticContact CE2-CZ 3.82Å; Y60-F509 HydrophobicContact CE2-CZ 3.82Å; L463-F509 VanDerWaalsContact CD1-CA 3.43Å; L463-F509 HydrophobicContact CD1-CB 3.56Å; L463-F509 HydrophobicContact CD1-CD2 3.9Å; L463-F509 HydrophobicContact CD1-CG 4.23Å; L467-F509 HydrophobicContact CD2-CD2 4.2Å; L467-F509 HydrophobicContact CD2-CE2 4.09Å; L467-F509 HydrophobicContact CG-CD2 4.29Å; L467-F509 HydrophobicContact CG-CE2 4.2Å; E470-F509 HydrophobicContact CG-CZ 3.8Å; I505-F509 PolarHBondContact O-N 2.89Å; Q506-F509 PolarHBondContact O-N 3.4Å; Q507-F509 VanDerWaalsContact C-N 3.3Å; Q507-F509 PolarHBondContact O-N 3.35Å; F509-Y511 PolarHBondContact O-N 3.49Å; F509-L512 PolarHBondContact O-N 2.79Å; F509-L512 VanDerWaalsContact O-N 3.12Å; F509-L513 HydrophobicContact CD1-CD1 4.23Å; F509-L513 HydrophobicContact CE1-CD1 3.87Å; F509-L513 HydrophobicContact CE1-CG 4.41Å; F509-L513 HydrophobicContact CE2-CD2 4.32Å; F509-L513 HydrophobicContact CZ-CD1 4.22Å; F509-L513 HydrophobicContact CZ-CD2 4.18Å; F509-L513 HydrophobicContact CZ-CG 4.39Å; F509-L513 WeakPolarHBondContact O-CG 3.16Å; F509-L513 PolarHBondContact O-N 3Å; F509-L513 VanDerWaalsContact O-N 3.08Å
510	E	88.6	Confident	74.3	Confident	77 Å²	77	39.3 Å²	39.3	36%	0.36	19%	0.189	S	C	.	.	H	α-helix	trans	-60.7	-32.5	177.4	-69.4	173.8	-164.6	0	0	112.9	Q506 Q507 R514	Q506-E510 PolarHBondContact NE2-OE1 2.9Å; Q506-E510 PolarHBondContact O-N 3.38Å; Q506-E510 VanDerWaalsContact O-N 3.15Å; Q507-E510 PolarHBondContact O-N 3.24Å; E510-R514 WeakPolarHBondContact O-CG 3.11Å
511	Y	86.5	Confident	72.6	Confident	31 Å²	31	39.1 Å²	39.1	12%	0.122	20%	0.198	C	C	.	.	H	α-helix	trans	-67.5	-47	173.9	-176.9	-78.7	0	0	0	111.5	A482 N485 T486 Q507 A508 F509 L513 R514 L618	A482-Y511 HydrophobicContact CB-CD1 3.53Å; A482-Y511 HydrophobicContact CB-CE1 4.11Å; A482-Y511 HydrophobicContact CB-CG 4.23Å; N485-Y511 HydrophobicContact CB-CE2 4.11Å; N485-Y511 PolarHBondContact ND2-OH 2.93Å; T486-Y511 HydrophobicContact CG2-CD2 4.22Å; T486-Y511 HydrophobicContact CG2-CG 4.27Å; Q507-Y511 WeakPolarHBondContact O-CB 3.23Å; Q507-Y511 PolarHBondContact O-N 2.81Å; A508-Y511 PolarHBondContact O-N 2.87Å; F509-Y511 PolarHBondContact O-N 3.49Å; Y511-L513 PolarHBondContact O-N 3.39Å; Y511-R514 WeakPolarHBondContact O-CB 3.49Å; Y511-R514 PolarHBondContact O-N 3.08Å; Y511-R514 VanDerWaalsContact O-N 3.11Å; Y511-L618 PolarHBondContact OH-O 3.11Å
512	L	81.7	Confident	71.6	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-68.2	-31.6	-177.3	-76.9	172.6	0	0	0	113.8	L463 L467 S478 I479 A482 A508 F509 R514 F515	L463-L512 HydrophobicContact CD1-CD1 4.16Å; L463-L512 HydrophobicContact CD2-CD1 3.66Å; L463-L512 HydrophobicContact CG-CD1 4Å; L467-L512 HydrophobicContact CD1-CD1 3.66Å; L467-L512 HydrophobicContact CD2-CB 3.85Å; L467-L512 HydrophobicContact CD2-CD1 4.49Å; S478-L512 WeakPolarHBondContact O-CD2 3.18Å; I479-L512 HydrophobicContact CG1-CD1 4.08Å; A482-L512 HydrophobicContact CB-CD1 3.99Å; A482-L512 HydrophobicContact CB-CD2 3.74Å; A482-L512 HydrophobicContact CB-CG 3.53Å; A508-L512 WeakPolarHBondContact O-CG 3.25Å; A508-L512 PolarHBondContact O-N 3.29Å; F509-L512 PolarHBondContact O-N 2.79Å; F509-L512 VanDerWaalsContact O-N 3.12Å; L512-R514 PolarHBondContact O-N 3.13Å; L512-F515 PolarHBondContact O-N 3.34Å
513	L	74.5	Confident	71	Confident	77 Å²	77	46.7 Å²	46.7	40%	0.403	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-18.1	172.9	-68.8	-178.9	0	0	0	112.8	L467 E470 V472 F509 Y511	L467-L513 HydrophobicContact CD2-CD2 4.48Å; E470-L513 HydrophobicContact CB-CD2 4.23Å; E470-L513 HydrophobicContact CG-CD2 4.28Å; V472-L513 HydrophobicContact CG2-CD2 3.73Å; F509-L513 HydrophobicContact CD1-CD1 4.23Å; F509-L513 HydrophobicContact CE1-CD1 3.87Å; F509-L513 HydrophobicContact CE1-CG 4.41Å; F509-L513 HydrophobicContact CE2-CD2 4.32Å; F509-L513 HydrophobicContact CZ-CD1 4.22Å; F509-L513 HydrophobicContact CZ-CD2 4.18Å; F509-L513 HydrophobicContact CZ-CG 4.39Å; F509-L513 WeakPolarHBondContact O-CG 3.16Å; F509-L513 PolarHBondContact O-N 3Å; F509-L513 VanDerWaalsContact O-N 3.08Å; Y511-L513 PolarHBondContact O-N 3.39Å
514	R	63.5	Low	70.8	Confident	151 Å²	151	47.4 Å²	47.4	57%	0.57	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-35.8	-178.8	-56.5	174.3	-174.2	-179.4	2.6	112.3	E510 Y511 L512	E510-R514 WeakPolarHBondContact O-CG 3.11Å; Y511-R514 WeakPolarHBondContact O-CB 3.49Å; Y511-R514 PolarHBondContact O-N 3.08Å; Y511-R514 VanDerWaalsContact O-N 3.11Å; L512-R514 PolarHBondContact O-N 3.13Å
515	F	48.1	Very low	70.6	Confident	60 Å²	60	48.1 Å²	48.1	26%	0.263	24%	0.24	S	C	.	.			trans	-158.4	155.4	-165.7	-48.4	-74.5	0	0	0	116.3	L512 I617 L618	L512-F515 PolarHBondContact O-N 3.34Å; F515-I617 HydrophobicContact CE2-CG1 4.48Å; F515-I617 HydrophobicContact CE2-CG2 3.78Å; F515-I617 HydrophobicContact CZ-CG2 3.63Å; F515-L618 HydrophobicContact CB-CD2 3.3Å; F515-L618 HydrophobicContact CD1-CD2 3.73Å; F515-L618 HydrophobicContact CD2-CD2 3.29Å; F515-L618 HydrophobicContact CD2-CG 4.33Å; F515-L618 HydrophobicContact CE1-CD2 4.4Å; F515-L618 HydrophobicContact CE2-CD2 3.99Å; F515-L618 HydrophobicContact CG-CD2 3.14Å; F515-L618 HydrophobicContact CG-CG 4.3Å
516	V	39.4	Very low	70.5	Confident	61 Å²	61	49 Å²	49	37%	0.37	25%	0.245	S	C	.	.			trans	-135.4	122.2	174.1	177.9	0	0	0	0	109.6	S473	S473-V516 WeakPolarHBondContact O-CG2 3.42Å
517	L	41	Very low	70.4	Confident	57 Å²	57	49 Å²	49	30%	0.298	24%	0.244	S	C	.	.			trans	-146.9	160.8	174.5	-72.9	178.2	0	0	0	111.6	S478 L481 T613 L618 V621	S478-L517 PolarHBondContact N-O 3.25Å; L481-L517 HydrophobicContact CD2-CB 4.12Å; L517-T613 HydrophobicContact CD1-CG2 4.21Å; L517-L618 HydrophobicContact CD1-CD1 3.56Å; L517-L618 HydrophobicContact CD1-CD2 4.45Å; L517-V621 HydrophobicContact CD1-CG1 3.64Å
518	E	42.2	Very low	70.3	Confident	83 Å²	83	46.1 Å²	46.1	39%	0.388	23%	0.231	S	C	.	.			trans	-109	151.2	-174	-59.4	-173.6	162.9	0	0	113.3	F477	F477-E518 HydrophobicContact CB-CB 4.11Å; F477-E518 HydrophobicContact CB-CG 4.13Å; F477-E518 HydrophobicContact CD2-CB 4.37Å; F477-E518 HydrophobicContact CD2-CG 3.93Å; F477-E518 HydrophobicContact CG-CB 4.27Å; F477-E518 HydrophobicContact CG-CG 4.25Å
519	D	43	Very low	70.3	Confident	28 Å²	28	46.9 Å²	46.9	15%	0.15	24%	0.235	C	C	.	.			trans	-122	147.1	-172.3	174.6	37.3	0	0	0	111.9	R480 L622	R480-D519 IonicContact CZ-OD2 3.49Å; R480-D519 VanDerWaalsContact CZ-OD2 3.3Å; R480-D519 IonicContact NH1-OD2 3.61Å; R480-D519 PolarHBondContact NH1-OD2 3.27Å; R480-D519 IonicContact NH2-OD2 2.82Å; R480-D519 PolarHBondContact NH2-OD2 2.91Å; D519-L622 WeakPolarHBondContact OD1-CD1 3.4Å
520	G	41.1	Very low	70.3	Confident	27 Å²	27	52.7 Å²	52.7	28%	0.278	26%	0.258	S	S	.	.			trans	-163.7	129.8	177.1	0	0	0	0	0	117.8	L622	G520-L622 WeakPolarHBondContact O-CD1 3.42Å; G520-L622 VanDerWaalsContact O-CD2 3.31Å; G520-L622 WeakPolarHBondContact O-CD2 3.28Å
521	S	52.2	Low	70.3	Confident	65 Å²	65	51.7 Å²	51.7	46%	0.455	25%	0.253	S	S	.	.			trans	105	149.7	160	-57.7	0	0	0	0	120.3
522	R	68	Low	70.6	Confident	142 Å²	142	50.6 Å²	50.6	54%	0.536	25%	0.249	S	C	.	.			trans	-105.5	-4.2	-135.2	-73.7	175.2	-83.9	174.5	-5.5	118.2	D418 G419 W420	D418-R522 WeakPolarHBondContact OD2-CD 3.44Å; G419-R522 CarbonylContact C-O 3.52Å; G419-R522 VanDerWaalsContact C-O 3.29Å; W420-R522 WeakPolarHBondContact CA-O 3.49Å; W420-R522 HydrophobicContact CB-CB 4.15Å; W420-R522 WeakPolarHBondContact CB-O 3.44Å; W420-R522 HydrophobicContact CG-CB 4.5Å; W420-R522 PolarHBondContact N-O 3.35Å
523	G	78.1	Confident	71.1	Confident	25 Å²	25	56 Å²	56	26%	0.258	28%	0.275	S	S	.	.			trans	104.9	-178.4	168.8	0	0	0	0	0	117.2	P625	G523-P625 CarbonylContact C-O 3.53Å; G523-P625 VanDerWaalsContact CA-O 3.23Å; G523-P625 WeakPolarHBondContact CA-O 3.47Å
524	V	86.5	Confident	72	Confident	15 Å²	15	58.7 Å²	58.7	9%	0.091	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131.4	-175.6	-177.9	0	0	0	0	109.9	V538 L592 I594 P625 I626 T627	V524-V538 HydrophobicContact CG1-CG2 4.26Å; V524-V538 HydrophobicContact CG2-CG1 4.2Å; V524-L592 HydrophobicContact CG2-CD2 4.42Å; V524-I594 HydrophobicContact CB-CD1 4.45Å; V524-I594 HydrophobicContact CG1-CD1 3.67Å; V524-P625 PolarHBondContact N-O 3.27Å; V524-I626 HydrophobicContact CB-CG1 4.25Å; V524-I626 HydrophobicContact CB-CG2 4.33Å; V524-I626 HydrophobicContact CG2-CG1 4.41Å; V524-I626 WeakPolarHBondContact O-CA 3.46Å; V524-T627 PolarHBondContact O-N 2.85Å
525	Y	89.7	Confident	73.4	Confident	29 Å²	29	53.9 Å²	53.9	11%	0.114	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	115	177	-174.8	-153.1	0	0	0	112.4	S370 P415 G419 R527 T627 V629 L683	S370-Y525 WeakPolarHBondContact OG-CE1 3.27Å; S370-Y525 PolarHBondContact OG-OH 2.88Å; P415-Y525 HydrophobicContact CG-CD1 4.04Å; P415-Y525 HydrophobicContact CG-CD2 3.83Å; P415-Y525 HydrophobicContact CG-CE1 4.01Å; P415-Y525 HydrophobicContact CG-CE2 3.78Å; P415-Y525 HydrophobicContact CG-CG 3.96Å; G419-Y525 VanDerWaalsContact CA-CB 3.46Å; Y525-R527 HydrophobicContact CD2-CB 4.43Å; Y525-R527 HydrophobicContact CE1-CB 4.23Å; Y525-R527 HydrophobicContact CE2-CB 3.94Å; Y525-R527 HydrophobicContact CE2-CG 4.32Å; Y525-R527 VanDerWaalsContact OH-CD 3.28Å; Y525-R527 WeakPolarHBondContact OH-CD 3.39Å; Y525-R527 PolarHBondContact OH-NH1 3.46Å; Y525-R527 VanDerWaalsContact OH-NH1 3.09Å; Y525-T627 WeakPolarHBondContact CA-O 3.18Å; Y525-T627 HydrophobicContact CD2-CG2 3.89Å; Y525-T627 HydrophobicContact CE2-CG2 3.86Å; Y525-V629 HydrophobicContact CE2-CG2 3.96Å; Y525-L683 HydrophobicContact CE1-CD1 4.1Å
526	L	91.1	Very high	75.5	Confident	19 Å²	19	52.3 Å²	52.3	10%	0.099	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	120.7	172	-52	-180	0	0	0	107.8	E531 V532 I594 T627 V628 V629	L526-E531 HydrophobicContact CB-CB 4.27Å; L526-E531 HydrophobicContact CD2-CB 4.35Å; L526-V532 HydrophobicContact CB-CG1 4Å; L526-I594 HydrophobicContact CD1-CB 4.46Å; L526-I594 HydrophobicContact CD1-CD1 4.38Å; L526-I594 HydrophobicContact CD1-CG2 3.93Å; L526-T627 PolarHBondContact N-O 2.85Å; L526-V628 HydrophobicContact CB-CG1 4.43Å; L526-V628 HydrophobicContact CB-CG2 4.38Å; L526-V628 HydrophobicContact CD1-CG2 4.26Å; L526-V628 CarbonylContact O-C 3.58Å; L526-V628 WeakPolarHBondContact O-CA 3.4Å; L526-V629 PolarHBondContact O-N 3.42Å
527	R	89.8	Confident	78	Confident	7 Å²	7	54.6 Å²	54.6	3%	0.026	28%	0.276	C	S	.	.			trans	-127.6	-36.8	-173.1	-173.2	-173.4	176.4	135.1	-7.1	113	S370 Y525 E531 V629 S681 L683 T714	S370-R527 PolarHBondContact OG-NH1 3.01Å; Y525-R527 HydrophobicContact CD2-CB 4.43Å; Y525-R527 HydrophobicContact CE1-CB 4.23Å; Y525-R527 HydrophobicContact CE2-CB 3.94Å; Y525-R527 HydrophobicContact CE2-CG 4.32Å; Y525-R527 VanDerWaalsContact OH-CD 3.28Å; Y525-R527 WeakPolarHBondContact OH-CD 3.39Å; Y525-R527 PolarHBondContact OH-NH1 3.46Å; Y525-R527 VanDerWaalsContact OH-NH1 3.09Å; R527-E531 PolarHBondContact N-OE2 2.89Å; R527-V629 HydrophobicContact CG-CB 4.28Å; R527-S681 PolarHBondContact NH2-O 2.64Å; R527-S681 PolarHBondContact NH2-OG 2.82Å; R527-L683 VanDerWaalsContact NH1-CD1 3.32Å; R527-T714 PolarHBondContact O-OG1 3.09Å
528	E	90.1	Very high	80.2	Confident	7 Å²	7	53.9 Å²	53.9	3%	0.033	27%	0.274	C	S	.	.	S	Bend	trans	-86.3	150.8	-172.4	-61.3	-61.9	175.2	0	0	112.1	Y530 E531 V532 T714	E528-Y530 HydrophobicContact CB-CD1 3.7Å; E528-Y530 HydrophobicContact CB-CE1 3.29Å; E528-Y530 HydrophobicContact CB-CG 4.5Å; E528-Y530 HydrophobicContact CG-CE1 3.79Å; E528-Y530 PolarHBondContact O-N 2.79Å; E528-Y530 VanDerWaalsContact O-N 3.16Å; E528-E531 HydrophobicContact CB-CG 4.12Å; E528-E531 PolarHBondContact N-OE2 3.06Å; E528-E531 WeakPolarHBondContact O-CB 3.4Å; E528-E531 PolarHBondContact O-N 2.82Å; E528-V532 PolarHBondContact O-N 3.06Å; E528-T714 WeakPolarHBondContact OE2-CB 3.35Å; E528-T714 PolarHBondContact OE2-N 3.49Å; E528-T714 PolarHBondContact OE2-OG1 2.81Å
529	L	90.7	Very high	82.4	Confident	16 Å²	16	53.2 Å²	53.2	8%	0.084	28%	0.276	C	S	.	.	H	α-helix	trans	-54.2	-40.7	-176.2	179.7	63.4	0	0	0	112.4	E531 V532 Q533 P631 Q633 H660	L529-E531 PolarHBondContact O-N 2.92Å; L529-V532 WeakPolarHBondContact O-CG2 3.38Å; L529-V532 PolarHBondContact O-N 3.16Å; L529-Q533 HydrophobicContact CD1-CG 4.26Å; L529-Q533 HydrophobicContact CG-CG 4.43Å; L529-Q533 VanDerWaalsContact O-CG 3.26Å; L529-Q533 WeakPolarHBondContact O-CG 3.4Å; L529-Q533 PolarHBondContact O-N 2.78Å; L529-P631 HydrophobicContact CB-CG 3.98Å; L529-P631 HydrophobicContact CD1-CG 4.12Å; L529-Q633 HydrophobicContact CD1-CG 4.06Å; L529-Q633 HydrophobicContact CD2-CG 3.84Å; L529-H660 HydrophobicContact CD2-CB 4.34Å
530	Y	89.9	Confident	84.4	Confident	127 Å²	127	52.6 Å²	52.6	50%	0.498	27%	0.273	S	S	.	.	H	α-helix	trans	-68.2	-20.1	179.6	67.5	-96.8	0	0	0	113.5	E528	E528-Y530 HydrophobicContact CB-CD1 3.7Å; E528-Y530 HydrophobicContact CB-CE1 3.29Å; E528-Y530 HydrophobicContact CB-CG 4.5Å; E528-Y530 HydrophobicContact CG-CE1 3.79Å; E528-Y530 PolarHBondContact O-N 2.79Å; E528-Y530 VanDerWaalsContact O-N 3.16Å
531	E	89.4	Confident	86.5	Confident	55 Å²	55	57.5 Å²	57.5	26%	0.257	29%	0.287	S	S	.	.	H	α-helix	trans	-83.5	-24.2	179.8	-58.1	176.2	145.7	0	0	111.9	L526 R527 E528 L529	L526-E531 HydrophobicContact CB-CB 4.27Å; L526-E531 HydrophobicContact CD2-CB 4.35Å; R527-E531 PolarHBondContact N-OE2 2.89Å; E528-E531 HydrophobicContact CB-CG 4.12Å; E528-E531 PolarHBondContact N-OE2 3.06Å; E528-E531 WeakPolarHBondContact O-CB 3.4Å; E528-E531 PolarHBondContact O-N 2.82Å; L529-E531 PolarHBondContact O-N 2.92Å
532	V	93.1	Very high	87.8	Confident	8 Å²	8	55 Å²	55	5%	0.048	27%	0.268	C	S	.	.	H	α-helix	trans	-109.2	1.4	-171.9	-57.3	0	0	0	0	114.2	L526 E528 L529 Q534 P596 V628 I630	L526-V532 HydrophobicContact CB-CG1 4Å; E528-V532 PolarHBondContact O-N 3.06Å; L529-V532 WeakPolarHBondContact O-CG2 3.38Å; L529-V532 PolarHBondContact O-N 3.16Å; V532-Q534 VanDerWaalsContact C-N 3.35Å; V532-P596 HydrophobicContact CB-CB 4.11Å; V532-P596 HydrophobicContact CB-CG 4.06Å; V532-P596 HydrophobicContact CG1-CB 4.44Å; V532-P596 WeakPolarHBondContact O-CG 3.47Å; V532-V628 HydrophobicContact CG1-CG1 3.81Å; V532-I630 HydrophobicContact CB-CD1 3.65Å; V532-I630 HydrophobicContact CG1-CD1 3.93Å; V532-I630 HydrophobicContact CG2-CD1 3.97Å
533	Q	91.6	Very high	88.4	Confident	118 Å²	118	54.6 Å²	54.6	55%	0.551	27%	0.272	S	S	*	.	S	Bend	trans	-79.4	-17.2	178	-83.8	173.7	-29.4	0	0	113.8	L529	L529-Q533 HydrophobicContact CD1-CG 4.26Å; L529-Q533 HydrophobicContact CG-CG 4.43Å; L529-Q533 VanDerWaalsContact O-CG 3.26Å; L529-Q533 WeakPolarHBondContact O-CG 3.4Å; L529-Q533 PolarHBondContact O-N 2.78Å
534	Q	93	Very high	88.3	Confident	133 Å²	133	54 Å²	54	62%	0.621	27%	0.265	S	S	*	.	S	Bend	trans	-142.6	156.1	-178.6	62.2	-176.5	-7.8	0	0	110.7	V532	V532-Q534 VanDerWaalsContact C-N 3.35Å
535	P	94.2	Very high	87.7	Confident	49 Å²	49	55.9 Å²	55.9	32%	0.318	28%	0.282	S	S	.	.			trans	-60.3	141.7	171.5	-20.7	32.2	0	0	0	111.5	I594 D595 T597	P535-I594 CarbonylContact C-O 3.51Å; P535-I594 WeakPolarHBondContact CA-O 3.26Å; P535-D595 HydrophobicContact CB-CB 4.35Å; P535-D595 HydrophobicContact CG-CB 4.38Å; P535-T597 HydrophobicContact CG-CG2 4.49Å
536	S	92	Very high	86.9	Confident	27 Å²	27	56 Å²	56	19%	0.189	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	145.9	176.7	57.7	0	0	0	0	111	R593 I594	S536-R593 WeakPolarHBondContact O-CA 3.12Å; S536-I594 PolarHBondContact N-O 3.22Å; S536-I594 PolarHBondContact O-N 3.23Å
537	E	91.3	Very high	85.8	Confident	109 Å²	109	56.1 Å²	56.1	51%	0.509	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	130.9	168.5	-73.1	-169.3	-177.5	0	0	109.2	R591 L592 R593	E537-R591 IonicContact OE2-NH1 2.71Å; E537-R591 PolarHBondContact OE2-NH1 2.95Å; E537-L592 WeakPolarHBondContact CA-O 3.33Å; E537-R593 HydrophobicContact CG-CB 4.26Å; E537-R593 HydrophobicContact CG-CG 4.25Å; E537-R593 IonicContact OE1-NH1 3.36Å
538	V	88	Confident	84.5	Confident	42 Å²	42	61.2 Å²	61.2	26%	0.255	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	131.9	176.8	-177.4	0	0	0	0	108.2	V524 R591 L592 I594	V524-V538 HydrophobicContact CG1-CG2 4.26Å; V524-V538 HydrophobicContact CG2-CG1 4.2Å; V538-R591 WeakPolarHBondContact O-CA 3.44Å; V538-L592 HydrophobicContact CB-CD1 3.8Å; V538-L592 HydrophobicContact CB-CG 3.99Å; V538-L592 HydrophobicContact CG2-CD1 4.15Å; V538-L592 PolarHBondContact N-O 2.97Å; V538-L592 PolarHBondContact O-N 3.43Å; V538-I594 HydrophobicContact CG2-CD1 4.42Å
539	V	88.3	Confident	83.1	Confident	69 Å²	69	66.8 Å²	66.8	42%	0.418	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.2	173	-173.5	0	0	0	0	108	F541 R591	V539-F541 HydrophobicContact CB-CE2 4.32Å; V539-F541 HydrophobicContact CG1-CD2 4.32Å; V539-F541 HydrophobicContact CG1-CE2 3.72Å; V539-F541 HydrophobicContact CG1-CZ 3.91Å; V539-R591 HydrophobicContact CG2-CG 4.25Å
540	V	85.1	Confident	81.6	Confident	15 Å²	15	71.2 Å²	71.2	9%	0.091	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.7	174.1	174.6	0	0	0	0	108.6	I542 S589 F590 L592 I624	V540-I542 HydrophobicContact CG1-CG1 4.19Å; V540-S589 CarbonylContact O-C 3.59Å; V540-S589 WeakPolarHBondContact O-CA 3.06Å; V540-S589 WeakPolarHBondContact O-CB 3.34Å; V540-F590 HydrophobicContact CB-CD1 4.17Å; V540-F590 HydrophobicContact CB-CE1 3.7Å; V540-F590 HydrophobicContact CB-CE2 4.26Å; V540-F590 HydrophobicContact CB-CZ 3.75Å; V540-F590 HydrophobicContact CG1-CD1 4.31Å; V540-F590 HydrophobicContact CG1-CE1 3.53Å; V540-F590 HydrophobicContact CG1-CZ 3.79Å; V540-F590 HydrophobicContact CG2-CE2 4.38Å; V540-F590 HydrophobicContact CG2-CZ 4.09Å; V540-F590 PolarHBondContact N-O 3.33Å; V540-F590 PolarHBondContact O-N 2.97Å; V540-L592 HydrophobicContact CG2-CD2 3.41Å; V540-L592 VanDerWaalsContact CG2-CD2 3.41Å; V540-L592 HydrophobicContact CG2-CG 4.28Å; V540-I624 HydrophobicContact CG1-CD1 3.57Å; V540-I624 HydrophobicContact CG2-CD1 4.36Å
541	F	83.9	Confident	80.1	Confident	130 Å²	130	67.5 Å²	67.5	57%	0.57	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	132.3	170.2	-66	-92.1	0	0	0	109.5	V539	V539-F541 HydrophobicContact CB-CE2 4.32Å; V539-F541 HydrophobicContact CG1-CD2 4.32Å; V539-F541 HydrophobicContact CG1-CE2 3.72Å; V539-F541 HydrophobicContact CG1-CZ 3.91Å
542	I	80.7	Confident	78.4	Confident	12 Å²	12	68.2 Å²	68.2	6%	0.062	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	128.3	172	-63.4	-174.4	0	0	0	107.3	V540 L581 I583 P587 R588 F590 I611 L622	V540-I542 HydrophobicContact CG1-CG1 4.19Å; I542-L581 HydrophobicContact CB-CD2 4.33Å; I542-L581 HydrophobicContact CD1-CD2 3.77Å; I542-L581 HydrophobicContact CG1-CD2 4.37Å; I542-I583 HydrophobicContact CG2-CD1 4.35Å; I542-I583 HydrophobicContact CG2-CG2 4.12Å; I542-P587 CarbonylContact O-C 3.35Å; I542-P587 WeakPolarHBondContact O-CA 3.46Å; I542-R588 PolarHBondContact N-O 2.6Å; I542-R588 PolarHBondContact O-N 2.86Å; I542-F590 HydrophobicContact CD1-CD1 4.36Å; I542-F590 HydrophobicContact CD1-CE1 3.7Å; I542-F590 HydrophobicContact CG1-CE1 4.18Å; I542-I611 HydrophobicContact CD1-CD1 3.48Å; I542-I611 VanDerWaalsContact CD1-CD1 3.48Å; I542-L622 HydrophobicContact CD1-CD2 4.12Å; I542-L622 HydrophobicContact CG1-CD2 4.47Å
543	E	79.2	Confident	76.4	Confident	134 Å²	134	72.6 Å²	72.6	63%	0.626	40%	0.403	S	S	*	.			trans	-128.9	137.4	178.4	179.3	171.8	-162.8	0	0	108.8	P587	E543-P587 HydrophobicContact CB-CB 4.24Å; E543-P587 HydrophobicContact CB-CG 4.24Å; E543-P587 HydrophobicContact CG-CB 4.46Å; E543-P587 HydrophobicContact CG-CG 3.93Å
544	A	77.4	Confident	74.9	Confident	13 Å²	13	72.1 Å²	72.1	11%	0.107	40%	0.403	C	S	.	.			trans	-81.1	115.3	169.6	0	0	0	0	0	108.6	F546 F562	A544-F546 HydrophobicContact CB-CE2 3.8Å; A544-F546 HydrophobicContact CB-CZ 3.9Å; A544-F546 WeakPolarHBondContact O-CE2 2.99Å; A544-F562 HydrophobicContact CB-CD1 4.13Å; A544-F562 HydrophobicContact CB-CE1 3.45Å; A544-F562 VanDerWaalsContact CB-CE1 3.45Å; A544-F562 HydrophobicContact CB-CZ 3.76Å
545	A	73.1	Confident	73.5	Confident	54 Å²	54	67.6 Å²	67.6	45%	0.446	38%	0.382	S	S	.	.			trans	-83.1	142.8	168.6	0	0	0	0	0	109.3
546	F	72.9	Confident	72.6	Confident	31 Å²	31	69.8 Å²	69.8	14%	0.136	40%	0.396	C	S	.	.			trans	-125.5	129.8	173.7	-59.5	-89.1	0	0	0	107.8	A544 E548 L551 V558 R559 F562	A544-F546 HydrophobicContact CB-CE2 3.8Å; A544-F546 HydrophobicContact CB-CZ 3.9Å; A544-F546 WeakPolarHBondContact O-CE2 2.99Å; F546-E548 PolarHBondContact O-N 3.03Å; F546-E548 VanDerWaalsContact O-N 3.15Å; F546-L551 HydrophobicContact CB-CD1 4.29Å; F546-L551 HydrophobicContact CD1-CD1 4.33Å; F546-V558 HydrophobicContact CD1-CG1 4.25Å; F546-V558 HydrophobicContact CE1-CG1 4.14Å; F546-R559 HydrophobicContact CD2-CG 4.01Å; F546-R559 HydrophobicContact CE2-CG 3.99Å; F546-R559 HydrophobicContact CG-CG 4.3Å; F546-R559 HydrophobicContact CZ-CG 4.25Å; F546-F562 HydrophobicContact CE1-CB 4.26Å; F546-F562 AromaticContact CE1-CD2 3.83Å; F546-F562 HydrophobicContact CE1-CD2 3.83Å; F546-F562 HydrophobicContact CE1-CE2 4.33Å; F546-F562 HydrophobicContact CE1-CG 4.01Å; F546-F562 HydrophobicContact CZ-CB 3.94Å; F546-F562 AromaticContact CZ-CD1 3.94Å; F546-F562 HydrophobicContact CZ-CD1 3.94Å; F546-F562 AromaticContact CZ-CD2 3.92Å; F546-F562 HydrophobicContact CZ-CD2 3.92Å; F546-F562 HydrophobicContact CZ-CE1 4.43Å; F546-F562 HydrophobicContact CZ-CE2 4.4Å; F546-F562 AromaticContact CZ-CG 3.66Å; F546-F562 HydrophobicContact CZ-CG 3.66Å
547	N	67.2	Low	71.7	Confident	22 Å²	22	72.3 Å²	72.3	12%	0.118	41%	0.413	C	S	.	.			trans	-65.9	113.7	176.8	176.5	-46	0	0	0	110.3	Y352 H549 T550 L551	Y352-N547 PolarHBondContact O-ND2 3.08Å; N547-H549 PolarHBondContact O-N 3.47Å; N547-H549 PolarHBondContact OD1-N 2.84Å; N547-T550 PolarHBondContact ND2-OG1 2.85Å; N547-T550 VanDerWaalsContact ND2-OG1 3.12Å; N547-T550 PolarHBondContact O-N 2.97Å; N547-T550 PolarHBondContact OD1-N 2.83Å; N547-T550 PolarHBondContact OD1-OG1 2.92Å; N547-L551 WeakPolarHBondContact O-CB 3.27Å; N547-L551 PolarHBondContact O-N 3.11Å; N547-L551 VanDerWaalsContact O-N 3.16Å
548	E	63.6	Low	70.8	Confident	115 Å²	115	69.4 Å²	69.4	54%	0.537	40%	0.403	S	S	.	.	H	α-helix	trans	-62.9	-38.7	-174.9	-65.7	-171.6	162.4	0	0	112.5	F546 A552	F546-E548 PolarHBondContact O-N 3.03Å; F546-E548 VanDerWaalsContact O-N 3.15Å; E548-A552 WeakPolarHBondContact O-CA 3.46Å; E548-A552 VanDerWaalsContact O-CB 3.25Å; E548-A552 WeakPolarHBondContact O-CB 3.4Å; E548-A552 PolarHBondContact O-N 2.96Å; E548-A552 VanDerWaalsContact O-N 3.07Å
549	H	60.9	Low	70.2	Confident	124 Å²	124	71.9 Å²	71.9	57%	0.574	41%	0.408	S	S	*	.	H	α-helix	trans	-75.5	-33.6	-176.7	-78	-78.6	0	0	0	114	N547	N547-H549 PolarHBondContact O-N 3.47Å; N547-H549 PolarHBondContact OD1-N 2.84Å
550	T	58.6	Low	69.8	Low	109 Å²	109	77.2 Å²	77.2	67%	0.669	43%	0.426	S	S	*	.	H	α-helix	trans	-87.2	-27.8	-174.5	-33.8	0	0	0	0	111.2	N547	N547-T550 PolarHBondContact ND2-OG1 2.85Å; N547-T550 VanDerWaalsContact ND2-OG1 3.12Å; N547-T550 PolarHBondContact O-N 2.97Å; N547-T550 PolarHBondContact OD1-N 2.83Å; N547-T550 PolarHBondContact OD1-OG1 2.92Å
551	L	58.6	Low	69.7	Low	49 Å²	49	83.8 Å²	83.8	26%	0.257	46%	0.455	S	S	.	.	H	α-helix	trans	-109.9	-0.1	-176.1	-65.8	169.6	0	0	0	114.2	F546 N547 A553 L554 E555	F546-L551 HydrophobicContact CB-CD1 4.29Å; F546-L551 HydrophobicContact CD1-CD1 4.33Å; N547-L551 WeakPolarHBondContact O-CB 3.27Å; N547-L551 PolarHBondContact O-N 3.11Å; N547-L551 VanDerWaalsContact O-N 3.16Å; L551-A553 PolarHBondContact O-N 3.19Å; L551-L554 CarbonylContact O-C 3.59Å; L551-L554 PolarHBondContact O-N 2.52Å; L551-E555 HydrophobicContact CB-CG 4.35Å; L551-E555 WeakPolarHBondContact O-CA 3.12Å; L551-E555 WeakPolarHBondContact O-CB 3.49Å; L551-E555 PolarHBondContact O-N 3.13Å
552	A	53.5	Low	69.6	Low	69 Å²	69	79.6 Å²	79.6	57%	0.57	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.8	-40.4	-176.5	0	0	0	0	0	114.9	E548	E548-A552 WeakPolarHBondContact O-CA 3.46Å; E548-A552 VanDerWaalsContact O-CB 3.25Å; E548-A552 WeakPolarHBondContact O-CB 3.4Å; E548-A552 PolarHBondContact O-N 2.96Å; E548-A552 VanDerWaalsContact O-N 3.07Å
553	A	51.7	Low	69.8	Low	101 Å²	101	81.3 Å²	81.3	84%	0.835	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-24	-179	0	0	0	0	0	114.5	L551	L551-A553 PolarHBondContact O-N 3.19Å
554	L	59.2	Low	70	Confident	107 Å²	107	80.3 Å²	80.3	56%	0.56	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-4	-177.2	-68.7	170	0	0	0	112.5	L551 C557 V558	L551-L554 CarbonylContact O-C 3.59Å; L551-L554 PolarHBondContact O-N 2.52Å; L554-C557 PolarHBondContact O-N 2.91Å; L554-C557 VanDerWaalsContact O-N 3.12Å; L554-V558 HydrophobicContact CB-CG2 3.92Å; L554-V558 WeakPolarHBondContact O-CG2 3.26Å; L554-V558 PolarHBondContact O-N 2.69Å
555	E	64.2	Low	70.6	Confident	39 Å²	39	84.3 Å²	84.3	18%	0.182	46%	0.459	C	S	.	.	H	α-helix	trans	-56.5	-45.5	-163.1	-139.8	-149.2	-168.3	0	0	114	L551 C557 V558 R559	L551-E555 HydrophobicContact CB-CG 4.35Å; L551-E555 WeakPolarHBondContact O-CA 3.12Å; L551-E555 WeakPolarHBondContact O-CB 3.49Å; L551-E555 PolarHBondContact O-N 3.13Å; E555-C557 PolarHBondContact O-N 2.49Å; E555-V558 PolarHBondContact O-N 2.91Å; E555-R559 VanDerWaalsContact CD-CZ 3.43Å; E555-R559 HydrophobicContact CG-CG 4.45Å; E555-R559 VanDerWaalsContact O-CB 3.24Å; E555-R559 WeakPolarHBondContact O-CB 3.43Å; E555-R559 VanDerWaalsContact O-CG 3.24Å; E555-R559 WeakPolarHBondContact O-CG 3.28Å; E555-R559 PolarHBondContact O-N 3.5Å; E555-R559 IonicContact OE1-CZ 2.84Å; E555-R559 IonicContact OE1-NE 3.71Å; E555-R559 PolarHBondContact OE1-NE 2.71Å; E555-R559 IonicContact OE1-NH2 2.82Å; E555-R559 PolarHBondContact OE1-NH2 2.74Å; E555-R559 IonicContact OE2-CZ 3.28Å; E555-R559 IonicContact OE2-NE 3.9Å; E555-R559 PolarHBondContact OE2-NE 2.79Å; E555-R559 IonicContact OE2-NH1 3.55Å; E555-R559 IonicContact OE2-NH2 2.86Å
556	P	74.3	Confident	71.3	Confident	94 Å²	94	82.3 Å²	82.3	61%	0.61	44%	0.441	S	S	*	.	H	α-helix	trans	-64.9	-39.8	-179.5	-21.8	33.9	0	0	0	112.5	F560	P556-F560 WeakPolarHBondContact O-CB 3.43Å; P556-F560 PolarHBondContact O-N 3.22Å
557	C	74.8	Confident	72.2	Confident	81 Å²	81	82.6 Å²	82.6	55%	0.547	45%	0.45	S	S	.	.	H	α-helix	trans	-71.8	-43.3	-179.5	-68	0	0	0	0	111.3	L554 E555 F560 Q561	L554-C557 PolarHBondContact O-N 2.91Å; L554-C557 VanDerWaalsContact O-N 3.12Å; E555-C557 PolarHBondContact O-N 2.49Å; C557-F560 PolarHBondContact O-N 3.36Å; C557-Q561 WeakPolarHBondContact O-CB 3.49Å; C557-Q561 WeakPolarHBondContact O-CG 3.23Å; C557-Q561 PolarHBondContact O-N 2.88Å
558	V	72.6	Confident	73.4	Confident	48 Å²	48	82.1 Å²	82.1	29%	0.291	45%	0.447	S	S	.	.	H	α-helix	trans	-63.9	-47.2	177.7	172.9	0	0	0	0	110.4	F546 L554 E555 Q561 F562	F546-V558 HydrophobicContact CD1-CG1 4.25Å; F546-V558 HydrophobicContact CE1-CG1 4.14Å; L554-V558 HydrophobicContact CB-CG2 3.92Å; L554-V558 WeakPolarHBondContact O-CG2 3.26Å; L554-V558 PolarHBondContact O-N 2.69Å; E555-V558 PolarHBondContact O-N 2.91Å; V558-Q561 PolarHBondContact O-N 3.48Å; V558-F562 WeakPolarHBondContact O-CB 3.37Å; V558-F562 PolarHBondContact O-N 3.16Å
559	R	75.2	Confident	74.9	Confident	93 Å²	93	84.1 Å²	84.1	35%	0.351	45%	0.449	S	S	.	.	H	α-helix	trans	-61.4	-44.8	176.5	-73.4	177.9	172.8	-154.3	1.7	111.6	F546 E555 Q561 F562	F546-R559 HydrophobicContact CD2-CG 4.01Å; F546-R559 HydrophobicContact CE2-CG 3.99Å; F546-R559 HydrophobicContact CG-CG 4.3Å; F546-R559 HydrophobicContact CZ-CG 4.25Å; E555-R559 VanDerWaalsContact CD-CZ 3.43Å; E555-R559 HydrophobicContact CG-CG 4.45Å; E555-R559 VanDerWaalsContact O-CB 3.24Å; E555-R559 WeakPolarHBondContact O-CB 3.43Å; E555-R559 VanDerWaalsContact O-CG 3.24Å; E555-R559 WeakPolarHBondContact O-CG 3.28Å; E555-R559 PolarHBondContact O-N 3.5Å; E555-R559 IonicContact OE1-CZ 2.84Å; E555-R559 IonicContact OE1-NE 3.71Å; E555-R559 PolarHBondContact OE1-NE 2.71Å; E555-R559 IonicContact OE1-NH2 2.82Å; E555-R559 PolarHBondContact OE1-NH2 2.74Å; E555-R559 IonicContact OE2-CZ 3.28Å; E555-R559 IonicContact OE2-NE 3.9Å; E555-R559 PolarHBondContact OE2-NE 2.79Å; E555-R559 IonicContact OE2-NH1 3.55Å; E555-R559 IonicContact OE2-NH2 2.86Å; R559-Q561 VanDerWaalsContact C-N 3.33Å; R559-Q561 PolarHBondContact O-N 3.32Å; R559-F562 PolarHBondContact O-N 3.37Å
560	F	80.2	Confident	76.5	Confident	182 Å²	182	79.5 Å²	79.5	80%	0.798	43%	0.431	S	S	*	.	H	α-helix	trans	-62.1	-38.9	178.9	179.7	-98.3	0	0	0	112.9	P556 C557 F562	P556-F560 WeakPolarHBondContact O-CB 3.43Å; P556-F560 PolarHBondContact O-N 3.22Å; C557-F560 PolarHBondContact O-N 3.36Å; F560-F562 VanDerWaalsContact C-N 3.34Å
561	Q	81.3	Confident	78.1	Confident	152 Å²	152	81.1 Å²	81.1	71%	0.71	43%	0.431	S	S	*	.	H	α-helix	trans	-84.9	-7.6	179.8	-67.9	178.4	-9.4	0	0	113.5	C557 V558 R559 S563	C557-Q561 WeakPolarHBondContact O-CB 3.49Å; C557-Q561 WeakPolarHBondContact O-CG 3.23Å; C557-Q561 PolarHBondContact O-N 2.88Å; V558-Q561 PolarHBondContact O-N 3.48Å; R559-Q561 VanDerWaalsContact C-N 3.33Å; R559-Q561 PolarHBondContact O-N 3.32Å; Q561-S563 PolarHBondContact O-N 3.01Å
562	F	82	Confident	79.8	Confident	43 Å²	43	79.6 Å²	79.6	19%	0.189	43%	0.426	C	S	.	.			trans	-74.4	101.9	-177.5	-171.6	-91.3	0	0	0	110.5	A544 F546 V558 R559 F560 R564 I583 N584	A544-F562 HydrophobicContact CB-CD1 4.13Å; A544-F562 HydrophobicContact CB-CE1 3.45Å; A544-F562 VanDerWaalsContact CB-CE1 3.45Å; A544-F562 HydrophobicContact CB-CZ 3.76Å; F546-F562 HydrophobicContact CE1-CB 4.26Å; F546-F562 AromaticContact CE1-CD2 3.83Å; F546-F562 HydrophobicContact CE1-CD2 3.83Å; F546-F562 HydrophobicContact CE1-CE2 4.33Å; F546-F562 HydrophobicContact CE1-CG 4.01Å; F546-F562 HydrophobicContact CZ-CB 3.94Å; F546-F562 AromaticContact CZ-CD1 3.94Å; F546-F562 HydrophobicContact CZ-CD1 3.94Å; F546-F562 AromaticContact CZ-CD2 3.92Å; F546-F562 HydrophobicContact CZ-CD2 3.92Å; F546-F562 HydrophobicContact CZ-CE1 4.43Å; F546-F562 HydrophobicContact CZ-CE2 4.4Å; F546-F562 AromaticContact CZ-CG 3.66Å; F546-F562 HydrophobicContact CZ-CG 3.66Å; V558-F562 WeakPolarHBondContact O-CB 3.37Å; V558-F562 PolarHBondContact O-N 3.16Å; R559-F562 PolarHBondContact O-N 3.37Å; F560-F562 VanDerWaalsContact C-N 3.34Å; F562-R564 HydrophobicContact CE1-CG 4.36Å; F562-R564 HydrophobicContact CE2-CG 4.05Å; F562-R564 HydrophobicContact CZ-CG 3.86Å; F562-I583 HydrophobicContact CE1-CD1 4Å; F562-I583 HydrophobicContact CE1-CG1 4.15Å; F562-I583 HydrophobicContact CZ-CD1 4.23Å; F562-N584 VanDerWaalsContact O-CA 3.27Å; F562-N584 WeakPolarHBondContact O-CA 3.02Å
563	S	85.2	Confident	81.7	Confident	48 Å²	48	85.4 Å²	85.4	34%	0.336	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	135.4	159.6	176.3	0	0	0	0	109.4	Q561 E582 I583	Q561-S563 PolarHBondContact O-N 3.01Å; S563-E582 PolarHBondContact OG-OE1 2.93Å; S563-I583 CarbonylContact C-O 3.59Å; S563-I583 WeakPolarHBondContact CA-O 2.91Å
564	R	84.5	Confident	83.8	Confident	112 Å²	112	82.8 Å²	82.8	42%	0.423	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	122.5	175.4	-67.8	-65.3	-179.7	-92.1	0.6	109.8	F562 L566 E582 I583	F562-R564 HydrophobicContact CE1-CG 4.36Å; F562-R564 HydrophobicContact CE2-CG 4.05Å; F562-R564 HydrophobicContact CZ-CG 3.86Å; R564-L566 HydrophobicContact CB-CD2 4.19Å; R564-E582 CarbonylContact O-C 3.46Å; R564-E582 WeakPolarHBondContact O-CA 3.38Å; R564-I583 HydrophobicContact CB-CG1 3.98Å; R564-I583 PolarHBondContact N-O 3.36Å; R564-I583 PolarHBondContact O-N 2.86Å
565	L	89.2	Confident	85.6	Confident	97 Å²	97	78.1 Å²	78.1	51%	0.508	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	116.6	166.4	-175.3	65.2	0	0	0	109	H580 E582	L565-H580 HydrophobicContact CD1-CB 4.19Å; L565-E582 HydrophobicContact CD1-CB 4.07Å
566	L	88.4	Confident	87.1	Confident	12 Å²	12	84.6 Å²	84.6	6%	0.063	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	135.2	178.8	-53.4	177.9	0	0	0	109.9	R564 L568 H580 L581 I583 I611 S612 T613	R564-L566 HydrophobicContact CB-CD2 4.19Å; L566-L568 HydrophobicContact CB-CD1 4.39Å; L566-H580 CarbonylContact O-C 3.54Å; L566-H580 VanDerWaalsContact O-CA 3.25Å; L566-H580 WeakPolarHBondContact O-CA 3.37Å; L566-L581 WeakPolarHBondContact CA-O 3.46Å; L566-L581 VanDerWaalsContact CB-O 3.3Å; L566-L581 WeakPolarHBondContact CB-O 3.21Å; L566-L581 PolarHBondContact N-O 3.42Å; L566-L581 PolarHBondContact O-N 3.04Å; L566-I583 HydrophobicContact CD1-CD1 3.73Å; L566-I583 HydrophobicContact CD1-CG1 3.9Å; L566-I583 HydrophobicContact CD1-CG2 4.12Å; L566-I583 HydrophobicContact CG-CD1 4.47Å; L566-I583 HydrophobicContact CG-CG1 4.26Å; L566-I611 HydrophobicContact CB-CG2 3.75Å; L566-I611 HydrophobicContact CD1-CG2 3.78Å; L566-I611 HydrophobicContact CG-CG2 4.25Å; L566-S612 CarbonylContact C-O 3.58Å; L566-S612 WeakPolarHBondContact CA-O 3.42Å; L566-T613 HydrophobicContact CD2-CG2 4.15Å
567	A	92.1	Very high	88.1	Confident	38 Å²	38	82 Å²	82	31%	0.314	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.5	170.7	0	0	0	0	0	109.6	I611 S612	A567-I611 WeakPolarHBondContact O-CA 3.4Å; A567-S612 PolarHBondContact N-O 2.98Å; A567-S612 PolarHBondContact O-N 3.06Å
568	L	92.3	Very high	89	Confident	12 Å²	12	80.4 Å²	80.4	6%	0.063	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132.4	-179	-71.2	79.2	0	0	0	109.7	L566 I577 P578 T579 L581 F590 V609 M610 I611	L566-L568 HydrophobicContact CB-CD1 4.39Å; L568-I577 HydrophobicContact CB-CD1 4.1Å; L568-P578 WeakPolarHBondContact CB-O 3.25Å; L568-T579 PolarHBondContact N-O 3.03Å; L568-L581 HydrophobicContact CD1-CB 3.55Å; L568-F590 HydrophobicContact CD2-CD1 4.26Å; L568-F590 HydrophobicContact CD2-CD2 4.22Å; L568-F590 HydrophobicContact CD2-CE1 3.88Å; L568-F590 HydrophobicContact CD2-CE2 3.84Å; L568-F590 HydrophobicContact CD2-CG 4.41Å; L568-F590 HydrophobicContact CD2-CZ 3.65Å; L568-V609 HydrophobicContact CB-CG1 4.43Å; L568-V609 HydrophobicContact CD2-CG1 4.18Å; L568-M610 WeakPolarHBondContact CA-O 3.18Å; L568-I611 HydrophobicContact CD2-CD1 4.3Å; L568-I611 HydrophobicContact CG-CD1 4.34Å; L568-I611 HydrophobicContact CG-CG1 4.11Å; L568-I611 HydrophobicContact CG-CG2 4.5Å
569	R	94.2	Very high	90.1	Very high	156 Å²	156	82.7 Å²	82.7	59%	0.589	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138	138.7	178.9	-179.2	178.9	166.1	-175.4	-9.1	110.7	E571 M610	R569-E571 IonicContact CZ-OE1 3.9Å; R569-E571 IonicContact NE-OE1 3.6Å; R569-E571 IonicContact NH2-OE1 3.61Å; R569-E571 PolarHBondContact NH2-OE1 3.37Å; R569-M610 HydrophobicContact CG-CE 4.27Å; R569-M610 PolarHBondContact N-O 3.4Å; R569-M610 PolarHBondContact O-N 3.23Å
570	C	93.7	Very high	90.9	Very high	28 Å²	28	83.3 Å²	83.3	19%	0.189	40%	0.398	C	S	.	.			trans	-136.3	136	168.9	-172.3	0	0	0	0	108.3	I577 E608 V609	C570-I577 HydrophobicContact CB-CD1 3.69Å; C570-I577 HydrophobicContact CB-CG1 4.32Å; C570-E608 WeakPolarHBondContact CA-O 3.49Å; C570-E608 PolarHBondContact SG-O 3.32Å; C570-V609 HydrophobicContact CB-CG2 4.46Å
571	E	93	Very high	91.4	Very high	142 Å²	142	74.9 Å²	74.9	66%	0.664	36%	0.361	S	S	*	.			trans	-87	-16.1	-177.5	-58.9	-167.7	151	0	0	112.9	R569 M610	R569-E571 IonicContact CZ-OE1 3.9Å; R569-E571 IonicContact NE-OE1 3.6Å; R569-E571 IonicContact NH2-OE1 3.61Å; R569-E571 PolarHBondContact NH2-OE1 3.37Å; E571-M610 HydrophobicContact CG-CE 4.03Å
572	A	94	Very high	91.7	Very high	18 Å²	18	72.7 Å²	72.7	15%	0.149	35%	0.351	C	S	.	.			trans	-83.2	121.3	-177.5	0	0	0	0	0	112	W574 V575 A607	A572-W574 HydrophobicContact CB-CD2 4.14Å; A572-W574 HydrophobicContact CB-CG 4.34Å; A572-W574 HydrophobicContact CB-CZ2 4.04Å; A572-W574 PolarHBondContact O-N 2.89Å; A572-V575 HydrophobicContact CB-CB 4.47Å; A572-V575 HydrophobicContact CB-CG2 4.1Å; A572-V575 PolarHBondContact O-N 3.01Å; A572-A607 HydrophobicContact CB-CB 3.47Å; A572-A607 VanDerWaalsContact CB-CB 3.47Å
573	E	94.2	Very high	91.9	Very high	190 Å²	190	71.2 Å²	71.2	89%	0.888	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-24.3	179.6	-61	-173.6	166.7	0	0	114	V575	E573-V575 PolarHBondContact O-N 2.82Å
574	W	95.5	Very high	91.9	Very high	46 Å²	46	73 Å²	73	17%	0.174	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-1.2	177.2	53.6	-93.2	0	0	0	113.3	A572 I594 D595 L599 H605 A607 I626 V628	A572-W574 HydrophobicContact CB-CD2 4.14Å; A572-W574 HydrophobicContact CB-CG 4.34Å; A572-W574 HydrophobicContact CB-CZ2 4.04Å; A572-W574 PolarHBondContact O-N 2.89Å; W574-I594 HydrophobicContact CE3-CG2 3.88Å; W574-I594 HydrophobicContact CZ3-CG2 3.87Å; W574-D595 WeakPolarHBondContact CB-O 3.37Å; W574-D595 PolarHBondContact O-N 3.44Å; W574-L599 HydrophobicContact CB-CD2 4.44Å; W574-L599 HydrophobicContact CD2-CD1 4.17Å; W574-L599 HydrophobicContact CD2-CD2 4.3Å; W574-L599 HydrophobicContact CE3-CD1 4.38Å; W574-L599 HydrophobicContact CG-CD1 4.45Å; W574-L599 HydrophobicContact CG-CD2 3.89Å; W574-H605 HydrophobicContact CZ2-CB 4.17Å; W574-A607 HydrophobicContact CH2-CB 3.48Å; W574-A607 VanDerWaalsContact CH2-CB 3.48Å; W574-A607 HydrophobicContact CZ2-CB 3.51Å; W574-A607 HydrophobicContact CZ3-CB 4.3Å; W574-I626 HydrophobicContact CH2-CG2 4.01Å; W574-I626 HydrophobicContact CZ3-CG2 3.81Å; W574-V628 HydrophobicContact CH2-CG2 4Å; W574-V628 HydrophobicContact CZ3-CG2 3.68Å
575	V	96	Very high	91.7	Very high	10 Å²	10	70 Å²	70	6%	0.061	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.4	172.6	-176.2	0	0	0	0	109.2	A572 E573 I577 R593 A607 I626	A572-V575 HydrophobicContact CB-CB 4.47Å; A572-V575 HydrophobicContact CB-CG2 4.1Å; A572-V575 PolarHBondContact O-N 3.01Å; E573-V575 PolarHBondContact O-N 2.82Å; V575-I577 HydrophobicContact CG1-CG2 4.1Å; V575-R593 WeakPolarHBondContact CA-O 3.11Å; V575-A607 HydrophobicContact CG2-CB 3.92Å; V575-I626 HydrophobicContact CG1-CD1 3.65Å; V575-I626 HydrophobicContact CG2-CD1 4.02Å
576	R	96.3	Very high	91.3	Very high	174 Å²	174	67.5 Å²	67.5	66%	0.657	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	130.6	173.1	-60.5	-176.5	-176.1	176	1.1	110.5	L592 R593	R576-L592 WeakPolarHBondContact O-CA 3.36Å; R576-R593 HydrophobicContact CB-CB 4.34Å; R576-R593 PolarHBondContact N-O 2.89Å; R576-R593 PolarHBondContact O-N 3.11Å
577	I	94.8	Very high	90.9	Very high	39 Å²	39	70.6 Å²	70.6	20%	0.2	36%	0.361	C	S	.	.			trans	-137.4	158.9	-178.8	54.8	171	0	0	0	110.3	L568 C570 V575 F590 L592 V609	L568-I577 HydrophobicContact CB-CD1 4.1Å; C570-I577 HydrophobicContact CB-CD1 3.69Å; C570-I577 HydrophobicContact CB-CG1 4.32Å; V575-I577 HydrophobicContact CG1-CG2 4.1Å; I577-F590 HydrophobicContact CG2-CE2 4.42Å; I577-L592 HydrophobicContact CG2-CB 3.8Å; I577-V609 HydrophobicContact CD1-CG1 3.82Å; I577-V609 HydrophobicContact CD1-CG2 4.41Å; I577-V609 HydrophobicContact CG2-CG1 4.46Å; I577-V609 HydrophobicContact CG2-CG2 3.86Å
578	P	95	Very high	90.6	Very high	48 Å²	48	73.7 Å²	73.7	31%	0.312	37%	0.365	S	S	.	.			trans	-66.1	159	162.9	30	-34.9	0	0	0	110.8	L568 F590	L568-P578 WeakPolarHBondContact CB-O 3.25Å; P578-F590 HydrophobicContact CG-CB 3.9Å; P578-F590 HydrophobicContact CG-CD2 3.8Å; P578-F590 HydrophobicContact CG-CG 4.08Å
579	T	94.1	Very high	90.5	Very high	96 Å²	96	75.9 Å²	75.9	59%	0.589	38%	0.381	S	S	*	.	S	Bend	trans	-86.8	-25.2	-179	55.4	0	0	0	0	113.8	L568	L568-T579 PolarHBondContact N-O 3.03Å
580	H	93.2	Very high	90.3	Very high	107 Å²	107	69 Å²	69	50%	0.495	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	148.9	-176.4	-59.5	79.8	0	0	0	111.7	L565 L566	L565-H580 HydrophobicContact CD1-CB 4.19Å; L566-H580 CarbonylContact O-C 3.54Å; L566-H580 VanDerWaalsContact O-CA 3.25Å; L566-H580 WeakPolarHBondContact O-CA 3.37Å
581	L	90.2	Very high	90.2	Very high	4 Å²	4	75.6 Å²	75.6	2%	0.021	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	112.4	174.7	-170.5	77.9	0	0	0	109.1	I542 L566 L568 I583 R588 F590	I542-L581 HydrophobicContact CB-CD2 4.33Å; I542-L581 HydrophobicContact CD1-CD2 3.77Å; I542-L581 HydrophobicContact CG1-CD2 4.37Å; L566-L581 WeakPolarHBondContact CA-O 3.46Å; L566-L581 VanDerWaalsContact CB-O 3.3Å; L566-L581 WeakPolarHBondContact CB-O 3.21Å; L566-L581 PolarHBondContact N-O 3.42Å; L566-L581 PolarHBondContact O-N 3.04Å; L568-L581 HydrophobicContact CD1-CB 3.55Å; L581-I583 HydrophobicContact CD2-CG2 3.73Å; L581-I583 HydrophobicContact CG-CG2 4.03Å; L581-R588 VanDerWaalsContact CD1-CD 3.43Å; L581-R588 HydrophobicContact CD1-CG 3.95Å; L581-R588 VanDerWaalsContact CD1-NE 3.28Å; L581-F590 HydrophobicContact CD1-CB 4.19Å; L581-F590 HydrophobicContact CD1-CD1 4.45Å; L581-F590 HydrophobicContact CD2-CD1 3.95Å; L581-F590 HydrophobicContact CD2-CE1 4.47Å
582	E	88.6	Confident	90.1	Very high	106 Å²	106	68.8 Å²	68.8	50%	0.495	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	119.7	166.2	-172.2	178.3	-173.3	0	0	110.5	S563 R564 L565 R588	S563-E582 PolarHBondContact OG-OE1 2.93Å; R564-E582 CarbonylContact O-C 3.46Å; R564-E582 WeakPolarHBondContact O-CA 3.38Å; L565-E582 HydrophobicContact CD1-CB 4.07Å; E582-R588 VanDerWaalsContact CA-NH1 3.35Å; E582-R588 WeakPolarHBondContact O-CD 3.28Å; E582-R588 PolarHBondContact O-NH1 3.39Å
583	I	86.5	Confident	90.2	Very high	13 Å²	13	72.8 Å²	72.8	7%	0.067	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	141.8	173.7	61.5	165.6	0	0	0	109.6	I542 F562 S563 R564 L566 L581 R588	I542-I583 HydrophobicContact CG2-CD1 4.35Å; I542-I583 HydrophobicContact CG2-CG2 4.12Å; F562-I583 HydrophobicContact CE1-CD1 4Å; F562-I583 HydrophobicContact CE1-CG1 4.15Å; F562-I583 HydrophobicContact CZ-CD1 4.23Å; S563-I583 CarbonylContact C-O 3.59Å; S563-I583 WeakPolarHBondContact CA-O 2.91Å; R564-I583 HydrophobicContact CB-CG1 3.98Å; R564-I583 PolarHBondContact N-O 3.36Å; R564-I583 PolarHBondContact O-N 2.86Å; L566-I583 HydrophobicContact CD1-CD1 3.73Å; L566-I583 HydrophobicContact CD1-CG1 3.9Å; L566-I583 HydrophobicContact CD1-CG2 4.12Å; L566-I583 HydrophobicContact CG-CD1 4.47Å; L566-I583 HydrophobicContact CG-CG1 4.26Å; L581-I583 HydrophobicContact CD2-CG2 3.73Å; L581-I583 HydrophobicContact CG-CG2 4.03Å; I583-R588 HydrophobicContact CG2-CB 4.28Å
584	N	84.6	Confident	90.2	Very high	84 Å²	84	63.7 Å²	63.7	45%	0.449	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	-165.8	167.8	51.2	10.9	0	0	0	108.6	F562 A586	F562-N584 VanDerWaalsContact O-CA 3.27Å; F562-N584 WeakPolarHBondContact O-CA 3.02Å; N584-A586 PolarHBondContact O-N 3.02Å; N584-A586 VanDerWaalsContact O-N 3.16Å; N584-A586 PolarHBondContact OD1-N 3.35Å; N584-A586 PolarHBondContact OD1-O 2.67Å
585	S	80.1	Confident	90.3	Very high	49 Å²	49	63.7 Å²	63.7	34%	0.343	32%	0.317	S	S	.	.	S	Bend	trans	-66.5	-10.9	178.7	62.8	0	0	0	0	113.8
586	A	80.1	Confident	90.2	Very high	46 Å²	46	63.3 Å²	63.3	38%	0.38	32%	0.315	S	S	.	.	S	Bend	trans	-94.1	149.1	177.6	0	0	0	0	0	111.1	N584 R588	N584-A586 PolarHBondContact O-N 3.02Å; N584-A586 VanDerWaalsContact O-N 3.16Å; N584-A586 PolarHBondContact OD1-N 3.35Å; N584-A586 PolarHBondContact OD1-O 2.67Å; A586-R588 PolarHBondContact O-N 3.26Å
587	P	80.6	Confident	90	Very high	76 Å²	76	58.4 Å²	58.4	49%	0.494	30%	0.304	S	S	.	.			trans	-57.1	132.1	173.5	-22.3	30.9	0	0	0	111.6	I542 E543	I542-P587 CarbonylContact O-C 3.35Å; I542-P587 WeakPolarHBondContact O-CA 3.46Å; E543-P587 HydrophobicContact CB-CB 4.24Å; E543-P587 HydrophobicContact CB-CG 4.24Å; E543-P587 HydrophobicContact CG-CB 4.46Å; E543-P587 HydrophobicContact CG-CG 3.93Å
588	R	86.5	Confident	89.9	Confident	103 Å²	103	67.4 Å²	67.4	39%	0.389	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139	173.2	-168.7	180	177	-179.4	4.8	110.3	I542 L581 E582 I583 A586	I542-R588 PolarHBondContact N-O 2.6Å; I542-R588 PolarHBondContact O-N 2.86Å; L581-R588 VanDerWaalsContact CD1-CD 3.43Å; L581-R588 HydrophobicContact CD1-CG 3.95Å; L581-R588 VanDerWaalsContact CD1-NE 3.28Å; E582-R588 VanDerWaalsContact CA-NH1 3.35Å; E582-R588 WeakPolarHBondContact O-CD 3.28Å; E582-R588 PolarHBondContact O-NH1 3.39Å; I583-R588 HydrophobicContact CG2-CB 4.28Å; A586-R588 PolarHBondContact O-N 3.26Å
589	S	88.5	Confident	89.9	Confident	58 Å²	58	66.2 Å²	66.2	41%	0.406	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	153	175.6	65.8	0	0	0	0	113.5	V540	V540-S589 CarbonylContact O-C 3.59Å; V540-S589 WeakPolarHBondContact O-CA 3.06Å; V540-S589 WeakPolarHBondContact O-CB 3.34Å
590	F	90.8	Very high	89.9	Confident	12 Å²	12	67.4 Å²	67.4	5%	0.053	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	163.9	161.1	69.2	-83.4	0	0	0	110.7	V540 I542 L568 I577 P578 L581 L592 I624	V540-F590 HydrophobicContact CB-CD1 4.17Å; V540-F590 HydrophobicContact CB-CE1 3.7Å; V540-F590 HydrophobicContact CB-CE2 4.26Å; V540-F590 HydrophobicContact CB-CZ 3.75Å; V540-F590 HydrophobicContact CG1-CD1 4.31Å; V540-F590 HydrophobicContact CG1-CE1 3.53Å; V540-F590 HydrophobicContact CG1-CZ 3.79Å; V540-F590 HydrophobicContact CG2-CE2 4.38Å; V540-F590 HydrophobicContact CG2-CZ 4.09Å; V540-F590 PolarHBondContact N-O 3.33Å; V540-F590 PolarHBondContact O-N 2.97Å; I542-F590 HydrophobicContact CD1-CD1 4.36Å; I542-F590 HydrophobicContact CD1-CE1 3.7Å; I542-F590 HydrophobicContact CG1-CE1 4.18Å; L568-F590 HydrophobicContact CD2-CD1 4.26Å; L568-F590 HydrophobicContact CD2-CD2 4.22Å; L568-F590 HydrophobicContact CD2-CE1 3.88Å; L568-F590 HydrophobicContact CD2-CE2 3.84Å; L568-F590 HydrophobicContact CD2-CG 4.41Å; L568-F590 HydrophobicContact CD2-CZ 3.65Å; I577-F590 HydrophobicContact CG2-CE2 4.42Å; P578-F590 HydrophobicContact CG-CB 3.9Å; P578-F590 HydrophobicContact CG-CD2 3.8Å; P578-F590 HydrophobicContact CG-CG 4.08Å; L581-F590 HydrophobicContact CD1-CB 4.19Å; L581-F590 HydrophobicContact CD1-CD1 4.45Å; L581-F590 HydrophobicContact CD2-CD1 3.95Å; L581-F590 HydrophobicContact CD2-CE1 4.47Å; F590-L592 HydrophobicContact CE2-CB 4.43Å; F590-I624 HydrophobicContact CE1-CD1 4.44Å; F590-I624 HydrophobicContact CZ-CD1 3.99Å
591	R	91	Very high	89.9	Confident	166 Å²	166	66.2 Å²	66.2	63%	0.626	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.2	176.8	-62	-171.1	-174.3	-170.6	3.2	110.2	E537 V538 V539	E537-R591 IonicContact OE2-NH1 2.71Å; E537-R591 PolarHBondContact OE2-NH1 2.95Å; V538-R591 WeakPolarHBondContact O-CA 3.44Å; V539-R591 HydrophobicContact CG2-CG 4.25Å
592	L	91.6	Very high	90	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.5	165.5	66.5	87.9	0	0	0	109.3	V524 E537 V538 V540 R576 I577 F590 I594 I626	V524-L592 HydrophobicContact CG2-CD2 4.42Å; E537-L592 WeakPolarHBondContact CA-O 3.33Å; V538-L592 HydrophobicContact CB-CD1 3.8Å; V538-L592 HydrophobicContact CB-CG 3.99Å; V538-L592 HydrophobicContact CG2-CD1 4.15Å; V538-L592 PolarHBondContact N-O 2.97Å; V538-L592 PolarHBondContact O-N 3.43Å; V540-L592 HydrophobicContact CG2-CD2 3.41Å; V540-L592 VanDerWaalsContact CG2-CD2 3.41Å; V540-L592 HydrophobicContact CG2-CG 4.28Å; R576-L592 WeakPolarHBondContact O-CA 3.36Å; I577-L592 HydrophobicContact CG2-CB 3.8Å; F590-L592 HydrophobicContact CE2-CB 4.43Å; L592-I594 HydrophobicContact CD1-CD1 3.43Å; L592-I594 VanDerWaalsContact CD1-CD1 3.43Å; L592-I594 HydrophobicContact CD1-CG1 3.48Å; L592-I594 VanDerWaalsContact CD1-CG1 3.48Å; L592-I626 HydrophobicContact CD1-CD1 4.36Å; L592-I626 HydrophobicContact CD2-CD1 4.33Å
593	R	95.6	Very high	90.2	Very high	101 Å²	101	67.1 Å²	67.1	38%	0.381	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	126.1	175.4	-177.3	-176.6	179.9	113.3	-1.5	109.1	S536 E537 V575 R576	S536-R593 WeakPolarHBondContact O-CA 3.12Å; E537-R593 HydrophobicContact CG-CB 4.26Å; E537-R593 HydrophobicContact CG-CG 4.25Å; E537-R593 IonicContact OE1-NH1 3.36Å; V575-R593 WeakPolarHBondContact CA-O 3.11Å; R576-R593 HydrophobicContact CB-CB 4.34Å; R576-R593 PolarHBondContact N-O 2.89Å; R576-R593 PolarHBondContact O-N 3.11Å
594	I	95.4	Very high	90.5	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.9	178.5	-62.6	163.6	0	0	0	107.5	V524 L526 P535 S536 V538 W574 L592 P596 I626 V628	V524-I594 HydrophobicContact CB-CD1 4.45Å; V524-I594 HydrophobicContact CG1-CD1 3.67Å; L526-I594 HydrophobicContact CD1-CB 4.46Å; L526-I594 HydrophobicContact CD1-CD1 4.38Å; L526-I594 HydrophobicContact CD1-CG2 3.93Å; P535-I594 CarbonylContact C-O 3.51Å; P535-I594 WeakPolarHBondContact CA-O 3.26Å; S536-I594 PolarHBondContact N-O 3.22Å; S536-I594 PolarHBondContact O-N 3.23Å; V538-I594 HydrophobicContact CG2-CD1 4.42Å; W574-I594 HydrophobicContact CE3-CG2 3.88Å; W574-I594 HydrophobicContact CZ3-CG2 3.87Å; L592-I594 HydrophobicContact CD1-CD1 3.43Å; L592-I594 VanDerWaalsContact CD1-CD1 3.43Å; L592-I594 HydrophobicContact CD1-CG1 3.48Å; L592-I594 VanDerWaalsContact CD1-CG1 3.48Å; I594-P596 WeakPolarHBondContact O-CD 3.28Å; I594-I626 HydrophobicContact CD1-CG2 3.63Å; I594-I626 HydrophobicContact CG1-CG2 4.18Å; I594-V628 HydrophobicContact CG2-CG2 4.06Å
595	D	96.5	Very high	91	Very high	46 Å²	46	66.1 Å²	66.1	25%	0.246	32%	0.323	C	S	.	.			trans	-114.7	89.9	176	-172	-7.8	0	0	0	110.9	P535 W574 T597	P535-D595 HydrophobicContact CB-CB 4.35Å; P535-D595 HydrophobicContact CG-CB 4.38Å; W574-D595 WeakPolarHBondContact CB-O 3.37Å; W574-D595 PolarHBondContact O-N 3.44Å; D595-T597 VanDerWaalsContact C-N 3.27Å; D595-T597 PolarHBondContact O-N 3.17Å; D595-T597 WeakPolarHBondContact OD1-CB 3.46Å; D595-T597 WeakPolarHBondContact OD1-CG2 3.26Å; D595-T597 PolarHBondContact OD1-N 3.31Å; D595-T597 PolarHBondContact OD1-OG1 3.07Å
596	P	94.6	Very high	91.7	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.013	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-81.6	-3.4	-176.8	32.9	-33.5	0	0	0	113.7	V532 I594 R598 L599 V628 I630	V532-P596 HydrophobicContact CB-CB 4.11Å; V532-P596 HydrophobicContact CB-CG 4.06Å; V532-P596 HydrophobicContact CG1-CB 4.44Å; V532-P596 WeakPolarHBondContact O-CG 3.47Å; I594-P596 WeakPolarHBondContact O-CD 3.28Å; P596-R598 PolarHBondContact O-N 3.08Å; P596-R598 VanDerWaalsContact O-N 3.09Å; P596-L599 HydrophobicContact CB-CD1 4.01Å; P596-L599 WeakPolarHBondContact O-CB 3.14Å; P596-L599 PolarHBondContact O-N 3.37Å; P596-V628 HydrophobicContact CB-CG1 3.83Å; P596-I630 HydrophobicContact CB-CD1 3.95Å
597	T	92.3	Very high	92.3	Very high	70 Å²	70	64.7 Å²	64.7	43%	0.429	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-65.6	-20.7	-165.3	60.6	0	0	0	0	114.9	P535 D595	P535-T597 HydrophobicContact CG-CG2 4.49Å; D595-T597 VanDerWaalsContact C-N 3.27Å; D595-T597 PolarHBondContact O-N 3.17Å; D595-T597 WeakPolarHBondContact OD1-CB 3.46Å; D595-T597 WeakPolarHBondContact OD1-CG2 3.26Å; D595-T597 PolarHBondContact OD1-N 3.31Å; D595-T597 PolarHBondContact OD1-OG1 3.07Å
598	R	92.7	Very high	92.8	Very high	228 Å²	228	62.4 Å²	62.4	86%	0.86	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-105.3	3.3	179.5	-58.1	-175.4	-173	-171.9	0.3	113.4	P596	P596-R598 PolarHBondContact O-N 3.08Å; P596-R598 VanDerWaalsContact O-N 3.09Å
599	L	95.2	Very high	93	Very high	24 Å²	24	57.5 Å²	57.5	13%	0.126	27%	0.266	C	S	.	.	S	Bend	trans	-77.4	144.7	-179	-65	-179.2	0	0	0	111	W574 P596 H605 V628 I630	W574-L599 HydrophobicContact CB-CD2 4.44Å; W574-L599 HydrophobicContact CD2-CD1 4.17Å; W574-L599 HydrophobicContact CD2-CD2 4.3Å; W574-L599 HydrophobicContact CE3-CD1 4.38Å; W574-L599 HydrophobicContact CG-CD1 4.45Å; W574-L599 HydrophobicContact CG-CD2 3.89Å; P596-L599 HydrophobicContact CB-CD1 4.01Å; P596-L599 WeakPolarHBondContact O-CB 3.14Å; P596-L599 PolarHBondContact O-N 3.37Å; L599-H605 HydrophobicContact CD1-CB 3.93Å; L599-V628 HydrophobicContact CD1-CB 4.24Å; L599-V628 HydrophobicContact CD1-CG1 3.98Å; L599-I630 HydrophobicContact CB-CD1 4.06Å; L599-I630 HydrophobicContact CB-CG1 3.73Å; L599-I630 HydrophobicContact CD1-CD1 4.34Å
600	E	93.9	Very high	93.1	Very high	121 Å²	121	56.9 Å²	56.9	57%	0.565	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-63.2	132.9	-179.8	-65.8	-173.7	171.5	0	0	111.8	R603 H605 I630	E600-R603 HydrophobicContact CB-CG 4.1Å; E600-R603 IonicContact OE2-NE 3.51Å; E600-H605 PolarHBondContact N-NE2 2.61Å; E600-H605 PolarHBondContact O-NE2 3.25Å; E600-I630 WeakPolarHBondContact O-CB 3.39Å
601	P	92.7	Very high	92.9	Very high	81 Å²	81	56.4 Å²	56.4	53%	0.526	26%	0.255	S	S	.	.	S	Bend	trans	-67.1	163.7	170.7	-19.9	32.6	0	0	0	114	R603 I630	P601-R603 WeakPolarHBondContact O-CG 3.23Å; P601-R603 PolarHBondContact O-N 2.88Å; P601-I630 CarbonylContact C-O 3.49Å; P601-I630 HydrophobicContact CB-CG2 4.08Å; P601-I630 HydrophobicContact CG-CG2 4.24Å
602	D	91.9	Very high	92.8	Very high	23 Å²	23	50 Å²	50	12%	0.123	24%	0.235	C	C	.	.	S	Bend	trans	58.5	30.2	-177.9	-162.5	39.9	0	0	0	113.6	I630 M632 H657 F658	D602-I630 PolarHBondContact N-O 2.85Å; D602-M632 HydrophobicContact CB-CB 4.19Å; D602-M632 HydrophobicContact CB-CG 4.49Å; D602-M632 HydrophobicContact CB-SD 4.47Å; D602-H657 WeakPolarHBondContact OD1-CA 3.4Å; D602-H657 IonicContact OD1-CG 2.98Å; D602-H657 IonicContact OD1-ND1 3.81Å; D602-H657 PolarHBondContact OD1-ND1 3.21Å; D602-H657 IonicContact OD2-CE1 2.93Å; D602-H657 IonicContact OD2-CG 3.78Å; D602-H657 IonicContact OD2-ND1 3.2Å; D602-H657 PolarHBondContact OD2-ND1 2.89Å; D602-F658 PolarHBondContact OD1-N 3.35Å
603	R	92.5	Very high	92.5	Very high	106 Å²	106	50.9 Å²	50.9	40%	0.4	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	154.3	-175.7	-65.6	-79.9	-174	-139.1	-4.2	110.5	E600 P601 I630 R655	E600-R603 HydrophobicContact CB-CG 4.1Å; E600-R603 IonicContact OE2-NE 3.51Å; P601-R603 WeakPolarHBondContact O-CG 3.23Å; P601-R603 PolarHBondContact O-N 2.88Å; R603-I630 PolarHBondContact O-N 3.43Å; R603-I630 VanDerWaalsContact O-N 3.1Å; R603-R655 VanDerWaalsContact NH1-NH2 3.19Å
604	V	93.3	Very high	91.8	Very high	44 Å²	44	52 Å²	52	27%	0.267	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	131.6	163.2	60.7	0	0	0	0	107.9	L369 F496 T627 V629 F658	L369-V604 HydrophobicContact CD1-CB 4.28Å; L369-V604 HydrophobicContact CD1-CG1 4.48Å; L369-V604 HydrophobicContact CD1-CG2 4.03Å; F496-V604 HydrophobicContact CE2-CG1 4.02Å; F496-V604 HydrophobicContact CE2-CG2 3.75Å; F496-V604 HydrophobicContact CZ-CG2 3.74Å; V604-T627 HydrophobicContact CG2-CG2 3.64Å; V604-V629 HydrophobicContact CB-CG2 4.18Å; V604-V629 HydrophobicContact CG2-CG2 3.94Å; V604-F658 HydrophobicContact CB-CE2 4.11Å; V604-F658 HydrophobicContact CB-CZ 4.32Å
605	H	95.2	Very high	91	Very high	33 Å²	33	57.1 Å²	57.1	15%	0.153	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	140	176.4	-60.9	-88.3	0	0	0	108.4	W574 L599 E600 V628	W574-H605 HydrophobicContact CZ2-CB 4.17Å; L599-H605 HydrophobicContact CD1-CB 3.93Å; E600-H605 PolarHBondContact N-NE2 2.61Å; E600-H605 PolarHBondContact O-NE2 3.25Å; H605-V628 HydrophobicContact CB-CB 4.46Å; H605-V628 PolarHBondContact N-O 2.64Å; H605-V628 PolarHBondContact O-N 3Å
606	Y	94.1	Very high	90	Very high	59 Å²	59	60.2 Å²	60.2	23%	0.231	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	137.6	-173.7	-175.4	-103.6	0	0	0	110.5	L421 V495 F496 E608 P625 I626	L421-Y606 WeakPolarHBondContact CD1-OH 3.25Å; L421-Y606 HydrophobicContact CD2-CE2 3.94Å; V495-Y606 HydrophobicContact CB-CE1 4.38Å; V495-Y606 HydrophobicContact CG1-CE1 4.28Å; V495-Y606 HydrophobicContact CG2-CD1 3.72Å; V495-Y606 HydrophobicContact CG2-CD2 4.16Å; V495-Y606 HydrophobicContact CG2-CE1 3.54Å; V495-Y606 HydrophobicContact CG2-CE2 3.99Å; V495-Y606 HydrophobicContact CG2-CG 4.01Å; F496-Y606 AromaticContact CE1-CD2 3.67Å; F496-Y606 HydrophobicContact CE1-CD2 3.67Å; F496-Y606 HydrophobicContact CE1-CE2 4.07Å; F496-Y606 HydrophobicContact CE1-CG 4.48Å; F496-Y606 AromaticContact CZ-CD2 3.55Å; F496-Y606 HydrophobicContact CZ-CD2 3.55Å; F496-Y606 HydrophobicContact CZ-CE2 4.38Å; F496-Y606 AromaticContact CZ-CG 4Å; F496-Y606 HydrophobicContact CZ-CG 4Å; Y606-E608 HydrophobicContact CE1-CG 3.52Å; Y606-E608 VanDerWaalsContact CE1-OE1 3.32Å; Y606-E608 WeakPolarHBondContact CE1-OE1 3.08Å; Y606-E608 VanDerWaalsContact CZ-OE1 3.29Å; Y606-E608 WeakPolarHBondContact OH-CG 3.45Å; Y606-E608 PolarHBondContact OH-OE1 3.23Å; Y606-P625 HydrophobicContact CE2-CB 3.86Å; Y606-P625 WeakPolarHBondContact OH-CB 3.42Å; Y606-I626 WeakPolarHBondContact CA-O 3.2Å
607	A	93.6	Very high	89.2	Confident	6 Å²	6	65.2 Å²	65.2	5%	0.05	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	159.2	171.7	0	0	0	0	0	109.8	A572 W574 V575 I626	A572-A607 HydrophobicContact CB-CB 3.47Å; A572-A607 VanDerWaalsContact CB-CB 3.47Å; W574-A607 HydrophobicContact CH2-CB 3.48Å; W574-A607 VanDerWaalsContact CH2-CB 3.48Å; W574-A607 HydrophobicContact CZ2-CB 3.51Å; W574-A607 HydrophobicContact CZ3-CB 4.3Å; V575-A607 HydrophobicContact CG2-CB 3.92Å; A607-I626 HydrophobicContact CB-CB 4.38Å; A607-I626 PolarHBondContact N-O 3.09Å; A607-I626 PolarHBondContact O-N 3.38Å
608	E	90.7	Very high	88.4	Confident	27 Å²	27	62.2 Å²	62.2	13%	0.126	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.8	171.1	-76	-179	-165.8	0	0	110.4	R500 C570 Y606 I624	R500-E608 IonicContact CZ-OE1 2.68Å; R500-E608 IonicContact CZ-OE2 3.39Å; R500-E608 IonicContact NH1-OE1 3.81Å; R500-E608 PolarHBondContact NH1-OE1 3.49Å; R500-E608 IonicContact NH1-OE2 3.82Å; R500-E608 PolarHBondContact NH1-OE2 3.12Å; R500-E608 IonicContact NH2-OE1 3.69Å; R500-E608 IonicContact NH2-OE2 3.07Å; R500-E608 PolarHBondContact NH2-OE2 3.2Å; C570-E608 WeakPolarHBondContact CA-O 3.49Å; C570-E608 PolarHBondContact SG-O 3.32Å; Y606-E608 HydrophobicContact CE1-CG 3.52Å; Y606-E608 VanDerWaalsContact CE1-OE1 3.32Å; Y606-E608 WeakPolarHBondContact CE1-OE1 3.08Å; Y606-E608 VanDerWaalsContact CZ-OE1 3.29Å; Y606-E608 WeakPolarHBondContact OH-CG 3.45Å; Y606-E608 PolarHBondContact OH-OE1 3.23Å; E608-I624 WeakPolarHBondContact CA-O 3.32Å
609	V	90.6	Very high	87.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	105	160.9	-177.6	0	0	0	0	107	L568 C570 I577 I611 C623 I624 I626	L568-V609 HydrophobicContact CB-CG1 4.43Å; L568-V609 HydrophobicContact CD2-CG1 4.18Å; C570-V609 HydrophobicContact CB-CG2 4.46Å; I577-V609 HydrophobicContact CD1-CG1 3.82Å; I577-V609 HydrophobicContact CD1-CG2 4.41Å; I577-V609 HydrophobicContact CG2-CG1 4.46Å; I577-V609 HydrophobicContact CG2-CG2 3.86Å; V609-I611 HydrophobicContact CG1-CD1 4.49Å; V609-I611 HydrophobicContact CG1-CG1 4.14Å; V609-C623 WeakPolarHBondContact O-CA 3.44Å; V609-I624 HydrophobicContact CB-CB 4.17Å; V609-I624 PolarHBondContact N-O 3.14Å; V609-I624 PolarHBondContact O-N 2.83Å; V609-I626 HydrophobicContact CG2-CD1 3.9Å
610	M	90	Very high	87.4	Confident	46 Å²	46	52.7 Å²	52.7	23%	0.227	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	125.1	174.5	-67.9	177	-76.8	0	0	109.1	L568 R569 E571 P620	L568-M610 WeakPolarHBondContact CA-O 3.18Å; R569-M610 HydrophobicContact CG-CE 4.27Å; R569-M610 PolarHBondContact N-O 3.4Å; R569-M610 PolarHBondContact O-N 3.23Å; E571-M610 HydrophobicContact CG-CE 4.03Å; M610-P620 HydrophobicContact CB-CB 4.19Å; M610-P620 HydrophobicContact CG-CB 4.47Å
611	I	87.9	Confident	86.8	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.6	-179.3	-51.9	-169.6	0	0	0	107.3	I542 L566 A567 L568 V609 P620 V621 L622 I624	I542-I611 HydrophobicContact CD1-CD1 3.48Å; I542-I611 VanDerWaalsContact CD1-CD1 3.48Å; L566-I611 HydrophobicContact CB-CG2 3.75Å; L566-I611 HydrophobicContact CD1-CG2 3.78Å; L566-I611 HydrophobicContact CG-CG2 4.25Å; A567-I611 WeakPolarHBondContact O-CA 3.4Å; L568-I611 HydrophobicContact CD2-CD1 4.3Å; L568-I611 HydrophobicContact CG-CD1 4.34Å; L568-I611 HydrophobicContact CG-CG1 4.11Å; L568-I611 HydrophobicContact CG-CG2 4.5Å; V609-I611 HydrophobicContact CG1-CD1 4.49Å; V609-I611 HydrophobicContact CG1-CG1 4.14Å; I611-P620 CarbonylContact O-C 3.53Å; I611-P620 WeakPolarHBondContact O-CA 3.07Å; I611-V621 VanDerWaalsContact O-CG2 3.31Å; I611-V621 WeakPolarHBondContact O-CG2 3.49Å; I611-V621 PolarHBondContact O-N 3.5Å; I611-L622 HydrophobicContact CB-CB 4.12Å; I611-L622 WeakPolarHBondContact CB-O 3.27Å; I611-L622 HydrophobicContact CD1-CD2 3.9Å; I611-L622 HydrophobicContact CD1-CG 4.18Å; I611-L622 PolarHBondContact N-O 3.49Å; I611-L622 PolarHBondContact O-N 3.43Å; I611-I624 HydrophobicContact CD1-CD1 3.96Å; I611-I624 HydrophobicContact CD1-CG1 4.38Å
612	S	88	Confident	86.3	Confident	31 Å²	31	44.4 Å²	44.4	22%	0.217	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	154.8	-176.2	-55.5	0	0	0	0	110.3	L566 A567	L566-S612 CarbonylContact C-O 3.58Å; L566-S612 WeakPolarHBondContact CA-O 3.42Å; A567-S612 PolarHBondContact N-O 2.98Å; A567-S612 PolarHBondContact O-N 3.06Å
613	T	85.1	Confident	85.9	Confident	19 Å²	19	44.1 Å²	44.1	12%	0.117	24%	0.235	C	C	.	.			trans	-83.5	-179.6	171.2	62.2	0	0	0	0	110.5	L517 L566 K615 L618 V621	L517-T613 HydrophobicContact CD1-CG2 4.21Å; L566-T613 HydrophobicContact CD2-CG2 4.15Å; T613-K615 PolarHBondContact O-N 3.4Å; T613-K615 VanDerWaalsContact O-N 3.13Å; T613-K615 PolarHBondContact OG1-N 3.42Å; T613-L618 WeakPolarHBondContact OG1-CD1 3.31Å; T613-V621 HydrophobicContact CG2-CG1 3.86Å; T613-V621 HydrophobicContact CG2-CG2 4.06Å
614	D	80.9	Confident	85.7	Confident	124 Å²	124	39.3 Å²	39.3	66%	0.663	22%	0.217	S	C	*	.	S	Bend	trans	-63	-6.8	170.7	64.6	-31.3	0	0	0	114.2	P616	D614-P616 WeakPolarHBondContact O-CD 3.48Å
615	K	79.3	Confident	85.5	Confident	108 Å²	108	37.4 Å²	37.4	47%	0.47	21%	0.206	S	C	.	.			trans	-109.6	94.2	176.8	-65	179.8	-175.7	-179.6	0	110.7	T613 I617 L618	T613-K615 PolarHBondContact O-N 3.4Å; T613-K615 VanDerWaalsContact O-N 3.13Å; T613-K615 PolarHBondContact OG1-N 3.42Å; K615-I617 HydrophobicContact CB-CG2 4.5Å; K615-I617 PolarHBondContact O-N 3.41Å; K615-L618 HydrophobicContact CB-CD1 3.86Å; K615-L618 HydrophobicContact CB-CG 4.23Å; K615-L618 HydrophobicContact CD-CD1 4.4Å; K615-L618 WeakPolarHBondContact O-CB 3.28Å; K615-L618 PolarHBondContact O-N 3.47Å; K615-L618 VanDerWaalsContact O-N 3.11Å
616	P	75.1	Confident	85.3	Confident	112 Å²	112	35.8 Å²	35.8	73%	0.727	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-59.3	-26	-175.9	-23.3	32.5	0	0	0	114.3	D614 L618 G619	D614-P616 WeakPolarHBondContact O-CD 3.48Å; P616-L618 PolarHBondContact O-N 2.99Å; P616-G619 PolarHBondContact O-N 3.02Å
617	I	77.5	Confident	85.3	Confident	107 Å²	107	33 Å²	33	55%	0.549	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-62.5	-21.8	-179.9	-165.5	162.4	0	0	0	113.3	F515 K615 G619	F515-I617 HydrophobicContact CE2-CG1 4.48Å; F515-I617 HydrophobicContact CE2-CG2 3.78Å; F515-I617 HydrophobicContact CZ-CG2 3.63Å; K615-I617 HydrophobicContact CB-CG2 4.5Å; K615-I617 PolarHBondContact O-N 3.41Å; I617-G619 PolarHBondContact O-N 3.34Å
618	L	75.6	Confident	85.4	Confident	6 Å²	6	32.7 Å²	32.7	3%	0.031	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-71.7	-18.4	174.5	-69.1	171.1	0	0	0	112.3	N485 Y511 F515 L517 T613 K615 P616	N485-L618 PolarHBondContact ND2-O 3.09Å; Y511-L618 PolarHBondContact OH-O 3.11Å; F515-L618 HydrophobicContact CB-CD2 3.3Å; F515-L618 HydrophobicContact CD1-CD2 3.73Å; F515-L618 HydrophobicContact CD2-CD2 3.29Å; F515-L618 HydrophobicContact CD2-CG 4.33Å; F515-L618 HydrophobicContact CE1-CD2 4.4Å; F515-L618 HydrophobicContact CE2-CD2 3.99Å; F515-L618 HydrophobicContact CG-CD2 3.14Å; F515-L618 HydrophobicContact CG-CG 4.3Å; L517-L618 HydrophobicContact CD1-CD1 3.56Å; L517-L618 HydrophobicContact CD1-CD2 4.45Å; T613-L618 WeakPolarHBondContact OG1-CD1 3.31Å; K615-L618 HydrophobicContact CB-CD1 3.86Å; K615-L618 HydrophobicContact CB-CG 4.23Å; K615-L618 HydrophobicContact CD-CD1 4.4Å; K615-L618 WeakPolarHBondContact O-CB 3.28Å; K615-L618 PolarHBondContact O-N 3.47Å; K615-L618 VanDerWaalsContact O-N 3.11Å; P616-L618 PolarHBondContact O-N 2.99Å
619	G	83	Confident	85.6	Confident	24 Å²	24	31.4 Å²	31.4	25%	0.247	18%	0.179	C	C	.	.			trans	64.9	-167.7	-164.4	0	0	0	0	0	111.6	P616 I617 V621	P616-G619 PolarHBondContact O-N 3.02Å; I617-G619 PolarHBondContact O-N 3.34Å; G619-V621 PolarHBondContact O-N 3.35Å
620	P	85.1	Confident	85.8	Confident	28 Å²	28	32.1 Å²	32.1	18%	0.182	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	131.4	177.1	29.2	-32.9	0	0	0	110.2	L481 N485 M610 I611 C623	L481-P620 WeakPolarHBondContact CD1-O 3.43Å; N485-P620 PolarHBondContact ND2-O 3.49Å; M610-P620 HydrophobicContact CB-CB 4.19Å; M610-P620 HydrophobicContact CG-CB 4.47Å; I611-P620 CarbonylContact O-C 3.53Å; I611-P620 WeakPolarHBondContact O-CA 3.07Å; P620-C623 VanDerWaalsContact CB-SG 3.6Å
621	V	81.1	Confident	85.9	Confident	14 Å²	14	30.1 Å²	30.1	9%	0.085	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-25.8	178.4	-63.9	0	0	0	0	112.2	L517 I611 T613 G619	L517-V621 HydrophobicContact CD1-CG1 3.64Å; I611-V621 VanDerWaalsContact O-CG2 3.31Å; I611-V621 WeakPolarHBondContact O-CG2 3.49Å; I611-V621 PolarHBondContact O-N 3.5Å; T613-V621 HydrophobicContact CG2-CG1 3.86Å; T613-V621 HydrophobicContact CG2-CG2 4.06Å; G619-V621 PolarHBondContact O-N 3.35Å
622	L	80.9	Confident	86.1	Confident	15 Å²	15	32 Å²	32	8%	0.079	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	141.3	175.5	169.4	62.2	0	0	0	108.5	D519 G520 I542 I611	D519-L622 WeakPolarHBondContact OD1-CD1 3.4Å; G520-L622 WeakPolarHBondContact O-CD1 3.42Å; G520-L622 VanDerWaalsContact O-CD2 3.31Å; G520-L622 WeakPolarHBondContact O-CD2 3.28Å; I542-L622 HydrophobicContact CD1-CD2 4.12Å; I542-L622 HydrophobicContact CG1-CD2 4.47Å; I611-L622 HydrophobicContact CB-CB 4.12Å; I611-L622 WeakPolarHBondContact CB-O 3.27Å; I611-L622 HydrophobicContact CD1-CD2 3.9Å; I611-L622 HydrophobicContact CD1-CG 4.18Å; I611-L622 PolarHBondContact N-O 3.49Å; I611-L622 PolarHBondContact O-N 3.43Å
623	C	85.3	Confident	86	Confident	16 Å²	16	36.1 Å²	36.1	11%	0.108	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	126.3	175.2	-68.6	0	0	0	0	109.9	R500 V609 P620 P625	R500-C623 PolarHBondContact NH2-SG 2.98Å; V609-C623 WeakPolarHBondContact O-CA 3.44Å; P620-C623 VanDerWaalsContact CB-SG 3.6Å; C623-P625 WeakPolarHBondContact O-CD 3.32Å
624	I	86.8	Confident	85.7	Confident	6 Å²	6	36.4 Å²	36.4	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	107.5	178.3	-53.1	175.4	0	0	0	107.9	V540 F590 E608 V609 I611	V540-I624 HydrophobicContact CG1-CD1 3.57Å; V540-I624 HydrophobicContact CG2-CD1 4.36Å; F590-I624 HydrophobicContact CE1-CD1 4.44Å; F590-I624 HydrophobicContact CZ-CD1 3.99Å; E608-I624 WeakPolarHBondContact CA-O 3.32Å; V609-I624 HydrophobicContact CB-CB 4.17Å; V609-I624 PolarHBondContact N-O 3.14Å; V609-I624 PolarHBondContact O-N 2.83Å; I611-I624 HydrophobicContact CD1-CD1 3.96Å; I611-I624 HydrophobicContact CD1-CG1 4.38Å
625	P	89.6	Confident	85.2	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.019	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	136.4	178.1	28.8	-32.8	0	0	0	110.5	W420 L421 G523 V524 Y606 C623	W420-P625 HydrophobicContact CE3-CG 3.79Å; W420-P625 HydrophobicContact CZ3-CG 4.07Å; L421-P625 HydrophobicContact CG-CB 4.03Å; L421-P625 HydrophobicContact CG-CG 4.34Å; G523-P625 CarbonylContact C-O 3.53Å; G523-P625 VanDerWaalsContact CA-O 3.23Å; G523-P625 WeakPolarHBondContact CA-O 3.47Å; V524-P625 PolarHBondContact N-O 3.27Å; Y606-P625 HydrophobicContact CE2-CB 3.86Å; Y606-P625 WeakPolarHBondContact OH-CB 3.42Å; C623-P625 WeakPolarHBondContact O-CD 3.32Å
626	I	92.1	Very high	84	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	113.5	173.7	-57.2	172.6	0	0	0	107.3	V524 W574 V575 L592 I594 Y606 A607 V609 V628	V524-I626 HydrophobicContact CB-CG1 4.25Å; V524-I626 HydrophobicContact CB-CG2 4.33Å; V524-I626 HydrophobicContact CG2-CG1 4.41Å; V524-I626 WeakPolarHBondContact O-CA 3.46Å; W574-I626 HydrophobicContact CH2-CG2 4.01Å; W574-I626 HydrophobicContact CZ3-CG2 3.81Å; V575-I626 HydrophobicContact CG1-CD1 3.65Å; V575-I626 HydrophobicContact CG2-CD1 4.02Å; L592-I626 HydrophobicContact CD1-CD1 4.36Å; L592-I626 HydrophobicContact CD2-CD1 4.33Å; I594-I626 HydrophobicContact CD1-CG2 3.63Å; I594-I626 HydrophobicContact CG1-CG2 4.18Å; Y606-I626 WeakPolarHBondContact CA-O 3.2Å; A607-I626 HydrophobicContact CB-CB 4.38Å; A607-I626 PolarHBondContact N-O 3.09Å; A607-I626 PolarHBondContact O-N 3.38Å; V609-I626 HydrophobicContact CG2-CD1 3.9Å; I626-V628 HydrophobicContact CG2-CG2 4.38Å
627	T	93.6	Very high	82.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	129.4	177.2	-53.2	0	0	0	0	110.1	P415 F496 V524 Y525 L526 V604	P415-T627 HydrophobicContact CG-CG2 3.84Å; F496-T627 HydrophobicContact CE1-CG2 3.79Å; F496-T627 WeakPolarHBondContact CE1-OG1 3.29Å; F496-T627 HydrophobicContact CZ-CG2 3.7Å; V524-T627 PolarHBondContact O-N 2.85Å; Y525-T627 WeakPolarHBondContact CA-O 3.18Å; Y525-T627 HydrophobicContact CD2-CG2 3.89Å; Y525-T627 HydrophobicContact CE2-CG2 3.86Å; L526-T627 PolarHBondContact N-O 2.85Å; V604-T627 HydrophobicContact CG2-CG2 3.64Å
628	V	95	Very high	81.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	122.7	176	-178.3	0	0	0	0	108.8	L526 V532 W574 I594 P596 L599 H605 I626 I630	L526-V628 HydrophobicContact CB-CG1 4.43Å; L526-V628 HydrophobicContact CB-CG2 4.38Å; L526-V628 HydrophobicContact CD1-CG2 4.26Å; L526-V628 CarbonylContact O-C 3.58Å; L526-V628 WeakPolarHBondContact O-CA 3.4Å; V532-V628 HydrophobicContact CG1-CG1 3.81Å; W574-V628 HydrophobicContact CH2-CG2 4Å; W574-V628 HydrophobicContact CZ3-CG2 3.68Å; I594-V628 HydrophobicContact CG2-CG2 4.06Å; P596-V628 HydrophobicContact CB-CG1 3.83Å; L599-V628 HydrophobicContact CD1-CB 4.24Å; L599-V628 HydrophobicContact CD1-CG1 3.98Å; H605-V628 HydrophobicContact CB-CB 4.46Å; H605-V628 PolarHBondContact N-O 2.64Å; H605-V628 PolarHBondContact O-N 3Å; I626-V628 HydrophobicContact CG2-CG2 4.38Å; V628-I630 HydrophobicContact CG1-CD1 3.57Å; V628-I630 HydrophobicContact CG1-CG1 4.34Å
629	V	94.5	Very high	80.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.6	171.2	170.7	0	0	0	0	108.3	Y525 L526 R527 V604 P631 F658 T714	Y525-V629 HydrophobicContact CE2-CG2 3.96Å; L526-V629 PolarHBondContact O-N 3.42Å; R527-V629 HydrophobicContact CG-CB 4.28Å; V604-V629 HydrophobicContact CB-CG2 4.18Å; V604-V629 HydrophobicContact CG2-CG2 3.94Å; V629-P631 VanDerWaalsContact O-CD 3.32Å; V629-P631 WeakPolarHBondContact O-CD 3.43Å; V629-F658 HydrophobicContact CG1-CB 3.67Å; V629-F658 HydrophobicContact CG1-CD1 3.39Å; V629-F658 HydrophobicContact CG1-CD2 3.91Å; V629-F658 HydrophobicContact CG1-CE1 3.93Å; V629-F658 HydrophobicContact CG1-CE2 4.39Å; V629-F658 HydrophobicContact CG1-CG 3.37Å; V629-F658 HydrophobicContact CG1-CZ 4.4Å; V629-F658 HydrophobicContact CG2-CD1 4.45Å; V629-F658 HydrophobicContact CG2-CE1 4.15Å; V629-F658 HydrophobicContact CG2-CZ 4.29Å; V629-T714 HydrophobicContact CG1-CG2 4.46Å
630	I	95.2	Very high	78.9	Confident	14 Å²	14	50 Å²	50	7%	0.072	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	103.3	175.3	-50.3	-62.1	0	0	0	108.2	V532 P596 L599 E600 P601 D602 R603 V628	V532-I630 HydrophobicContact CB-CD1 3.65Å; V532-I630 HydrophobicContact CG1-CD1 3.93Å; V532-I630 HydrophobicContact CG2-CD1 3.97Å; P596-I630 HydrophobicContact CB-CD1 3.95Å; L599-I630 HydrophobicContact CB-CD1 4.06Å; L599-I630 HydrophobicContact CB-CG1 3.73Å; L599-I630 HydrophobicContact CD1-CD1 4.34Å; E600-I630 WeakPolarHBondContact O-CB 3.39Å; P601-I630 CarbonylContact C-O 3.49Å; P601-I630 HydrophobicContact CB-CG2 4.08Å; P601-I630 HydrophobicContact CG-CG2 4.24Å; D602-I630 PolarHBondContact N-O 2.85Å; R603-I630 PolarHBondContact O-N 3.43Å; R603-I630 VanDerWaalsContact O-N 3.1Å; V628-I630 HydrophobicContact CG1-CD1 3.57Å; V628-I630 HydrophobicContact CG1-CG1 4.34Å
631	P	92.7	Very high	78.2	Confident	4 Å²	4	54.2 Å²	54.2	3%	0.026	28%	0.275	C	S	.	.			trans	-71.2	139.6	179.2	28.6	-33.2	0	0	0	111.1	L529 V629 F658 H660 T714	L529-P631 HydrophobicContact CB-CG 3.98Å; L529-P631 HydrophobicContact CD1-CG 4.12Å; V629-P631 VanDerWaalsContact O-CD 3.32Å; V629-P631 WeakPolarHBondContact O-CD 3.43Å; P631-F658 CarbonylContact C-O 3.52Å; P631-F658 VanDerWaalsContact CA-O 3.29Å; P631-F658 WeakPolarHBondContact CA-O 3.48Å; P631-H660 HydrophobicContact CB-CB 4.15Å; P631-H660 HydrophobicContact CG-CB 4.44Å; P631-T714 HydrophobicContact CB-CG2 3.81Å; P631-T714 HydrophobicContact CG-CG2 4.46Å
632	M	91.6	Very high	78.3	Confident	41 Å²	41	54.6 Å²	54.6	20%	0.202	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-69.3	145.3	164.4	68.4	177.6	-68.1	0	0	110.3	D602 L642 F658 I659 H660	D602-M632 HydrophobicContact CB-CB 4.19Å; D602-M632 HydrophobicContact CB-CG 4.49Å; D602-M632 HydrophobicContact CB-SD 4.47Å; M632-L642 HydrophobicContact CE-CD1 4.02Å; M632-L642 HydrophobicContact CE-CD2 3.48Å; M632-L642 VanDerWaalsContact CE-CD2 3.48Å; M632-L642 HydrophobicContact CE-CG 4.38Å; M632-L642 HydrophobicContact SD-CD1 4.29Å; M632-F658 WeakPolarHBondContact CG-O 3.44Å; M632-F658 PolarHBondContact N-O 2.68Å; M632-I659 HydrophobicContact CG-CB 4.27Å; M632-I659 HydrophobicContact CG-CG1 3.81Å; M632-I659 HydrophobicContact CG-CG2 4.29Å; M632-I659 HydrophobicContact SD-CG1 3.95Å; M632-H660 PolarHBondContact O-N 3.14Å
633	Q	87.2	Confident	78.5	Confident	117 Å²	117	56.9 Å²	56.9	55%	0.547	29%	0.293	S	S	.	.			trans	-105.4	113.1	175.2	-67.6	174.6	73.5	0	0	108.1	L529 K635 H660	L529-Q633 HydrophobicContact CD1-CG 4.06Å; L529-Q633 HydrophobicContact CD2-CG 3.84Å; Q633-K635 PolarHBondContact O-N 2.78Å; Q633-H660 HydrophobicContact CG-CB 4.34Å
634	P	78.2	Confident	78.5	Confident	26 Å²	26	57.9 Å²	57.9	17%	0.169	30%	0.296	C	S	.	.			trans	-57.8	136.3	167.4	-16.1	29	0	0	0	108.5	E636 L642 I659 H660 P662 F737	P634-E636 PolarHBondContact O-N 2.79Å; P634-L642 HydrophobicContact CG-CD1 4.49Å; P634-I659 HydrophobicContact CG-CG2 3.69Å; P634-H660 WeakPolarHBondContact CD-O 3.39Å; P634-P662 HydrophobicContact CB-CG 4.38Å; P634-P662 HydrophobicContact CG-CG 4.09Å; P634-F737 HydrophobicContact CG-CE2 4.46Å
635	K	69.7	Low	78.5	Confident	153 Å²	153	62.3 Å²	62.3	67%	0.665	32%	0.324	S	S	*	.			trans	-61	137.1	175.3	-69.8	179.2	178.9	175.7	0	108.9	Q633 C637	Q633-K635 PolarHBondContact O-N 2.78Å; K635-C637 PolarHBondContact O-N 2.83Å
636	E	54.1	Low	78.2	Confident	192 Å²	192	68.1 Å²	68.1	90%	0.897	35%	0.354	S	S	*	.	S	Bend	trans	-63	-5	-177.6	-64.9	-174.4	154.3	0	0	113.9	P634 V638	P634-E636 PolarHBondContact O-N 2.79Å; E636-V638 PolarHBondContact O-N 2.87Å; E636-V638 VanDerWaalsContact O-N 3.14Å
637	C	45.6	Very low	77.9	Confident	91 Å²	91	69.1 Å²	69.1	62%	0.615	36%	0.361	S	S	*	.	S	Bend	trans	-79.5	98.8	-177.6	-60	0	0	0	0	112	K635	K635-C637 PolarHBondContact O-N 2.83Å
638	V	47.7	Very low	77.4	Confident	96 Å²	96	73.9 Å²	73.9	58%	0.582	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	22.3	101.5	145.5	-164.1	0	0	0	0	115	E636	E636-V638 PolarHBondContact O-N 2.87Å; E636-V638 VanDerWaalsContact O-N 3.14Å
639	N	53	Low	76.7	Confident	113 Å²	113	74 Å²	74	60%	0.604	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	7.9	170.5	-58.2	-35.5	0	0	0	119.6	K641	N639-K641 PolarHBondContact O-N 2.87Å; N639-K641 VanDerWaalsContact O-N 3.13Å
640	E	58.1	Low	75.8	Confident	121 Å²	121	75.5 Å²	75.5	57%	0.565	40%	0.397	S	S	*	.			trans	-66.8	117.8	176	-99.3	-172.1	176.4	0	0	112.3
641	K	70.9	Confident	74.6	Confident	116 Å²	116	75.8 Å²	75.8	50%	0.504	40%	0.399	S	S	.	.			trans	-93.6	113	175.3	-50.3	-176.2	-175.3	173.2	0	107.7	N639 S643 R734 T736	N639-K641 PolarHBondContact O-N 2.87Å; N639-K641 VanDerWaalsContact O-N 3.13Å; K641-S643 PolarHBondContact O-N 2.91Å; K641-S643 PolarHBondContact O-OG 2.85Å; K641-S643 VanDerWaalsContact O-OG 3.05Å; K641-R734 HydrophobicContact CB-CG 3.79Å; K641-T736 HydrophobicContact CB-CG2 3.81Å; K641-T736 HydrophobicContact CD-CG2 3.99Å; K641-T736 HydrophobicContact CG-CG2 3.64Å
642	L	82	Confident	73.4	Confident	23 Å²	23	77.3 Å²	77.3	12%	0.12	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	111.5	174.4	-62.3	178	0	0	0	108	M632 P634 F644 I659 R734 I735 F737	M632-L642 HydrophobicContact CE-CD1 4.02Å; M632-L642 HydrophobicContact CE-CD2 3.48Å; M632-L642 VanDerWaalsContact CE-CD2 3.48Å; M632-L642 HydrophobicContact CE-CG 4.38Å; M632-L642 HydrophobicContact SD-CD1 4.29Å; P634-L642 HydrophobicContact CG-CD1 4.49Å; L642-F644 HydrophobicContact CB-CE2 3.89Å; L642-F644 HydrophobicContact CB-CZ 4.32Å; L642-I659 HydrophobicContact CD1-CD1 3.74Å; L642-I659 HydrophobicContact CD1-CG1 4.23Å; L642-I659 HydrophobicContact CD1-CG2 4.17Å; L642-R734 CarbonylContact O-C 3.53Å; L642-R734 WeakPolarHBondContact O-CA 3.36Å; L642-R734 WeakPolarHBondContact O-CG 3.21Å; L642-I735 HydrophobicContact CB-CB 4.28Å; L642-I735 PolarHBondContact N-O 3.37Å; L642-I735 PolarHBondContact O-N 3.09Å; L642-F737 HydrophobicContact CD1-CE2 4.15Å
643	S	85.5	Confident	72.4	Confident	62 Å²	62	76.4 Å²	76.4	43%	0.434	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	128.2	-175.8	-57.2	0	0	0	0	108.9	K641 R734	K641-S643 PolarHBondContact O-N 2.91Å; K641-S643 PolarHBondContact O-OG 2.85Å; K641-S643 VanDerWaalsContact O-OG 3.05Å; S643-R734 PolarHBondContact OG-NE 3.44Å; S643-R734 VanDerWaalsContact OG-NE 3.11Å
644	F	86.3	Confident	72.1	Confident	38 Å²	38	72.4 Å²	72.4	17%	0.167	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.6	178.8	-57	-87.7	0	0	0	107.6	L642 V647 H657 D732 Y733 I735	L642-F644 HydrophobicContact CB-CE2 3.89Å; L642-F644 HydrophobicContact CB-CZ 4.32Å; F644-V647 HydrophobicContact CB-CG2 3.76Å; F644-H657 AromaticContact CD1-CE1 3.49Å; F644-H657 VanDerWaalsContact CD1-CE1 3.49Å; F644-H657 WeakPolarHBondContact CD1-CE1 3.4Å; F644-H657 AromaticContact CD1-NE2 3.76Å; F644-H657 AromaticContact CE1-CE1 3.13Å; F644-H657 WeakPolarHBondContact CE1-CE1 3.39Å; F644-H657 AromaticContact CE1-ND1 3.52Å; F644-H657 AromaticContact CE1-NE2 3.7Å; F644-H657 AromaticContact CZ-CE1 3.64Å; F644-H657 AromaticContact CZ-CG 3.99Å; F644-H657 AromaticContact CZ-ND1 3.67Å; F644-H657 AromaticContact CZ-NE2 3.95Å; F644-D732 WeakPolarHBondContact O-CA 3.47Å; F644-Y733 HydrophobicContact CB-CD1 4.49Å; F644-Y733 HydrophobicContact CB-CD2 4.09Å; F644-Y733 HydrophobicContact CB-CE1 4.12Å; F644-Y733 HydrophobicContact CB-CE2 3.66Å; F644-Y733 HydrophobicContact CB-CG 4.48Å; F644-Y733 AromaticContact CD2-CD2 3.66Å; F644-Y733 HydrophobicContact CD2-CD2 3.66Å; F644-Y733 AromaticContact CD2-CE2 3.26Å; F644-Y733 HydrophobicContact CD2-CE2 3.26Å; F644-Y733 HydrophobicContact CE2-CE2 4.01Å; F644-Y733 HydrophobicContact CG-CD2 4.2Å; F644-Y733 AromaticContact CG-CE2 3.56Å; F644-Y733 HydrophobicContact CG-CE2 3.56Å; F644-Y733 AromaticContact CG-CZ 3.9Å; F644-Y733 PolarHBondContact N-O 2.69Å; F644-Y733 PolarHBondContact O-N 3.21Å; F644-I735 HydrophobicContact CE2-CD1 3.91Å; F644-I735 HydrophobicContact CE2-CG1 4.5Å
645	T	85.8	Confident	72.4	Confident	99 Å²	99	74.5 Å²	74.5	61%	0.607	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	144	-174.1	52.4	0	0	0	0	110.6	V647 D732	T645-V647 VanDerWaalsContact C-N 3.3Å; T645-V647 PolarHBondContact O-N 2.69Å; T645-D732 VanDerWaalsContact CA-OD1 3.24Å; T645-D732 WeakPolarHBondContact CA-OD1 3.38Å
646	N	84.4	Confident	73.2	Confident	124 Å²	124	68.3 Å²	68.3	66%	0.663	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.3	43.4	-179.5	-61.8	-44	0	0	0	112.9	L648 V730 D732	N646-L648 PolarHBondContact O-N 3Å; N646-V730 HydrophobicContact CB-CG1 4.18Å; N646-D732 PolarHBondContact N-OD1 2.94Å
647	V	84.2	Confident	74.9	Confident	22 Å²	22	59.3 Å²	59.3	13%	0.133	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	111.8	178.6	-177.5	0	0	0	0	109.3	F644 T645 L649 R655 V730 V731 Y733	F644-V647 HydrophobicContact CB-CG2 3.76Å; T645-V647 VanDerWaalsContact C-N 3.3Å; T645-V647 PolarHBondContact O-N 2.69Å; V647-L649 HydrophobicContact CG1-CD2 4.43Å; V647-R655 HydrophobicContact CG1-CB 4.22Å; V647-R655 HydrophobicContact CG1-CG 4Å; V647-V730 WeakPolarHBondContact O-CA 3.46Å; V647-V731 WeakPolarHBondContact CB-O 3.42Å; V647-V731 PolarHBondContact N-O 2.9Å; V647-V731 VanDerWaalsContact N-O 3.08Å; V647-V731 PolarHBondContact O-N 2.91Å; V647-Y733 HydrophobicContact CB-CE1 3.85Å; V647-Y733 HydrophobicContact CG1-CE1 4.05Å; V647-Y733 HydrophobicContact CG2-CE1 3.65Å
648	L	84.6	Confident	77	Confident	100 Å²	100	55.1 Å²	55.1	52%	0.524	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	124.4	173	-173.4	67.9	0	0	0	110.5	N646 E728 L729 V730	N646-L648 PolarHBondContact O-N 3Å; L648-E728 HydrophobicContact CD1-CB 3.95Å; L648-L729 CarbonylContact C-O 3.58Å; L648-V730 HydrophobicContact CD1-CG2 3.93Å
649	L	79	Confident	78.9	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	106.5	172	-63.5	176.6	0	0	0	108.4	V647 R655 F676 I719 L729 V731	V647-L649 HydrophobicContact CG1-CD2 4.43Å; L649-R655 HydrophobicContact CD2-CB 3.98Å; L649-F676 HydrophobicContact CD1-CB 3.92Å; L649-I719 HydrophobicContact CD1-CG2 3.67Å; L649-I719 HydrophobicContact CD2-CB 4.48Å; L649-I719 HydrophobicContact CD2-CG2 3.82Å; L649-I719 HydrophobicContact CG-CG2 4.38Å; L649-L729 HydrophobicContact CB-CB 4.4Å; L649-L729 PolarHBondContact N-O 3.12Å; L649-L729 PolarHBondContact O-N 3.1Å; L649-V731 HydrophobicContact CD1-CB 4.26Å; L649-V731 HydrophobicContact CD1-CG2 3.62Å; L649-V731 HydrophobicContact CG-CG2 4.39Å
650	S	77.1	Confident	80.7	Confident	32 Å²	32	46.8 Å²	46.8	22%	0.224	25%	0.253	C	S	.	.			trans	-70.2	159.9	173.2	71.5	0	0	0	0	111.3	S652 G653	S650-S652 PolarHBondContact O-N 2.65Å; S650-G653 PolarHBondContact O-N 3.11Å; S650-G653 VanDerWaalsContact OG-CA 3.24Å; S650-G653 WeakPolarHBondContact OG-CA 3.25Å; S650-G653 PolarHBondContact OG-N 3.44Å
651	V	68.6	Low	82	Confident	19 Å²	19	41.1 Å²	41.1	12%	0.115	23%	0.226	C	C	.	.	S	Bend	trans	-59.8	-31.2	-177.4	178.1	0	0	0	0	112.9	I403 A725 E728	I403-V651 HydrophobicContact CG2-CG1 4.04Å; V651-A725 WeakPolarHBondContact CG1-O 3.38Å; V651-E728 HydrophobicContact CG2-CG 4.49Å
652	S	67.5	Low	82.6	Confident	36 Å²	36	37.1 Å²	37.1	25%	0.252	21%	0.213	S	C	.	.	S	Bend	trans	-106.4	-13.7	-179.6	53.8	0	0	0	0	114	S650	S650-S652 PolarHBondContact O-N 2.65Å
653	G	71.4	Confident	82.7	Confident	23 Å²	23	44.1 Å²	44.1	24%	0.237	24%	0.242	C	C	.	.			trans	-90.4	168.3	-171.3	0	0	0	0	0	114.2	S650	S650-G653 PolarHBondContact O-N 3.11Å; S650-G653 VanDerWaalsContact OG-CA 3.24Å; S650-G653 WeakPolarHBondContact OG-CA 3.25Å; S650-G653 PolarHBondContact OG-N 3.44Å
654	C	79.5	Confident	82.2	Confident	32 Å²	32	42.2 Å²	42.2	22%	0.216	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	145.6	168	65.5	0	0	0	0	110.3	R656 I719 A720	C654-R656 PolarHBondContact SG-NH2 2.95Å; C654-I719 CarbonylContact C-O 3.51Å; C654-I719 WeakPolarHBondContact CA-O 3.35Å; C654-I719 WeakPolarHBondContact CB-O 3.45Å; C654-A720 HydrophobicContact CB-CB 3.83Å
655	R	85.5	Confident	81.9	Confident	70 Å²	70	40.5 Å²	40.5	26%	0.264	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	124.1	170.2	-165.8	59.2	-179.9	114.5	-0.8	110.5	R603 V647 L649 C718 I719	R603-R655 VanDerWaalsContact NH1-NH2 3.19Å; V647-R655 HydrophobicContact CG1-CB 4.22Å; V647-R655 HydrophobicContact CG1-CG 4Å; L649-R655 HydrophobicContact CD2-CB 3.98Å; R655-C718 CarbonylContact O-C 3.54Å; R655-C718 WeakPolarHBondContact O-CA 3.31Å; R655-I719 PolarHBondContact N-O 3.08Å; R655-I719 PolarHBondContact O-N 2.82Å
656	R	87.2	Confident	81.3	Confident	24 Å²	24	37.5 Å²	37.5	9%	0.091	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	141.5	-179.8	-59.3	170.1	-169.9	-80.1	-9.6	110.5	P367 E497 C654 F658 E716 I717 C718	P367-R656 PolarHBondContact O-NH1 2.85Å; P367-R656 PolarHBondContact O-NH2 3.05Å; E497-R656 IonicContact OE1-NH2 2.68Å; C654-R656 PolarHBondContact SG-NH2 2.95Å; R656-F658 HydrophobicContact CB-CE2 4.18Å; R656-F658 HydrophobicContact CB-CZ 4.37Å; R656-E716 IonicContact CZ-OE1 3.89Å; R656-E716 IonicContact NH1-OE1 3.92Å; R656-E716 PolarHBondContact NH1-OE1 2.87Å; R656-I717 CarbonylContact C-O 3.5Å; R656-I717 WeakPolarHBondContact CA-O 3.49Å; R656-C718 HydrophobicContact CG-CB 4.2Å
657	H	88.3	Confident	80.4	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.009	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.3	166	-64.2	-67.2	0	0	0	110.5	D602 F644 I659 E716 I717 Y733	D602-H657 WeakPolarHBondContact OD1-CA 3.4Å; D602-H657 IonicContact OD1-CG 2.98Å; D602-H657 IonicContact OD1-ND1 3.81Å; D602-H657 PolarHBondContact OD1-ND1 3.21Å; D602-H657 IonicContact OD2-CE1 2.93Å; D602-H657 IonicContact OD2-CG 3.78Å; D602-H657 IonicContact OD2-ND1 3.2Å; D602-H657 PolarHBondContact OD2-ND1 2.89Å; F644-H657 AromaticContact CD1-CE1 3.49Å; F644-H657 VanDerWaalsContact CD1-CE1 3.49Å; F644-H657 WeakPolarHBondContact CD1-CE1 3.4Å; F644-H657 AromaticContact CD1-NE2 3.76Å; F644-H657 AromaticContact CE1-CE1 3.13Å; F644-H657 WeakPolarHBondContact CE1-CE1 3.39Å; F644-H657 AromaticContact CE1-ND1 3.52Å; F644-H657 AromaticContact CE1-NE2 3.7Å; F644-H657 AromaticContact CZ-CE1 3.64Å; F644-H657 AromaticContact CZ-CG 3.99Å; F644-H657 AromaticContact CZ-ND1 3.67Å; F644-H657 AromaticContact CZ-NE2 3.95Å; H657-I659 HydrophobicContact CB-CD1 4.19Å; H657-I659 HydrophobicContact CB-CG1 4.25Å; H657-E716 CarbonylContact O-C 3.57Å; H657-E716 WeakPolarHBondContact O-CA 3.29Å; H657-I717 PolarHBondContact N-O 2.79Å; H657-I717 PolarHBondContact O-N 3.23Å; H657-Y733 AromaticContact CD2-CE2 3.91Å; H657-Y733 PolarHBondContact CD2-OH 2.83Å; H657-Y733 AromaticContact NE2-CE2 3.71Å; H657-Y733 AromaticContact NE2-CZ 3.57Å; H657-Y733 PolarHBondContact NE2-OH 2.88Å
658	F	90.4	Very high	79.2	Confident	3 Å²	3	30.8 Å²	30.8	1%	0.013	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	109.4	175	-61.1	-78.5	0	0	0	108.1	L369 D602 V604 V629 P631 M632 R656 T714 E716	L369-F658 HydrophobicContact CD1-CE1 4.14Å; L369-F658 HydrophobicContact CD1-CZ 3.69Å; L369-F658 HydrophobicContact CG-CZ 4.34Å; D602-F658 PolarHBondContact OD1-N 3.35Å; V604-F658 HydrophobicContact CB-CE2 4.11Å; V604-F658 HydrophobicContact CB-CZ 4.32Å; V629-F658 HydrophobicContact CG1-CB 3.67Å; V629-F658 HydrophobicContact CG1-CD1 3.39Å; V629-F658 HydrophobicContact CG1-CD2 3.91Å; V629-F658 HydrophobicContact CG1-CE1 3.93Å; V629-F658 HydrophobicContact CG1-CE2 4.39Å; V629-F658 HydrophobicContact CG1-CG 3.37Å; V629-F658 HydrophobicContact CG1-CZ 4.4Å; V629-F658 HydrophobicContact CG2-CD1 4.45Å; V629-F658 HydrophobicContact CG2-CE1 4.15Å; V629-F658 HydrophobicContact CG2-CZ 4.29Å; P631-F658 CarbonylContact C-O 3.52Å; P631-F658 VanDerWaalsContact CA-O 3.29Å; P631-F658 WeakPolarHBondContact CA-O 3.48Å; M632-F658 WeakPolarHBondContact CG-O 3.44Å; M632-F658 PolarHBondContact N-O 2.68Å; R656-F658 HydrophobicContact CB-CE2 4.18Å; R656-F658 HydrophobicContact CB-CZ 4.37Å; F658-T714 HydrophobicContact CB-CG2 4.25Å; F658-E716 HydrophobicContact CD1-CB 4.04Å; F658-E716 HydrophobicContact CD1-CG 4.02Å; F658-E716 HydrophobicContact CE1-CB 4.01Å; F658-E716 HydrophobicContact CE1-CG 3.63Å; F658-E716 HydrophobicContact CZ-CG 4.33Å
659	I	88.5	Confident	77.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	125.8	-171.3	-54.9	161.6	0	0	0	109	M632 P634 L642 H657 V661 A715 I717 I735 F737	M632-I659 HydrophobicContact CG-CB 4.27Å; M632-I659 HydrophobicContact CG-CG1 3.81Å; M632-I659 HydrophobicContact CG-CG2 4.29Å; M632-I659 HydrophobicContact SD-CG1 3.95Å; P634-I659 HydrophobicContact CG-CG2 3.69Å; L642-I659 HydrophobicContact CD1-CD1 3.74Å; L642-I659 HydrophobicContact CD1-CG1 4.23Å; L642-I659 HydrophobicContact CD1-CG2 4.17Å; H657-I659 HydrophobicContact CB-CD1 4.19Å; H657-I659 HydrophobicContact CB-CG1 4.25Å; I659-V661 PolarHBondContact O-N 2.99Å; I659-A715 PolarHBondContact N-O 3.35Å; I659-A715 PolarHBondContact O-N 3Å; I659-I717 HydrophobicContact CD1-CD1 4.16Å; I659-I735 HydrophobicContact CD1-CD1 3.95Å; I659-I735 HydrophobicContact CD1-CG2 4.37Å; I659-F737 HydrophobicContact CB-CZ 4.15Å; I659-F737 HydrophobicContact CD1-CE2 4.4Å; I659-F737 HydrophobicContact CD1-CZ 4.17Å; I659-F737 HydrophobicContact CG2-CE2 3.68Å; I659-F737 HydrophobicContact CG2-CZ 3.63Å
660	H	90	Very high	76.7	Confident	34 Å²	34	26.2 Å²	26.2	16%	0.157	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	115.9	169	-174.2	69.9	0	0	0	108.7	L529 P631 M632 Q633 P634 P662 G712	L529-H660 HydrophobicContact CD2-CB 4.34Å; P631-H660 HydrophobicContact CB-CB 4.15Å; P631-H660 HydrophobicContact CG-CB 4.44Å; M632-H660 PolarHBondContact O-N 3.14Å; Q633-H660 HydrophobicContact CG-CB 4.34Å; P634-H660 WeakPolarHBondContact CD-O 3.39Å; H660-P662 WeakPolarHBondContact O-CD 3.36Å; H660-G712 VanDerWaalsContact CE1-C 3.44Å; H660-G712 PolarHBondContact CE1-O 3.47Å; H660-G712 VanDerWaalsContact CE1-O 3.22Å
661	V	84.9	Confident	75.4	Confident	2 Å²	2	25.5 Å²	25.5	1%	0.012	14%	0.141	C	C	.	.	P	Polyproline II helix	trans	-69.8	123.6	-176	-179.4	0	0	0	0	109.1	I659 C665 V709 I710 G712 R713 A715 F737	I659-V661 PolarHBondContact O-N 2.99Å; V661-C665 HydrophobicContact CG1-CB 4.11Å; V661-V709 HydrophobicContact CG1-CB 3.99Å; V661-V709 HydrophobicContact CG1-CG2 3.67Å; V661-V709 HydrophobicContact CG2-CB 4.14Å; V661-V709 HydrophobicContact CG2-CG1 4.4Å; V661-I710 VanDerWaalsContact CB-O 3.26Å; V661-I710 WeakPolarHBondContact CB-O 3.39Å; V661-I710 WeakPolarHBondContact CG1-O 3.08Å; V661-G712 PolarHBondContact O-N 3.38Å; V661-R713 WeakPolarHBondContact CB-O 3.32Å; V661-R713 VanDerWaalsContact CG2-O 3.32Å; V661-R713 WeakPolarHBondContact CG2-O 3.35Å; V661-R713 PolarHBondContact N-O 3.17Å; V661-A715 HydrophobicContact CG2-CB 3.62Å; V661-F737 HydrophobicContact CG1-CD1 4.18Å; V661-F737 HydrophobicContact CG1-CE1 4.31Å; V661-F737 HydrophobicContact CG2-CE1 4.1Å
662	P	84.3	Confident	74.5	Confident	33 Å²	33	24.6 Å²	24.6	21%	0.214	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-58.4	149.8	179.1	-24.3	34	0	0	0	112.8	P634 H660 C665 F737	P634-P662 HydrophobicContact CB-CG 4.38Å; P634-P662 HydrophobicContact CG-CG 4.09Å; H660-P662 WeakPolarHBondContact O-CD 3.36Å; P662-C665 WeakPolarHBondContact O-CB 3.21Å; P662-C665 PolarHBondContact O-N 3.26Å; P662-F737 HydrophobicContact CG-CB 4.5Å; P662-F737 HydrophobicContact CG-CD2 4.49Å; P662-F737 HydrophobicContact CG-CG 4.49Å
663	K	82.9	Confident	72.9	Confident	169 Å²	169	28.7 Å²	28.7	74%	0.735	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	140.8	171.2	-66.7	-177.5	-178.7	175.3	0	110.4	C665 E711	K663-C665 VanDerWaalsContact C-N 3.33Å; K663-E711 WeakPolarHBondContact CA-OE2 3.2Å
664	G	76.7	Confident	71	Confident	22 Å²	22	30.4 Å²	30.4	23%	0.227	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	84	-4.1	-177	0	0	0	0	0	115.1	E711 G767	G664-E711 PolarHBondContact N-OE2 3.4Å; G664-G767 WeakPolarHBondContact O-CA 3.4Å
665	C	79.2	Confident	68.7	Low	2 Å²	2	30.6 Å²	30.6	1%	0.014	15%	0.149	C	C	.	.			trans	-98	131.9	-179.8	-64.4	0	0	0	0	112.2	V661 P662 K663 V709 F737	V661-C665 HydrophobicContact CG1-CB 4.11Å; P662-C665 WeakPolarHBondContact O-CB 3.21Å; P662-C665 PolarHBondContact O-N 3.26Å; K663-C665 VanDerWaalsContact C-N 3.33Å; C665-V709 HydrophobicContact CB-CG2 4.46Å; C665-F737 HydrophobicContact CB-CB 4.05Å
666	N	73.6	Confident	66.1	Low	36 Å²	36	27.4 Å²	27.4	19%	0.193	14%	0.137	C	C	.	.			trans	-128	0.4	173.6	69.4	-7.5	0	0	0	113.7	P708 V709 C738 G739 F740	N666-P708 CarbonylContact O-C 3.49Å; N666-P708 WeakPolarHBondContact O-CA 3.42Å; N666-V709 CarbonylContact C-O 2.92Å; N666-V709 VanDerWaalsContact CA-O 3.31Å; N666-V709 WeakPolarHBondContact CA-O 2.84Å; N666-V709 PolarHBondContact O-N 2.53Å; N666-C738 PolarHBondContact N-O 3.23Å; N666-G739 WeakPolarHBondContact OD1-CA 3.27Å; N666-F740 PolarHBondContact ND2-O 3.4Å; N666-F740 PolarHBondContact OD1-N 3.16Å
667	T	64.9	Low	63.5	Low	4 Å²	4	26.7 Å²	26.7	3%	0.025	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	138.9	172.6	-52.8	0	0	0	0	110.5	N706 I707 F737 C738 A967 C968	T667-N706 HydrophobicContact CG2-CB 4.08Å; T667-I707 CarbonylContact C-O 3.51Å; T667-I707 WeakPolarHBondContact CA-O 3.37Å; T667-F737 WeakPolarHBondContact O-CA 3.16Å; T667-C738 CarbonylContact C-O 3.59Å; T667-C738 WeakPolarHBondContact CA-O 3.35Å; T667-C738 PolarHBondContact N-O 2.88Å; T667-C738 PolarHBondContact O-N 2.67Å; T667-A967 HydrophobicContact CG2-CB 4.5Å; T667-C968 WeakPolarHBondContact OG1-CB 3.36Å; T667-C968 PolarHBondContact OG1-SG 3.48Å
668	A	59.9	Low	60.9	Low	1 Å²	1	27 Å²	27	1%	0.008	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	121.2	163.4	0	0	0	0	0	108.9	I707 V709 T736 F737	A668-I707 PolarHBondContact N-O 2.73Å; A668-I707 PolarHBondContact O-N 3.14Å; A668-V709 HydrophobicContact CB-CG1 3.6Å; A668-T736 CarbonylContact C-O 3.47Å; A668-T736 WeakPolarHBondContact CA-O 3.4Å; A668-F737 HydrophobicContact CB-CD1 3.86Å; A668-F737 HydrophobicContact CB-CE1 3.82Å
669	G	55.3	Low	58.1	Low	3 Å²	3	27.7 Å²	27.7	3%	0.031	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	122.4	166	0	0	0	0	0	110	F705 I735 T736	G669-F705 CarbonylContact C-O 3.5Å; G669-F705 VanDerWaalsContact CA-O 3.27Å; G669-F705 WeakPolarHBondContact CA-O 3.37Å; G669-I735 CarbonylContact O-C 3.57Å; G669-I735 WeakPolarHBondContact O-CA 3.01Å; G669-T736 PolarHBondContact N-O 3.28Å; G669-T736 PolarHBondContact O-N 2.86Å; G669-T736 PolarHBondContact O-OG1 2.73Å
670	A	54.8	Low	55.6	Low	3 Å²	3	28.3 Å²	28.3	3%	0.025	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	117	168.9	0	0	0	0	0	108.7	L678 T704 F705 I707 R734	A670-L678 HydrophobicContact CB-CD1 3.63Å; A670-L678 HydrophobicContact CB-CD2 4.36Å; A670-T704 CarbonylContact O-C 3.58Å; A670-T704 WeakPolarHBondContact O-CA 3.38Å; A670-F705 PolarHBondContact N-O 2.9Å; A670-F705 WeakPolarHBondContact O-CD2 3.37Å; A670-F705 PolarHBondContact O-N 3.26Å; A670-I707 HydrophobicContact CB-CD1 4.44Å; A670-R734 CarbonylContact C-O 3.57Å; A670-R734 WeakPolarHBondContact CA-O 3.31Å
671	S	51	Low	52.9	Low	17 Å²	17	26.7 Å²	26.7	12%	0.119	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.2	174.9	-46.3	0	0	0	0	109.2	F703 Y733 R734	S671-F703 CarbonylContact C-O 3.57Å; S671-F703 VanDerWaalsContact CA-O 3.3Å; S671-F703 WeakPolarHBondContact CA-O 3.5Å; S671-Y733 CarbonylContact O-C 3.54Å; S671-Y733 WeakPolarHBondContact O-CA 3.32Å; S671-R734 PolarHBondContact N-O 2.84Å; S671-R734 PolarHBondContact O-N 3.41Å
672	A	48.6	Very low	50.1	Low	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	163.7	179.7	0	0	0	0	0	113.6	F676 F703 D732	A672-F676 HydrophobicContact CB-CD1 3.99Å; A672-F676 HydrophobicContact CB-CE1 2.92Å; A672-F676 HydrophobicContact CB-CE2 4.1Å; A672-F676 HydrophobicContact CB-CZ 2.99Å; A672-F703 PolarHBondContact N-O 2.99Å; A672-F703 PolarHBondContact O-N 2.87Å; A672-D732 WeakPolarHBondContact CA-O 2.88Å
673	W	34.7	Very low	47.6	Very low	123 Å²	123	26.7 Å²	26.7	47%	0.466	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	116.8	-176.8	-49.5	89.8	0	0	0	106.5	K702 V731 D732	W673-K702 HydrophobicContact CD2-CB 4.2Å; W673-K702 HydrophobicContact CD2-CG 4.07Å; W673-K702 HydrophobicContact CE3-CB 3.73Å; W673-K702 HydrophobicContact CE3-CG 4.11Å; W673-K702 HydrophobicContact CH2-CB 3.83Å; W673-K702 HydrophobicContact CH2-CD 3.63Å; W673-K702 HydrophobicContact CH2-CG 3.88Å; W673-K702 HydrophobicContact CZ2-CB 4.26Å; W673-K702 HydrophobicContact CZ2-CD 3.53Å; W673-K702 HydrophobicContact CZ2-CG 3.8Å; W673-K702 HydrophobicContact CZ3-CB 3.55Å; W673-K702 HydrophobicContact CZ3-CD 4.26Å; W673-K702 HydrophobicContact CZ3-CG 4.03Å; W673-V731 WeakPolarHBondContact O-CG1 3.31Å; W673-D732 HydrophobicContact CB-CB 4.48Å; W673-D732 PolarHBondContact N-O 2.62Å
674	L	31.5	Very low	45.1	Very low	58 Å²	58	22.8 Å²	22.8	30%	0.304	12%	0.116	S	C	.	.	S	Bend	trans	72.9	168.6	-178.7	-66.1	136.9	0	0	0	116.6	F676 F697	L674-F676 WeakPolarHBondContact O-CD1 3.47Å; L674-F676 VanDerWaalsContact O-CE1 3.26Å; L674-F676 WeakPolarHBondContact O-CE1 3.28Å; L674-F697 VanDerWaalsContact C-CD1 3.41Å; L674-F697 VanDerWaalsContact CA-CD1 3.46Å; L674-F697 WeakPolarHBondContact O-CE1 3.38Å; L674-F697 WeakPolarHBondContact O-CZ 3.43Å
675	T	29.9	Very low	42.8	Very low	36 Å²	36	28.9 Å²	28.9	22%	0.221	14%	0.138	C	C	.	.			trans	-64.8	121.3	-152.5	-39.4	0	0	0	0	117.5	F697 V731	T675-F697 VanDerWaalsContact CA-CE2 3.47Å; T675-F697 HydrophobicContact CG2-CD2 3.75Å; T675-F697 HydrophobicContact CG2-CE2 4.25Å; T675-F697 WeakPolarHBondContact OG1-CB 3.06Å; T675-V731 WeakPolarHBondContact O-CG2 3.35Å
676	F	32.5	Very low	40.6	Very low	4 Å²	4	33 Å²	33	2%	0.018	17%	0.166	C	C	.	.			trans	-156.6	160.1	166.2	60.2	-73.8	0	0	0	112.8	L649 A672 L674 L678 F697 F705 I719 V731	L649-F676 HydrophobicContact CD1-CB 3.92Å; A672-F676 HydrophobicContact CB-CD1 3.99Å; A672-F676 HydrophobicContact CB-CE1 2.92Å; A672-F676 HydrophobicContact CB-CE2 4.1Å; A672-F676 HydrophobicContact CB-CZ 2.99Å; L674-F676 WeakPolarHBondContact O-CD1 3.47Å; L674-F676 VanDerWaalsContact O-CE1 3.26Å; L674-F676 WeakPolarHBondContact O-CE1 3.28Å; F676-L678 HydrophobicContact CD2-CB 4.18Å; F676-L678 HydrophobicContact CD2-CD1 4.25Å; F676-L678 HydrophobicContact CE2-CB 3.98Å; F676-L678 HydrophobicContact CE2-CD1 3.72Å; F676-L678 HydrophobicContact CE2-CG 4.47Å; F676-F697 HydrophobicContact CD1-CE2 4.46Å; F676-F697 AromaticContact CD1-CZ 3.89Å; F676-F697 HydrophobicContact CD1-CZ 3.89Å; F676-F697 AromaticContact CE1-CE1 3.91Å; F676-F697 HydrophobicContact CE1-CE1 3.91Å; F676-F697 HydrophobicContact CE1-CE2 4.33Å; F676-F697 AromaticContact CE1-CZ 3.39Å; F676-F697 HydrophobicContact CE1-CZ 3.39Å; F676-F697 HydrophobicContact CZ-CZ 4.06Å; F676-F705 HydrophobicContact CE2-CE2 4.34Å; F676-F705 HydrophobicContact CZ-CD2 4.46Å; F676-F705 AromaticContact CZ-CE2 3.85Å; F676-F705 HydrophobicContact CZ-CE2 3.85Å; F676-I719 HydrophobicContact CB-CG2 3.3Å; F676-I719 HydrophobicContact CD2-CD1 4.22Å; F676-I719 HydrophobicContact CD2-CG1 4.2Å; F676-I719 HydrophobicContact CD2-CG2 3.91Å; F676-I719 HydrophobicContact CG-CG2 3.79Å; F676-V731 HydrophobicContact CD1-CG1 3.56Å; F676-V731 HydrophobicContact CE1-CG1 4.21Å; F676-V731 HydrophobicContact CG-CG1 4.32Å
677	F	32.8	Very low	38.6	Very low	8 Å²	8	35.5 Å²	35.5	4%	0.035	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	144.6	163.5	-69	-105.2	0	0	0	109.2	Y679 L694 I719 A720 W722	F677-Y679 HydrophobicContact CB-CD2 3.67Å; F677-Y679 HydrophobicContact CB-CE2 3.17Å; F677-Y679 AromaticContact CD1-CE2 3.76Å; F677-Y679 HydrophobicContact CD1-CE2 3.76Å; F677-Y679 AromaticContact CD1-CZ 3.68Å; F677-Y679 WeakPolarHBondContact CD1-OH 3.01Å; F677-Y679 AromaticContact CG-CE2 3.7Å; F677-Y679 HydrophobicContact CG-CE2 3.7Å; F677-L694 HydrophobicContact CD1-CD1 4.4Å; F677-L694 HydrophobicContact CE1-CB 4.33Å; F677-L694 HydrophobicContact CE1-CD1 3.28Å; F677-L694 HydrophobicContact CE1-CG 4.41Å; F677-L694 HydrophobicContact CE2-CD1 4.14Å; F677-L694 HydrophobicContact CZ-CD1 3.1Å; F677-I719 WeakPolarHBondContact O-CA 3.41Å; F677-A720 WeakPolarHBondContact CD2-O 3.38Å; F677-A720 PolarHBondContact N-O 2.85Å; F677-A720 VanDerWaalsContact N-O 3.11Å; F677-W722 AromaticContact CE1-CE3 3.82Å; F677-W722 HydrophobicContact CE1-CE3 3.82Å; F677-W722 HydrophobicContact CE1-CZ3 4.13Å; F677-W722 VanDerWaalsContact CE2-CA 3.47Å; F677-W722 HydrophobicContact CE2-CB 3.59Å; F677-W722 HydrophobicContact CE2-CD2 4.43Å; F677-W722 AromaticContact CE2-CE3 3.97Å; F677-W722 HydrophobicContact CE2-CE3 3.97Å; F677-W722 HydrophobicContact CE2-CG 4.36Å; F677-W722 HydrophobicContact CZ-CB 3.88Å; F677-W722 AromaticContact CZ-CD2 3.83Å; F677-W722 HydrophobicContact CZ-CD2 3.83Å; F677-W722 AromaticContact CZ-CE3 3.17Å; F677-W722 HydrophobicContact CZ-CE3 3.17Å; F677-W722 HydrophobicContact CZ-CG 4.16Å; F677-W722 AromaticContact CZ-CZ3 3.93Å; F677-W722 HydrophobicContact CZ-CZ3 3.93Å
678	L	32.6	Very low	37.5	Very low	8 Å²	8	37.4 Å²	37.4	4%	0.042	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	115.1	169.3	-157.6	130	0	0	0	108.8	A670 F676 I707 I717 I719	A670-L678 HydrophobicContact CB-CD1 3.63Å; A670-L678 HydrophobicContact CB-CD2 4.36Å; F676-L678 HydrophobicContact CD2-CB 4.18Å; F676-L678 HydrophobicContact CD2-CD1 4.25Å; F676-L678 HydrophobicContact CE2-CB 3.98Å; F676-L678 HydrophobicContact CE2-CD1 3.72Å; F676-L678 HydrophobicContact CE2-CG 4.47Å; L678-I707 HydrophobicContact CD2-CD1 3.07Å; L678-I707 HydrophobicContact CD2-CG1 4.34Å; L678-I717 HydrophobicContact CD1-CG2 3.82Å; L678-I717 HydrophobicContact CD2-CG2 4.12Å; L678-I717 HydrophobicContact CG-CG2 3.87Å; L678-I719 HydrophobicContact CD1-CD1 4.28Å; L678-I719 HydrophobicContact CD1-CG1 4.29Å
679	Y	32.2	Very low	36.4	Very low	18 Å²	18	43.3 Å²	43.3	7%	0.071	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	140.2	-179.8	-65.8	-88.6	0	0	0	109.1	P367 C368 F677 K692 C718	P367-Y679 VanDerWaalsContact CD-CD1 3.49Å; P367-Y679 HydrophobicContact CG-CD1 4.35Å; P367-Y679 HydrophobicContact CG-CD2 3.2Å; P367-Y679 HydrophobicContact CG-CE2 3.45Å; P367-Y679 VanDerWaalsContact CG-CE2 3.45Å; P367-Y679 HydrophobicContact CG-CG 3.67Å; C368-Y679 VanDerWaalsContact SG-CB 3.57Å; C368-Y679 PolarHBondContact SG-O 3.02Å; F677-Y679 HydrophobicContact CB-CD2 3.67Å; F677-Y679 HydrophobicContact CB-CE2 3.17Å; F677-Y679 AromaticContact CD1-CE2 3.76Å; F677-Y679 HydrophobicContact CD1-CE2 3.76Å; F677-Y679 AromaticContact CD1-CZ 3.68Å; F677-Y679 WeakPolarHBondContact CD1-OH 3.01Å; F677-Y679 AromaticContact CG-CE2 3.7Å; F677-Y679 HydrophobicContact CG-CE2 3.7Å; Y679-K692 HydrophobicContact CD1-CD 4.47Å; Y679-K692 HydrophobicContact CD1-CG 3.92Å; Y679-K692 HydrophobicContact CE1-CB 4.39Å; Y679-K692 HydrophobicContact CE1-CD 3.94Å; Y679-K692 HydrophobicContact CE1-CG 3.76Å; Y679-C718 PolarHBondContact N-O 3.13Å; Y679-C718 PolarHBondContact O-N 2.84Å
680	R	35.6	Very low	36.1	Very low	13 Å²	13	48 Å²	48	5%	0.049	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	137.7	176.3	-179.9	165.7	162	-131.6	-29.3	112.2	C368 I707 P708 V709 E716	C368-R680 VanDerWaalsContact SG-C 3.57Å; R680-I707 HydrophobicContact CB-CG2 4.44Å; R680-P708 PolarHBondContact NH1-O 2.93Å; R680-P708 PolarHBondContact NH2-O 2.93Å; R680-V709 VanDerWaalsContact CZ-CG1 3.44Å; R680-V709 VanDerWaalsContact NH2-CA 3.3Å; R680-E716 VanDerWaalsContact CA-O 3.28Å; R680-E716 WeakPolarHBondContact CA-O 3.31Å; R680-E716 WeakPolarHBondContact CG-O 3.47Å
681	S	32.8	Very low	35.6	Very low	1 Å²	1	51 Å²	51	1%	0.007	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.6	159.5	80.7	0	0	0	0	108.6	R527 E716	R527-S681 PolarHBondContact NH2-O 2.64Å; R527-S681 PolarHBondContact NH2-OG 2.82Å; S681-E716 PolarHBondContact N-O 2.89Å; S681-E716 PolarHBondContact O-N 3.02Å; S681-E716 PolarHBondContact OG-OE2 3.01Å
682	A	27.3	Very low	35.6	Very low	4 Å²	4	55.1 Å²	55.1	3%	0.033	26%	0.257	C	S	.	.			trans	-125.7	128.3	161.4	0	0	0	0	0	105.7
683	L	31.5	Very low	35.7	Very low	30 Å²	30	56.8 Å²	56.8	16%	0.157	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	116	-176.8	-131.3	138.7	0	0	0	107.4	S370 Y525 R527	S370-L683 WeakPolarHBondContact OG-CD1 3.48Å; Y525-L683 HydrophobicContact CE1-CD1 4.1Å; R527-L683 VanDerWaalsContact NH1-CD1 3.32Å
684	F	29.1	Very low	36.6	Very low	88 Å²	88	56 Å²	56	39%	0.386	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	109.7	176	177.8	-88.6	0	0	0	107.2	C686 F687 I710	F684-C686 VanDerWaalsContact C-N 3.31Å; F684-C686 PolarHBondContact O-N 3.12Å; F684-F687 PolarHBondContact N-O 2.89Å; F684-F687 VanDerWaalsContact N-O 3.08Å; F684-F687 PolarHBondContact O-N 3.39Å; F684-I710 HydrophobicContact CB-CD1 4.24Å; F684-I710 HydrophobicContact CD2-CD1 4.05Å; F684-I710 HydrophobicContact CG-CD1 4.41Å
685	Q	30.2	Very low	37.7	Very low	150 Å²	150	54.3 Å²	54.3	70%	0.701	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	26.1	66.7	172.4	-79.6	179.2	-33.5	0	0	113	F687	Q685-F687 PolarHBondContact O-N 3.05Å
686	C	32.1	Very low	39	Very low	87 Å²	87	63.3 Å²	63.3	59%	0.588	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	-3.7	-179	-53	0	0	0	0	119.7	F684 E838	F684-C686 VanDerWaalsContact C-N 3.31Å; F684-C686 PolarHBondContact O-N 3.12Å; C686-E838 WeakPolarHBondContact CB-OE1 3.27Å
687	F	31.4	Very low	40.1	Very low	89 Å²	89	64.5 Å²	64.5	39%	0.39	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.3	177.7	-69.2	-87.6	0	0	0	113.8	F684 Q685 Y835	F684-F687 PolarHBondContact N-O 2.89Å; F684-F687 VanDerWaalsContact N-O 3.08Å; F684-F687 PolarHBondContact O-N 3.39Å; Q685-F687 PolarHBondContact O-N 3.05Å; F687-Y835 HydrophobicContact CZ-CD1 4.49Å; F687-Y835 HydrophobicContact CZ-CE1 4.35Å
688	I	42.7	Very low	41	Very low	45 Å²	45	66.1 Å²	66.1	23%	0.231	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	114.7	174.8	-58.4	166.3	0	0	0	108.8	S370 R690	S370-I688 WeakPolarHBondContact O-CD1 3.22Å; I688-R690 HydrophobicContact CB-CG 4.46Å; I688-R690 HydrophobicContact CG2-CG 3.74Å
689	W	36	Very low	42	Very low	124 Å²	124	72.6 Å²	72.6	47%	0.47	35%	0.354	S	S	.	.			trans	-77.6	121.3	170.3	-99.1	78.6	0	0	0	110.8	P708 I971	W689-P708 HydrophobicContact CE3-CG 4.01Å; W689-P708 HydrophobicContact CZ3-CG 3.95Å; W689-I971 HydrophobicContact CH2-CD1 3.85Å; W689-I971 HydrophobicContact CH2-CG1 4.32Å
690	R	48.5	Very low	43.2	Very low	102 Å²	102	80 Å²	80	39%	0.385	39%	0.39	S	S	.	.			trans	-121.5	125.7	-171.6	-59.4	175.7	-171.7	171.7	2.5	110.7	N365 I688	N365-R690 PolarHBondContact ND2-NH1 3.07Å; N365-R690 PolarHBondContact OD1-NH1 2.83Å; N365-R690 VanDerWaalsContact OD1-NH1 3.16Å; I688-R690 HydrophobicContact CB-CG 4.46Å; I688-R690 HydrophobicContact CG2-CG 3.74Å
691	V	45.4	Very low	44.3	Very low	65 Å²	65	82.2 Å²	82.2	39%	0.394	41%	0.405	S	S	.	.			trans	-126	120.9	164.7	-178.5	0	0	0	0	106.6
692	K	50.1	Low	45.9	Very low	104 Å²	104	87.5 Å²	87.5	45%	0.452	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.7	173.2	-67.2	-173.2	172.7	-178.5	0	107.5	N364 Y679	N364-K692 PolarHBondContact O-NZ 2.7Å; Y679-K692 HydrophobicContact CD1-CD 4.47Å; Y679-K692 HydrophobicContact CD1-CG 3.92Å; Y679-K692 HydrophobicContact CE1-CB 4.39Å; Y679-K692 HydrophobicContact CE1-CD 3.94Å; Y679-K692 HydrophobicContact CE1-CG 3.76Å
693	S	51.3	Low	47.7	Very low	35 Å²	35	90.6 Å²	90.6	25%	0.245	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.9	171.9	53.7	0	0	0	0	109.6
694	L	53.5	Low	49.5	Very low	108 Å²	108	93.1 Å²	93.1	57%	0.565	46%	0.457	S	S	*	.			trans	-87.4	127.2	168.1	175	71.8	0	0	0	108	F677	F677-L694 HydrophobicContact CD1-CD1 4.4Å; F677-L694 HydrophobicContact CE1-CB 4.33Å; F677-L694 HydrophobicContact CE1-CD1 3.28Å; F677-L694 HydrophobicContact CE1-CG 4.41Å; F677-L694 HydrophobicContact CE2-CD1 4.14Å; F677-L694 HydrophobicContact CZ-CD1 3.1Å
695	V	55	Low	51.4	Low	21 Å²	21	90.6 Å²	90.6	13%	0.127	45%	0.446	C	S	.	.			trans	-132.6	126.7	-178.8	-174.1	0	0	0	0	108.3	F697 F703 F705	V695-F697 HydrophobicContact CB-CD2 4.14Å; V695-F697 HydrophobicContact CB-CE2 3.55Å; V695-F697 HydrophobicContact CB-CZ 4.18Å; V695-F697 HydrophobicContact CG1-CD2 3.77Å; V695-F697 HydrophobicContact CG1-CE1 4.48Å; V695-F697 HydrophobicContact CG1-CE2 3.44Å; V695-F697 VanDerWaalsContact CG1-CE2 3.44Å; V695-F697 HydrophobicContact CG1-CG 4.5Å; V695-F697 HydrophobicContact CG1-CZ 3.83Å; V695-F697 WeakPolarHBondContact O-CD2 3.22Å; V695-F703 HydrophobicContact CG1-CD1 4.26Å; V695-F703 HydrophobicContact CG1-CD2 4.41Å; V695-F703 HydrophobicContact CG1-CE1 4.33Å; V695-F703 HydrophobicContact CG1-CE2 4.45Å; V695-F703 HydrophobicContact CG1-CG 4.29Å; V695-F703 HydrophobicContact CG1-CZ 4.42Å; V695-F705 HydrophobicContact CB-CZ 4.39Å; V695-F705 HydrophobicContact CG1-CZ 4.31Å; V695-F705 HydrophobicContact CG2-CE1 3.58Å; V695-F705 HydrophobicContact CG2-CZ 3.61Å
696	R	55.7	Low	53.3	Low	225 Å²	225	87.6 Å²	87.6	85%	0.849	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-93.7	125.2	171.2	-67.5	-178.2	-178	174.9	-0	107.2
697	F	56.2	Low	55.2	Low	29 Å²	29	83.9 Å²	83.9	13%	0.127	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-103.9	144	178.9	-62.5	-117.7	0	0	0	109.2	L674 T675 F676 V695 F703	L674-F697 VanDerWaalsContact C-CD1 3.41Å; L674-F697 VanDerWaalsContact CA-CD1 3.46Å; L674-F697 WeakPolarHBondContact O-CE1 3.38Å; L674-F697 WeakPolarHBondContact O-CZ 3.43Å; T675-F697 VanDerWaalsContact CA-CE2 3.47Å; T675-F697 HydrophobicContact CG2-CD2 3.75Å; T675-F697 HydrophobicContact CG2-CE2 4.25Å; T675-F697 WeakPolarHBondContact OG1-CB 3.06Å; F676-F697 HydrophobicContact CD1-CE2 4.46Å; F676-F697 AromaticContact CD1-CZ 3.89Å; F676-F697 HydrophobicContact CD1-CZ 3.89Å; F676-F697 AromaticContact CE1-CE1 3.91Å; F676-F697 HydrophobicContact CE1-CE1 3.91Å; F676-F697 HydrophobicContact CE1-CE2 4.33Å; F676-F697 AromaticContact CE1-CZ 3.39Å; F676-F697 HydrophobicContact CE1-CZ 3.39Å; F676-F697 HydrophobicContact CZ-CZ 4.06Å; V695-F697 HydrophobicContact CB-CD2 4.14Å; V695-F697 HydrophobicContact CB-CE2 3.55Å; V695-F697 HydrophobicContact CB-CZ 4.18Å; V695-F697 HydrophobicContact CG1-CD2 3.77Å; V695-F697 HydrophobicContact CG1-CE1 4.48Å; V695-F697 HydrophobicContact CG1-CE2 3.44Å; V695-F697 VanDerWaalsContact CG1-CE2 3.44Å; V695-F697 HydrophobicContact CG1-CG 4.5Å; V695-F697 HydrophobicContact CG1-CZ 3.83Å; V695-F697 WeakPolarHBondContact O-CD2 3.22Å; F697-F703 AromaticContact CD1-CD2 3.45Å; F697-F703 HydrophobicContact CD1-CD2 3.45Å; F697-F703 VanDerWaalsContact CD1-CD2 3.45Å; F697-F703 AromaticContact CD1-CE2 3.67Å; F697-F703 HydrophobicContact CD1-CE2 3.67Å; F697-F703 HydrophobicContact CE1-CB 4.23Å; F697-F703 AromaticContact CE1-CD2 3.36Å; F697-F703 HydrophobicContact CE1-CD2 3.36Å; F697-F703 HydrophobicContact CE1-CE2 4.05Å; F697-F703 HydrophobicContact CE1-CG 4.12Å; F697-F703 HydrophobicContact CG-CD2 4.33Å; F697-F703 HydrophobicContact CG-CE2 4.2Å; F697-F703 HydrophobicContact CZ-CD2 4.19Å
698	G	52.9	Low	57.1	Low	43 Å²	43	81.5 Å²	81.5	44%	0.443	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-103.1	161.6	156.4	0	0	0	0	0	108.8	E700 T701	G698-E700 PolarHBondContact O-N 2.92Å; G698-T701 PolarHBondContact O-N 3.17Å; G698-T701 PolarHBondContact O-OG1 3.41Å
699	D	52.8	Low	58.6	Low	143 Å²	143	79.9 Å²	79.9	77%	0.765	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	136	179.6	-61.5	-30.5	0	0	0	111.2	T701	D699-T701 PolarHBondContact O-N 3.4Å
700	E	57.9	Low	60.5	Low	175 Å²	175	76.6 Å²	76.6	82%	0.818	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	7.2	175.4	-50.4	-168.5	158.2	0	0	119.2	G698	G698-E700 PolarHBondContact O-N 2.92Å
701	T	59.1	Low	62.1	Low	59 Å²	59	74.7 Å²	74.7	36%	0.362	38%	0.381	S	S	.	.			trans	-89.6	123.2	179.9	44.9	0	0	0	0	113.9	G698 D699 F703	G698-T701 PolarHBondContact O-N 3.17Å; G698-T701 PolarHBondContact O-OG1 3.41Å; D699-T701 PolarHBondContact O-N 3.4Å; T701-F703 VanDerWaalsContact OG1-CE2 3.32Å; T701-F703 WeakPolarHBondContact OG1-CE2 3.48Å
702	K	65.6	Low	63.9	Low	111 Å²	111	72.9 Å²	72.9	48%	0.483	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	126.2	173	-167.1	-172.6	-177	-180	0	110.9	W673	W673-K702 HydrophobicContact CD2-CB 4.2Å; W673-K702 HydrophobicContact CD2-CG 4.07Å; W673-K702 HydrophobicContact CE3-CB 3.73Å; W673-K702 HydrophobicContact CE3-CG 4.11Å; W673-K702 HydrophobicContact CH2-CB 3.83Å; W673-K702 HydrophobicContact CH2-CD 3.63Å; W673-K702 HydrophobicContact CH2-CG 3.88Å; W673-K702 HydrophobicContact CZ2-CB 4.26Å; W673-K702 HydrophobicContact CZ2-CD 3.53Å; W673-K702 HydrophobicContact CZ2-CG 3.8Å; W673-K702 HydrophobicContact CZ3-CB 3.55Å; W673-K702 HydrophobicContact CZ3-CD 4.26Å; W673-K702 HydrophobicContact CZ3-CG 4.03Å
703	F	65.8	Low	65.6	Low	70 Å²	70	71 Å²	71	31%	0.307	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	146.3	171.4	-68.9	-90.8	0	0	0	111.1	S671 A672 V695 F697 T701 F705	S671-F703 CarbonylContact C-O 3.57Å; S671-F703 VanDerWaalsContact CA-O 3.3Å; S671-F703 WeakPolarHBondContact CA-O 3.5Å; A672-F703 PolarHBondContact N-O 2.99Å; A672-F703 PolarHBondContact O-N 2.87Å; V695-F703 HydrophobicContact CG1-CD1 4.26Å; V695-F703 HydrophobicContact CG1-CD2 4.41Å; V695-F703 HydrophobicContact CG1-CE1 4.33Å; V695-F703 HydrophobicContact CG1-CE2 4.45Å; V695-F703 HydrophobicContact CG1-CG 4.29Å; V695-F703 HydrophobicContact CG1-CZ 4.42Å; F697-F703 AromaticContact CD1-CD2 3.45Å; F697-F703 HydrophobicContact CD1-CD2 3.45Å; F697-F703 VanDerWaalsContact CD1-CD2 3.45Å; F697-F703 AromaticContact CD1-CE2 3.67Å; F697-F703 HydrophobicContact CD1-CE2 3.67Å; F697-F703 HydrophobicContact CE1-CB 4.23Å; F697-F703 AromaticContact CE1-CD2 3.36Å; F697-F703 HydrophobicContact CE1-CD2 3.36Å; F697-F703 HydrophobicContact CE1-CE2 4.05Å; F697-F703 HydrophobicContact CE1-CG 4.12Å; F697-F703 HydrophobicContact CG-CD2 4.33Å; F697-F703 HydrophobicContact CG-CE2 4.2Å; F697-F703 HydrophobicContact CZ-CD2 4.19Å; T701-F703 VanDerWaalsContact OG1-CE2 3.32Å; T701-F703 WeakPolarHBondContact OG1-CE2 3.48Å; F703-F705 HydrophobicContact CB-CE2 3.78Å; F703-F705 HydrophobicContact CB-CZ 3.6Å; F703-F705 HydrophobicContact CG-CZ 4.39Å
704	T	68.5	Low	67.4	Low	82 Å²	82	69.3 Å²	69.3	50%	0.503	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	131.3	175.8	-55.1	0	0	0	0	109.4	A670	A670-T704 CarbonylContact O-C 3.58Å; A670-T704 WeakPolarHBondContact O-CA 3.38Å
705	F	70	Confident	68.9	Low	36 Å²	36	64.2 Å²	64.2	16%	0.158	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.7	179.2	-50.5	-81.3	0	0	0	109.1	G669 A670 F676 V695 F703	G669-F705 CarbonylContact C-O 3.5Å; G669-F705 VanDerWaalsContact CA-O 3.27Å; G669-F705 WeakPolarHBondContact CA-O 3.37Å; A670-F705 PolarHBondContact N-O 2.9Å; A670-F705 WeakPolarHBondContact O-CD2 3.37Å; A670-F705 PolarHBondContact O-N 3.26Å; F676-F705 HydrophobicContact CE2-CE2 4.34Å; F676-F705 HydrophobicContact CZ-CD2 4.46Å; F676-F705 AromaticContact CZ-CE2 3.85Å; F676-F705 HydrophobicContact CZ-CE2 3.85Å; V695-F705 HydrophobicContact CB-CZ 4.39Å; V695-F705 HydrophobicContact CG1-CZ 4.31Å; V695-F705 HydrophobicContact CG2-CE1 3.58Å; V695-F705 HydrophobicContact CG2-CZ 3.61Å; F703-F705 HydrophobicContact CB-CE2 3.78Å; F703-F705 HydrophobicContact CB-CZ 3.6Å; F703-F705 HydrophobicContact CG-CZ 4.39Å
706	N	69.2	Low	70.5	Confident	87 Å²	87	63.2 Å²	63.2	47%	0.465	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	132.9	172.9	-66	-32.6	0	0	0	109.2	T667	T667-N706 HydrophobicContact CG2-CB 4.08Å
707	I	72.4	Confident	71.7	Confident	9 Å²	9	52.5 Å²	52.5	5%	0.046	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	125.7	-170.6	-38.4	165.8	0	0	0	109.2	T667 A668 A670 L678 R680 V709	T667-I707 CarbonylContact C-O 3.51Å; T667-I707 WeakPolarHBondContact CA-O 3.37Å; A668-I707 PolarHBondContact N-O 2.73Å; A668-I707 PolarHBondContact O-N 3.14Å; A670-I707 HydrophobicContact CB-CD1 4.44Å; L678-I707 HydrophobicContact CD2-CD1 3.07Å; L678-I707 HydrophobicContact CD2-CG1 4.34Å; R680-I707 HydrophobicContact CB-CG2 4.44Å; I707-V709 PolarHBondContact O-N 3.14Å
708	P	70.6	Confident	73	Confident	39 Å²	39	51.1 Å²	51.1	25%	0.253	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	105.5	-172	27	-34.4	0	0	0	113.1	N666 R680 W689	N666-P708 CarbonylContact O-C 3.49Å; N666-P708 WeakPolarHBondContact O-CA 3.42Å; R680-P708 PolarHBondContact NH1-O 2.93Å; R680-P708 PolarHBondContact NH2-O 2.93Å; W689-P708 HydrophobicContact CE3-CG 4.01Å; W689-P708 HydrophobicContact CZ3-CG 3.95Å
709	V	73.5	Confident	74.3	Confident	10 Å²	10	49.1 Å²	49.1	6%	0.061	25%	0.254	C	S	.	.			trans	-91.9	161.2	-178.2	-62.7	0	0	0	0	114.4	V661 C665 N666 A668 R680 I707 F737	V661-V709 HydrophobicContact CG1-CB 3.99Å; V661-V709 HydrophobicContact CG1-CG2 3.67Å; V661-V709 HydrophobicContact CG2-CB 4.14Å; V661-V709 HydrophobicContact CG2-CG1 4.4Å; C665-V709 HydrophobicContact CB-CG2 4.46Å; N666-V709 CarbonylContact C-O 2.92Å; N666-V709 VanDerWaalsContact CA-O 3.31Å; N666-V709 WeakPolarHBondContact CA-O 2.84Å; N666-V709 PolarHBondContact O-N 2.53Å; A668-V709 HydrophobicContact CB-CG1 3.6Å; R680-V709 VanDerWaalsContact CZ-CG1 3.44Å; R680-V709 VanDerWaalsContact NH2-CA 3.3Å; I707-V709 PolarHBondContact O-N 3.14Å; V709-F737 HydrophobicContact CG1-CD1 4.47Å; V709-F737 HydrophobicContact CG1-CE1 4.16Å; V709-F737 HydrophobicContact CG2-CD1 4.19Å
710	I	77.4	Confident	75.5	Confident	56 Å²	56	42.3 Å²	42.3	29%	0.287	22%	0.218	S	C	.	.			trans	-113.4	123.6	172.6	-56.4	176.4	0	0	0	107.1	V661 F684 R713	V661-I710 VanDerWaalsContact CB-O 3.26Å; V661-I710 WeakPolarHBondContact CB-O 3.39Å; V661-I710 WeakPolarHBondContact CG1-O 3.08Å; F684-I710 HydrophobicContact CB-CD1 4.24Å; F684-I710 HydrophobicContact CD2-CD1 4.05Å; F684-I710 HydrophobicContact CG-CD1 4.41Å; I710-R713 HydrophobicContact CB-CB 4.49Å; I710-R713 HydrophobicContact CB-CG 4.34Å; I710-R713 HydrophobicContact CG2-CG 3.9Å
711	E	81.3	Confident	76.2	Confident	61 Å²	61	34.2 Å²	34.2	29%	0.285	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	148.3	177.3	60.7	174.2	165.8	0	0	112.9	K663 G664 R713 R741	K663-E711 WeakPolarHBondContact CA-OE2 3.2Å; G664-E711 PolarHBondContact N-OE2 3.4Å; E711-R713 PolarHBondContact O-N 2.82Å; E711-R713 VanDerWaalsContact O-N 3.09Å; E711-R741 IonicContact OE1-CZ 3.23Å; E711-R741 IonicContact OE1-NH1 2.86Å; E711-R741 PolarHBondContact OE1-NH1 2.78Å
712	G	83	Confident	76.9	Confident	27 Å²	27	35.8 Å²	35.8	28%	0.278	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	5.6	175	0	0	0	0	0	115.1	H660 V661	H660-G712 VanDerWaalsContact CE1-C 3.44Å; H660-G712 PolarHBondContact CE1-O 3.47Å; H660-G712 VanDerWaalsContact CE1-O 3.22Å; V661-G712 PolarHBondContact O-N 3.38Å
713	R	85.3	Confident	77.2	Confident	64 Å²	64	31 Å²	31	24%	0.242	16%	0.159	C	C	.	.	S	Bend	trans	-111.9	160.9	176	-65.2	-64	-164.4	178.6	1.9	111	V661 I710 E711	V661-R713 WeakPolarHBondContact CB-O 3.32Å; V661-R713 VanDerWaalsContact CG2-O 3.32Å; V661-R713 WeakPolarHBondContact CG2-O 3.35Å; V661-R713 PolarHBondContact N-O 3.17Å; I710-R713 HydrophobicContact CB-CB 4.49Å; I710-R713 HydrophobicContact CB-CG 4.34Å; I710-R713 HydrophobicContact CG2-CG 3.9Å; E711-R713 PolarHBondContact O-N 2.82Å; E711-R713 VanDerWaalsContact O-N 3.09Å
714	T	89.1	Confident	77.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	113.8	177.2	-57.8	0	0	0	0	110.9	R527 E528 V629 P631 F658	R527-T714 PolarHBondContact O-OG1 3.09Å; E528-T714 WeakPolarHBondContact OE2-CB 3.35Å; E528-T714 PolarHBondContact OE2-N 3.49Å; E528-T714 PolarHBondContact OE2-OG1 2.81Å; V629-T714 HydrophobicContact CG1-CG2 4.46Å; P631-T714 HydrophobicContact CB-CG2 3.81Å; P631-T714 HydrophobicContact CG-CG2 4.46Å; F658-T714 HydrophobicContact CB-CG2 4.25Å
715	A	85.2	Confident	77.6	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.008	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	127.2	171.8	0	0	0	0	0	110.3	I659 V661	I659-A715 PolarHBondContact N-O 3.35Å; I659-A715 PolarHBondContact O-N 3Å; V661-A715 HydrophobicContact CG2-CB 3.62Å
716	E	88.4	Confident	77.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	125.1	167	-177.8	-174.2	-172.3	0	0	109.3	C368 L369 R656 H657 F658 R680 S681	C368-E716 WeakPolarHBondContact CA-OE1 3.5Å; C368-E716 WeakPolarHBondContact CA-OE2 3.45Å; C368-E716 WeakPolarHBondContact CB-OE2 3.22Å; L369-E716 VanDerWaalsContact N-CD 3.33Å; L369-E716 PolarHBondContact N-OE1 2.84Å; L369-E716 PolarHBondContact N-OE2 2.79Å; R656-E716 IonicContact CZ-OE1 3.89Å; R656-E716 IonicContact NH1-OE1 3.92Å; R656-E716 PolarHBondContact NH1-OE1 2.87Å; H657-E716 CarbonylContact O-C 3.57Å; H657-E716 WeakPolarHBondContact O-CA 3.29Å; F658-E716 HydrophobicContact CD1-CB 4.04Å; F658-E716 HydrophobicContact CD1-CG 4.02Å; F658-E716 HydrophobicContact CE1-CB 4.01Å; F658-E716 HydrophobicContact CE1-CG 3.63Å; F658-E716 HydrophobicContact CZ-CG 4.33Å; R680-E716 VanDerWaalsContact CA-O 3.28Å; R680-E716 WeakPolarHBondContact CA-O 3.31Å; R680-E716 WeakPolarHBondContact CG-O 3.47Å; S681-E716 PolarHBondContact N-O 2.89Å; S681-E716 PolarHBondContact O-N 3.02Å; S681-E716 PolarHBondContact OG-OE2 3.01Å
717	I	82.7	Confident	77.7	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	110	172.3	-65.8	175.5	0	0	0	107.6	R656 H657 I659 L678 I719 I735	R656-I717 CarbonylContact C-O 3.5Å; R656-I717 WeakPolarHBondContact CA-O 3.49Å; H657-I717 PolarHBondContact N-O 2.79Å; H657-I717 PolarHBondContact O-N 3.23Å; I659-I717 HydrophobicContact CD1-CD1 4.16Å; L678-I717 HydrophobicContact CD1-CG2 3.82Å; L678-I717 HydrophobicContact CD2-CG2 4.12Å; L678-I717 HydrophobicContact CG-CG2 3.87Å; I717-I719 HydrophobicContact CG2-CG1 4.48Å; I717-I735 HydrophobicContact CB-CD1 4.38Å; I717-I735 HydrophobicContact CD1-CD1 3.71Å; I717-I735 HydrophobicContact CD1-CG1 4.27Å; I717-I735 HydrophobicContact CD1-CG2 3.9Å; I717-I735 HydrophobicContact CG2-CD1 4.06Å
718	C	83.5	Confident	78	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	130.9	-176.9	-176	0	0	0	0	110.9	P367 R655 R656 Y679	P367-C718 HydrophobicContact CG-CB 4.37Å; P367-C718 VanDerWaalsContact CG-SG 3.57Å; R655-C718 CarbonylContact O-C 3.54Å; R655-C718 WeakPolarHBondContact O-CA 3.31Å; R656-C718 HydrophobicContact CG-CB 4.2Å; Y679-C718 PolarHBondContact N-O 3.13Å; Y679-C718 PolarHBondContact O-N 2.84Å
719	I	79.3	Confident	78.2	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	121.5	-175.4	-61.6	-178.1	0	0	0	108.4	L649 C654 R655 F676 F677 L678 I717 Y733	L649-I719 HydrophobicContact CD1-CG2 3.67Å; L649-I719 HydrophobicContact CD2-CB 4.48Å; L649-I719 HydrophobicContact CD2-CG2 3.82Å; L649-I719 HydrophobicContact CG-CG2 4.38Å; C654-I719 CarbonylContact C-O 3.51Å; C654-I719 WeakPolarHBondContact CA-O 3.35Å; C654-I719 WeakPolarHBondContact CB-O 3.45Å; R655-I719 PolarHBondContact N-O 3.08Å; R655-I719 PolarHBondContact O-N 2.82Å; F676-I719 HydrophobicContact CB-CG2 3.3Å; F676-I719 HydrophobicContact CD2-CD1 4.22Å; F676-I719 HydrophobicContact CD2-CG1 4.2Å; F676-I719 HydrophobicContact CD2-CG2 3.91Å; F676-I719 HydrophobicContact CG-CG2 3.79Å; F677-I719 WeakPolarHBondContact O-CA 3.41Å; L678-I719 HydrophobicContact CD1-CD1 4.28Å; L678-I719 HydrophobicContact CD1-CG1 4.29Å; I717-I719 HydrophobicContact CG2-CG1 4.48Å; I719-Y733 HydrophobicContact CD1-CD1 3.77Å; I719-Y733 HydrophobicContact CD1-CD2 3.66Å; I719-Y733 HydrophobicContact CD1-CE1 3.53Å; I719-Y733 HydrophobicContact CD1-CE2 3.42Å; I719-Y733 VanDerWaalsContact CD1-CE2 3.42Å; I719-Y733 HydrophobicContact CD1-CG 3.83Å
720	A	77.7	Confident	78.5	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	159.2	-177.4	0	0	0	0	0	110.3	P367 C654 F677	P367-A720 HydrophobicContact CG-CB 4.29Å; C654-A720 HydrophobicContact CB-CB 3.83Å; F677-A720 WeakPolarHBondContact CD2-O 3.38Å; F677-A720 PolarHBondContact N-O 2.85Å; F677-A720 VanDerWaalsContact N-O 3.11Å
721	S	73.6	Confident	78.5	Confident	4 Å²	4	39.2 Å²	39.2	3%	0.028	20%	0.203	C	C	.	.			trans	-80.2	159.9	168.1	-169.8	0	0	0	0	111.1	A725	S721-A725 WeakPolarHBondContact OG-CB 3.45Å
722	W	73.2	Confident	78.5	Confident	93 Å²	93	39.1 Å²	39.1	35%	0.352	21%	0.205	S	C	.	.			trans	-71.1	135	168.4	-174.5	-126.9	0	0	0	108.3	F677 M724 A725	F677-W722 AromaticContact CE1-CE3 3.82Å; F677-W722 HydrophobicContact CE1-CE3 3.82Å; F677-W722 HydrophobicContact CE1-CZ3 4.13Å; F677-W722 VanDerWaalsContact CE2-CA 3.47Å; F677-W722 HydrophobicContact CE2-CB 3.59Å; F677-W722 HydrophobicContact CE2-CD2 4.43Å; F677-W722 AromaticContact CE2-CE3 3.97Å; F677-W722 HydrophobicContact CE2-CE3 3.97Å; F677-W722 HydrophobicContact CE2-CG 4.36Å; F677-W722 HydrophobicContact CZ-CB 3.88Å; F677-W722 AromaticContact CZ-CD2 3.83Å; F677-W722 HydrophobicContact CZ-CD2 3.83Å; F677-W722 AromaticContact CZ-CE3 3.17Å; F677-W722 HydrophobicContact CZ-CE3 3.17Å; F677-W722 HydrophobicContact CZ-CG 4.16Å; F677-W722 AromaticContact CZ-CZ3 3.93Å; F677-W722 HydrophobicContact CZ-CZ3 3.93Å; W722-M724 PolarHBondContact O-N 2.81Å; W722-A725 WeakPolarHBondContact O-CB 3.24Å; W722-A725 PolarHBondContact O-N 2.93Å
723	W	72.3	Confident	78.5	Confident	11 Å²	11	38.2 Å²	38.2	4%	0.042	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-16.7	-173	65.4	-90	0	0	0	115	L388 Y397 M406 F408 P409 W410	L388-W723 HydrophobicContact CD2-CE3 4.49Å; L388-W723 HydrophobicContact CD2-CZ3 4.48Å; Y397-W723 AromaticContact CD1-CH2 3.38Å; Y397-W723 HydrophobicContact CD1-CH2 3.38Å; Y397-W723 HydrophobicContact CD1-CZ2 4.35Å; Y397-W723 HydrophobicContact CD1-CZ3 4.1Å; Y397-W723 AromaticContact CD2-CH2 3.91Å; Y397-W723 HydrophobicContact CD2-CH2 3.91Å; Y397-W723 AromaticContact CD2-CZ3 3.79Å; Y397-W723 HydrophobicContact CD2-CZ3 3.79Å; Y397-W723 AromaticContact CE1-CH2 3.33Å; Y397-W723 HydrophobicContact CE1-CH2 3.33Å; Y397-W723 HydrophobicContact CE1-CZ2 4.04Å; Y397-W723 HydrophobicContact CE1-CZ3 4.17Å; Y397-W723 AromaticContact CE2-CH2 3.91Å; Y397-W723 HydrophobicContact CE2-CH2 3.91Å; Y397-W723 AromaticContact CE2-CZ3 3.9Å; Y397-W723 HydrophobicContact CE2-CZ3 3.9Å; Y397-W723 AromaticContact CG-CH2 3.62Å; Y397-W723 HydrophobicContact CG-CH2 3.62Å; Y397-W723 AromaticContact CG-CZ3 3.86Å; Y397-W723 HydrophobicContact CG-CZ3 3.86Å; Y397-W723 AromaticContact CZ-CH2 3.6Å; M406-W723 HydrophobicContact CE-CB 3.61Å; M406-W723 HydrophobicContact SD-CB 4Å; F408-W723 HydrophobicContact CD1-CD2 4.18Å; F408-W723 HydrophobicContact CD1-CG 4.2Å; F408-W723 AromaticContact CE1-CD2 3.92Å; F408-W723 HydrophobicContact CE1-CD2 3.92Å; F408-W723 HydrophobicContact CE1-CE3 4.02Å; F408-W723 HydrophobicContact CE1-CG 4.41Å; F408-W723 HydrophobicContact CE1-CH2 4.5Å; F408-W723 HydrophobicContact CE1-CZ2 4.37Å; F408-W723 HydrophobicContact CE1-CZ3 4.33Å; P409-W723 HydrophobicContact CG-CB 3.8Å; P409-W723 HydrophobicContact CG-CG 4.47Å; W410-W723 AromaticContact NE1-CD1 3.84Å; W410-W723 AromaticContact NE1-NE1 3.85Å
724	M	71.7	Confident	78.5	Confident	87 Å²	87	39.8 Å²	39.8	43%	0.429	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-2	172	-57.4	178.2	-175.9	0	0	113.3	W722 S726	W722-M724 PolarHBondContact O-N 2.81Å; M724-S726 PolarHBondContact O-N 2.97Å
725	A	71.2	Confident	78.1	Confident	24 Å²	24	39.8 Å²	39.8	20%	0.198	20%	0.199	C	C	.	.			trans	-61.6	136	175.4	0	0	0	0	0	109.3	V651 S721 W722	V651-A725 WeakPolarHBondContact CG1-O 3.38Å; S721-A725 WeakPolarHBondContact OG-CB 3.45Å; W722-A725 WeakPolarHBondContact O-CB 3.24Å; W722-A725 PolarHBondContact O-N 2.93Å
726	S	67.6	Low	77.9	Confident	68 Å²	68	41.6 Å²	41.6	48%	0.476	21%	0.21	S	C	.	.			trans	-90.9	-21.5	178.3	48.3	0	0	0	0	112.9	M724	M724-S726 PolarHBondContact O-N 2.97Å
727	E	72.6	Confident	77.5	Confident	143 Å²	143	42.9 Å²	42.9	67%	0.668	22%	0.215	S	C	*	.	S	Bend	trans	-121.5	152.4	-172	-65.4	176.7	-166.5	0	0	111.5
728	E	78	Confident	77.3	Confident	116 Å²	116	43.7 Å²	43.7	54%	0.542	22%	0.221	S	C	.	.			trans	-71.9	145.6	170.2	-56.8	-168.3	143.8	0	0	110.2	L648 V651	L648-E728 HydrophobicContact CD1-CB 3.95Å; V651-E728 HydrophobicContact CG2-CG 4.49Å
729	L	75.5	Confident	76.9	Confident	44 Å²	44	43.9 Å²	43.9	23%	0.23	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	137.6	-176.4	-68.2	161.7	0	0	0	109.8	L648 L649 V731	L648-L729 CarbonylContact C-O 3.58Å; L649-L729 HydrophobicContact CB-CB 4.4Å; L649-L729 PolarHBondContact N-O 3.12Å; L649-L729 PolarHBondContact O-N 3.1Å; L729-V731 HydrophobicContact CB-CG2 4.31Å
730	V	80	Confident	76.8	Confident	78 Å²	78	44.5 Å²	44.5	47%	0.473	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124	168.7	-178.1	0	0	0	0	108	N646 V647 L648	N646-V730 HydrophobicContact CB-CG1 4.18Å; V647-V730 WeakPolarHBondContact O-CA 3.46Å; L648-V730 HydrophobicContact CD1-CG2 3.93Å
731	V	77.1	Confident	76.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137.8	-172.7	-176.6	0	0	0	0	110.7	V647 L649 W673 T675 F676 L729 Y733	V647-V731 WeakPolarHBondContact CB-O 3.42Å; V647-V731 PolarHBondContact N-O 2.9Å; V647-V731 VanDerWaalsContact N-O 3.08Å; V647-V731 PolarHBondContact O-N 2.91Å; L649-V731 HydrophobicContact CD1-CB 4.26Å; L649-V731 HydrophobicContact CD1-CG2 3.62Å; L649-V731 HydrophobicContact CG-CG2 4.39Å; W673-V731 WeakPolarHBondContact O-CG1 3.31Å; T675-V731 WeakPolarHBondContact O-CG2 3.35Å; F676-V731 HydrophobicContact CD1-CG1 3.56Å; F676-V731 HydrophobicContact CE1-CG1 4.21Å; F676-V731 HydrophobicContact CG-CG1 4.32Å; L729-V731 HydrophobicContact CB-CG2 4.31Å; V731-Y733 HydrophobicContact CG1-CD1 4.03Å
732	D	81.9	Confident	76.9	Confident	59 Å²	59	50.2 Å²	50.2	32%	0.316	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.3	168.9	-74.2	-5.1	0	0	0	109.7	F644 T645 N646 A672 W673	F644-D732 WeakPolarHBondContact O-CA 3.47Å; T645-D732 VanDerWaalsContact CA-OD1 3.24Å; T645-D732 WeakPolarHBondContact CA-OD1 3.38Å; N646-D732 PolarHBondContact N-OD1 2.94Å; A672-D732 WeakPolarHBondContact CA-O 2.88Å; W673-D732 HydrophobicContact CB-CB 4.48Å; W673-D732 PolarHBondContact N-O 2.62Å
733	Y	83.4	Confident	77.1	Confident	8 Å²	8	50.2 Å²	50.2	3%	0.031	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	161	177.2	59.2	-89.3	0	0	0	112.7	F644 V647 H657 S671 I719 V731 I735	F644-Y733 HydrophobicContact CB-CD1 4.49Å; F644-Y733 HydrophobicContact CB-CD2 4.09Å; F644-Y733 HydrophobicContact CB-CE1 4.12Å; F644-Y733 HydrophobicContact CB-CE2 3.66Å; F644-Y733 HydrophobicContact CB-CG 4.48Å; F644-Y733 AromaticContact CD2-CD2 3.66Å; F644-Y733 HydrophobicContact CD2-CD2 3.66Å; F644-Y733 AromaticContact CD2-CE2 3.26Å; F644-Y733 HydrophobicContact CD2-CE2 3.26Å; F644-Y733 HydrophobicContact CE2-CE2 4.01Å; F644-Y733 HydrophobicContact CG-CD2 4.2Å; F644-Y733 AromaticContact CG-CE2 3.56Å; F644-Y733 HydrophobicContact CG-CE2 3.56Å; F644-Y733 AromaticContact CG-CZ 3.9Å; F644-Y733 PolarHBondContact N-O 2.69Å; F644-Y733 PolarHBondContact O-N 3.21Å; V647-Y733 HydrophobicContact CB-CE1 3.85Å; V647-Y733 HydrophobicContact CG1-CE1 4.05Å; V647-Y733 HydrophobicContact CG2-CE1 3.65Å; H657-Y733 AromaticContact CD2-CE2 3.91Å; H657-Y733 PolarHBondContact CD2-OH 2.83Å; H657-Y733 AromaticContact NE2-CE2 3.71Å; H657-Y733 AromaticContact NE2-CZ 3.57Å; H657-Y733 PolarHBondContact NE2-OH 2.88Å; S671-Y733 CarbonylContact O-C 3.54Å; S671-Y733 WeakPolarHBondContact O-CA 3.32Å; I719-Y733 HydrophobicContact CD1-CD1 3.77Å; I719-Y733 HydrophobicContact CD1-CD2 3.66Å; I719-Y733 HydrophobicContact CD1-CE1 3.53Å; I719-Y733 HydrophobicContact CD1-CE2 3.42Å; I719-Y733 VanDerWaalsContact CD1-CE2 3.42Å; I719-Y733 HydrophobicContact CD1-CG 3.83Å; V731-Y733 HydrophobicContact CG1-CD1 4.03Å; Y733-I735 HydrophobicContact CE2-CD1 4.49Å
734	R	83.7	Confident	77.2	Confident	97 Å²	97	52.5 Å²	52.5	37%	0.366	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	137.1	-174.9	178.9	-177.1	-83.6	169.1	4	110.3	K641 L642 S643 A670 S671 T736	K641-R734 HydrophobicContact CB-CG 3.79Å; L642-R734 CarbonylContact O-C 3.53Å; L642-R734 WeakPolarHBondContact O-CA 3.36Å; L642-R734 WeakPolarHBondContact O-CG 3.21Å; S643-R734 PolarHBondContact OG-NE 3.44Å; S643-R734 VanDerWaalsContact OG-NE 3.11Å; A670-R734 CarbonylContact C-O 3.57Å; A670-R734 WeakPolarHBondContact CA-O 3.31Å; S671-R734 PolarHBondContact N-O 2.84Å; S671-R734 PolarHBondContact O-N 3.41Å; R734-T736 HydrophobicContact CG-CG2 4.23Å
735	I	82.4	Confident	76.9	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.8	178.1	-58	165.8	0	0	0	108.3	L642 F644 I659 G669 I717 Y733 F737	L642-I735 HydrophobicContact CB-CB 4.28Å; L642-I735 PolarHBondContact N-O 3.37Å; L642-I735 PolarHBondContact O-N 3.09Å; F644-I735 HydrophobicContact CE2-CD1 3.91Å; F644-I735 HydrophobicContact CE2-CG1 4.5Å; I659-I735 HydrophobicContact CD1-CD1 3.95Å; I659-I735 HydrophobicContact CD1-CG2 4.37Å; G669-I735 CarbonylContact O-C 3.57Å; G669-I735 WeakPolarHBondContact O-CA 3.01Å; I717-I735 HydrophobicContact CB-CD1 4.38Å; I717-I735 HydrophobicContact CD1-CD1 3.71Å; I717-I735 HydrophobicContact CD1-CG1 4.27Å; I717-I735 HydrophobicContact CD1-CG2 3.9Å; I717-I735 HydrophobicContact CG2-CD1 4.06Å; Y733-I735 HydrophobicContact CE2-CD1 4.49Å; I735-F737 HydrophobicContact CG2-CE2 3.93Å; I735-F737 HydrophobicContact CG2-CZ 4.06Å
736	T	81.2	Confident	76.6	Confident	38 Å²	38	55.8 Å²	55.8	23%	0.233	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	129.7	179.1	55	0	0	0	0	109.6	K641 A668 G669 R734	K641-T736 HydrophobicContact CB-CG2 3.81Å; K641-T736 HydrophobicContact CD-CG2 3.99Å; K641-T736 HydrophobicContact CG-CG2 3.64Å; A668-T736 CarbonylContact C-O 3.47Å; A668-T736 WeakPolarHBondContact CA-O 3.4Å; G669-T736 PolarHBondContact N-O 3.28Å; G669-T736 PolarHBondContact O-N 2.86Å; G669-T736 PolarHBondContact O-OG1 2.73Å; R734-T736 HydrophobicContact CG-CG2 4.23Å
737	F	79.2	Confident	76.4	Confident	27 Å²	27	53.4 Å²	53.4	12%	0.118	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	132.6	174.7	-64.4	-86	0	0	0	110	P634 L642 I659 V661 P662 C665 T667 A668 V709 I735	P634-F737 HydrophobicContact CG-CE2 4.46Å; L642-F737 HydrophobicContact CD1-CE2 4.15Å; I659-F737 HydrophobicContact CB-CZ 4.15Å; I659-F737 HydrophobicContact CD1-CE2 4.4Å; I659-F737 HydrophobicContact CD1-CZ 4.17Å; I659-F737 HydrophobicContact CG2-CE2 3.68Å; I659-F737 HydrophobicContact CG2-CZ 3.63Å; V661-F737 HydrophobicContact CG1-CD1 4.18Å; V661-F737 HydrophobicContact CG1-CE1 4.31Å; V661-F737 HydrophobicContact CG2-CE1 4.1Å; P662-F737 HydrophobicContact CG-CB 4.5Å; P662-F737 HydrophobicContact CG-CD2 4.49Å; P662-F737 HydrophobicContact CG-CG 4.49Å; C665-F737 HydrophobicContact CB-CB 4.05Å; T667-F737 WeakPolarHBondContact O-CA 3.16Å; A668-F737 HydrophobicContact CB-CD1 3.86Å; A668-F737 HydrophobicContact CB-CE1 3.82Å; V709-F737 HydrophobicContact CG1-CD1 4.47Å; V709-F737 HydrophobicContact CG1-CE1 4.16Å; V709-F737 HydrophobicContact CG2-CD1 4.19Å; I735-F737 HydrophobicContact CG2-CE2 3.93Å; I735-F737 HydrophobicContact CG2-CZ 4.06Å
738	C	78.1	Confident	76.1	Confident	18 Å²	18	49.5 Å²	49.5	12%	0.122	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	163.7	177.2	54.8	0	0	0	0	109.5	N666 T667 E771	N666-C738 PolarHBondContact N-O 3.23Å; T667-C738 CarbonylContact C-O 3.59Å; T667-C738 WeakPolarHBondContact CA-O 3.35Å; T667-C738 PolarHBondContact N-O 2.88Å; T667-C738 PolarHBondContact O-N 2.67Å; C738-E771 HydrophobicContact CB-CG 4.3Å; C738-E771 WeakPolarHBondContact CB-OE1 3.32Å
739	G	75.5	Confident	75.4	Confident	5 Å²	5	46.2 Å²	46.2	5%	0.052	25%	0.249	C	C	.	.			trans	173.5	158.3	174.2	0	0	0	0	0	116	N666 G767	N666-G739 WeakPolarHBondContact OD1-CA 3.27Å; G739-G767 PolarHBondContact O-N 3.45Å
740	F	76.5	Confident	74.7	Confident	13 Å²	13	47.6 Å²	47.6	6%	0.057	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.1	166.6	-77.9	-78.9	0	0	0	109	N666 I765 C766 E771 L773 V931	N666-F740 PolarHBondContact ND2-O 3.4Å; N666-F740 PolarHBondContact OD1-N 3.16Å; F740-I765 CarbonylContact C-O 3.59Å; F740-I765 WeakPolarHBondContact CA-O 3.46Å; F740-C766 HydrophobicContact CD1-CB 4.08Å; F740-C766 HydrophobicContact CE1-CB 3.64Å; F740-C766 VanDerWaalsContact CE1-SG 3.56Å; F740-C766 HydrophobicContact CZ-CB 4.48Å; F740-E771 HydrophobicContact CD2-CB 4.33Å; F740-E771 HydrophobicContact CE2-CB 3.37Å; F740-E771 HydrophobicContact CE2-CG 4.36Å; F740-E771 HydrophobicContact CZ-CB 3.57Å; F740-L773 HydrophobicContact CD1-CD1 4.48Å; F740-L773 HydrophobicContact CE1-CB 4.27Å; F740-L773 HydrophobicContact CE1-CD1 4.4Å; F740-L773 HydrophobicContact CE2-CB 4.28Å; F740-L773 HydrophobicContact CE2-CD1 4.48Å; F740-L773 HydrophobicContact CZ-CB 3.81Å; F740-L773 HydrophobicContact CZ-CD1 4.4Å; F740-V931 HydrophobicContact CE1-CB 4.04Å; F740-V931 HydrophobicContact CE1-CG1 4.16Å; F740-V931 HydrophobicContact CE1-CG2 4.29Å; F740-V931 HydrophobicContact CZ-CB 4.06Å; F740-V931 HydrophobicContact CZ-CG2 4.29Å
741	R	76.3	Confident	73.5	Confident	110 Å²	110	49.3 Å²	49.3	42%	0.415	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.5	170.6	-170.6	174	179.8	-177.6	-5.1	109.5	E711 E745 I765	E711-R741 IonicContact OE1-CZ 3.23Å; E711-R741 IonicContact OE1-NH1 2.86Å; E711-R741 PolarHBondContact OE1-NH1 2.78Å; R741-E745 IonicContact CZ-OE1 2.77Å; R741-E745 IonicContact NE-OE1 3.69Å; R741-E745 PolarHBondContact NE-OE1 2.7Å; R741-E745 IonicContact NH2-OE1 3.3Å; R741-E745 PolarHBondContact NH2-OE1 3.1Å; R741-I765 HydrophobicContact CB-CB 4.35Å; R741-I765 PolarHBondContact N-O 3.41Å; R741-I765 PolarHBondContact O-N 2.67Å
742	A	77.2	Confident	72	Confident	15 Å²	15	53 Å²	53	12%	0.124	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	136.6	172.8	0	0	0	0	0	109.4	P744 E745 V762 M763 I963	A742-P744 CarbonylContact O-C 3.49Å; A742-E745 WeakPolarHBondContact O-CA 3.28Å; A742-E745 WeakPolarHBondContact O-CG 3.43Å; A742-E745 PolarHBondContact O-N 2.91Å; A742-V762 HydrophobicContact CB-CG1 3.96Å; A742-M763 CarbonylContact C-O 3.54Å; A742-I963 HydrophobicContact CB-CD1 4.08Å
743	N	77.4	Confident	70.2	Confident	92 Å²	92	54 Å²	54	49%	0.492	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	117.7	171.1	-176.7	3	0	0	0	109.7	M763 I765	N743-M763 HydrophobicContact CB-CB 4.29Å; N743-M763 PolarHBondContact N-O 2.9Å; N743-M763 PolarHBondContact O-N 3.46Å; N743-I765 HydrophobicContact CB-CD1 4.28Å
744	P	73.9	Confident	68.4	Low	60 Å²	60	58.2 Å²	58.2	39%	0.39	33%	0.329	S	S	.	.	S	Bend	cis	-69.6	151.1	-0.8	30.3	-35.3	0	0	0	112.6	A742 I747	A742-P744 CarbonylContact O-C 3.49Å; P744-I747 HydrophobicContact CG-CG1 4.5Å
745	E	66.6	Low	66.3	Low	107 Å²	107	58.7 Å²	58.7	50%	0.5	34%	0.343	S	S	.	.	S	Bend	trans	-72.3	-33.2	177.7	-74	178.8	-166.9	0	0	112.3	R741 A742 C972	R741-E745 IonicContact CZ-OE1 2.77Å; R741-E745 IonicContact NE-OE1 3.69Å; R741-E745 PolarHBondContact NE-OE1 2.7Å; R741-E745 IonicContact NH2-OE1 3.3Å; R741-E745 PolarHBondContact NH2-OE1 3.1Å; A742-E745 WeakPolarHBondContact O-CA 3.28Å; A742-E745 WeakPolarHBondContact O-CG 3.43Å; A742-E745 PolarHBondContact O-N 2.91Å; E745-C972 PolarHBondContact O-SG 2.83Å
746	A	65	Low	64.4	Low	72 Å²	72	65.2 Å²	65.2	60%	0.595	38%	0.378	S	S	*	.	S	Bend	trans	-110.3	130.2	174.3	0	0	0	0	0	109.8
747	I	63.9	Low	63	Low	19 Å²	19	69.3 Å²	69.3	10%	0.097	40%	0.399	C	S	.	.			trans	-114.2	114.8	-178.6	-58.2	174.4	0	0	0	108.4	P744 W749 F760 V762 M777 I963 F974	P744-I747 HydrophobicContact CG-CG1 4.5Å; I747-W749 VanDerWaalsContact CG2-CD1 3.49Å; I747-F760 HydrophobicContact CG2-CD1 4.14Å; I747-V762 HydrophobicContact CD1-CG2 3.48Å; I747-V762 VanDerWaalsContact CD1-CG2 3.48Å; I747-V762 HydrophobicContact CG1-CG2 4.43Å; I747-M777 HydrophobicContact CD1-SD 4.08Å; I747-I963 HydrophobicContact CD1-CD1 3.86Å; I747-F974 VanDerWaalsContact O-CE2 3.23Å; I747-F974 WeakPolarHBondContact O-CE2 3.11Å; I747-F974 WeakPolarHBondContact O-CZ 3.4Å
748	S	64.3	Low	62.4	Low	61 Å²	61	71 Å²	71	43%	0.427	41%	0.409	S	S	.	.			trans	-101	121.9	169.7	-170.5	0	0	0	0	110.1	F760	S748-F760 VanDerWaalsContact O-CE1 3.24Å; S748-F760 WeakPolarHBondContact O-CE1 3.18Å
749	W	65	Low	62.4	Low	47 Å²	47	71.8 Å²	71.8	18%	0.178	41%	0.411	C	S	.	.			trans	-101.2	106.8	174.6	-84.1	16.4	0	0	0	110	I747 F760 M777 F779 A909 F941 G943	I747-W749 VanDerWaalsContact CG2-CD1 3.49Å; W749-F760 HydrophobicContact CB-CE2 4.31Å; W749-F760 HydrophobicContact CB-CZ 4.23Å; W749-F760 AromaticContact CD1-CD1 3.43Å; W749-F760 VanDerWaalsContact CD1-CD1 3.43Å; W749-F760 AromaticContact CD1-CD2 3.28Å; W749-F760 AromaticContact CD1-CE1 3.29Å; W749-F760 AromaticContact CD1-CE2 3.12Å; W749-F760 AromaticContact CD1-CG 3.42Å; W749-F760 VanDerWaalsContact CD1-CG 3.42Å; W749-F760 AromaticContact CD1-CZ 3.13Å; W749-F760 AromaticContact CD2-CD2 3.94Å; W749-F760 HydrophobicContact CD2-CD2 3.94Å; W749-F760 AromaticContact CD2-CE2 3.89Å; W749-F760 HydrophobicContact CD2-CE2 3.89Å; W749-F760 AromaticContact CE2-CD2 3.19Å; W749-F760 AromaticContact CE2-CE2 3.64Å; W749-F760 AromaticContact CE2-CG 3.64Å; W749-F760 AromaticContact CG-CD2 3.96Å; W749-F760 HydrophobicContact CG-CD2 3.96Å; W749-F760 HydrophobicContact CG-CE1 4.31Å; W749-F760 AromaticContact CG-CE2 3.56Å; W749-F760 HydrophobicContact CG-CE2 3.56Å; W749-F760 HydrophobicContact CG-CG 4.47Å; W749-F760 AromaticContact CG-CZ 3.76Å; W749-F760 HydrophobicContact CG-CZ 3.76Å; W749-F760 HydrophobicContact CZ2-CB 4.1Å; W749-F760 AromaticContact CZ2-CD2 3.7Å; W749-F760 HydrophobicContact CZ2-CD2 3.7Å; W749-F760 HydrophobicContact CZ2-CE2 4.45Å; W749-F760 HydrophobicContact CZ2-CG 4.16Å; W749-F760 AromaticContact NE1-CD1 3.3Å; W749-F760 VanDerWaalsContact NE1-CD1 3.3Å; W749-F760 AromaticContact NE1-CD2 2.81Å; W749-F760 AromaticContact NE1-CE1 3.69Å; W749-F760 AromaticContact NE1-CE2 3.24Å; W749-F760 AromaticContact NE1-CG 2.83Å; W749-F760 AromaticContact NE1-CZ 3.65Å; W749-M777 HydrophobicContact CH2-CE 3.59Å; W749-M777 HydrophobicContact CZ2-CE 3.32Å; W749-M777 HydrophobicContact CZ3-CE 4.46Å; W749-F779 HydrophobicContact CD2-CZ 4.29Å; W749-F779 AromaticContact CE3-CE1 3.85Å; W749-F779 HydrophobicContact CE3-CE1 3.85Å; W749-F779 HydrophobicContact CE3-CE2 4.38Å; W749-F779 AromaticContact CE3-CZ 3.35Å; W749-F779 HydrophobicContact CE3-CZ 3.35Å; W749-F779 HydrophobicContact CH2-CE2 4.41Å; W749-F779 AromaticContact CH2-CZ 3.98Å; W749-F779 HydrophobicContact CH2-CZ 3.98Å; W749-F779 HydrophobicContact CZ3-CE1 4.07Å; W749-F779 AromaticContact CZ3-CE2 3.76Å; W749-F779 HydrophobicContact CZ3-CE2 3.76Å; W749-F779 AromaticContact CZ3-CZ 3.13Å; W749-F779 HydrophobicContact CZ3-CZ 3.13Å; W749-A909 HydrophobicContact CH2-CB 3.98Å; W749-F941 HydrophobicContact CZ2-CB 4.14Å; W749-G943 VanDerWaalsContact CH2-N 3.27Å
750	V	59.2	Low	62.6	Low	72 Å²	72	74.2 Å²	74.2	44%	0.436	42%	0.421	S	S	.	.			trans	-106.4	119.2	171.9	-175.9	0	0	0	0	108	C752 L982	V750-C752 PolarHBondContact O-N 3.31Å; V750-L982 HydrophobicContact CG1-CD1 4.07Å
751	R	56.2	Low	63	Low	114 Å²	114	79 Å²	79	43%	0.43	44%	0.441	S	S	.	.			trans	-88.6	88.1	175.6	-166.2	176.8	-174.6	160.7	4.7	109.2
752	C	44.8	Very low	63.4	Low	79 Å²	79	74 Å²	74	53%	0.534	42%	0.423	S	S	.	.			trans	-86	109.1	171.1	-87	0	0	0	0	109.8	V750	V750-C752 PolarHBondContact O-N 3.31Å
753	S	43.6	Very low	63.9	Low	80 Å²	80	75.8 Å²	75.8	56%	0.559	43%	0.43	S	S	*	.	S	Bend	trans	77	163.9	174.8	103.4	0	0	0	0	117.9	T755	S753-T755 PolarHBondContact O-N 2.92Å; S753-T755 PolarHBondContact OG-N 2.68Å; S753-T755 PolarHBondContact OG-O 2.97Å; S753-T755 VanDerWaalsContact OG-O 3.08Å
754	A	47.3	Very low	64.3	Low	95 Å²	95	71.5 Å²	71.5	79%	0.785	41%	0.407	S	S	*	.	S	Bend	trans	-72.7	-9.2	-176.5	0	0	0	0	0	113.9
755	T	38.8	Very low	64.8	Low	108 Å²	108	71.4 Å²	71.4	66%	0.663	40%	0.402	S	S	*	.	S	Bend	trans	-140.6	115.4	-172.4	50.5	0	0	0	0	109.2	S753	S753-T755 PolarHBondContact O-N 2.92Å; S753-T755 PolarHBondContact OG-N 2.68Å; S753-T755 PolarHBondContact OG-O 2.97Å; S753-T755 VanDerWaalsContact OG-O 3.08Å
756	N	42.4	Very low	65.6	Low	138 Å²	138	66.4 Å²	66.4	74%	0.738	38%	0.379	S	S	*	.	S	Bend	trans	68.6	127.5	178.4	-62.6	-2.6	0	0	0	115.3
757	D	50.9	Low	66.3	Low	123 Å²	123	63 Å²	63	66%	0.658	35%	0.351	S	S	*	.			cis	-137.8	120.7	15.3	-75.2	-49.8	0	0	0	109.8
758	L	67.4	Low	67	Low	63 Å²	63	63.5 Å²	63.5	33%	0.33	36%	0.356	S	S	.	.			trans	-87	7.7	172.3	-79.8	163.2	0	0	0	112.1	V942 G943	L758-V942 HydrophobicContact CB-CG1 4.23Å; L758-V942 CarbonylContact O-C 3.56Å; L758-V942 VanDerWaalsContact O-CA 3.24Å; L758-V942 WeakPolarHBondContact O-CA 3.48Å; L758-G943 PolarHBondContact O-N 2.71Å
759	L	78.1	Confident	67.6	Low	34 Å²	34	61.1 Å²	61.1	18%	0.178	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.6	-169.9	-169.8	85.7	0	0	0	111.8	F915 A918 Y940 F941 V942	L759-F915 HydrophobicContact CD2-CD2 3.24Å; L759-F915 HydrophobicContact CD2-CE2 3.24Å; L759-F915 HydrophobicContact CD2-CG 4.41Å; L759-F915 HydrophobicContact CD2-CZ 4.42Å; L759-A918 HydrophobicContact CD1-CB 3.21Å; L759-Y940 HydrophobicContact CD2-CD1 4.03Å; L759-Y940 HydrophobicContact CG-CD1 4.47Å; L759-F941 CarbonylContact C-O 3.57Å; L759-F941 WeakPolarHBondContact CA-O 3.41Å; L759-V942 HydrophobicContact CD1-CG2 3.6Å
760	F	79.7	Confident	68.5	Low	56 Å²	56	61.5 Å²	61.5	25%	0.246	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128.9	175.1	-79	-104.2	0	0	0	111.9	I747 S748 W749 Y940 F941	I747-F760 HydrophobicContact CG2-CD1 4.14Å; S748-F760 VanDerWaalsContact O-CE1 3.24Å; S748-F760 WeakPolarHBondContact O-CE1 3.18Å; W749-F760 HydrophobicContact CB-CE2 4.31Å; W749-F760 HydrophobicContact CB-CZ 4.23Å; W749-F760 AromaticContact CD1-CD1 3.43Å; W749-F760 VanDerWaalsContact CD1-CD1 3.43Å; W749-F760 AromaticContact CD1-CD2 3.28Å; W749-F760 AromaticContact CD1-CE1 3.29Å; W749-F760 AromaticContact CD1-CE2 3.12Å; W749-F760 AromaticContact CD1-CG 3.42Å; W749-F760 VanDerWaalsContact CD1-CG 3.42Å; W749-F760 AromaticContact CD1-CZ 3.13Å; W749-F760 AromaticContact CD2-CD2 3.94Å; W749-F760 HydrophobicContact CD2-CD2 3.94Å; W749-F760 AromaticContact CD2-CE2 3.89Å; W749-F760 HydrophobicContact CD2-CE2 3.89Å; W749-F760 AromaticContact CE2-CD2 3.19Å; W749-F760 AromaticContact CE2-CE2 3.64Å; W749-F760 AromaticContact CE2-CG 3.64Å; W749-F760 AromaticContact CG-CD2 3.96Å; W749-F760 HydrophobicContact CG-CD2 3.96Å; W749-F760 HydrophobicContact CG-CE1 4.31Å; W749-F760 AromaticContact CG-CE2 3.56Å; W749-F760 HydrophobicContact CG-CE2 3.56Å; W749-F760 HydrophobicContact CG-CG 4.47Å; W749-F760 AromaticContact CG-CZ 3.76Å; W749-F760 HydrophobicContact CG-CZ 3.76Å; W749-F760 HydrophobicContact CZ2-CB 4.1Å; W749-F760 AromaticContact CZ2-CD2 3.7Å; W749-F760 HydrophobicContact CZ2-CD2 3.7Å; W749-F760 HydrophobicContact CZ2-CE2 4.45Å; W749-F760 HydrophobicContact CZ2-CG 4.16Å; W749-F760 AromaticContact NE1-CD1 3.3Å; W749-F760 VanDerWaalsContact NE1-CD1 3.3Å; W749-F760 AromaticContact NE1-CD2 2.81Å; W749-F760 AromaticContact NE1-CE1 3.69Å; W749-F760 AromaticContact NE1-CE2 3.24Å; W749-F760 AromaticContact NE1-CG 2.83Å; W749-F760 AromaticContact NE1-CZ 3.65Å; F760-Y940 CarbonylContact O-C 3.58Å; F760-Y940 WeakPolarHBondContact O-CA 3.25Å; F760-F941 PolarHBondContact N-O 3.18Å; F760-F941 PolarHBondContact O-N 2.63Å
761	K	84.7	Confident	69.5	Low	114 Å²	114	60.7 Å²	60.7	50%	0.496	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	131.9	177.3	-175.2	-179.6	176.6	-177.6	0	110.2	M763 L939 Y940	K761-M763 HydrophobicContact CD-SD 4.47Å; K761-M763 WeakPolarHBondContact CE-SD 3.39Å; K761-M763 HydrophobicContact CG-SD 4.46Å; K761-L939 CarbonylContact C-O 3.49Å; K761-L939 WeakPolarHBondContact CA-O 3.46Å; K761-Y940 HydrophobicContact CB-CD1 4.08Å; K761-Y940 HydrophobicContact CB-CE1 3.99Å; K761-Y940 HydrophobicContact CD-CE1 3.82Å; K761-Y940 HydrophobicContact CG-CD1 4.2Å; K761-Y940 HydrophobicContact CG-CE1 3.77Å
762	V	84.8	Confident	70.8	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.024	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	129.5	174.3	-179.7	0	0	0	0	108.2	A742 I747 L939 F941	A742-V762 HydrophobicContact CB-CG1 3.96Å; I747-V762 HydrophobicContact CD1-CG2 3.48Å; I747-V762 VanDerWaalsContact CD1-CG2 3.48Å; I747-V762 HydrophobicContact CG1-CG2 4.43Å; V762-L939 PolarHBondContact N-O 3.32Å; V762-L939 WeakPolarHBondContact O-CB 3.4Å; V762-L939 PolarHBondContact O-N 3.37Å; V762-F941 HydrophobicContact CB-CD2 4.38Å; V762-F941 HydrophobicContact CB-CE2 4.18Å; V762-F941 HydrophobicContact CG2-CD2 3.85Å; V762-F941 HydrophobicContact CG2-CE2 3.97Å
763	M	87.4	Confident	72.6	Confident	54 Å²	54	56.6 Å²	56.6	27%	0.266	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	114.3	173	-56.8	-59.8	-77.5	0	0	108.6	A742 N743 K761 V936 P938	A742-M763 CarbonylContact C-O 3.54Å; N743-M763 HydrophobicContact CB-CB 4.29Å; N743-M763 PolarHBondContact N-O 2.9Å; N743-M763 PolarHBondContact O-N 3.46Å; K761-M763 HydrophobicContact CD-SD 4.47Å; K761-M763 WeakPolarHBondContact CE-SD 3.39Å; K761-M763 HydrophobicContact CG-SD 4.46Å; M763-V936 HydrophobicContact CB-CG1 3.99Å; M763-V936 HydrophobicContact CE-CG1 3.44Å; M763-V936 VanDerWaalsContact CE-CG1 3.44Å; M763-P938 HydrophobicContact CE-CB 4.25Å; M763-P938 HydrophobicContact SD-CB 3.76Å
764	A	85.9	Confident	74.6	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.008	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	113.3	171.2	0	0	0	0	0	109.1	L773 V936 T937 L939	A764-L773 HydrophobicContact CB-CD1 4.33Å; A764-L773 HydrophobicContact CB-CD2 3.97Å; A764-V936 WeakPolarHBondContact O-CA 3.3Å; A764-T937 PolarHBondContact N-O 2.73Å; A764-T937 PolarHBondContact O-N 3.27Å; A764-L939 HydrophobicContact CB-CD1 3.96Å
765	I	85.5	Confident	76.3	Confident	58 Å²	58	52.1 Å²	52.1	30%	0.297	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	116.9	179.1	-54.8	170.2	0	0	0	107.6	F740 R741 N743 V936	F740-I765 CarbonylContact C-O 3.59Å; F740-I765 WeakPolarHBondContact CA-O 3.46Å; R741-I765 HydrophobicContact CB-CB 4.35Å; R741-I765 PolarHBondContact N-O 3.41Å; R741-I765 PolarHBondContact O-N 2.67Å; N743-I765 HydrophobicContact CB-CD1 4.28Å; I765-V936 HydrophobicContact CG1-CG1 4.19Å; I765-V936 HydrophobicContact CG1-CG2 4.23Å; I765-V936 HydrophobicContact CG2-CG2 4.46Å
766	C	83.2	Confident	78.3	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.014	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	137.7	177.3	-160.7	0	0	0	0	110.2	F740 S769 V931 P932 N934 S935	F740-C766 HydrophobicContact CD1-CB 4.08Å; F740-C766 HydrophobicContact CE1-CB 3.64Å; F740-C766 VanDerWaalsContact CE1-SG 3.56Å; F740-C766 HydrophobicContact CZ-CB 4.48Å; C766-S769 PolarHBondContact SG-O 2.78Å; C766-V931 HydrophobicContact CB-CG1 3.75Å; C766-P932 WeakPolarHBondContact CB-O 3.26Å; C766-N934 WeakPolarHBondContact O-CA 3.36Å; C766-N934 PolarHBondContact O-N 3.47Å; C766-S935 WeakPolarHBondContact CB-O 3.33Å; C766-S935 PolarHBondContact N-O 2.76Å
767	G	78.4	Confident	80	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.01	22%	0.222	C	C	.	.			trans	-68.9	-164	173.2	0	0	0	0	0	113.7	G664 G739 S769 A933 N934	G664-G767 WeakPolarHBondContact O-CA 3.4Å; G739-G767 PolarHBondContact O-N 3.45Å; G767-S769 PolarHBondContact O-N 3.4Å; G767-A933 CarbonylContact O-C 3.6Å; G767-A933 WeakPolarHBondContact O-CA 3.19Å; G767-N934 PolarHBondContact O-N 3.37Å
768	P	79	Confident	81.4	Confident	30 Å²	30	37.1 Å²	37.1	20%	0.195	19%	0.193	C	C	.	.	S	Bend	trans	-72.6	-8.7	-174.2	28.4	-34.8	0	0	0	114.5	A933	P768-A933 VanDerWaalsContact O-CB 3.24Å; P768-A933 WeakPolarHBondContact O-CB 3.32Å
769	S	78.5	Confident	81.9	Confident	11 Å²	11	34.2 Å²	34.2	8%	0.077	18%	0.178	C	C	.	.	S	Bend	trans	-105.3	150.5	174.1	56.5	0	0	0	0	111.6	C766 G767 E771	C766-S769 PolarHBondContact SG-O 2.78Å; G767-S769 PolarHBondContact O-N 3.4Å; S769-E771 WeakPolarHBondContact CB-OE1 3.48Å; S769-E771 PolarHBondContact OG-OE1 3.2Å
770	S	82.9	Confident	82.1	Confident	54 Å²	54	37 Å²	37	38%	0.378	19%	0.186	S	C	.	.			trans	-76	124.9	171.3	-171.3	0	0	0	0	109.8	V931	S770-V931 WeakPolarHBondContact CA-O 3.45Å; S770-V931 PolarHBondContact OG-O 3.34Å
771	E	79.8	Confident	82.2	Confident	56 Å²	56	34.6 Å²	34.6	26%	0.262	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	157.6	-170.4	-65.9	-61.3	154.6	0	0	112.2	C738 F740 S769 R930 V931	C738-E771 HydrophobicContact CB-CG 4.3Å; C738-E771 WeakPolarHBondContact CB-OE1 3.32Å; F740-E771 HydrophobicContact CD2-CB 4.33Å; F740-E771 HydrophobicContact CE2-CB 3.37Å; F740-E771 HydrophobicContact CE2-CG 4.36Å; F740-E771 HydrophobicContact CZ-CB 3.57Å; S769-E771 WeakPolarHBondContact CB-OE1 3.48Å; S769-E771 PolarHBondContact OG-OE1 3.2Å; E771-R930 WeakPolarHBondContact O-CA 3.34Å; E771-V931 PolarHBondContact N-O 3.25Å; E771-V931 VanDerWaalsContact N-O 3.15Å; E771-V931 PolarHBondContact O-N 2.77Å
772	E	84.5	Confident	82.1	Confident	107 Å²	107	29.7 Å²	29.7	50%	0.5	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	118.6	175.4	-170.5	174.7	174.3	0	0	110.9	S928 S966	E772-S928 VanDerWaalsContact CD-OG 3.29Å; E772-S928 WeakPolarHBondContact CG-OG 3.31Å; E772-S928 PolarHBondContact OE1-OG 2.82Å; E772-S966 PolarHBondContact O-OG 2.89Å
773	L	82.8	Confident	82.1	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	113.8	-179.1	177.3	57.8	0	0	0	110.5	F740 A764 P775 F926 S928 R929 V931 T937 L939 H965	F740-L773 HydrophobicContact CD1-CD1 4.48Å; F740-L773 HydrophobicContact CE1-CB 4.27Å; F740-L773 HydrophobicContact CE1-CD1 4.4Å; F740-L773 HydrophobicContact CE2-CB 4.28Å; F740-L773 HydrophobicContact CE2-CD1 4.48Å; F740-L773 HydrophobicContact CZ-CB 3.81Å; F740-L773 HydrophobicContact CZ-CD1 4.4Å; A764-L773 HydrophobicContact CB-CD1 4.33Å; A764-L773 HydrophobicContact CB-CD2 3.97Å; L773-P775 HydrophobicContact CD1-CB 4.35Å; L773-P775 HydrophobicContact CD1-CG 4.48Å; L773-F926 HydrophobicContact CD2-CZ 4.03Å; L773-F926 HydrophobicContact CG-CE1 4.32Å; L773-F926 HydrophobicContact CG-CZ 4.17Å; L773-S928 WeakPolarHBondContact O-CA 3.43Å; L773-R929 PolarHBondContact N-O 3.39Å; L773-R929 PolarHBondContact O-N 3.46Å; L773-R929 VanDerWaalsContact O-N 3.17Å; L773-V931 HydrophobicContact CB-CG2 3.56Å; L773-V931 HydrophobicContact CD2-CG2 3.84Å; L773-V931 HydrophobicContact CG-CG2 4.35Å; L773-T937 HydrophobicContact CD2-CG2 4.01Å; L773-L939 HydrophobicContact CD2-CD1 4.41Å; L773-L939 HydrophobicContact CD2-CD2 4.36Å; L773-H965 WeakPolarHBondContact CD1-CE1 3.2Å; L773-H965 WeakPolarHBondContact CD1-ND1 3.43Å
774	N	84.5	Confident	82	Confident	73 Å²	73	29.2 Å²	29.2	39%	0.39	16%	0.156	S	C	.	.			trans	-131.4	84.7	171.1	-174	22.1	0	0	0	110.5
775	P	82.4	Confident	82.2	Confident	8 Å²	8	31.3 Å²	31.3	5%	0.052	17%	0.17	C	C	.	.			trans	-81.4	135.1	-169.8	32.7	-33.1	0	0	0	111.8	L773 F926 L939 F941	L773-P775 HydrophobicContact CD1-CB 4.35Å; L773-P775 HydrophobicContact CD1-CG 4.48Å; P775-F926 VanDerWaalsContact CD-CE1 3.45Å; P775-F926 HydrophobicContact CG-CD1 3.8Å; P775-F926 HydrophobicContact CG-CE1 3.96Å; P775-F926 HydrophobicContact CG-CG 4.37Å; P775-L939 HydrophobicContact CB-CD1 3.7Å; P775-L939 HydrophobicContact CG-CD1 3.73Å; P775-L939 HydrophobicContact CG-CD2 4.01Å; P775-F941 HydrophobicContact CB-CZ 4.13Å
776	T	80.7	Confident	82.5	Confident	45 Å²	45	29.9 Å²	29.9	28%	0.276	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	143.1	173.9	58	0	0	0	0	111.1	I963 N964	T776-I963 WeakPolarHBondContact O-CA 3.31Å; T776-N964 PolarHBondContact N-O 3.02Å; T776-N964 PolarHBondContact O-N 2.74Å; T776-N964 VanDerWaalsContact O-N 3.13Å; T776-N964 WeakPolarHBondContact OG1-CB 3.19Å; T776-N964 PolarHBondContact OG1-O 2.94Å; T776-N964 VanDerWaalsContact OG1-O 3.13Å
777	M	79.1	Confident	83	Confident	1 Å²	1	37 Å²	37	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	124.1	179	-175	167.2	82.4	0	0	109.3	I747 W749 A909 F941 L961	I747-M777 HydrophobicContact CD1-SD 4.08Å; W749-M777 HydrophobicContact CH2-CE 3.59Å; W749-M777 HydrophobicContact CZ2-CE 3.32Å; W749-M777 HydrophobicContact CZ3-CE 4.46Å; M777-A909 HydrophobicContact CB-CB 4.14Å; M777-A909 HydrophobicContact CE-CB 3.45Å; M777-A909 VanDerWaalsContact CE-CB 3.45Å; M777-A909 HydrophobicContact CG-CB 4.34Å; M777-A909 PolarHBondContact O-N 2.81Å; M777-F941 HydrophobicContact CB-CD1 3.85Å; M777-F941 HydrophobicContact CB-CE1 3.57Å; M777-F941 HydrophobicContact CB-CZ 4.22Å; M777-F941 HydrophobicContact CE-CB 3.47Å; M777-F941 VanDerWaalsContact CE-CB 3.47Å; M777-F941 HydrophobicContact CE-CD1 3.75Å; M777-F941 HydrophobicContact CE-CD2 4.37Å; M777-F941 HydrophobicContact CE-CG 3.62Å; M777-F941 HydrophobicContact SD-CD1 4.28Å; M777-F941 HydrophobicContact SD-CG 4.24Å; M777-L961 HydrophobicContact CE-CD1 4.14Å; M777-L961 HydrophobicContact CG-CB 4.06Å; M777-L961 HydrophobicContact CG-CD1 3.97Å; M777-L961 HydrophobicContact CG-CD2 3.48Å; M777-L961 VanDerWaalsContact CG-CD2 3.48Å; M777-L961 HydrophobicContact CG-CG 4.03Å; M777-L961 HydrophobicContact SD-CB 4.5Å; M777-L961 HydrophobicContact SD-CD1 3.76Å; M777-L961 HydrophobicContact SD-CD2 4.4Å; M777-L961 HydrophobicContact SD-CG 4.44Å
778	S	79.2	Confident	83.8	Confident	8 Å²	8	38 Å²	38	6%	0.056	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	132.6	-170.8	63.6	0	0	0	0	112.9	R780 I907 L961 P962	S778-R780 PolarHBondContact OG-NE 2.97Å; S778-I907 CarbonylContact C-O 3.56Å; S778-I907 WeakPolarHBondContact CA-O 3.19Å; S778-L961 VanDerWaalsContact O-CD2 3.24Å; S778-L961 WeakPolarHBondContact O-CD2 3.32Å; S778-P962 WeakPolarHBondContact O-CD 3.47Å
779	F	78.3	Confident	84.7	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.009	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	115.6	171.1	-58.5	-88.2	0	0	0	108.6	W749 N906 I907 A909 P944 F959 L961	W749-F779 HydrophobicContact CD2-CZ 4.29Å; W749-F779 AromaticContact CE3-CE1 3.85Å; W749-F779 HydrophobicContact CE3-CE1 3.85Å; W749-F779 HydrophobicContact CE3-CE2 4.38Å; W749-F779 AromaticContact CE3-CZ 3.35Å; W749-F779 HydrophobicContact CE3-CZ 3.35Å; W749-F779 HydrophobicContact CH2-CE2 4.41Å; W749-F779 AromaticContact CH2-CZ 3.98Å; W749-F779 HydrophobicContact CH2-CZ 3.98Å; W749-F779 HydrophobicContact CZ3-CE1 4.07Å; W749-F779 AromaticContact CZ3-CE2 3.76Å; W749-F779 HydrophobicContact CZ3-CE2 3.76Å; W749-F779 AromaticContact CZ3-CZ 3.13Å; W749-F779 HydrophobicContact CZ3-CZ 3.13Å; F779-N906 WeakPolarHBondContact O-CA 3.36Å; F779-I907 HydrophobicContact CB-CB 4Å; F779-I907 HydrophobicContact CD2-CB 4.17Å; F779-I907 HydrophobicContact CD2-CG2 4.37Å; F779-I907 VanDerWaalsContact CD2-O 3.27Å; F779-I907 WeakPolarHBondContact CD2-O 3.37Å; F779-I907 HydrophobicContact CG-CB 4.41Å; F779-I907 PolarHBondContact N-O 3.32Å; F779-I907 PolarHBondContact O-N 3.39Å; F779-I907 VanDerWaalsContact O-N 3.08Å; F779-A909 HydrophobicContact CE2-CB 4.03Å; F779-P944 HydrophobicContact CD2-CG 4.35Å; F779-P944 HydrophobicContact CE2-CG 4.24Å; F779-F959 HydrophobicContact CB-CD1 4.1Å; F779-F959 HydrophobicContact CD1-CB 3.28Å; F779-F959 AromaticContact CD1-CD1 3.69Å; F779-F959 HydrophobicContact CD1-CD1 3.69Å; F779-F959 AromaticContact CD1-CD2 3.97Å; F779-F959 HydrophobicContact CD1-CD2 3.97Å; F779-F959 AromaticContact CD1-CG 3.39Å; F779-F959 HydrophobicContact CD1-CG 3.39Å; F779-F959 HydrophobicContact CE1-CB 3.7Å; F779-F959 HydrophobicContact CE1-CD2 4.2Å; F779-F959 AromaticContact CE1-CG 3.98Å; F779-F959 HydrophobicContact CE1-CG 3.98Å; F779-F959 HydrophobicContact CG-CB 4.44Å; F779-F959 HydrophobicContact CG-CD1 4.33Å; F779-F959 HydrophobicContact CG-CG 4.42Å; F779-L961 HydrophobicContact CD1-CD2 3.76Å; F779-L961 HydrophobicContact CD1-CG 4.31Å; F779-L961 HydrophobicContact CD2-CD2 4Å; F779-L961 HydrophobicContact CE1-CD1 3.81Å; F779-L961 HydrophobicContact CE1-CD2 3.57Å; F779-L961 HydrophobicContact CE1-CG 3.89Å; F779-L961 HydrophobicContact CE2-CD2 3.83Å; F779-L961 HydrophobicContact CG-CD2 3.89Å; F779-L961 HydrophobicContact CZ-CD1 3.83Å; F779-L961 HydrophobicContact CZ-CD2 3.52Å; F779-L961 HydrophobicContact CZ-CG 4.13Å
780	R	81.9	Confident	85.5	Confident	91 Å²	91	47.2 Å²	47.2	34%	0.343	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-31.4	-174.4	-62.5	-173.5	178.7	-174.8	5.4	114	S778 L903 P962	S778-R780 PolarHBondContact OG-NE 2.97Å; R780-L903 WeakPolarHBondContact O-CB 3.48Å; R780-L903 PolarHBondContact O-N 3.34Å; R780-P962 VanDerWaalsContact NE-CG 3.28Å
781	S	83.2	Confident	86.2	Confident	7 Å²	7	46.5 Å²	46.5	5%	0.049	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	150.2	-172.3	-52.1	0	0	0	0	111.1	E900 C901	S781-E900 VanDerWaalsContact CB-CG 3.41Å; S781-E900 WeakPolarHBondContact CB-OE1 3.48Å; S781-E900 PolarHBondContact OG-OE1 2.96Å; S781-C901 CarbonylContact C-O 3.53Å; S781-C901 WeakPolarHBondContact CA-O 3.38Å
782	L	82.3	Confident	87	Confident	10 Å²	10	47.8 Å²	47.8	5%	0.052	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	120.5	172.9	-178	68.6	0	0	0	108.5	C901 L903 W957 F959	L782-C901 HydrophobicContact CB-CB 4.34Å; L782-C901 PolarHBondContact N-O 2.9Å; L782-C901 PolarHBondContact O-N 3.12Å; L782-L903 HydrophobicContact CB-CD2 4.28Å; L782-W957 HydrophobicContact CD1-CB 3.78Å; L782-W957 HydrophobicContact CD1-CD2 3.67Å; L782-W957 HydrophobicContact CD1-CE3 3.31Å; L782-W957 HydrophobicContact CD1-CG 3.89Å; L782-W957 HydrophobicContact CD1-CZ3 4.05Å; L782-W957 HydrophobicContact CD2-CD2 4.47Å; L782-W957 HydrophobicContact CD2-CE3 3.73Å; L782-W957 HydrophobicContact CD2-CH2 4.19Å; L782-W957 HydrophobicContact CD2-CZ3 3.53Å; L782-W957 HydrophobicContact CG-CD2 4.28Å; L782-W957 HydrophobicContact CG-CE3 3.45Å; L782-W957 VanDerWaalsContact CG-CE3 3.45Å; L782-W957 HydrophobicContact CG-CZ3 3.71Å; L782-F959 HydrophobicContact CD1-CE1 4.11Å; L782-F959 HydrophobicContact CD1-CZ 4.22Å
783	C	84.1	Confident	87.5	Confident	18 Å²	18	44.1 Å²	44.1	12%	0.122	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	124.3	177.4	-59.8	0	0	0	0	110.7	I899 F958	C783-I899 WeakPolarHBondContact CA-O 3.45Å; C783-F958 HydrophobicContact CB-CB 4.44Å; C783-F958 WeakPolarHBondContact CB-O 3.45Å; C783-F958 PolarHBondContact N-O 2.82Å
784	V	85.9	Confident	88.1	Confident	30 Å²	30	46 Å²	46	18%	0.182	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	109.6	179.3	-160.7	0	0	0	0	109	L786 F898 I899 W957	V784-L786 HydrophobicContact CG1-CD2 4.34Å; V784-F898 CarbonylContact O-C 3.57Å; V784-F898 VanDerWaalsContact O-CA 3.31Å; V784-F898 WeakPolarHBondContact O-CA 3.36Å; V784-I899 HydrophobicContact CB-CB 4.3Å; V784-I899 HydrophobicContact CG2-CB 4.46Å; V784-I899 PolarHBondContact N-O 3.41Å; V784-I899 PolarHBondContact O-N 2.87Å; V784-W957 HydrophobicContact CB-CZ3 4.14Å; V784-W957 HydrophobicContact CG1-CH2 4.38Å; V784-W957 HydrophobicContact CG1-CZ3 3.95Å; V784-W957 HydrophobicContact CG2-CE3 4.36Å; V784-W957 HydrophobicContact CG2-CH2 4.48Å; V784-W957 HydrophobicContact CG2-CZ3 3.58Å
785	P	89.5	Confident	88.5	Confident	46 Å²	46	47.2 Å²	47.2	30%	0.299	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	137.6	174.4	28.6	-32	0	0	0	110.6	I897 F898	P785-I897 CarbonylContact C-O 3.58Å; P785-I897 WeakPolarHBondContact CA-O 3.39Å; P785-F898 HydrophobicContact CB-CD1 3.86Å; P785-F898 HydrophobicContact CB-CE1 3.79Å
786	L	92.1	Very high	88.9	Confident	27 Å²	27	47.8 Å²	47.8	14%	0.141	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.9	177.6	-58	174.3	0	0	0	110.5	V784 Y815 F817 G896 I897 I899	V784-L786 HydrophobicContact CG1-CD2 4.34Å; L786-Y815 HydrophobicContact CB-CD1 3.93Å; L786-F817 HydrophobicContact CD1-CB 3.72Å; L786-F817 HydrophobicContact CD1-CD1 4.2Å; L786-F817 HydrophobicContact CD1-CG 4.17Å; L786-F817 HydrophobicContact CD2-CB 4.05Å; L786-G896 WeakPolarHBondContact O-CA 3Å; L786-I897 HydrophobicContact CB-CG1 3.9Å; L786-I897 HydrophobicContact CD1-CD1 4.34Å; L786-I897 HydrophobicContact CD1-CG1 4.39Å; L786-I897 PolarHBondContact N-O 3.43Å; L786-I897 PolarHBondContact O-N 2.81Å; L786-I899 HydrophobicContact CD1-CD1 4.3Å; L786-I899 HydrophobicContact CD1-CG1 3.47Å; L786-I899 VanDerWaalsContact CD1-CG1 3.47Å; L786-I899 HydrophobicContact CG-CG1 4.37Å
787	K	93.9	Very high	89.1	Confident	152 Å²	152	47.3 Å²	47.3	66%	0.661	25%	0.25	S	S	*	.			trans	-108.3	152	164.9	-74.8	-166.4	174.8	-166.6	0	109.5	Y815	K787-Y815 VanDerWaalsContact C-CD1 3.46Å; K787-Y815 WeakPolarHBondContact O-CD1 3.48Å
788	P	96	Very high	89.4	Confident	21 Å²	21	51.6 Å²	51.6	14%	0.136	28%	0.278	C	S	.	.			trans	-66.8	136.8	177.6	25.5	-28.7	0	0	0	110	N813 T814 Y815 K893	P788-N813 HydrophobicContact CB-CB 4.08Å; P788-T814 CarbonylContact C-O 3.59Å; P788-T814 VanDerWaalsContact CA-O 3.28Å; P788-T814 WeakPolarHBondContact CA-O 3.24Å; P788-Y815 HydrophobicContact CB-CD1 4.25Å; P788-Y815 HydrophobicContact CB-CE1 3.82Å; P788-Y815 HydrophobicContact CB-CE2 4.43Å; P788-Y815 HydrophobicContact CG-CE1 4.15Å; P788-Y815 VanDerWaalsContact N-CE1 3.28Å; P788-K893 WeakPolarHBondContact CG-O 3.24Å
789	I	96.5	Very high	89.8	Confident	106 Å²	106	53.3 Å²	53.3	54%	0.544	28%	0.284	S	S	.	.	S	Bend	trans	-84.3	-21.3	172.5	56.3	156.6	0	0	0	111.8	T814 E816	I789-T814 HydrophobicContact CD1-CG2 4.22Å; I789-T814 HydrophobicContact CG1-CG2 4.19Å; I789-T814 VanDerWaalsContact CG1-O 3.23Å; I789-T814 WeakPolarHBondContact CG1-O 3.13Å; I789-T814 PolarHBondContact N-O 3.25Å; I789-E816 HydrophobicContact CD1-CB 4.43Å; I789-E816 VanDerWaalsContact CD1-CD 3.43Å; I789-E816 HydrophobicContact CD1-CG 3.62Å; I789-E816 WeakPolarHBondContact CD1-OE1 3.33Å; I789-E816 HydrophobicContact CG1-CG 4.48Å
790	K	96.6	Very high	90.3	Very high	130 Å²	130	53.7 Å²	53.7	57%	0.565	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.6	134.6	179.2	-179.4	179.4	178.4	-179.6	0	108.1	N813 T814	K790-N813 WeakPolarHBondContact O-CA 3.04Å; K790-T814 PolarHBondContact O-N 2.82Å
791	S	96.8	Very high	90.6	Very high	39 Å²	39	52.2 Å²	52.2	27%	0.273	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132	170.4	-174.6	0	0	0	0	109.1	V811 L812 N813 K893	S791-V811 WeakPolarHBondContact OG-CG2 3.11Å; S791-L812 WeakPolarHBondContact CA-O 3.39Å; S791-N813 WeakPolarHBondContact CB-OD1 3.32Å; S791-N813 PolarHBondContact OG-OD1 3.02Å; S791-K893 WeakPolarHBondContact OG-CA 3.47Å
792	L	96.6	Very high	90.6	Very high	82 Å²	82	53.9 Å²	53.9	43%	0.429	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	123.1	179.9	-178.9	71.1	0	0	0	109.7	T794 V811 L812	L792-T794 HydrophobicContact CD1-CG2 4.47Å; L792-T794 HydrophobicContact CD2-CG2 3.83Å; L792-T794 HydrophobicContact CG-CG2 3.88Å; L792-V811 CarbonylContact O-C 3.28Å; L792-V811 WeakPolarHBondContact O-CA 3.41Å; L792-L812 PolarHBondContact N-O 3.3Å; L792-L812 PolarHBondContact O-N 2.97Å
793	I	95.7	Very high	90.4	Very high	30 Å²	30	56.6 Å²	56.6	15%	0.154	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	134.3	169.9	-61.4	-178.2	0	0	0	108.5	Q810 V811 E886 L889 I890 K893	I793-Q810 CarbonylContact C-O 3.5Å; I793-Q810 VanDerWaalsContact CA-O 3.27Å; I793-Q810 WeakPolarHBondContact CA-O 3.47Å; I793-V811 HydrophobicContact CG1-CB 4.03Å; I793-V811 HydrophobicContact CG1-CG2 3.89Å; I793-E886 HydrophobicContact CG2-CG 4.22Å; I793-L889 HydrophobicContact CD1-CB 4.16Å; I793-I890 HydrophobicContact CD1-CB 4.42Å; I793-I890 HydrophobicContact CD1-CG1 3.73Å; I793-K893 HydrophobicContact CD1-CD 4.46Å; I793-K893 HydrophobicContact CD1-CG 4.3Å
794	T	95	Very high	90.2	Very high	40 Å²	40	60 Å²	60	25%	0.245	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	150.4	178	51.1	0	0	0	0	111.5	L792 Q810	L792-T794 HydrophobicContact CD1-CG2 4.47Å; L792-T794 HydrophobicContact CD2-CG2 3.83Å; L792-T794 HydrophobicContact CG-CG2 3.88Å; T794-Q810 PolarHBondContact N-O 3.31Å; T794-Q810 PolarHBondContact O-N 2.96Å; T794-Q810 WeakPolarHBondContact OG1-CG 3.26Å; T794-Q810 PolarHBondContact OG1-NE2 2.99Å
795	N	93	Very high	90.1	Very high	99 Å²	99	61 Å²	61	53%	0.529	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	138.2	169.5	-53.7	9.2	0	0	0	108.1	Q807 Y809	N795-Q807 HydrophobicContact CB-CG 4.32Å; N795-Y809 HydrophobicContact CB-CD1 4.47Å; N795-Y809 WeakPolarHBondContact OD1-CD1 3.32Å; N795-Y809 WeakPolarHBondContact OD1-CE1 3.47Å
796	L	90.7	Very high	90.1	Very high	20 Å²	20	64.9 Å²	64.9	11%	0.105	35%	0.347	C	S	.	.			trans	-85.4	163	176.8	-67	160.3	0	0	0	111.6	D800 Q807 C808 Q810 R882	L796-D800 HydrophobicContact CB-CB 3.55Å; L796-D800 HydrophobicContact CD1-CB 4.1Å; L796-D800 HydrophobicContact CG-CB 4.43Å; L796-Q807 PolarHBondContact O-NE2 2.96Å; L796-C808 WeakPolarHBondContact CB-O 3.48Å; L796-C808 HydrophobicContact CD1-CB 4.08Å; L796-C808 PolarHBondContact N-O 3.5Å; L796-Q810 HydrophobicContact CD1-CB 4.27Å; L796-Q810 HydrophobicContact CD2-CB 4.3Å; L796-Q810 VanDerWaalsContact CD2-CD 3.5Å; L796-Q810 HydrophobicContact CD2-CG 3.94Å; L796-Q810 HydrophobicContact CG-CB 4.33Å; L796-Q810 HydrophobicContact CG-CG 4.2Å; L796-R882 HydrophobicContact CD1-CG 4.34Å; L796-R882 VanDerWaalsContact CD1-NH1 3.32Å
797	G	85.6	Confident	90	Very high	35 Å²	35	66.1 Å²	66.1	36%	0.361	35%	0.352	S	S	.	.			trans	-73.2	-179.3	-177.7	0	0	0	0	0	114.4	R799 D800	G797-R799 PolarHBondContact O-N 3.22Å; G797-R799 VanDerWaalsContact O-N 3.08Å; G797-D800 PolarHBondContact O-N 2.83Å
798	P	84.5	Confident	89.9	Confident	91 Å²	91	58.9 Å²	58.9	59%	0.591	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-57	-27.5	-176.3	-25.6	34.3	0	0	0	115.1	D800 L801	P798-D800 PolarHBondContact O-N 3.05Å; P798-L801 PolarHBondContact O-N 2.78Å
799	R	87.7	Confident	89.8	Confident	44 Å²	44	60 Å²	60	17%	0.166	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-60.3	-24.6	175	-177.8	176.7	67.5	173.6	-4.9	113.1	D102 R324 G797	D102-R799 VanDerWaalsContact CG-NH1 3.3Å; D102-R799 IonicContact OD1-CZ 2.7Å; D102-R799 IonicContact OD1-NH1 3.75Å; D102-R799 PolarHBondContact OD1-NH1 3.02Å; D102-R799 IonicContact OD2-CZ 3.09Å; D102-R799 VanDerWaalsContact OD2-CZ 3.28Å; D102-R799 IonicContact OD2-NH1 2.72Å; D102-R799 PolarHBondContact OD2-NH1 2.73Å; D102-R799 IonicContact OD2-NH2 3.18Å; D102-R799 PolarHBondContact OD2-NH2 3.06Å; R324-R799 VanDerWaalsContact NH2-NH2 3.11Å; G797-R799 PolarHBondContact O-N 3.22Å; G797-R799 VanDerWaalsContact O-N 3.08Å
800	D	89.1	Confident	89.8	Confident	9 Å²	9	56.2 Å²	56.2	5%	0.048	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-107.4	20	-172.1	-68.4	-47.1	0	0	0	112.5	R324 L796 G797 P798 C808 R882	R324-D800 IonicContact CZ-OD1 3.62Å; R324-D800 IonicContact NE-OD1 3.93Å; R324-D800 PolarHBondContact NE-OD1 3.04Å; R324-D800 VanDerWaalsContact NH2-CG 3.31Å; R324-D800 IonicContact NH2-OD1 2.79Å; R324-D800 PolarHBondContact NH2-OD1 3.49Å; R324-D800 IonicContact NH2-OD2 2.6Å; R324-D800 PolarHBondContact NH2-OD2 2.77Å; L796-D800 HydrophobicContact CB-CB 3.55Å; L796-D800 HydrophobicContact CD1-CB 4.1Å; L796-D800 HydrophobicContact CG-CB 4.43Å; G797-D800 PolarHBondContact O-N 2.83Å; P798-D800 PolarHBondContact O-N 3.05Å; D800-C808 HydrophobicContact CB-CB 4.28Å; D800-C808 WeakPolarHBondContact O-CB 3.46Å; D800-R882 IonicContact OD1-CZ 2.7Å; D800-R882 IonicContact OD1-NH1 2.84Å; D800-R882 IonicContact OD1-NH2 2.96Å; D800-R882 PolarHBondContact OD1-NH2 3.33Å; D800-R882 IonicContact OD2-CZ 2.8Å; D800-R882 IonicContact OD2-NH1 2.92Å; D800-R882 PolarHBondContact OD2-NH1 3.46Å; D800-R882 IonicContact OD2-NH2 2.69Å; D800-R882 PolarHBondContact OD2-NH2 3.39Å
801	L	87.4	Confident	89.7	Confident	61 Å²	61	50 Å²	50	32%	0.319	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-80.5	141.5	170.3	-65.6	174.6	0	0	0	110.6	P798 Q807	P798-L801 PolarHBondContact O-N 2.78Å; L801-Q807 HydrophobicContact CD2-CB 4.43Å
802	Y	82.7	Confident	89.7	Confident	41 Å²	41	50.4 Å²	50.4	16%	0.161	27%	0.274	C	S	.	.			trans	-70.3	159.7	166.9	-77.9	-109.5	0	0	0	109.9	L323 D804 G805 R806 C808 V884	L323-Y802 HydrophobicContact CD1-CD1 3.79Å; L323-Y802 HydrophobicContact CD1-CE1 3.39Å; L323-Y802 HydrophobicContact CD1-CE2 4.45Å; L323-Y802 HydrophobicContact CD1-CG 4.47Å; L323-Y802 HydrophobicContact CD2-CD2 4.33Å; L323-Y802 HydrophobicContact CD2-CE1 4.05Å; L323-Y802 HydrophobicContact CD2-CE2 3.65Å; L323-Y802 VanDerWaalsContact CD2-CZ 3.49Å; L323-Y802 HydrophobicContact CG-CE1 4.36Å; Y802-D804 VanDerWaalsContact CB-OD1 3.24Å; Y802-D804 WeakPolarHBondContact CB-OD1 3.44Å; Y802-D804 PolarHBondContact O-N 2.97Å; Y802-G805 WeakPolarHBondContact O-CA 3.39Å; Y802-G805 PolarHBondContact O-N 3.42Å; Y802-R806 HydrophobicContact CD2-CB 4.48Å; Y802-R806 HydrophobicContact CG-CB 4.47Å; Y802-R806 PolarHBondContact N-O 3.33Å; Y802-C808 HydrophobicContact CE2-CB 4.29Å; Y802-V884 HydrophobicContact CD2-CG2 3.6Å; Y802-V884 HydrophobicContact CE2-CB 3.84Å; Y802-V884 HydrophobicContact CE2-CG2 3.36Å; Y802-V884 HydrophobicContact CG-CG2 4.41Å
803	N	78.1	Confident	89.8	Confident	68 Å²	68	46.5 Å²	46.5	36%	0.364	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.9	179.4	62.8	-34.3	0	0	0	113.8	T327 D349 G805	T327-N803 HydrophobicContact CG2-CB 4.21Å; D349-N803 PolarHBondContact OD2-ND2 3.38Å; N803-G805 PolarHBondContact O-N 2.96Å
804	D	81.2	Confident	89.8	Confident	90 Å²	90	46.1 Å²	46.1	48%	0.481	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	3.5	173	61.2	14.6	0	0	0	113.9	Y802 R806	Y802-D804 VanDerWaalsContact CB-OD1 3.24Å; Y802-D804 WeakPolarHBondContact CB-OD1 3.44Å; Y802-D804 PolarHBondContact O-N 2.97Å; D804-R806 VanDerWaalsContact CG-NE 3.31Å; D804-R806 VanDerWaalsContact OD1-CB 3.31Å; D804-R806 WeakPolarHBondContact OD1-CB 3.4Å; D804-R806 VanDerWaalsContact OD1-CG 3.32Å; D804-R806 WeakPolarHBondContact OD1-CG 3.28Å; D804-R806 PolarHBondContact OD1-N 3.08Å; D804-R806 IonicContact OD1-NE 2.78Å; D804-R806 PolarHBondContact OD1-NE 2.97Å; D804-R806 IonicContact OD2-CZ 3.87Å; D804-R806 IonicContact OD2-NE 3.27Å; D804-R806 PolarHBondContact OD2-NE 2.86Å; D804-R806 IonicContact OD2-NH2 2.87Å; D804-R806 PolarHBondContact OD2-NH2 3.44Å
805	G	84.4	Confident	89.9	Confident	51 Å²	51	44.2 Å²	44.2	53%	0.526	24%	0.241	S	C	.	.			trans	85.4	1	-180	0	0	0	0	0	114.6	Y802 N803 Q807	Y802-G805 WeakPolarHBondContact O-CA 3.39Å; Y802-G805 PolarHBondContact O-N 3.42Å; N803-G805 PolarHBondContact O-N 2.96Å; G805-Q807 PolarHBondContact O-N 3.34Å
806	R	88.1	Confident	90	Very high	127 Å²	127	45.1 Å²	45.1	48%	0.479	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-62.7	136.4	175.3	-73.2	-178.2	-69.6	171.6	-8.5	111.5	Y802 D804 V884	Y802-R806 HydrophobicContact CD2-CB 4.48Å; Y802-R806 HydrophobicContact CG-CB 4.47Å; Y802-R806 PolarHBondContact N-O 3.33Å; D804-R806 VanDerWaalsContact CG-NE 3.31Å; D804-R806 VanDerWaalsContact OD1-CB 3.31Å; D804-R806 WeakPolarHBondContact OD1-CB 3.4Å; D804-R806 VanDerWaalsContact OD1-CG 3.32Å; D804-R806 WeakPolarHBondContact OD1-CG 3.28Å; D804-R806 PolarHBondContact OD1-N 3.08Å; D804-R806 IonicContact OD1-NE 2.78Å; D804-R806 PolarHBondContact OD1-NE 2.97Å; D804-R806 IonicContact OD2-CZ 3.87Å; D804-R806 IonicContact OD2-NE 3.27Å; D804-R806 PolarHBondContact OD2-NE 2.86Å; D804-R806 IonicContact OD2-NH2 2.87Å; D804-R806 PolarHBondContact OD2-NH2 3.44Å; R806-V884 HydrophobicContact CB-CG2 3.82Å
807	Q	90	Very high	90.2	Very high	53 Å²	53	44.9 Å²	44.9	25%	0.248	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-77.4	134.1	178.9	-178.3	61.5	66.4	0	0	111	N795 L796 L801 G805 Y809 V884	N795-Q807 HydrophobicContact CB-CG 4.32Å; L796-Q807 PolarHBondContact O-NE2 2.96Å; L801-Q807 HydrophobicContact CD2-CB 4.43Å; G805-Q807 PolarHBondContact O-N 3.34Å; Q807-Y809 HydrophobicContact CB-CE2 4.04Å; Q807-Y809 HydrophobicContact CG-CD2 4.47Å; Q807-Y809 HydrophobicContact CG-CE1 4.41Å; Q807-Y809 HydrophobicContact CG-CE2 3.99Å; Q807-Y809 WeakPolarHBondContact O-CD2 3.43Å; Q807-Y809 WeakPolarHBondContact O-CE2 3.36Å; Q807-V884 VanDerWaalsContact O-CG2 3.3Å; Q807-V884 WeakPolarHBondContact O-CG2 3.4Å
808	C	92	Very high	90.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-93.7	140.3	168.5	-166.6	0	0	0	0	110.6	L796 D800 Y802 C842	L796-C808 WeakPolarHBondContact CB-O 3.48Å; L796-C808 HydrophobicContact CD1-CB 4.08Å; L796-C808 PolarHBondContact N-O 3.5Å; D800-C808 HydrophobicContact CB-CB 4.28Å; D800-C808 WeakPolarHBondContact O-CB 3.46Å; Y802-C808 HydrophobicContact CE2-CB 4.29Å; C808-C842 VanDerWaalsContact SG-SG 3.62Å
809	Y	94.8	Very high	90.9	Very high	45 Å²	45	42.7 Å²	42.7	18%	0.176	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	161.8	-179.9	-59.6	-100.3	0	0	0	110.1	N795 Q807 R882 H883 V884 E886	N795-Y809 HydrophobicContact CB-CD1 4.47Å; N795-Y809 WeakPolarHBondContact OD1-CD1 3.32Å; N795-Y809 WeakPolarHBondContact OD1-CE1 3.47Å; Q807-Y809 HydrophobicContact CB-CE2 4.04Å; Q807-Y809 HydrophobicContact CG-CD2 4.47Å; Q807-Y809 HydrophobicContact CG-CE1 4.41Å; Q807-Y809 HydrophobicContact CG-CE2 3.99Å; Q807-Y809 WeakPolarHBondContact O-CD2 3.43Å; Q807-Y809 WeakPolarHBondContact O-CE2 3.36Å; Y809-R882 VanDerWaalsContact O-CA 3.31Å; Y809-R882 WeakPolarHBondContact O-CA 3.47Å; Y809-H883 PolarHBondContact N-O 2.98Å; Y809-H883 PolarHBondContact O-N 3.15Å; Y809-H883 VanDerWaalsContact O-N 3.11Å; Y809-V884 WeakPolarHBondContact CD2-O 3.26Å; Y809-V884 WeakPolarHBondContact CE2-O 3.43Å; Y809-E886 HydrophobicContact CD1-CB 4.18Å; Y809-E886 HydrophobicContact CD1-CG 4.14Å; Y809-E886 HydrophobicContact CD2-CB 4.29Å; Y809-E886 HydrophobicContact CE1-CB 4.19Å; Y809-E886 HydrophobicContact CE1-CG 4.29Å; Y809-E886 WeakPolarHBondContact CE1-OE2 3.36Å; Y809-E886 HydrophobicContact CE2-CB 4.36Å; Y809-E886 HydrophobicContact CG-CB 4.22Å
810	Q	95.3	Very high	90.7	Very high	26 Å²	26	45.3 Å²	45.3	12%	0.121	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	148.8	170	66.5	177.7	-22.2	0	0	111.3	I793 T794 L796 V881 R882	I793-Q810 CarbonylContact C-O 3.5Å; I793-Q810 VanDerWaalsContact CA-O 3.27Å; I793-Q810 WeakPolarHBondContact CA-O 3.47Å; T794-Q810 PolarHBondContact N-O 3.31Å; T794-Q810 PolarHBondContact O-N 2.96Å; T794-Q810 WeakPolarHBondContact OG1-CG 3.26Å; T794-Q810 PolarHBondContact OG1-NE2 2.99Å; L796-Q810 HydrophobicContact CD1-CB 4.27Å; L796-Q810 HydrophobicContact CD2-CB 4.3Å; L796-Q810 VanDerWaalsContact CD2-CD 3.5Å; L796-Q810 HydrophobicContact CD2-CG 3.94Å; L796-Q810 HydrophobicContact CG-CB 4.33Å; L796-Q810 HydrophobicContact CG-CG 4.2Å; Q810-V881 CarbonylContact C-O 3.11Å; Q810-V881 VanDerWaalsContact CA-O 3.24Å; Q810-V881 WeakPolarHBondContact CA-O 3.48Å; Q810-R882 HydrophobicContact CB-CG 3.97Å
811	V	96.1	Very high	90.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.7	161.5	65.2	0	0	0	0	109.3	S791 L792 I793 N813 Q880 V881 L889 L892	S791-V811 WeakPolarHBondContact OG-CG2 3.11Å; L792-V811 CarbonylContact O-C 3.28Å; L792-V811 WeakPolarHBondContact O-CA 3.41Å; I793-V811 HydrophobicContact CG1-CB 4.03Å; I793-V811 HydrophobicContact CG1-CG2 3.89Å; V811-N813 WeakPolarHBondContact CG2-OD1 3.32Å; V811-Q880 WeakPolarHBondContact O-CA 3.34Å; V811-V881 HydrophobicContact CG1-CB 3.75Å; V811-V881 HydrophobicContact CG1-CG2 4.26Å; V811-V881 PolarHBondContact N-O 2.86Å; V811-V881 PolarHBondContact O-N 3.17Å; V811-L889 HydrophobicContact CB-CB 4.37Å; V811-L889 HydrophobicContact CG1-CD2 4.05Å; V811-L892 HydrophobicContact CG1-CB 4.19Å; V811-L892 HydrophobicContact CG1-CD1 4.25Å
812	L	96.9	Very high	90.7	Very high	46 Å²	46	45.5 Å²	45.5	24%	0.241	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	104.4	175.6	-66.5	173.8	0	0	0	109.2	S791 L792 I878 L879 Q880	S791-L812 WeakPolarHBondContact CA-O 3.39Å; L792-L812 PolarHBondContact N-O 3.3Å; L792-L812 PolarHBondContact O-N 2.97Å; L812-I878 HydrophobicContact CD2-CG2 4.3Å; L812-L879 CarbonylContact C-O 3.56Å; L812-L879 WeakPolarHBondContact CA-O 3.5Å; L812-Q880 HydrophobicContact CD2-CB 3.74Å; L812-Q880 HydrophobicContact CD2-CG 3.77Å
813	N	97.1	Very high	91.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	122.1	176.5	-72.8	-14.4	0	0	0	110.1	P788 K790 S791 V811 Y815 I878 L879 L892	P788-N813 HydrophobicContact CB-CB 4.08Å; K790-N813 WeakPolarHBondContact O-CA 3.04Å; S791-N813 WeakPolarHBondContact CB-OD1 3.32Å; S791-N813 PolarHBondContact OG-OD1 3.02Å; V811-N813 WeakPolarHBondContact CG2-OD1 3.32Å; N813-Y815 HydrophobicContact CB-CD2 4.47Å; N813-Y815 HydrophobicContact CB-CE2 3.52Å; N813-Y815 PolarHBondContact ND2-OH 3.3Å; N813-I878 CarbonylContact O-C 3.54Å; N813-I878 WeakPolarHBondContact O-CA 3.29Å; N813-L879 HydrophobicContact CB-CB 4.28Å; N813-L879 PolarHBondContact N-O 3.45Å; N813-L879 PolarHBondContact O-N 3.33Å; N813-L892 PolarHBondContact ND2-O 3.45Å
814	T	97.3	Very high	92	Very high	22 Å²	22	42.4 Å²	42.4	14%	0.135	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.9	176.6	-56.1	0	0	0	0	110.1	P788 I789 K790 K876 L877 I878	P788-T814 CarbonylContact C-O 3.59Å; P788-T814 VanDerWaalsContact CA-O 3.28Å; P788-T814 WeakPolarHBondContact CA-O 3.24Å; I789-T814 HydrophobicContact CD1-CG2 4.22Å; I789-T814 HydrophobicContact CG1-CG2 4.19Å; I789-T814 VanDerWaalsContact CG1-O 3.23Å; I789-T814 WeakPolarHBondContact CG1-O 3.13Å; I789-T814 PolarHBondContact N-O 3.25Å; K790-T814 PolarHBondContact O-N 2.82Å; T814-K876 HydrophobicContact CG2-CD 3.84Å; T814-K876 HydrophobicContact CG2-CG 3.75Å; T814-L877 CarbonylContact C-O 3.56Å; T814-L877 WeakPolarHBondContact CA-O 3.46Å; T814-I878 HydrophobicContact CG2-CG1 4.46Å
815	Y	96.6	Very high	92.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141.5	176.7	-53	-100.5	0	0	0	109.1	L786 K787 P788 N813 K876 L877 L879 L895 I897	L786-Y815 HydrophobicContact CB-CD1 3.93Å; K787-Y815 VanDerWaalsContact C-CD1 3.46Å; K787-Y815 WeakPolarHBondContact O-CD1 3.48Å; P788-Y815 HydrophobicContact CB-CD1 4.25Å; P788-Y815 HydrophobicContact CB-CE1 3.82Å; P788-Y815 HydrophobicContact CB-CE2 4.43Å; P788-Y815 HydrophobicContact CG-CE1 4.15Å; P788-Y815 VanDerWaalsContact N-CE1 3.28Å; N813-Y815 HydrophobicContact CB-CD2 4.47Å; N813-Y815 HydrophobicContact CB-CE2 3.52Å; N813-Y815 PolarHBondContact ND2-OH 3.3Å; Y815-K876 CarbonylContact O-C 3.6Å; Y815-K876 WeakPolarHBondContact O-CA 3.28Å; Y815-L877 HydrophobicContact CD2-CD2 3.64Å; Y815-L877 HydrophobicContact CE2-CD2 4.18Å; Y815-L877 HydrophobicContact CG-CD2 4.46Å; Y815-L877 PolarHBondContact N-O 2.95Å; Y815-L877 PolarHBondContact O-N 3.18Å; Y815-L879 HydrophobicContact CE2-CB 3.93Å; Y815-L879 HydrophobicContact CE2-CD2 4.45Å; Y815-L895 WeakPolarHBondContact CE1-O 3.47Å; Y815-L895 PolarHBondContact OH-O 2.94Å; Y815-I897 HydrophobicContact CD1-CD1 3.63Å; Y815-I897 HydrophobicContact CD1-CG1 3.69Å; Y815-I897 HydrophobicContact CD2-CD1 3.72Å; Y815-I897 HydrophobicContact CE1-CB 4.36Å; Y815-I897 HydrophobicContact CE1-CD1 3.86Å; Y815-I897 HydrophobicContact CE1-CG1 3.67Å; Y815-I897 HydrophobicContact CE1-CG2 3.94Å; Y815-I897 HydrophobicContact CE2-CD1 3.96Å; Y815-I897 HydrophobicContact CE2-CG2 4.32Å; Y815-I897 HydrophobicContact CG-CD1 3.56Å; Y815-I897 HydrophobicContact CG-CG1 4.17Å
816	E	95.5	Very high	93	Very high	119 Å²	119	36 Å²	36	56%	0.556	18%	0.182	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.9	171.9	-72.6	-178.9	177.5	0	0	109.3	I789	I789-E816 HydrophobicContact CD1-CB 4.43Å; I789-E816 VanDerWaalsContact CD1-CD 3.43Å; I789-E816 HydrophobicContact CD1-CG 3.62Å; I789-E816 WeakPolarHBondContact CD1-OE1 3.33Å; I789-E816 HydrophobicContact CG1-CG 4.48Å
817	F	94.3	Very high	93.3	Very high	14 Å²	14	30 Å²	30	6%	0.061	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	151.2	178.2	68.7	-79.6	0	0	0	111.5	L786 V819 V825 I848 L870 Y875 L877 I899	L786-F817 HydrophobicContact CD1-CB 3.72Å; L786-F817 HydrophobicContact CD1-CD1 4.2Å; L786-F817 HydrophobicContact CD1-CG 4.17Å; L786-F817 HydrophobicContact CD2-CB 4.05Å; F817-V819 HydrophobicContact CD2-CG2 4.03Å; F817-V819 HydrophobicContact CE2-CG2 3.83Å; F817-V825 HydrophobicContact CE2-CG1 4.44Å; F817-I848 HydrophobicContact CZ-CG2 4.4Å; F817-L870 HydrophobicContact CE2-CD1 4.07Å; F817-L870 HydrophobicContact CZ-CD1 4.08Å; F817-Y875 HydrophobicContact CE2-CD2 4.19Å; F817-Y875 HydrophobicContact CE2-CG 4.36Å; F817-Y875 HydrophobicContact CZ-CG 4.22Å; F817-Y875 PolarHBondContact N-O 3.38Å; F817-Y875 PolarHBondContact O-N 3.02Å; F817-L877 HydrophobicContact CE1-CB 4.17Å; F817-I899 HydrophobicContact CD1-CG1 4.38Å; F817-I899 HydrophobicContact CD2-CG1 4.29Å; F817-I899 HydrophobicContact CD2-CG2 4.1Å; F817-I899 HydrophobicContact CE1-CD1 4.4Å; F817-I899 HydrophobicContact CE2-CG1 4.49Å; F817-I899 HydrophobicContact CE2-CG2 4.02Å; F817-I899 HydrophobicContact CG-CG1 4.23Å; F817-I899 HydrophobicContact CZ-CD1 4.47Å
818	S	93	Very high	93.3	Very high	74 Å²	74	28.9 Å²	28.9	52%	0.517	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	144.9	176.2	-55.3	0	0	0	0	110.2	G873 D874	S818-G873 WeakPolarHBondContact CA-O 3.48Å; S818-D874 WeakPolarHBondContact CB-OD1 3.13Å; S818-D874 PolarHBondContact OG-OD1 3.11Å
819	V	90.5	Very high	93.2	Very high	6 Å²	6	28.9 Å²	28.9	4%	0.036	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.8	176	176.9	0	0	0	0	107.9	F817 F821 T823 V825 L870 K872 G873 Y875	F817-V819 HydrophobicContact CD2-CG2 4.03Å; F817-V819 HydrophobicContact CE2-CG2 3.83Å; V819-F821 WeakPolarHBondContact CG1-O 3.42Å; V819-T823 HydrophobicContact CG1-CG2 3.6Å; V819-V825 HydrophobicContact CG2-CG2 4.27Å; V819-L870 HydrophobicContact CG2-CD1 4.38Å; V819-K872 CarbonylContact O-C 3.54Å; V819-K872 VanDerWaalsContact O-CA 3.24Å; V819-K872 WeakPolarHBondContact O-CA 3.11Å; V819-K872 WeakPolarHBondContact O-CG 3.45Å; V819-G873 PolarHBondContact N-O 2.94Å; V819-G873 PolarHBondContact O-N 3.08Å; V819-Y875 HydrophobicContact CB-CD2 4.43Å; V819-Y875 HydrophobicContact CB-CE2 4.06Å; V819-Y875 HydrophobicContact CG2-CD2 3.9Å; V819-Y875 HydrophobicContact CG2-CE2 3.9Å
820	D	84.8	Confident	92.6	Very high	99 Å²	99	28.5 Å²	28.5	53%	0.529	16%	0.159	S	C	.	.	S	Bend	trans	-84.2	-18.1	-174.3	-72.8	-39.6	0	0	0	114.5	K872	D820-K872 VanDerWaalsContact O-CD 3.31Å; D820-K872 WeakPolarHBondContact O-CD 3.38Å; D820-K872 WeakPolarHBondContact O-CG 3.31Å
821	F	86.4	Confident	91.9	Very high	40 Å²	40	31.4 Å²	31.4	18%	0.175	18%	0.175	C	C	.	.	S	Bend	trans	-150.1	152.5	-176.5	57.7	-87.8	0	0	0	110.8	V819 T823 L903 F951	V819-F821 WeakPolarHBondContact CG1-O 3.42Å; F821-T823 HydrophobicContact CE2-CG2 4.25Å; F821-T823 PolarHBondContact O-N 3.33Å; F821-T823 VanDerWaalsContact O-N 3.1Å; F821-L903 HydrophobicContact CZ-CD2 4.39Å; F821-F951 HydrophobicContact CD1-CE1 4.06Å; F821-F951 HydrophobicContact CE1-CD1 4.4Å; F821-F951 AromaticContact CE1-CE1 3.72Å; F821-F951 HydrophobicContact CE1-CE1 3.72Å; F821-F951 HydrophobicContact CE1-CZ 4.07Å; F821-F951 HydrophobicContact CZ-CE1 4.45Å; F821-F951 HydrophobicContact CZ-CZ 4.37Å
822	S	90.8	Very high	91	Very high	35 Å²	35	31.5 Å²	31.5	25%	0.245	18%	0.176	C	C	.	.	S	Bend	trans	-56.1	119.1	175.3	-174.2	0	0	0	0	110.3	K869 L870 E871	S822-K869 WeakPolarHBondContact OG-CE 3.37Å; S822-L870 VanDerWaalsContact CA-O 3.31Å; S822-L870 WeakPolarHBondContact CA-O 3.4Å; S822-E871 VanDerWaalsContact CB-OE2 3.25Å; S822-E871 WeakPolarHBondContact CB-OE2 3.32Å; S822-E871 VanDerWaalsContact OG-CD 3.28Å; S822-E871 PolarHBondContact OG-OE1 2.81Å; S822-E871 PolarHBondContact OG-OE2 3.32Å
823	T	92.4	Very high	90	Very high	4 Å²	4	29.3 Å²	29.3	3%	0.025	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	164.2	-174.4	-173.8	0	0	0	0	111.9	V819 F821 V825 K869 L870 C901 R902	V819-T823 HydrophobicContact CG1-CG2 3.6Å; F821-T823 HydrophobicContact CE2-CG2 4.25Å; F821-T823 PolarHBondContact O-N 3.33Å; F821-T823 VanDerWaalsContact O-N 3.1Å; T823-V825 HydrophobicContact CG2-CG2 3.85Å; T823-K869 WeakPolarHBondContact O-CA 3.44Å; T823-L870 PolarHBondContact N-O 2.88Å; T823-L870 PolarHBondContact O-N 2.86Å; T823-C901 HydrophobicContact CG2-CB 4.04Å; T823-R902 PolarHBondContact OG1-N 2.87Å; T823-R902 VanDerWaalsContact OG1-N 3.12Å; T823-R902 PolarHBondContact OG1-O 3.38Å
824	T	94	Very high	88.8	Confident	39 Å²	39	32.6 Å²	32.6	24%	0.239	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	123.6	167.1	-54.1	0	0	0	0	108.8	Q867 V868 R902	T824-Q867 HydrophobicContact CG2-CB 3.71Å; T824-Q867 HydrophobicContact CG2-CG 4.4Å; T824-V868 CarbonylContact C-O 3.38Å; T824-V868 WeakPolarHBondContact CA-O 3.39Å; T824-R902 PolarHBondContact O-N 3.35Å
825	V	94.1	Very high	87.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	136.4	-179.5	169.1	0	0	0	0	110.5	F817 V819 T823 V868 L870 I899 E900	F817-V825 HydrophobicContact CE2-CG1 4.44Å; V819-V825 HydrophobicContact CG2-CG2 4.27Å; T823-V825 HydrophobicContact CG2-CG2 3.85Å; V825-V868 HydrophobicContact CB-CG1 4.35Å; V825-V868 PolarHBondContact N-O 3.21Å; V825-V868 PolarHBondContact O-N 3.04Å; V825-V868 VanDerWaalsContact O-N 3.12Å; V825-L870 HydrophobicContact CB-CD1 3.95Å; V825-L870 HydrophobicContact CB-CG 4.34Å; V825-L870 HydrophobicContact CG1-CD1 4.29Å; V825-L870 HydrophobicContact CG2-CB 4.39Å; V825-L870 HydrophobicContact CG2-CD1 3.81Å; V825-L870 HydrophobicContact CG2-CG 4.22Å; V825-I899 HydrophobicContact CB-CG2 4.49Å; V825-I899 HydrophobicContact CG1-CG2 3.46Å; V825-I899 VanDerWaalsContact CG1-CG2 3.46Å; V825-I899 HydrophobicContact CG2-CG2 4.33Å; V825-E900 CarbonylContact C-O 3.6Å; V825-E900 WeakPolarHBondContact CA-O 3.43Å
826	T	93.8	Very high	85.7	Confident	7 Å²	7	37.1 Å²	37.1	4%	0.043	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	109	172.5	-46.8	0	0	0	0	109.5	S863 E900	T826-S863 WeakPolarHBondContact CG2-O 3.44Å; T826-E900 PolarHBondContact N-O 2.93Å; T826-E900 WeakPolarHBondContact O-CB 3.33Å; T826-E900 PolarHBondContact O-N 3.09Å
827	P	93.7	Very high	83.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	134.9	170.2	-22.4	35.5	0	0	0	111.5	I829 W846 I848 S863 L877 I899	P827-I829 HydrophobicContact CB-CD1 4.35Å; P827-W846 HydrophobicContact CB-CD2 4.23Å; P827-W846 HydrophobicContact CB-CE3 4.47Å; P827-W846 HydrophobicContact CB-CH2 4.29Å; P827-W846 HydrophobicContact CB-CZ2 4.04Å; P827-W846 HydrophobicContact CG-CD2 4.23Å; P827-W846 HydrophobicContact CG-CE3 3.99Å; P827-W846 HydrophobicContact CG-CH2 3.56Å; P827-W846 HydrophobicContact CG-CZ2 3.81Å; P827-W846 HydrophobicContact CG-CZ3 3.69Å; P827-I848 HydrophobicContact CG-CD1 3.74Å; P827-I848 HydrophobicContact CG-CG1 4.42Å; P827-S863 WeakPolarHBondContact O-CB 3.43Å; P827-L877 HydrophobicContact CB-CD1 3.71Å; P827-L877 HydrophobicContact CG-CD1 3.7Å; P827-I899 HydrophobicContact CB-CD1 3.97Å; P827-I899 HydrophobicContact CG-CD1 4.02Å
828	V	90.1	Very high	82.3	Confident	31 Å²	31	41 Å²	41	19%	0.188	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	120.2	177	-177.1	0	0	0	0	108.6	F898	V828-F898 HydrophobicContact CB-CB 4.41Å; V828-F898 PolarHBondContact N-O 3.22Å; V828-F898 PolarHBondContact O-N 3.5Å
829	I	90	Very high	81	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.194	C	C	.	.			trans	-110.9	96.7	177.1	-57.3	83	0	0	0	106.9	P827 L831 V832 S833 F844 W846 L879 L895 I897	P827-I829 HydrophobicContact CB-CD1 4.35Å; I829-L831 VanDerWaalsContact C-N 3.27Å; I829-L831 PolarHBondContact O-N 3.32Å; I829-L831 VanDerWaalsContact O-N 3.14Å; I829-V832 HydrophobicContact CB-CG2 4.19Å; I829-V832 HydrophobicContact CG2-CG2 3.53Å; I829-V832 PolarHBondContact O-N 3.43Å; I829-V832 VanDerWaalsContact O-N 3.16Å; I829-S833 VanDerWaalsContact C-OG 3.25Å; I829-S833 WeakPolarHBondContact CA-OG 3.39Å; I829-S833 PolarHBondContact N-OG 2.78Å; I829-S833 VanDerWaalsContact O-CB 3.25Å; I829-S833 WeakPolarHBondContact O-CB 3.37Å; I829-S833 PolarHBondContact O-N 3.16Å; I829-S833 PolarHBondContact O-OG 2.81Å; I829-F844 HydrophobicContact CB-CE2 4.3Å; I829-F844 HydrophobicContact CB-CZ 3.86Å; I829-F844 HydrophobicContact CD1-CZ 3.92Å; I829-F844 HydrophobicContact CG1-CE2 4.41Å; I829-F844 HydrophobicContact CG1-CZ 3.93Å; I829-F844 HydrophobicContact CG2-CE2 4.11Å; I829-F844 HydrophobicContact CG2-CZ 4.18Å; I829-W846 HydrophobicContact CD1-CG 4.21Å; I829-L879 HydrophobicContact CG1-CD2 4.34Å; I829-L879 HydrophobicContact CG2-CD2 4.27Å; I829-L895 HydrophobicContact CG2-CD2 3.79Å; I829-L895 HydrophobicContact CG2-CG 4.45Å; I829-I897 HydrophobicContact CB-CG2 4.39Å; I829-I897 HydrophobicContact CG1-CB 4.37Å; I829-I897 HydrophobicContact CG1-CG2 3.78Å; I829-I897 HydrophobicContact CG2-CG2 4.22Å
830	P	81.4	Confident	80.2	Confident	36 Å²	36	42.1 Å²	42.1	23%	0.234	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-36.6	-164.4	-27	33.5	0	0	0	115.2	V832 F898 P976	P830-V832 PolarHBondContact O-N 3.37Å; P830-F898 HydrophobicContact CG-CD2 3.68Å; P830-F898 HydrophobicContact CG-CE2 3.45Å; P830-F898 VanDerWaalsContact CG-CE2 3.45Å; P830-P976 HydrophobicContact CB-CG 3.62Å; P830-P976 HydrophobicContact CG-CG 3.47Å; P830-P976 VanDerWaalsContact CG-CG 3.47Å
831	L	80.2	Confident	80.2	Confident	87 Å²	87	38.3 Å²	38.3	46%	0.455	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-30.3	-175.9	-173.6	69.9	0	0	0	112.8	I829 F841 L892 L895	I829-L831 VanDerWaalsContact C-N 3.27Å; I829-L831 PolarHBondContact O-N 3.32Å; I829-L831 VanDerWaalsContact O-N 3.14Å; L831-F841 HydrophobicContact CD2-CE2 4.21Å; L831-F841 HydrophobicContact CD2-CZ 4.1Å; L831-L892 HydrophobicContact CD2-CD2 3.46Å; L831-L892 VanDerWaalsContact CD2-CD2 3.46Å; L831-L895 HydrophobicContact CB-CD1 4.19Å; L831-L895 HydrophobicContact CD2-CD1 4.21Å
832	V	77.6	Confident	79.9	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.012	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.1	-19.5	-165.2	-96.1	0	0	0	0	114	I829 P830 D834 Y835 A839 F841 F844 Y861	I829-V832 HydrophobicContact CB-CG2 4.19Å; I829-V832 HydrophobicContact CG2-CG2 3.53Å; I829-V832 PolarHBondContact O-N 3.43Å; I829-V832 VanDerWaalsContact O-N 3.16Å; P830-V832 PolarHBondContact O-N 3.37Å; V832-D834 PolarHBondContact O-N 3.3Å; V832-Y835 PolarHBondContact O-N 2.9Å; V832-A839 HydrophobicContact CG1-CB 4.18Å; V832-F841 HydrophobicContact CG1-CD2 3.43Å; V832-F841 VanDerWaalsContact CG1-CD2 3.43Å; V832-F841 HydrophobicContact CG1-CE2 3.49Å; V832-F841 VanDerWaalsContact CG1-CE2 3.49Å; V832-F844 HydrophobicContact CB-CD2 4.21Å; V832-F844 HydrophobicContact CB-CE2 4.05Å; V832-F844 HydrophobicContact CB-CZ 4.26Å; V832-F844 HydrophobicContact CG2-CD2 3.74Å; V832-F844 HydrophobicContact CG2-CE1 4.43Å; V832-F844 HydrophobicContact CG2-CE2 3.23Å; V832-F844 HydrophobicContact CG2-CZ 3.65Å; V832-Y861 WeakPolarHBondContact O-CD1 3.47Å
833	S	76.6	Confident	79.6	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.007	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-23.4	-169.1	-65.5	0	0	0	0	114.9	I829 F862	I829-S833 VanDerWaalsContact C-OG 3.25Å; I829-S833 WeakPolarHBondContact CA-OG 3.39Å; I829-S833 PolarHBondContact N-OG 2.78Å; I829-S833 VanDerWaalsContact O-CB 3.25Å; I829-S833 WeakPolarHBondContact O-CB 3.37Å; I829-S833 PolarHBondContact O-N 3.16Å; I829-S833 PolarHBondContact O-OG 2.81Å; S833-F862 VanDerWaalsContact O-CA 3.27Å; S833-F862 WeakPolarHBondContact O-CA 2.81Å; S833-F862 PolarHBondContact O-N 2.93Å
834	D	71.3	Confident	79.4	Confident	69 Å²	69	35.8 Å²	35.8	37%	0.369	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-4.5	179.9	-67.8	-43.5	0	0	0	113.1	V832	V832-D834 PolarHBondContact O-N 3.3Å
835	Y	65.5	Low	79.4	Confident	100 Å²	100	34.8 Å²	34.8	39%	0.392	18%	0.178	S	C	.	.			trans	-119.7	97.5	-174.1	-55.8	-77.1	0	0	0	110	F687 V832 E838 A839 Y861	F687-Y835 HydrophobicContact CZ-CD1 4.49Å; F687-Y835 HydrophobicContact CZ-CE1 4.35Å; V832-Y835 PolarHBondContact O-N 2.9Å; Y835-E838 HydrophobicContact CD1-CB 4.29Å; Y835-E838 WeakPolarHBondContact CD1-OE2 3.47Å; Y835-A839 VanDerWaalsContact O-CB 3.27Å; Y835-A839 WeakPolarHBondContact O-CB 3.27Å; Y835-Y861 WeakPolarHBondContact O-CD1 3.17Å; Y835-Y861 WeakPolarHBondContact O-CE1 3.49Å
836	L	64.4	Low	79.4	Confident	16 Å²	16	34.8 Å²	34.8	8%	0.084	18%	0.178	C	C	.	.	S	Bend	trans	-77.8	-55.2	173.3	177	51.8	0	0	0	110.9	E343 Y861 F862	E343-L836 WeakPolarHBondContact OE1-CD2 3.18Å; E343-L836 WeakPolarHBondContact OE2-CD2 3.37Å; E343-L836 WeakPolarHBondContact OE2-CG 3.42Å; L836-Y861 HydrophobicContact CB-CD1 4.39Å; L836-Y861 HydrophobicContact CB-CD2 4.45Å; L836-Y861 HydrophobicContact CB-CG 4.03Å; L836-Y861 HydrophobicContact CD1-CD1 4.34Å; L836-Y861 HydrophobicContact CD1-CD2 3.04Å; L836-Y861 HydrophobicContact CD1-CE2 3.45Å; L836-Y861 VanDerWaalsContact CD1-CE2 3.45Å; L836-Y861 HydrophobicContact CD1-CG 3.51Å; L836-Y861 HydrophobicContact CG-CD2 4.26Å; L836-Y861 HydrophobicContact CG-CG 4.33Å; L836-F862 HydrophobicContact CB-CE2 3.78Å; L836-F862 HydrophobicContact CB-CZ 3.85Å; L836-F862 HydrophobicContact CD2-CD2 4.14Å; L836-F862 HydrophobicContact CD2-CE2 3.46Å; L836-F862 VanDerWaalsContact CD2-CE2 3.46Å; L836-F862 HydrophobicContact CD2-CZ 4.27Å; L836-F862 HydrophobicContact CG-CE2 4.32Å
837	Y	57.2	Low	79.5	Confident	109 Å²	109	35.1 Å²	35.1	43%	0.427	18%	0.18	S	C	.	.	S	Bend	trans	-87.5	-37.6	-170.2	-50.7	-48.3	0	0	0	114.5	E343 P344	E343-Y837 HydrophobicContact CB-CE1 3.7Å; E343-Y837 HydrophobicContact CG-CE1 3.71Å; E343-Y837 VanDerWaalsContact OE1-CE1 3.28Å; E343-Y837 WeakPolarHBondContact OE1-CE1 3.48Å; E343-Y837 VanDerWaalsContact OE1-CZ 3.22Å; E343-Y837 PolarHBondContact OE1-OH 2.79Å; E343-Y837 WeakPolarHBondContact OE2-CE1 3.48Å; P344-Y837 HydrophobicContact CG-CD1 3.27Å; P344-Y837 HydrophobicContact CG-CD2 4.4Å; P344-Y837 HydrophobicContact CG-CE1 3.9Å; P344-Y837 HydrophobicContact CG-CG 3.49Å; P344-Y837 VanDerWaalsContact CG-CG 3.49Å
838	E	60.4	Low	79.6	Confident	107 Å²	107	35.1 Å²	35.1	50%	0.5	18%	0.18	S	C	.	.	S	Bend	trans	-84.9	-3.2	-177.8	-60.7	171.5	174.3	0	0	110.9	C686 Y835	C686-E838 WeakPolarHBondContact CB-OE1 3.27Å; Y835-E838 HydrophobicContact CD1-CB 4.29Å; Y835-E838 WeakPolarHBondContact CD1-OE2 3.47Å
839	A	66.4	Low	79.9	Confident	14 Å²	14	36.5 Å²	36.5	12%	0.116	18%	0.183	C	C	.	.			trans	-63.9	129	174.1	0	0	0	0	0	109.3	V832 Y835 F841 Y861	V832-A839 HydrophobicContact CG1-CB 4.18Å; Y835-A839 VanDerWaalsContact O-CB 3.27Å; Y835-A839 WeakPolarHBondContact O-CB 3.27Å; A839-F841 HydrophobicContact CB-CD2 4.41Å; A839-F841 PolarHBondContact O-N 2.59Å; A839-Y861 HydrophobicContact CB-CE1 3.72Å
840	P	73.8	Confident	80	Confident	88 Å²	88	37.4 Å²	37.4	57%	0.571	19%	0.189	S	C	*	.	S	Bend	trans	-70.3	-4.7	179.1	30	-35.4	0	0	0	112.6	H883	P840-H883 PolarHBondContact O-CD2 3.49Å; P840-H883 PolarHBondContact O-NE2 2.83Å
841	F	83.5	Confident	80.4	Confident	19 Å²	19	42.3 Å²	42.3	8%	0.083	21%	0.207	C	C	.	.			trans	-94.7	137.9	-172.5	-51	-71.2	0	0	0	111.8	L831 V832 A839 G843 V881 H883 T888 L892	L831-F841 HydrophobicContact CD2-CE2 4.21Å; L831-F841 HydrophobicContact CD2-CZ 4.1Å; V832-F841 HydrophobicContact CG1-CD2 3.43Å; V832-F841 VanDerWaalsContact CG1-CD2 3.43Å; V832-F841 HydrophobicContact CG1-CE2 3.49Å; V832-F841 VanDerWaalsContact CG1-CE2 3.49Å; A839-F841 HydrophobicContact CB-CD2 4.41Å; A839-F841 PolarHBondContact O-N 2.59Å; F841-G843 VanDerWaalsContact C-N 3.25Å; F841-G843 PolarHBondContact O-N 2.61Å; F841-V881 HydrophobicContact CB-CG1 3.85Å; F841-V881 HydrophobicContact CD1-CG1 3.53Å; F841-V881 HydrophobicContact CD2-CG1 4.19Å; F841-V881 HydrophobicContact CE1-CG1 4.11Å; F841-V881 HydrophobicContact CG-CG1 3.56Å; F841-H883 HydrophobicContact CD1-CB 4.49Å; F841-T888 HydrophobicContact CE1-CG2 3.81Å; F841-L892 HydrophobicContact CD1-CD1 4.38Å; F841-L892 HydrophobicContact CE1-CD1 3.67Å; F841-L892 HydrophobicContact CZ-CD1 3.91Å; F841-L892 HydrophobicContact CZ-CD2 4.29Å
842	C	80.1	Confident	80.8	Confident	20 Å²	20	46.1 Å²	46.1	14%	0.135	22%	0.222	C	C	.	.	S	Bend	trans	-77.6	-10.6	177.5	68.4	0	0	0	0	113	G319 T320 C808 R882	G319-C842 CarbonylContact C-O 3.58Å; G319-C842 WeakPolarHBondContact CA-O 3.5Å; T320-C842 PolarHBondContact N-O 3.12Å; C808-C842 VanDerWaalsContact SG-SG 3.62Å; C842-R882 PolarHBondContact N-O 3.2Å; C842-R882 PolarHBondContact SG-O 3.44Å; C842-R882 VanDerWaalsContact SG-O 3.32Å
843	G	85.5	Confident	81.3	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	142.9	174.2	0	0	0	0	0	112.9	T320 F841 V881 R882	T320-G843 WeakPolarHBondContact OG1-CA 3.44Å; F841-G843 VanDerWaalsContact C-N 3.25Å; F841-G843 PolarHBondContact O-N 2.61Å; G843-V881 CarbonylContact O-C 3.58Å; G843-V881 WeakPolarHBondContact O-CA 3.25Å; G843-R882 PolarHBondContact N-O 2.9Å; G843-R882 PolarHBondContact O-N 3.09Å
844	F	88.9	Confident	81.9	Confident	6 Å²	6	56 Å²	56	3%	0.026	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	118.4	-179.4	177.9	-105	0	0	0	110.1	I829 V832 S860 Y861 L879 Q880 V881	I829-F844 HydrophobicContact CB-CE2 4.3Å; I829-F844 HydrophobicContact CB-CZ 3.86Å; I829-F844 HydrophobicContact CD1-CZ 3.92Å; I829-F844 HydrophobicContact CG1-CE2 4.41Å; I829-F844 HydrophobicContact CG1-CZ 3.93Å; I829-F844 HydrophobicContact CG2-CE2 4.11Å; I829-F844 HydrophobicContact CG2-CZ 4.18Å; V832-F844 HydrophobicContact CB-CD2 4.21Å; V832-F844 HydrophobicContact CB-CE2 4.05Å; V832-F844 HydrophobicContact CB-CZ 4.26Å; V832-F844 HydrophobicContact CG2-CD2 3.74Å; V832-F844 HydrophobicContact CG2-CE1 4.43Å; V832-F844 HydrophobicContact CG2-CE2 3.23Å; V832-F844 HydrophobicContact CG2-CZ 3.65Å; F844-S860 PolarHBondContact O-OG 3.27Å; F844-Y861 HydrophobicContact CB-CE1 3.91Å; F844-Y861 HydrophobicContact CB-CE2 3.8Å; F844-Y861 VanDerWaalsContact CB-CZ 3.45Å; F844-Y861 WeakPolarHBondContact CB-OH 3.25Å; F844-Y861 AromaticContact CD1-CD1 3.93Å; F844-Y861 HydrophobicContact CD1-CD1 3.93Å; F844-Y861 HydrophobicContact CD1-CD2 4.19Å; F844-Y861 AromaticContact CD1-CE1 3.95Å; F844-Y861 HydrophobicContact CD1-CE1 3.95Å; F844-Y861 HydrophobicContact CD1-CE2 4.22Å; F844-Y861 HydrophobicContact CD1-CG 4.12Å; F844-Y861 HydrophobicContact CG-CE1 4.11Å; F844-Y861 HydrophobicContact CG-CE2 4.47Å; F844-L879 HydrophobicContact CD2-CD1 3.92Å; F844-L879 HydrophobicContact CE2-CD1 3.35Å; F844-L879 HydrophobicContact CE2-CG 4.5Å; F844-L879 HydrophobicContact CZ-CD1 3.95Å; F844-Q880 WeakPolarHBondContact CA-O 3.42Å; F844-V881 HydrophobicContact CD2-CG2 4.05Å; F844-V881 HydrophobicContact CE2-CG2 4.46Å
845	L	92.5	Very high	82.8	Confident	18 Å²	18	55.9 Å²	55.9	9%	0.094	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	132.1	-179.8	-177.9	71.6	0	0	0	109.3	L313 Q880	L313-L845 HydrophobicContact CD1-CD1 3.98Å; L313-L845 HydrophobicContact CD2-CD1 3.72Å; L313-L845 HydrophobicContact CG-CD1 4.05Å; L845-Q880 PolarHBondContact N-O 3.44Å; L845-Q880 PolarHBondContact O-N 3.46Å
846	W	94.5	Very high	84.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	150.4	166.3	57.8	-98.8	0	0	0	110.5	P827 I829 I848 M857 S858 G859 Y866 L877 I878 L879	P827-W846 HydrophobicContact CB-CD2 4.23Å; P827-W846 HydrophobicContact CB-CE3 4.47Å; P827-W846 HydrophobicContact CB-CH2 4.29Å; P827-W846 HydrophobicContact CB-CZ2 4.04Å; P827-W846 HydrophobicContact CG-CD2 4.23Å; P827-W846 HydrophobicContact CG-CE3 3.99Å; P827-W846 HydrophobicContact CG-CH2 3.56Å; P827-W846 HydrophobicContact CG-CZ2 3.81Å; P827-W846 HydrophobicContact CG-CZ3 3.69Å; I829-W846 HydrophobicContact CD1-CG 4.21Å; W846-I848 HydrophobicContact CE3-CD1 4.45Å; W846-I848 HydrophobicContact CE3-CG1 4.08Å; W846-I848 HydrophobicContact CZ3-CD1 3.8Å; W846-I848 HydrophobicContact CZ3-CG1 3.84Å; W846-M857 HydrophobicContact CH2-CE 3.63Å; W846-M857 HydrophobicContact CZ3-CE 4.09Å; W846-S858 CarbonylContact O-C 3.54Å; W846-S858 WeakPolarHBondContact O-CA 3.36Å; W846-S858 WeakPolarHBondContact O-CB 3.21Å; W846-G859 VanDerWaalsContact CE2-C 3.47Å; W846-G859 VanDerWaalsContact CZ2-CA 3.46Å; W846-G859 PolarHBondContact N-O 3.05Å; W846-G859 VanDerWaalsContact NE1-C 3.3Å; W846-G859 PolarHBondContact NE1-O 3.45Å; W846-G859 PolarHBondContact O-N 3.27Å; W846-Y866 HydrophobicContact CZ2-CG 4.37Å; W846-L877 HydrophobicContact CB-CD2 4.17Å; W846-L877 HydrophobicContact CB-CG 4.44Å; W846-L877 HydrophobicContact CE3-CD1 4.31Å; W846-I878 CarbonylContact C-O 3.51Å; W846-I878 VanDerWaalsContact CA-O 3.25Å; W846-I878 WeakPolarHBondContact CA-O 3.41Å; W846-L879 HydrophobicContact CB-CD1 4.04Å
847	T	95.8	Very high	85.4	Confident	13 Å²	13	54.1 Å²	54.1	8%	0.08	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	131	-179.5	-56.7	0	0	0	0	110.6	Y849 Y855 S858 L877 I878	T847-Y849 HydrophobicContact CG2-CD2 4.08Å; T847-Y849 HydrophobicContact CG2-CE1 4.1Å; T847-Y849 HydrophobicContact CG2-CE2 3.41Å; T847-Y849 VanDerWaalsContact CG2-CE2 3.41Å; T847-Y849 VanDerWaalsContact CG2-CZ 3.42Å; T847-Y855 HydrophobicContact CG2-CD2 3.48Å; T847-Y855 VanDerWaalsContact CG2-CD2 3.48Å; T847-Y855 HydrophobicContact CG2-CE2 3.57Å; T847-S858 PolarHBondContact OG1-OG 2.84Å; T847-L877 CarbonylContact O-C 3.56Å; T847-L877 WeakPolarHBondContact O-CA 3.33Å; T847-I878 PolarHBondContact N-O 3.23Å; T847-I878 PolarHBondContact O-N 3.32Å
848	I	96.6	Very high	87.2	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.6	173.8	-60.2	173.1	0	0	0	109.5	F817 P827 W846 L856 M857 V868 Y875 K876 L877	F817-I848 HydrophobicContact CZ-CG2 4.4Å; P827-I848 HydrophobicContact CG-CD1 3.74Å; P827-I848 HydrophobicContact CG-CG1 4.42Å; W846-I848 HydrophobicContact CE3-CD1 4.45Å; W846-I848 HydrophobicContact CE3-CG1 4.08Å; W846-I848 HydrophobicContact CZ3-CD1 3.8Å; W846-I848 HydrophobicContact CZ3-CG1 3.84Å; I848-L856 HydrophobicContact CG2-CB 4.48Å; I848-L856 HydrophobicContact CG2-CD1 4.13Å; I848-L856 WeakPolarHBondContact O-CB 3.33Å; I848-L856 PolarHBondContact O-N 2.76Å; I848-M857 PolarHBondContact N-O 2.89Å; I848-V868 HydrophobicContact CD1-CG1 3.81Å; I848-Y875 HydrophobicContact CG2-CD1 4.47Å; I848-K876 CarbonylContact C-O 3.56Å; I848-K876 WeakPolarHBondContact CA-O 3.44Å; I848-L877 HydrophobicContact CG1-CB 4.49Å; I848-L877 HydrophobicContact CG1-CD1 4.05Å; I848-L877 HydrophobicContact CG1-CG 4.39Å
849	Y	95.6	Very high	88.7	Confident	61 Å²	61	43.9 Å²	43.9	24%	0.239	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	150.2	173.2	-60.1	-89.7	0	0	0	110.5	T847 D853 R854 K876 I878	T847-Y849 HydrophobicContact CG2-CD2 4.08Å; T847-Y849 HydrophobicContact CG2-CE1 4.1Å; T847-Y849 HydrophobicContact CG2-CE2 3.41Å; T847-Y849 VanDerWaalsContact CG2-CE2 3.41Å; T847-Y849 VanDerWaalsContact CG2-CZ 3.42Å; Y849-D853 WeakPolarHBondContact CD1-O 3.37Å; Y849-R854 CarbonylContact C-O 3.58Å; Y849-R854 VanDerWaalsContact CA-O 3.28Å; Y849-R854 WeakPolarHBondContact CA-O 3.34Å; Y849-K876 PolarHBondContact N-O 2.97Å; Y849-K876 PolarHBondContact O-N 3.24Å; Y849-I878 HydrophobicContact CD2-CD1 4.24Å; Y849-I878 HydrophobicContact CD2-CG1 4.3Å; Y849-I878 HydrophobicContact CE2-CB 4.37Å; Y849-I878 HydrophobicContact CE2-CD1 3.86Å; Y849-I878 HydrophobicContact CE2-CG1 4.12Å
850	S	93.1	Very high	89.8	Confident	19 Å²	19	43.2 Å²	43.2	13%	0.133	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	169	163.1	76.3	0	0	0	0	111.4	H852 D853 R854	S850-H852 PolarHBondContact O-N 2.82Å; S850-H852 VanDerWaalsContact O-N 3.08Å; S850-H852 PolarHBondContact OG-N 3.43Å; S850-D853 PolarHBondContact O-N 2.83Å; S850-R854 PolarHBondContact N-O 2.84Å; S850-R854 WeakPolarHBondContact OG-CB 3.22Å; S850-R854 PolarHBondContact OG-N 2.84Å
851	K	88.4	Confident	90.3	Very high	139 Å²	139	39.4 Å²	39.4	60%	0.604	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-24	170.6	-166.9	173.7	-167.8	157.4	0	115.2	D874	K851-D874 HydrophobicContact CD-CB 4.24Å; K851-D874 PolarHBondContact N-O 3.05Å; K851-D874 IonicContact NZ-OD2 3.61Å; K851-D874 PolarHBondContact NZ-OD2 2.89Å
852	H	89.1	Confident	90.1	Very high	166 Å²	166	40.2 Å²	40.2	77%	0.769	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.8	26.4	179.2	-52.1	97.9	0	0	0	112.2	S850 R854	S850-H852 PolarHBondContact O-N 2.82Å; S850-H852 VanDerWaalsContact O-N 3.08Å; S850-H852 PolarHBondContact OG-N 3.43Å; H852-R854 PolarHBondContact O-N 2.84Å
853	D	89	Confident	90.1	Very high	102 Å²	102	39.7 Å²	39.7	55%	0.545	18%	0.183	S	C	.	.			trans	58.8	11.6	179.1	-64.2	-40.7	0	0	0	116.2	Y849 S850 Y855 K876	Y849-D853 WeakPolarHBondContact CD1-O 3.37Å; S850-D853 PolarHBondContact O-N 2.83Å; D853-Y855 PolarHBondContact O-N 3.32Å; D853-K876 IonicContact OD1-NZ 3.34Å; D853-K876 PolarHBondContact OD1-NZ 3.5Å
854	R	88.2	Confident	89.9	Confident	109 Å²	109	44 Å²	44	41%	0.411	20%	0.203	S	C	.	.			trans	-63.3	125.1	167.3	-179	-175.6	167.6	-166.2	-5.3	110.3	D201 C203 Y849 S850 H852	D201-R854 IonicContact OD1-NH2 3.12Å; D201-R854 IonicContact OD2-CZ 2.87Å; D201-R854 IonicContact OD2-NH1 3.78Å; D201-R854 IonicContact OD2-NH2 3.84Å; D201-R854 PolarHBondContact OD2-NH2 2.81Å; C203-R854 PolarHBondContact SG-NH2 3.07Å; Y849-R854 CarbonylContact C-O 3.58Å; Y849-R854 VanDerWaalsContact CA-O 3.28Å; Y849-R854 WeakPolarHBondContact CA-O 3.34Å; S850-R854 PolarHBondContact N-O 2.84Å; S850-R854 WeakPolarHBondContact OG-CB 3.22Å; S850-R854 PolarHBondContact OG-N 2.84Å; H852-R854 PolarHBondContact O-N 2.84Å
855	Y	90.7	Very high	89.7	Confident	67 Å²	67	49.1 Å²	49.1	26%	0.263	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	132.1	168.9	170.8	-100	0	0	0	111.3	T847 D853 S858	T847-Y855 HydrophobicContact CG2-CD2 3.48Å; T847-Y855 VanDerWaalsContact CG2-CD2 3.48Å; T847-Y855 HydrophobicContact CG2-CE2 3.57Å; D853-Y855 PolarHBondContact O-N 3.32Å; Y855-S858 WeakPolarHBondContact CE2-OG 3.23Å; Y855-S858 PolarHBondContact OH-N 2.68Å; Y855-S858 VanDerWaalsContact OH-N 3.1Å
856	L	91.5	Very high	89.5	Confident	50 Å²	50	48.5 Å²	48.5	26%	0.262	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-53	177.4	-61.4	179.2	0	0	0	111.9	I848 L870 Y875	I848-L856 HydrophobicContact CG2-CB 4.48Å; I848-L856 HydrophobicContact CG2-CD1 4.13Å; I848-L856 WeakPolarHBondContact O-CB 3.33Å; I848-L856 PolarHBondContact O-N 2.76Å; L856-L870 HydrophobicContact CD1-CD2 3.83Å; L856-Y875 HydrophobicContact CD1-CD1 3.7Å; L856-Y875 HydrophobicContact CD1-CE1 3.67Å
857	M	92.6	Very high	89.4	Confident	29 Å²	29	53.2 Å²	53.2	14%	0.143	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	145.3	-179.4	-170.9	171.8	76.4	0	0	110.9	W846 I848 Y866 V868	W846-M857 HydrophobicContact CH2-CE 3.63Å; W846-M857 HydrophobicContact CZ3-CE 4.09Å; I848-M857 PolarHBondContact N-O 2.89Å; M857-Y866 VanDerWaalsContact CE-C 3.48Å; M857-V868 HydrophobicContact CB-CB 4.27Å; M857-V868 HydrophobicContact CB-CG2 4.4Å; M857-V868 HydrophobicContact CE-CB 3.54Å; M857-V868 HydrophobicContact CE-CG1 3.78Å; M857-V868 HydrophobicContact SD-CB 3.83Å
858	S	94.4	Very high	89.2	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.007	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	156.7	162.3	-62.5	0	0	0	0	111.4	W846 T847 Y855	W846-S858 CarbonylContact O-C 3.54Å; W846-S858 WeakPolarHBondContact O-CA 3.36Å; W846-S858 WeakPolarHBondContact O-CB 3.21Å; T847-S858 PolarHBondContact OG1-OG 2.84Å; Y855-S858 WeakPolarHBondContact CE2-OG 3.23Å; Y855-S858 PolarHBondContact OH-N 2.68Å; Y855-S858 VanDerWaalsContact OH-N 3.1Å
859	G	93.1	Very high	89	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	174.4	167.9	0	0	0	0	0	110.7	L313 W846	L313-G859 VanDerWaalsContact CD2-C 3.46Å; L313-G859 VanDerWaalsContact CD2-CA 3.46Å; W846-G859 VanDerWaalsContact CE2-C 3.47Å; W846-G859 VanDerWaalsContact CZ2-CA 3.46Å; W846-G859 PolarHBondContact N-O 3.05Å; W846-G859 VanDerWaalsContact NE1-C 3.3Å; W846-G859 PolarHBondContact NE1-O 3.45Å; W846-G859 PolarHBondContact O-N 3.27Å
860	S	89.3	Confident	88.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	26%	0.262	C	S	.	.			trans	-144.9	-140.7	-177.7	-172.9	0	0	0	0	107.9	F844	F844-S860 PolarHBondContact O-OG 3.27Å
861	Y	83	Confident	88.8	Confident	7 Å²	7	61.9 Å²	61.9	3%	0.027	28%	0.279	C	S	.	.	S	Bend	trans	-54.3	158.2	174.4	-50.2	-83.1	0	0	0	112.4	V832 Y835 L836 A839 F844 Y866	V832-Y861 WeakPolarHBondContact O-CD1 3.47Å; Y835-Y861 WeakPolarHBondContact O-CD1 3.17Å; Y835-Y861 WeakPolarHBondContact O-CE1 3.49Å; L836-Y861 HydrophobicContact CB-CD1 4.39Å; L836-Y861 HydrophobicContact CB-CD2 4.45Å; L836-Y861 HydrophobicContact CB-CG 4.03Å; L836-Y861 HydrophobicContact CD1-CD1 4.34Å; L836-Y861 HydrophobicContact CD1-CD2 3.04Å; L836-Y861 HydrophobicContact CD1-CE2 3.45Å; L836-Y861 VanDerWaalsContact CD1-CE2 3.45Å; L836-Y861 HydrophobicContact CD1-CG 3.51Å; L836-Y861 HydrophobicContact CG-CD2 4.26Å; L836-Y861 HydrophobicContact CG-CG 4.33Å; A839-Y861 HydrophobicContact CB-CE1 3.72Å; F844-Y861 HydrophobicContact CB-CE1 3.91Å; F844-Y861 HydrophobicContact CB-CE2 3.8Å; F844-Y861 VanDerWaalsContact CB-CZ 3.45Å; F844-Y861 WeakPolarHBondContact CB-OH 3.25Å; F844-Y861 AromaticContact CD1-CD1 3.93Å; F844-Y861 HydrophobicContact CD1-CD1 3.93Å; F844-Y861 HydrophobicContact CD1-CD2 4.19Å; F844-Y861 AromaticContact CD1-CE1 3.95Å; F844-Y861 HydrophobicContact CD1-CE1 3.95Å; F844-Y861 HydrophobicContact CD1-CE2 4.22Å; F844-Y861 HydrophobicContact CD1-CG 4.12Å; F844-Y861 HydrophobicContact CG-CE1 4.11Å; F844-Y861 HydrophobicContact CG-CE2 4.47Å; Y861-Y866 VanDerWaalsContact O-CE2 3.25Å; Y861-Y866 WeakPolarHBondContact O-CE2 3.04Å
862	F	80.9	Confident	89	Confident	36 Å²	36	62.6 Å²	62.6	16%	0.158	28%	0.282	C	S	.	.	S	Bend	trans	55.7	61.4	-175	-54	-51.2	0	0	0	112.7	S833 L836 H864 R865	S833-F862 VanDerWaalsContact O-CA 3.27Å; S833-F862 WeakPolarHBondContact O-CA 2.81Å; S833-F862 PolarHBondContact O-N 2.93Å; L836-F862 HydrophobicContact CB-CE2 3.78Å; L836-F862 HydrophobicContact CB-CZ 3.85Å; L836-F862 HydrophobicContact CD2-CD2 4.14Å; L836-F862 HydrophobicContact CD2-CE2 3.46Å; L836-F862 VanDerWaalsContact CD2-CE2 3.46Å; L836-F862 HydrophobicContact CD2-CZ 4.27Å; L836-F862 HydrophobicContact CG-CE2 4.32Å; F862-H864 PolarHBondContact O-N 3.31Å; F862-R865 HydrophobicContact CB-CG 4.06Å; F862-R865 WeakPolarHBondContact O-CB 3.26Å; F862-R865 PolarHBondContact O-N 3.02Å
863	S	80.4	Confident	89.3	Confident	9 Å²	9	55.9 Å²	55.9	6%	0.063	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-38.7	-41.5	-177.9	54.3	0	0	0	0	114.9	T826 P827 R865 Y866	T826-S863 WeakPolarHBondContact CG2-O 3.44Å; P827-S863 WeakPolarHBondContact O-CB 3.43Å; S863-R865 PolarHBondContact O-N 3.41Å; S863-Y866 PolarHBondContact O-N 3.36Å
864	H	80.7	Confident	89.6	Confident	93 Å²	93	54.3 Å²	54.3	43%	0.431	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-55.2	-20.5	177.6	70.2	-83.6	0	0	0	115.4	F862 Y866	F862-H864 PolarHBondContact O-N 3.31Å; H864-Y866 VanDerWaalsContact C-N 3.32Å
865	R	84.1	Confident	90	Very high	112 Å²	112	50.4 Å²	50.4	42%	0.423	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-76.7	-19.1	175.6	-64.1	-173.5	-179.2	-174.9	4.9	113.1	K314 F862 S863	K314-R865 PolarHBondContact NZ-O 2.71Å; F862-R865 HydrophobicContact CB-CG 4.06Å; F862-R865 WeakPolarHBondContact O-CB 3.26Å; F862-R865 PolarHBondContact O-N 3.02Å; S863-R865 PolarHBondContact O-N 3.41Å
866	Y	89.5	Confident	90.3	Very high	5 Å²	5	49.5 Å²	49.5	2%	0.02	23%	0.232	C	C	.	.			trans	-119.5	89.7	-170.6	-56.2	-71.4	0	0	0	110	L313 W846 M857 Y861 S863 H864	L313-Y866 HydrophobicContact CB-CE1 4.34Å; L313-Y866 HydrophobicContact CD2-CE1 4.06Å; L313-Y866 PolarHBondContact O-OH 2.74Å; L313-Y866 VanDerWaalsContact O-OH 3.13Å; W846-Y866 HydrophobicContact CZ2-CG 4.37Å; M857-Y866 VanDerWaalsContact CE-C 3.48Å; Y861-Y866 VanDerWaalsContact O-CE2 3.25Å; Y861-Y866 WeakPolarHBondContact O-CE2 3.04Å; S863-Y866 PolarHBondContact O-N 3.36Å; H864-Y866 VanDerWaalsContact C-N 3.32Å
867	Q	91.6	Very high	90.5	Very high	99 Å²	99	47.1 Å²	47.1	46%	0.463	22%	0.22	S	C	.	.			trans	-118.4	128.3	179.4	-61.9	-172.6	-3.8	0	0	109.7	T824	T824-Q867 HydrophobicContact CG2-CB 3.71Å; T824-Q867 HydrophobicContact CG2-CG 4.4Å
868	V	91.8	Very high	90.7	Very high	20 Å²	20	47.7 Å²	47.7	12%	0.121	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.7	178.5	59.9	0	0	0	0	110	T824 V825 I848 M857 L870	T824-V868 CarbonylContact C-O 3.38Å; T824-V868 WeakPolarHBondContact CA-O 3.39Å; V825-V868 HydrophobicContact CB-CG1 4.35Å; V825-V868 PolarHBondContact N-O 3.21Å; V825-V868 PolarHBondContact O-N 3.04Å; V825-V868 VanDerWaalsContact O-N 3.12Å; I848-V868 HydrophobicContact CD1-CG1 3.81Å; M857-V868 HydrophobicContact CB-CB 4.27Å; M857-V868 HydrophobicContact CB-CG2 4.4Å; M857-V868 HydrophobicContact CE-CB 3.54Å; M857-V868 HydrophobicContact CE-CG1 3.78Å; M857-V868 HydrophobicContact SD-CB 3.83Å; V868-L870 HydrophobicContact CB-CD2 4.5Å; V868-L870 HydrophobicContact CG1-CD1 4.29Å; V868-L870 HydrophobicContact CG1-CD2 4Å; V868-L870 HydrophobicContact CG1-CG 3.99Å; V868-L870 HydrophobicContact CG2-CD2 3.73Å; V868-L870 HydrophobicContact CG2-CG 4.4Å
869	K	92.7	Very high	90.8	Very high	145 Å²	145	47.7 Å²	47.7	63%	0.63	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	120.5	172	-168.1	177.9	178.2	-172.6	0	108.9	S822 T823	S822-K869 WeakPolarHBondContact OG-CE 3.37Å; T823-K869 WeakPolarHBondContact O-CA 3.44Å
870	L	93.3	Very high	90.9	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	140.9	179.7	-61	-175	0	0	0	109.8	F817 V819 S822 T823 V825 L856 V868 Y875	F817-L870 HydrophobicContact CE2-CD1 4.07Å; F817-L870 HydrophobicContact CZ-CD1 4.08Å; V819-L870 HydrophobicContact CG2-CD1 4.38Å; S822-L870 VanDerWaalsContact CA-O 3.31Å; S822-L870 WeakPolarHBondContact CA-O 3.4Å; T823-L870 PolarHBondContact N-O 2.88Å; T823-L870 PolarHBondContact O-N 2.86Å; V825-L870 HydrophobicContact CB-CD1 3.95Å; V825-L870 HydrophobicContact CB-CG 4.34Å; V825-L870 HydrophobicContact CG1-CD1 4.29Å; V825-L870 HydrophobicContact CG2-CB 4.39Å; V825-L870 HydrophobicContact CG2-CD1 3.81Å; V825-L870 HydrophobicContact CG2-CG 4.22Å; L856-L870 HydrophobicContact CD1-CD2 3.83Å; V868-L870 HydrophobicContact CB-CD2 4.5Å; V868-L870 HydrophobicContact CG1-CD1 4.29Å; V868-L870 HydrophobicContact CG1-CD2 4Å; V868-L870 HydrophobicContact CG1-CG 3.99Å; V868-L870 HydrophobicContact CG2-CD2 3.73Å; V868-L870 HydrophobicContact CG2-CG 4.4Å; L870-Y875 HydrophobicContact CB-CE1 4.36Å; L870-Y875 HydrophobicContact CB-CE2 3.99Å; L870-Y875 HydrophobicContact CD1-CD1 4.14Å; L870-Y875 HydrophobicContact CD1-CD2 4.02Å; L870-Y875 HydrophobicContact CD1-CE1 4.19Å; L870-Y875 HydrophobicContact CD1-CE2 4.07Å; L870-Y875 HydrophobicContact CD1-CG 4.05Å; L870-Y875 HydrophobicContact CD2-CD1 4.22Å; L870-Y875 HydrophobicContact CD2-CE1 3.75Å; L870-Y875 HydrophobicContact CG-CE1 4.32Å; L870-Y875 HydrophobicContact CG-CE2 4.49Å
871	E	91.4	Very high	91.1	Very high	107 Å²	107	50 Å²	50	50%	0.5	23%	0.234	S	C	.	.			trans	-85.7	169.4	171.9	-67.8	-58.3	138.8	0	0	110.7	S822 G873 Y875	S822-E871 VanDerWaalsContact CB-OE2 3.25Å; S822-E871 WeakPolarHBondContact CB-OE2 3.32Å; S822-E871 VanDerWaalsContact OG-CD 3.28Å; S822-E871 PolarHBondContact OG-OE1 2.81Å; S822-E871 PolarHBondContact OG-OE2 3.32Å; E871-G873 PolarHBondContact O-N 3.27Å; E871-Y875 PolarHBondContact N-OH 2.75Å; E871-Y875 VanDerWaalsContact N-OH 3.11Å; E871-Y875 WeakPolarHBondContact O-CE2 3.4Å; E871-Y875 PolarHBondContact O-OH 3.19Å
872	K	92.5	Very high	91.5	Very high	153 Å²	153	50 Å²	50	67%	0.665	23%	0.234	S	C	*	.	S	Bend	trans	-57.5	125.3	175.1	-179.4	-179.2	-175.9	171.5	0	110.4	V819 D820	V819-K872 CarbonylContact O-C 3.54Å; V819-K872 VanDerWaalsContact O-CA 3.24Å; V819-K872 WeakPolarHBondContact O-CA 3.11Å; V819-K872 WeakPolarHBondContact O-CG 3.45Å; D820-K872 VanDerWaalsContact O-CD 3.31Å; D820-K872 WeakPolarHBondContact O-CD 3.38Å; D820-K872 WeakPolarHBondContact O-CG 3.31Å
873	G	93.6	Very high	92	Very high	26 Å²	26	49.8 Å²	49.8	27%	0.268	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	160.2	-176.3	-179.1	0	0	0	0	0	113.7	S818 V819 E871 Y875	S818-G873 WeakPolarHBondContact CA-O 3.48Å; V819-G873 PolarHBondContact N-O 2.94Å; V819-G873 PolarHBondContact O-N 3.08Å; E871-G873 PolarHBondContact O-N 3.27Å; G873-Y875 WeakPolarHBondContact O-CD2 3.49Å; G873-Y875 WeakPolarHBondContact O-CE2 3.4Å
874	D	95.5	Very high	92.5	Very high	68 Å²	68	50.9 Å²	50.9	36%	0.364	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	141.1	178.9	-50.2	-40.3	0	0	0	110.8	S818 K851	S818-D874 WeakPolarHBondContact CB-OD1 3.13Å; S818-D874 PolarHBondContact OG-OD1 3.11Å; K851-D874 HydrophobicContact CD-CB 4.24Å; K851-D874 PolarHBondContact N-O 3.05Å; K851-D874 IonicContact NZ-OD2 3.61Å; K851-D874 PolarHBondContact NZ-OD2 2.89Å
875	Y	97.1	Very high	92.9	Very high	28 Å²	28	49.3 Å²	49.3	11%	0.11	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	158.1	-177.6	-60.2	-84.7	0	0	0	111	F817 V819 I848 L856 L870 E871 G873	F817-Y875 HydrophobicContact CE2-CD2 4.19Å; F817-Y875 HydrophobicContact CE2-CG 4.36Å; F817-Y875 HydrophobicContact CZ-CG 4.22Å; F817-Y875 PolarHBondContact N-O 3.38Å; F817-Y875 PolarHBondContact O-N 3.02Å; V819-Y875 HydrophobicContact CB-CD2 4.43Å; V819-Y875 HydrophobicContact CB-CE2 4.06Å; V819-Y875 HydrophobicContact CG2-CD2 3.9Å; V819-Y875 HydrophobicContact CG2-CE2 3.9Å; I848-Y875 HydrophobicContact CG2-CD1 4.47Å; L856-Y875 HydrophobicContact CD1-CD1 3.7Å; L856-Y875 HydrophobicContact CD1-CE1 3.67Å; L870-Y875 HydrophobicContact CB-CE1 4.36Å; L870-Y875 HydrophobicContact CB-CE2 3.99Å; L870-Y875 HydrophobicContact CD1-CD1 4.14Å; L870-Y875 HydrophobicContact CD1-CD2 4.02Å; L870-Y875 HydrophobicContact CD1-CE1 4.19Å; L870-Y875 HydrophobicContact CD1-CE2 4.07Å; L870-Y875 HydrophobicContact CD1-CG 4.05Å; L870-Y875 HydrophobicContact CD2-CD1 4.22Å; L870-Y875 HydrophobicContact CD2-CE1 3.75Å; L870-Y875 HydrophobicContact CG-CE1 4.32Å; L870-Y875 HydrophobicContact CG-CE2 4.49Å; E871-Y875 PolarHBondContact N-OH 2.75Å; E871-Y875 VanDerWaalsContact N-OH 3.11Å; E871-Y875 WeakPolarHBondContact O-CE2 3.4Å; E871-Y875 PolarHBondContact O-OH 3.19Å; G873-Y875 WeakPolarHBondContact O-CD2 3.49Å; G873-Y875 WeakPolarHBondContact O-CE2 3.4Å
876	K	96.5	Very high	93.3	Very high	47 Å²	47	47.7 Å²	47.7	20%	0.204	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.9	177	-174.4	177.8	72.2	-173	0	108.9	T814 Y815 I848 Y849 D853	T814-K876 HydrophobicContact CG2-CD 3.84Å; T814-K876 HydrophobicContact CG2-CG 3.75Å; Y815-K876 CarbonylContact O-C 3.6Å; Y815-K876 WeakPolarHBondContact O-CA 3.28Å; I848-K876 CarbonylContact C-O 3.56Å; I848-K876 WeakPolarHBondContact CA-O 3.44Å; Y849-K876 PolarHBondContact N-O 2.97Å; Y849-K876 PolarHBondContact O-N 3.24Å; D853-K876 IonicContact OD1-NZ 3.34Å; D853-K876 PolarHBondContact OD1-NZ 3.5Å
877	L	96.9	Very high	93.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	130	170.6	-177.7	152.7	0	0	0	108.7	T814 Y815 F817 P827 W846 T847 I848 L879 I897 I899	T814-L877 CarbonylContact C-O 3.56Å; T814-L877 WeakPolarHBondContact CA-O 3.46Å; Y815-L877 HydrophobicContact CD2-CD2 3.64Å; Y815-L877 HydrophobicContact CE2-CD2 4.18Å; Y815-L877 HydrophobicContact CG-CD2 4.46Å; Y815-L877 PolarHBondContact N-O 2.95Å; Y815-L877 PolarHBondContact O-N 3.18Å; F817-L877 HydrophobicContact CE1-CB 4.17Å; P827-L877 HydrophobicContact CB-CD1 3.71Å; P827-L877 HydrophobicContact CG-CD1 3.7Å; W846-L877 HydrophobicContact CB-CD2 4.17Å; W846-L877 HydrophobicContact CB-CG 4.44Å; W846-L877 HydrophobicContact CE3-CD1 4.31Å; T847-L877 CarbonylContact O-C 3.56Å; T847-L877 WeakPolarHBondContact O-CA 3.33Å; I848-L877 HydrophobicContact CG1-CB 4.49Å; I848-L877 HydrophobicContact CG1-CD1 4.05Å; I848-L877 HydrophobicContact CG1-CG 4.39Å; L877-L879 HydrophobicContact CD2-CB 4.14Å; L877-I897 HydrophobicContact CD1-CD1 4.27Å; L877-I897 HydrophobicContact CD2-CD1 3.88Å; L877-I899 HydrophobicContact CD1-CD1 4.11Å
878	I	96.7	Very high	93.4	Very high	42 Å²	42	51.7 Å²	51.7	22%	0.215	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	122.8	171	-57.6	-179.6	0	0	0	107.6	L812 N813 T814 W846 T847 Y849	L812-I878 HydrophobicContact CD2-CG2 4.3Å; N813-I878 CarbonylContact O-C 3.54Å; N813-I878 WeakPolarHBondContact O-CA 3.29Å; T814-I878 HydrophobicContact CG2-CG1 4.46Å; W846-I878 CarbonylContact C-O 3.51Å; W846-I878 VanDerWaalsContact CA-O 3.25Å; W846-I878 WeakPolarHBondContact CA-O 3.41Å; T847-I878 PolarHBondContact N-O 3.23Å; T847-I878 PolarHBondContact O-N 3.32Å; Y849-I878 HydrophobicContact CD2-CD1 4.24Å; Y849-I878 HydrophobicContact CD2-CG1 4.3Å; Y849-I878 HydrophobicContact CE2-CB 4.37Å; Y849-I878 HydrophobicContact CE2-CD1 3.86Å; Y849-I878 HydrophobicContact CE2-CG1 4.12Å
879	L	95.9	Very high	93.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126	173.3	171.9	63.5	0	0	0	109.4	L812 N813 Y815 I829 F844 W846 L877 V881 L895	L812-L879 CarbonylContact C-O 3.56Å; L812-L879 WeakPolarHBondContact CA-O 3.5Å; N813-L879 HydrophobicContact CB-CB 4.28Å; N813-L879 PolarHBondContact N-O 3.45Å; N813-L879 PolarHBondContact O-N 3.33Å; Y815-L879 HydrophobicContact CE2-CB 3.93Å; Y815-L879 HydrophobicContact CE2-CD2 4.45Å; I829-L879 HydrophobicContact CG1-CD2 4.34Å; I829-L879 HydrophobicContact CG2-CD2 4.27Å; F844-L879 HydrophobicContact CD2-CD1 3.92Å; F844-L879 HydrophobicContact CE2-CD1 3.35Å; F844-L879 HydrophobicContact CE2-CG 4.5Å; F844-L879 HydrophobicContact CZ-CD1 3.95Å; W846-L879 HydrophobicContact CB-CD1 4.04Å; L877-L879 HydrophobicContact CD2-CB 4.14Å; L879-V881 HydrophobicContact CD1-CG2 4.17Å; L879-V881 HydrophobicContact CD2-CG2 4.26Å; L879-V881 HydrophobicContact CG-CG2 4.04Å; L879-L895 HydrophobicContact CD2-CD2 3.75Å
880	Q	95.1	Very high	93.5	Very high	47 Å²	47	47.4 Å²	47.4	22%	0.22	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.1	173.2	-176	-174.1	36.3	0	0	109.3	V811 L812 F844 L845 R882	V811-Q880 WeakPolarHBondContact O-CA 3.34Å; L812-Q880 HydrophobicContact CD2-CB 3.74Å; L812-Q880 HydrophobicContact CD2-CG 3.77Å; F844-Q880 WeakPolarHBondContact CA-O 3.42Å; L845-Q880 PolarHBondContact N-O 3.44Å; L845-Q880 PolarHBondContact O-N 3.46Å; Q880-R882 HydrophobicContact CG-CG 4.29Å
881	V	94	Very high	93.3	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	137.4	169.5	-168.7	0	0	0	0	108.7	Q810 V811 F841 G843 F844 L879 L889 L892	Q810-V881 CarbonylContact C-O 3.11Å; Q810-V881 VanDerWaalsContact CA-O 3.24Å; Q810-V881 WeakPolarHBondContact CA-O 3.48Å; V811-V881 HydrophobicContact CG1-CB 3.75Å; V811-V881 HydrophobicContact CG1-CG2 4.26Å; V811-V881 PolarHBondContact N-O 2.86Å; V811-V881 PolarHBondContact O-N 3.17Å; F841-V881 HydrophobicContact CB-CG1 3.85Å; F841-V881 HydrophobicContact CD1-CG1 3.53Å; F841-V881 HydrophobicContact CD2-CG1 4.19Å; F841-V881 HydrophobicContact CE1-CG1 4.11Å; F841-V881 HydrophobicContact CG-CG1 3.56Å; G843-V881 CarbonylContact O-C 3.58Å; G843-V881 WeakPolarHBondContact O-CA 3.25Å; F844-V881 HydrophobicContact CD2-CG2 4.05Å; F844-V881 HydrophobicContact CE2-CG2 4.46Å; L879-V881 HydrophobicContact CD1-CG2 4.17Å; L879-V881 HydrophobicContact CD2-CG2 4.26Å; L879-V881 HydrophobicContact CG-CG2 4.04Å; V881-L889 HydrophobicContact CB-CD2 4.48Å; V881-L889 HydrophobicContact CG1-CD2 4.29Å; V881-L892 HydrophobicContact CB-CD1 3.97Å; V881-L892 HydrophobicContact CG1-CD1 3.74Å; V881-L892 HydrophobicContact CG2-CD1 4.18Å
882	R	92.2	Very high	93.3	Very high	7 Å²	7	49.1 Å²	49.1	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	139.8	-175.5	-64.7	170.4	55.8	123.4	-4.5	110.7	L796 D800 Y809 Q810 C842 G843 Q880	L796-R882 HydrophobicContact CD1-CG 4.34Å; L796-R882 VanDerWaalsContact CD1-NH1 3.32Å; D800-R882 IonicContact OD1-CZ 2.7Å; D800-R882 IonicContact OD1-NH1 2.84Å; D800-R882 IonicContact OD1-NH2 2.96Å; D800-R882 PolarHBondContact OD1-NH2 3.33Å; D800-R882 IonicContact OD2-CZ 2.8Å; D800-R882 IonicContact OD2-NH1 2.92Å; D800-R882 PolarHBondContact OD2-NH1 3.46Å; D800-R882 IonicContact OD2-NH2 2.69Å; D800-R882 PolarHBondContact OD2-NH2 3.39Å; Y809-R882 VanDerWaalsContact O-CA 3.31Å; Y809-R882 WeakPolarHBondContact O-CA 3.47Å; Q810-R882 HydrophobicContact CB-CG 3.97Å; C842-R882 PolarHBondContact N-O 3.2Å; C842-R882 PolarHBondContact SG-O 3.44Å; C842-R882 VanDerWaalsContact SG-O 3.32Å; G843-R882 PolarHBondContact N-O 2.9Å; G843-R882 PolarHBondContact O-N 3.09Å; Q880-R882 HydrophobicContact CG-CG 4.29Å
883	H	91.5	Very high	93.4	Very high	32 Å²	32	46 Å²	46	15%	0.148	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	157.1	178.2	-161.2	-113.6	0	0	0	111.1	Y809 P840 F841 D885 L889	Y809-H883 PolarHBondContact N-O 2.98Å; Y809-H883 PolarHBondContact O-N 3.15Å; Y809-H883 VanDerWaalsContact O-N 3.11Å; P840-H883 PolarHBondContact O-CD2 3.49Å; P840-H883 PolarHBondContact O-NE2 2.83Å; F841-H883 HydrophobicContact CD1-CB 4.49Å; H883-D885 WeakPolarHBondContact ND1-CB 3.03Å; H883-D885 PolarHBondContact ND1-N 2.59Å; H883-D885 PolarHBondContact ND1-O 3.42Å; H883-L889 HydrophobicContact CB-CD1 4.2Å; H883-L889 HydrophobicContact CB-CD2 3.66Å; H883-L889 HydrophobicContact CB-CG 3.85Å
884	V	89.5	Confident	93.2	Very high	33 Å²	33	50.8 Å²	50.8	20%	0.2	25%	0.254	C	S	.	.	S	Bend	trans	-82.1	-29	177.3	92.2	0	0	0	0	112.1	Y802 R806 Q807 Y809	Y802-V884 HydrophobicContact CD2-CG2 3.6Å; Y802-V884 HydrophobicContact CE2-CB 3.84Å; Y802-V884 HydrophobicContact CE2-CG2 3.36Å; Y802-V884 HydrophobicContact CG-CG2 4.41Å; R806-V884 HydrophobicContact CB-CG2 3.82Å; Q807-V884 VanDerWaalsContact O-CG2 3.3Å; Q807-V884 WeakPolarHBondContact O-CG2 3.4Å; Y809-V884 WeakPolarHBondContact CD2-O 3.26Å; Y809-V884 WeakPolarHBondContact CE2-O 3.43Å
885	D	90.4	Very high	93.1	Very high	60 Å²	60	48.8 Å²	48.8	32%	0.321	24%	0.244	S	C	.	.			trans	-94.9	121.9	173.5	164.1	43.1	0	0	0	110	H883 E887 T888	H883-D885 WeakPolarHBondContact ND1-CB 3.03Å; H883-D885 PolarHBondContact ND1-N 2.59Å; H883-D885 PolarHBondContact ND1-O 3.42Å; D885-E887 PolarHBondContact OD1-N 2.84Å; D885-T888 WeakPolarHBondContact OD2-CB 3.39Å; D885-T888 PolarHBondContact OD2-N 2.85Å; D885-T888 VanDerWaalsContact OD2-N 3.13Å; D885-T888 PolarHBondContact OD2-OG1 3.23Å
886	E	92.5	Very high	92.8	Very high	78 Å²	78	49 Å²	49	36%	0.364	26%	0.255	S	S	.	.	H	α-helix	trans	-69.8	-34	-179.1	-173.5	176.8	-174.7	0	0	112	I793 Y809 T888 L889 I890	I793-E886 HydrophobicContact CG2-CG 4.22Å; Y809-E886 HydrophobicContact CD1-CB 4.18Å; Y809-E886 HydrophobicContact CD1-CG 4.14Å; Y809-E886 HydrophobicContact CD2-CB 4.29Å; Y809-E886 HydrophobicContact CE1-CB 4.19Å; Y809-E886 HydrophobicContact CE1-CG 4.29Å; Y809-E886 WeakPolarHBondContact CE1-OE2 3.36Å; Y809-E886 HydrophobicContact CE2-CB 4.36Å; Y809-E886 HydrophobicContact CG-CB 4.22Å; E886-T888 PolarHBondContact O-N 3.05Å; E886-L889 WeakPolarHBondContact O-CB 3.41Å; E886-L889 PolarHBondContact O-N 3.34Å; E886-I890 PolarHBondContact O-N 2.97Å; E886-I890 VanDerWaalsContact O-N 3.14Å
887	E	91.4	Very high	92.6	Very high	144 Å²	144	46.9 Å²	46.9	67%	0.673	25%	0.246	S	C	*	.	H	α-helix	trans	-62.3	-44.9	-178.1	-68.9	-169.5	166.4	0	0	111	D885 L889 I890	D885-E887 PolarHBondContact OD1-N 2.84Å; E887-L889 PolarHBondContact O-N 3.4Å; E887-L889 VanDerWaalsContact O-N 3.1Å; E887-I890 WeakPolarHBondContact O-CB 3.2Å; E887-I890 PolarHBondContact O-N 3.37Å
888	T	90.7	Very high	92.3	Very high	43 Å²	43	47.9 Å²	47.9	26%	0.264	25%	0.25	S	S	.	.	H	α-helix	trans	-54.8	-30.3	173.3	-60.1	0	0	0	0	112.9	F841 D885 E886	F841-T888 HydrophobicContact CE1-CG2 3.81Å; D885-T888 WeakPolarHBondContact OD2-CB 3.39Å; D885-T888 PolarHBondContact OD2-N 2.85Å; D885-T888 VanDerWaalsContact OD2-N 3.13Å; D885-T888 PolarHBondContact OD2-OG1 3.23Å; E886-T888 PolarHBondContact O-N 3.05Å
889	L	92.9	Very high	92	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-82.2	-25.9	177.7	-63	-179.5	0	0	0	113.2	I793 V811 V881 H883 E886 E887 D891 L892	I793-L889 HydrophobicContact CD1-CB 4.16Å; V811-L889 HydrophobicContact CB-CB 4.37Å; V811-L889 HydrophobicContact CG1-CD2 4.05Å; V881-L889 HydrophobicContact CB-CD2 4.48Å; V881-L889 HydrophobicContact CG1-CD2 4.29Å; H883-L889 HydrophobicContact CB-CD1 4.2Å; H883-L889 HydrophobicContact CB-CD2 3.66Å; H883-L889 HydrophobicContact CB-CG 3.85Å; E886-L889 WeakPolarHBondContact O-CB 3.41Å; E886-L889 PolarHBondContact O-N 3.34Å; E887-L889 PolarHBondContact O-N 3.4Å; E887-L889 VanDerWaalsContact O-N 3.1Å; L889-D891 VanDerWaalsContact C-N 3.27Å; L889-D891 PolarHBondContact O-N 3.25Å; L889-L892 HydrophobicContact CD2-CD1 4.14Å; L889-L892 WeakPolarHBondContact O-CB 3.24Å; L889-L892 PolarHBondContact O-N 3.48Å; L889-L892 VanDerWaalsContact O-N 3.12Å
890	I	93.4	Very high	91.7	Very high	76 Å²	76	47.8 Å²	47.8	39%	0.39	25%	0.249	S	C	.	.	H	α-helix	trans	-62.2	-39.2	176.7	-67.4	171.4	0	0	0	110.3	I793 E886 E887 L892 K893	I793-I890 HydrophobicContact CD1-CB 4.42Å; I793-I890 HydrophobicContact CD1-CG1 3.73Å; E886-I890 PolarHBondContact O-N 2.97Å; E886-I890 VanDerWaalsContact O-N 3.14Å; E887-I890 WeakPolarHBondContact O-CB 3.2Å; E887-I890 PolarHBondContact O-N 3.37Å; I890-L892 PolarHBondContact O-N 3.3Å; I890-L892 VanDerWaalsContact O-N 3.14Å; I890-K893 WeakPolarHBondContact O-CB 3.13Å; I890-K893 WeakPolarHBondContact O-CG 3.27Å; I890-K893 PolarHBondContact O-N 3.37Å; I890-K893 VanDerWaalsContact O-N 3.13Å
891	D	89.7	Confident	91.5	Very high	137 Å²	137	45.9 Å²	45.9	73%	0.733	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.9	176.9	-69.9	-16.3	0	0	0	113.3	L889	L889-D891 VanDerWaalsContact C-N 3.27Å; L889-D891 PolarHBondContact O-N 3.25Å
892	L	92.2	Very high	91.3	Very high	9 Å²	9	52.5 Å²	52.5	5%	0.047	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-3	179.5	-57	-177	0	0	0	113.8	V811 N813 L831 F841 V881 L889 I890 D894 L895	V811-L892 HydrophobicContact CG1-CB 4.19Å; V811-L892 HydrophobicContact CG1-CD1 4.25Å; N813-L892 PolarHBondContact ND2-O 3.45Å; L831-L892 HydrophobicContact CD2-CD2 3.46Å; L831-L892 VanDerWaalsContact CD2-CD2 3.46Å; F841-L892 HydrophobicContact CD1-CD1 4.38Å; F841-L892 HydrophobicContact CE1-CD1 3.67Å; F841-L892 HydrophobicContact CZ-CD1 3.91Å; F841-L892 HydrophobicContact CZ-CD2 4.29Å; V881-L892 HydrophobicContact CB-CD1 3.97Å; V881-L892 HydrophobicContact CG1-CD1 3.74Å; V881-L892 HydrophobicContact CG2-CD1 4.18Å; L889-L892 HydrophobicContact CD2-CD1 4.14Å; L889-L892 WeakPolarHBondContact O-CB 3.24Å; L889-L892 PolarHBondContact O-N 3.48Å; L889-L892 VanDerWaalsContact O-N 3.12Å; I890-L892 PolarHBondContact O-N 3.3Å; I890-L892 VanDerWaalsContact O-N 3.14Å; L892-D894 PolarHBondContact O-N 3.05Å; L892-L895 HydrophobicContact CD2-CD2 4.4Å; L892-L895 VanDerWaalsContact O-CB 3.24Å; L892-L895 WeakPolarHBondContact O-CB 3.49Å; L892-L895 PolarHBondContact O-N 2.83Å; L892-L895 VanDerWaalsContact O-N 3.13Å
893	K	93.1	Very high	90.9	Very high	87 Å²	87	52.7 Å²	52.7	38%	0.378	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-35.2	-178.1	-75.7	-177.5	178.3	175.1	0	113.2	P788 S791 I793 I890	P788-K893 WeakPolarHBondContact CG-O 3.24Å; S791-K893 WeakPolarHBondContact OG-CA 3.47Å; I793-K893 HydrophobicContact CD1-CD 4.46Å; I793-K893 HydrophobicContact CD1-CG 4.3Å; I890-K893 WeakPolarHBondContact O-CB 3.13Å; I890-K893 WeakPolarHBondContact O-CG 3.27Å; I890-K893 PolarHBondContact O-N 3.37Å; I890-K893 VanDerWaalsContact O-N 3.13Å
894	D	91	Very high	90.5	Very high	127 Å²	127	57.6 Å²	57.6	68%	0.679	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	18.5	-179.1	-70.2	-37.3	0	0	0	113.2	L892 G896	L892-D894 PolarHBondContact O-N 3.05Å; D894-G896 PolarHBondContact O-N 2.68Å
895	L	92.2	Very high	90.3	Very high	26 Å²	26	60.3 Å²	60.3	14%	0.136	32%	0.315	C	S	.	.			trans	-57.3	112	-176.2	-179.2	65.2	0	0	0	111.3	Y815 I829 L831 L879 L892	Y815-L895 WeakPolarHBondContact CE1-O 3.47Å; Y815-L895 PolarHBondContact OH-O 2.94Å; I829-L895 HydrophobicContact CG2-CD2 3.79Å; I829-L895 HydrophobicContact CG2-CG 4.45Å; L831-L895 HydrophobicContact CB-CD1 4.19Å; L831-L895 HydrophobicContact CD2-CD1 4.21Å; L879-L895 HydrophobicContact CD2-CD2 3.75Å; L892-L895 HydrophobicContact CD2-CD2 4.4Å; L892-L895 VanDerWaalsContact O-CB 3.24Å; L892-L895 WeakPolarHBondContact O-CB 3.49Å; L892-L895 PolarHBondContact O-N 2.83Å; L892-L895 VanDerWaalsContact O-N 3.13Å
896	G	91.9	Very high	89.9	Confident	34 Å²	34	61.4 Å²	61.4	35%	0.351	32%	0.321	S	S	.	.			trans	-73.4	139.5	173.7	0	0	0	0	0	111.9	L786 D894	L786-G896 WeakPolarHBondContact O-CA 3Å; D894-G896 PolarHBondContact O-N 2.68Å
897	I	92.6	Very high	89.4	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	169	175.5	71.2	172.3	0	0	0	110.6	P785 L786 Y815 I829 L877	P785-I897 CarbonylContact C-O 3.58Å; P785-I897 WeakPolarHBondContact CA-O 3.39Å; L786-I897 HydrophobicContact CB-CG1 3.9Å; L786-I897 HydrophobicContact CD1-CD1 4.34Å; L786-I897 HydrophobicContact CD1-CG1 4.39Å; L786-I897 PolarHBondContact N-O 3.43Å; L786-I897 PolarHBondContact O-N 2.81Å; Y815-I897 HydrophobicContact CD1-CD1 3.63Å; Y815-I897 HydrophobicContact CD1-CG1 3.69Å; Y815-I897 HydrophobicContact CD2-CD1 3.72Å; Y815-I897 HydrophobicContact CE1-CB 4.36Å; Y815-I897 HydrophobicContact CE1-CD1 3.86Å; Y815-I897 HydrophobicContact CE1-CG1 3.67Å; Y815-I897 HydrophobicContact CE1-CG2 3.94Å; Y815-I897 HydrophobicContact CE2-CD1 3.96Å; Y815-I897 HydrophobicContact CE2-CG2 4.32Å; Y815-I897 HydrophobicContact CG-CD1 3.56Å; Y815-I897 HydrophobicContact CG-CG1 4.17Å; I829-I897 HydrophobicContact CB-CG2 4.39Å; I829-I897 HydrophobicContact CG1-CB 4.37Å; I829-I897 HydrophobicContact CG1-CG2 3.78Å; I829-I897 HydrophobicContact CG2-CG2 4.22Å; L877-I897 HydrophobicContact CD1-CD1 4.27Å; L877-I897 HydrophobicContact CD2-CD1 3.88Å
898	F	89.5	Confident	88.9	Confident	22 Å²	22	57.8 Å²	57.8	10%	0.096	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	143.6	170.5	-55.4	-85.4	0	0	0	111.2	V784 P785 V828 P830 P976 P979	V784-F898 CarbonylContact O-C 3.57Å; V784-F898 VanDerWaalsContact O-CA 3.31Å; V784-F898 WeakPolarHBondContact O-CA 3.36Å; P785-F898 HydrophobicContact CB-CD1 3.86Å; P785-F898 HydrophobicContact CB-CE1 3.79Å; V828-F898 HydrophobicContact CB-CB 4.41Å; V828-F898 PolarHBondContact N-O 3.22Å; V828-F898 PolarHBondContact O-N 3.5Å; P830-F898 HydrophobicContact CG-CD2 3.68Å; P830-F898 HydrophobicContact CG-CE2 3.45Å; P830-F898 VanDerWaalsContact CG-CE2 3.45Å; F898-P976 HydrophobicContact CD2-CG 4.18Å; F898-P976 HydrophobicContact CE2-CB 3.59Å; F898-P976 HydrophobicContact CE2-CG 3.39Å; F898-P976 HydrophobicContact CZ-CB 3.69Å; F898-P976 HydrophobicContact CZ-CG 4.04Å; F898-P979 HydrophobicContact CE1-CG 4.46Å; F898-P979 HydrophobicContact CZ-CG 3.98Å
899	I	91.5	Very high	88.4	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	112.4	165.6	-63	-55.6	0	0	0	107.2	C783 V784 L786 F817 V825 P827 L877	C783-I899 WeakPolarHBondContact CA-O 3.45Å; V784-I899 HydrophobicContact CB-CB 4.3Å; V784-I899 HydrophobicContact CG2-CB 4.46Å; V784-I899 PolarHBondContact N-O 3.41Å; V784-I899 PolarHBondContact O-N 2.87Å; L786-I899 HydrophobicContact CD1-CD1 4.3Å; L786-I899 HydrophobicContact CD1-CG1 3.47Å; L786-I899 VanDerWaalsContact CD1-CG1 3.47Å; L786-I899 HydrophobicContact CG-CG1 4.37Å; F817-I899 HydrophobicContact CD1-CG1 4.38Å; F817-I899 HydrophobicContact CD2-CG1 4.29Å; F817-I899 HydrophobicContact CD2-CG2 4.1Å; F817-I899 HydrophobicContact CE1-CD1 4.4Å; F817-I899 HydrophobicContact CE2-CG1 4.49Å; F817-I899 HydrophobicContact CE2-CG2 4.02Å; F817-I899 HydrophobicContact CG-CG1 4.23Å; F817-I899 HydrophobicContact CZ-CD1 4.47Å; V825-I899 HydrophobicContact CB-CG2 4.49Å; V825-I899 HydrophobicContact CG1-CG2 3.46Å; V825-I899 VanDerWaalsContact CG1-CG2 3.46Å; V825-I899 HydrophobicContact CG2-CG2 4.33Å; P827-I899 HydrophobicContact CB-CD1 3.97Å; P827-I899 HydrophobicContact CG-CD1 4.02Å; L877-I899 HydrophobicContact CD1-CD1 4.11Å
900	E	89.7	Confident	88	Confident	39 Å²	39	58.8 Å²	58.8	18%	0.182	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	112.5	173.3	-174.1	-170.5	169	0	0	109.6	S781 V825 T826	S781-E900 VanDerWaalsContact CB-CG 3.41Å; S781-E900 WeakPolarHBondContact CB-OE1 3.48Å; S781-E900 PolarHBondContact OG-OE1 2.96Å; V825-E900 CarbonylContact C-O 3.6Å; V825-E900 WeakPolarHBondContact CA-O 3.43Å; T826-E900 PolarHBondContact N-O 2.93Å; T826-E900 WeakPolarHBondContact O-CB 3.33Å; T826-E900 PolarHBondContact O-N 3.09Å
901	C	90.3	Very high	87.7	Confident	7 Å²	7	55.8 Å²	55.8	5%	0.047	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	117.8	176.4	-63.5	0	0	0	0	110.1	S781 L782 T823	S781-C901 CarbonylContact C-O 3.53Å; S781-C901 WeakPolarHBondContact CA-O 3.38Å; L782-C901 HydrophobicContact CB-CB 4.34Å; L782-C901 PolarHBondContact N-O 2.9Å; L782-C901 PolarHBondContact O-N 3.12Å; T823-C901 HydrophobicContact CG2-CB 4.04Å
902	R	89.1	Confident	87.8	Confident	141 Å²	141	50 Å²	50	53%	0.532	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	132.5	-180	-170.7	172.2	-179.5	146.6	-0.7	111.9	T823 T824	T823-R902 PolarHBondContact OG1-N 2.87Å; T823-R902 VanDerWaalsContact OG1-N 3.12Å; T823-R902 PolarHBondContact OG1-O 3.38Å; T824-R902 PolarHBondContact O-N 3.35Å
903	L	84.2	Confident	87.6	Confident	11 Å²	11	52.1 Å²	52.1	6%	0.058	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	143.9	175.5	-61.5	175.4	0	0	0	110.9	R780 L782 F821 S905 I907 F951	R780-L903 WeakPolarHBondContact O-CB 3.48Å; R780-L903 PolarHBondContact O-N 3.34Å; L782-L903 HydrophobicContact CB-CD2 4.28Å; F821-L903 HydrophobicContact CZ-CD2 4.39Å; L903-S905 VanDerWaalsContact C-N 3.27Å; L903-S905 PolarHBondContact O-N 2.94Å; L903-I907 HydrophobicContact CD1-CD1 4.27Å; L903-I907 HydrophobicContact CD1-CG1 4.41Å; L903-F951 HydrophobicContact CD2-CE2 3.81Å; L903-F951 HydrophobicContact CD2-CZ 4.02Å
904	N	82.9	Confident	87.4	Confident	135 Å²	135	49.8 Å²	49.8	72%	0.722	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	-32.8	176.1	-73.6	-20.7	0	0	0	112.3
905	S	84.8	Confident	87.2	Confident	90 Å²	90	48.7 Å²	48.7	63%	0.629	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	137	173.4	54.3	0	0	0	0	110.1	L903 I907	L903-S905 VanDerWaalsContact C-N 3.27Å; L903-S905 PolarHBondContact O-N 2.94Å; S905-I907 PolarHBondContact O-N 3.42Å
906	N	83.3	Confident	86.9	Confident	83 Å²	83	52.3 Å²	52.3	44%	0.444	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	131.7	177	-64.2	-10.7	0	0	0	109.5	F779	F779-N906 WeakPolarHBondContact O-CA 3.36Å
907	I	81.5	Confident	86.7	Confident	25 Å²	25	53.6 Å²	53.6	13%	0.128	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	130.6	172.8	-48.9	171.9	0	0	0	106.9	S778 F779 L903 S905 P944 L949	S778-I907 CarbonylContact C-O 3.56Å; S778-I907 WeakPolarHBondContact CA-O 3.19Å; F779-I907 HydrophobicContact CB-CB 4Å; F779-I907 HydrophobicContact CD2-CB 4.17Å; F779-I907 HydrophobicContact CD2-CG2 4.37Å; F779-I907 VanDerWaalsContact CD2-O 3.27Å; F779-I907 WeakPolarHBondContact CD2-O 3.37Å; F779-I907 HydrophobicContact CG-CB 4.41Å; F779-I907 PolarHBondContact N-O 3.32Å; F779-I907 PolarHBondContact O-N 3.39Å; F779-I907 VanDerWaalsContact O-N 3.08Å; L903-I907 HydrophobicContact CD1-CD1 4.27Å; L903-I907 HydrophobicContact CD1-CG1 4.41Å; S905-I907 PolarHBondContact O-N 3.42Å; I907-P944 HydrophobicContact CG2-CB 3.64Å; I907-P944 HydrophobicContact CG2-CG 3.96Å; I907-L949 HydrophobicContact CD1-CD2 4.15Å
908	Q	80.5	Confident	86.3	Confident	121 Å²	121	54 Å²	54	57%	0.565	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	135.9	178.4	-67.4	-155.3	-10.6	0	0	111.8
909	A	80.7	Confident	85.9	Confident	10 Å²	10	58.3 Å²	58.3	8%	0.083	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-74	145.2	165	0	0	0	0	0	109.7	W749 M777 F779 F941	W749-A909 HydrophobicContact CH2-CB 3.98Å; M777-A909 HydrophobicContact CB-CB 4.14Å; M777-A909 HydrophobicContact CE-CB 3.45Å; M777-A909 VanDerWaalsContact CE-CB 3.45Å; M777-A909 HydrophobicContact CG-CB 4.34Å; M777-A909 PolarHBondContact O-N 2.81Å; F779-A909 HydrophobicContact CE2-CB 4.03Å; A909-F941 HydrophobicContact CB-CD1 4.07Å
910	Q	85.2	Confident	85.4	Confident	54 Å²	54	61.4 Å²	61.4	25%	0.252	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.9	177.7	-54.3	-167.1	30.2	0	0	109.4	Y912 F941 V942	Q910-Y912 HydrophobicContact CB-CE2 3.73Å; Q910-Y912 PolarHBondContact OE1-OH 2.91Å; Q910-F941 CarbonylContact O-C 3.52Å; Q910-F941 VanDerWaalsContact O-CA 3.26Å; Q910-F941 WeakPolarHBondContact O-CA 3.32Å; Q910-V942 PolarHBondContact N-O 3.08Å; Q910-V942 PolarHBondContact O-N 3.48Å
911	C	87	Confident	84.4	Confident	13 Å²	13	66.3 Å²	66.3	9%	0.088	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	140.7	-179.7	-172.5	0	0	0	0	111.1	F926 Y940 F941	C911-F926 HydrophobicContact CB-CB 4.14Å; C911-F926 WeakPolarHBondContact O-CB 3.43Å; C911-F926 PolarHBondContact O-N 3.35Å; C911-Y940 CarbonylContact C-O 3.52Å; C911-Y940 WeakPolarHBondContact CA-O 3.24Å; C911-F941 HydrophobicContact CB-CD1 3.91Å; C911-F941 HydrophobicContact CB-CE1 3.66Å; C911-F941 HydrophobicContact CB-CZ 4.25Å
912	Y	90.7	Very high	83.5	Confident	16 Å²	16	73.6 Å²	73.6	6%	0.063	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	153.1	179.7	-60.7	-89.1	0	0	0	111	Q910 D917 A918 S923 K925 Y940 V942	Q910-Y912 HydrophobicContact CB-CE2 3.73Å; Q910-Y912 PolarHBondContact OE1-OH 2.91Å; Y912-D917 HydrophobicContact CD1-CB 4.04Å; Y912-A918 HydrophobicContact CD2-CB 3.69Å; Y912-A918 HydrophobicContact CE2-CB 4.42Å; Y912-A918 HydrophobicContact CG-CB 3.86Å; Y912-S923 WeakPolarHBondContact CE1-OG 3.27Å; Y912-K925 HydrophobicContact CE1-CG 4.31Å; Y912-Y940 PolarHBondContact N-O 3.13Å; Y912-Y940 PolarHBondContact O-N 3.01Å; Y912-V942 HydrophobicContact CD2-CG2 3.85Å; Y912-V942 HydrophobicContact CE2-CB 4.1Å; Y912-V942 HydrophobicContact CE2-CG2 3.6Å
913	A	88.5	Confident	83	Confident	52 Å²	52	68 Å²	68	43%	0.43	39%	0.387	S	S	.	.	S	Bend	trans	-83.6	-22.3	-179.8	0	0	0	0	0	113.3	F926	A913-F926 HydrophobicContact CB-CD2 3.84Å; A913-F926 HydrophobicContact CB-CE2 4.31Å
914	S	88.8	Confident	83	Confident	38 Å²	38	76.4 Å²	76.4	27%	0.266	42%	0.423	S	S	.	.	S	Bend	trans	-134.9	154.9	-180	83.4	0	0	0	0	111.7	V916 D917 A918	S914-V916 VanDerWaalsContact C-N 3.3Å; S914-V916 PolarHBondContact O-N 2.62Å; S914-D917 PolarHBondContact O-N 2.91Å; S914-D917 WeakPolarHBondContact OG-CB 3.45Å; S914-D917 PolarHBondContact OG-N 2.77Å; S914-D917 VanDerWaalsContact OG-N 3.08Å; S914-D917 PolarHBondContact OG-OD2 2.86Å; S914-A918 PolarHBondContact O-N 3.27Å; S914-A918 VanDerWaalsContact O-N 3.14Å
915	F	86.9	Confident	83.2	Confident	104 Å²	104	76 Å²	76	46%	0.456	42%	0.415	S	S	.	.	H	α-helix	trans	-60.6	-41.1	175.3	178.2	-97.9	0	0	0	111.7	L759 A918 L919 Y940	L759-F915 HydrophobicContact CD2-CD2 3.24Å; L759-F915 HydrophobicContact CD2-CE2 3.24Å; L759-F915 HydrophobicContact CD2-CG 4.41Å; L759-F915 HydrophobicContact CD2-CZ 4.42Å; F915-A918 PolarHBondContact O-N 3.22Å; F915-L919 HydrophobicContact CD1-CD1 3.95Å; F915-L919 HydrophobicContact CE1-CD1 3.32Å; F915-L919 HydrophobicContact CE1-CG 4.28Å; F915-L919 HydrophobicContact CE2-CD1 4.46Å; F915-L919 HydrophobicContact CZ-CD1 3.61Å; F915-L919 HydrophobicContact CZ-CG 4.33Å; F915-L919 PolarHBondContact O-N 2.77Å; F915-Y940 HydrophobicContact CB-CD1 4.22Å; F915-Y940 HydrophobicContact CB-CE1 3.77Å; F915-Y940 HydrophobicContact CB-CE2 4.38Å; F915-Y940 HydrophobicContact CD2-CD1 4.25Å; F915-Y940 HydrophobicContact CD2-CE1 4.04Å; F915-Y940 HydrophobicContact CG-CE1 4.42Å
916	V	85.9	Confident	83.3	Confident	103 Å²	103	73.1 Å²	73.1	62%	0.624	39%	0.391	S	S	*	.	H	α-helix	trans	-65	-43.4	-178.8	-179.7	0	0	0	0	110.8	S914 A918 L919 S920	S914-V916 VanDerWaalsContact C-N 3.3Å; S914-V916 PolarHBondContact O-N 2.62Å; V916-A918 VanDerWaalsContact C-N 3.32Å; V916-A918 PolarHBondContact O-N 2.81Å; V916-L919 PolarHBondContact O-N 3.48Å; V916-S920 PolarHBondContact O-N 2.64Å
917	D	87.1	Confident	83.3	Confident	60 Å²	60	73.6 Å²	73.6	32%	0.321	40%	0.401	S	S	.	.	H	α-helix	trans	-60.2	-46	175.2	-68.9	-44.9	0	0	0	110.3	Y912 S914 L919 S920 S923	Y912-D917 HydrophobicContact CD1-CB 4.04Å; S914-D917 PolarHBondContact O-N 2.91Å; S914-D917 WeakPolarHBondContact OG-CB 3.45Å; S914-D917 PolarHBondContact OG-N 2.77Å; S914-D917 VanDerWaalsContact OG-N 3.08Å; S914-D917 PolarHBondContact OG-OD2 2.86Å; D917-L919 PolarHBondContact O-N 3.45Å; D917-L919 VanDerWaalsContact O-N 3.13Å; D917-S920 PolarHBondContact O-N 3.29Å; D917-S923 WeakPolarHBondContact O-CB 3.36Å; D917-S923 PolarHBondContact O-OG 2.81Å
918	A	84.8	Confident	83.5	Confident	11 Å²	11	74.7 Å²	74.7	9%	0.091	41%	0.411	C	S	.	.	H	α-helix	trans	-62.8	-23.4	-177.2	0	0	0	0	0	114.5	L759 Y912 S914 F915 V916 V942	L759-A918 HydrophobicContact CD1-CB 3.21Å; Y912-A918 HydrophobicContact CD2-CB 3.69Å; Y912-A918 HydrophobicContact CE2-CB 4.42Å; Y912-A918 HydrophobicContact CG-CB 3.86Å; S914-A918 PolarHBondContact O-N 3.27Å; S914-A918 VanDerWaalsContact O-N 3.14Å; F915-A918 PolarHBondContact O-N 3.22Å; V916-A918 VanDerWaalsContact C-N 3.32Å; V916-A918 PolarHBondContact O-N 2.81Å; A918-V942 HydrophobicContact CB-CG2 3.91Å
919	L	81.4	Confident	83.8	Confident	112 Å²	112	77.1 Å²	77.1	59%	0.586	42%	0.415	S	S	*	.	H	α-helix	trans	-86.9	-17.4	174.9	-68	176.8	0	0	0	113.7	F915 V916 D917	F915-L919 HydrophobicContact CD1-CD1 3.95Å; F915-L919 HydrophobicContact CE1-CD1 3.32Å; F915-L919 HydrophobicContact CE1-CG 4.28Å; F915-L919 HydrophobicContact CE2-CD1 4.46Å; F915-L919 HydrophobicContact CZ-CD1 3.61Å; F915-L919 HydrophobicContact CZ-CG 4.33Å; F915-L919 PolarHBondContact O-N 2.77Å; V916-L919 PolarHBondContact O-N 3.48Å; D917-L919 PolarHBondContact O-N 3.45Å; D917-L919 VanDerWaalsContact O-N 3.13Å
920	S	79.9	Confident	84	Confident	64 Å²	64	85.2 Å²	85.2	45%	0.448	44%	0.443	S	S	.	.	S	Bend	trans	-86.3	133.4	-177.8	-92.3	0	0	0	0	112.3	V916 D917 N922 S923	V916-S920 PolarHBondContact O-N 2.64Å; D917-S920 PolarHBondContact O-N 3.29Å; S920-N922 PolarHBondContact O-N 3.41Å; S920-S923 PolarHBondContact O-OG 3.08Å; S920-S923 VanDerWaalsContact O-OG 3.12Å
921	V	69.7	Low	84	Confident	142 Å²	142	82.8 Å²	82.8	86%	0.861	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.4	-175.2	-175.6	0	0	0	0	113.7
922	N	71.2	Confident	84.1	Confident	161 Å²	161	86.2 Å²	86.2	86%	0.861	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.2	24.3	-175.4	-80.8	-18.5	0	0	0	113.7	S920	S920-N922 PolarHBondContact O-N 3.41Å
923	S	78.9	Confident	83.8	Confident	22 Å²	22	87 Å²	87	15%	0.154	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-73.9	155.8	-180	56.4	0	0	0	0	113.1	Y912 D917 S920 K925	Y912-S923 WeakPolarHBondContact CE1-OG 3.27Å; D917-S923 WeakPolarHBondContact O-CB 3.36Å; D917-S923 PolarHBondContact O-OG 2.81Å; S920-S923 PolarHBondContact O-OG 3.08Å; S920-S923 VanDerWaalsContact O-OG 3.12Å; S923-K925 PolarHBondContact O-N 2.93Å
924	K	83.2	Confident	83.7	Confident	188 Å²	188	90.1 Å²	90.1	82%	0.817	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-70.8	125.4	177.3	-121.3	-178.9	-178.3	178.8	0	110
925	K	86.7	Confident	83.7	Confident	126 Å²	126	89.8 Å²	89.8	55%	0.548	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-63.1	155	171.2	-63.6	178	-177.1	177.5	0	110.6	Y912 S923 S927	Y912-K925 HydrophobicContact CE1-CG 4.31Å; S923-K925 PolarHBondContact O-N 2.93Å; K925-S927 PolarHBondContact O-N 3.28Å
926	F	87.1	Confident	83.9	Confident	31 Å²	31	88.5 Å²	88.5	14%	0.136	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-55.6	123.1	174.3	-170.5	-83.7	0	0	0	110.2	L773 P775 C911 A913 R929 T937 L939	L773-F926 HydrophobicContact CD2-CZ 4.03Å; L773-F926 HydrophobicContact CG-CE1 4.32Å; L773-F926 HydrophobicContact CG-CZ 4.17Å; P775-F926 VanDerWaalsContact CD-CE1 3.45Å; P775-F926 HydrophobicContact CG-CD1 3.8Å; P775-F926 HydrophobicContact CG-CE1 3.96Å; P775-F926 HydrophobicContact CG-CG 4.37Å; C911-F926 HydrophobicContact CB-CB 4.14Å; C911-F926 WeakPolarHBondContact O-CB 3.43Å; C911-F926 PolarHBondContact O-N 3.35Å; A913-F926 HydrophobicContact CB-CD2 3.84Å; A913-F926 HydrophobicContact CB-CE2 4.31Å; F926-R929 HydrophobicContact CZ-CB 4.38Å; F926-T937 HydrophobicContact CE2-CG2 4.49Å; F926-L939 HydrophobicContact CD2-CD2 3.56Å; F926-L939 HydrophobicContact CE1-CD2 4.46Å; F926-L939 HydrophobicContact CE2-CD2 3.36Å; F926-L939 HydrophobicContact CG-CD2 4.21Å; F926-L939 HydrophobicContact CZ-CD2 3.86Å
927	S	84.7	Confident	84.1	Confident	93 Å²	93	84.8 Å²	84.8	65%	0.65	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-99.5	149.5	171.4	57.4	0	0	0	0	109.7	K925 R929	K925-S927 PolarHBondContact O-N 3.28Å; S927-R929 PolarHBondContact O-N 3.34Å
928	S	85.5	Confident	84.3	Confident	47 Å²	47	84.1 Å²	84.1	33%	0.329	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-46.6	134.7	175.4	-168.9	0	0	0	0	111.6	E772 L773	E772-S928 VanDerWaalsContact CD-OG 3.29Å; E772-S928 WeakPolarHBondContact CG-OG 3.31Å; E772-S928 PolarHBondContact OE1-OG 2.82Å; L773-S928 WeakPolarHBondContact O-CA 3.43Å
929	R	85.4	Confident	84.5	Confident	172 Å²	172	83.7 Å²	83.7	65%	0.649	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.9	138.5	-179.3	-171.3	178.7	-176.3	180	2.6	110.3	L773 F926 S927	L773-R929 PolarHBondContact N-O 3.39Å; L773-R929 PolarHBondContact O-N 3.46Å; L773-R929 VanDerWaalsContact O-N 3.17Å; F926-R929 HydrophobicContact CZ-CB 4.38Å; S927-R929 PolarHBondContact O-N 3.34Å
930	R	85.6	Confident	84.8	Confident	181 Å²	181	80 Å²	80	68%	0.683	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	125.1	169.4	-174.2	170	-82	-177.7	-5.6	110	E771	E771-R930 WeakPolarHBondContact O-CA 3.34Å
931	V	85.8	Confident	85	Confident	3 Å²	3	77 Å²	77	2%	0.018	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.8	-177.4	-178.8	0	0	0	0	108.4	F740 C766 S770 E771 L773 S935	F740-V931 HydrophobicContact CE1-CB 4.04Å; F740-V931 HydrophobicContact CE1-CG1 4.16Å; F740-V931 HydrophobicContact CE1-CG2 4.29Å; F740-V931 HydrophobicContact CZ-CB 4.06Å; F740-V931 HydrophobicContact CZ-CG2 4.29Å; C766-V931 HydrophobicContact CB-CG1 3.75Å; S770-V931 WeakPolarHBondContact CA-O 3.45Å; S770-V931 PolarHBondContact OG-O 3.34Å; E771-V931 PolarHBondContact N-O 3.25Å; E771-V931 VanDerWaalsContact N-O 3.15Å; E771-V931 PolarHBondContact O-N 2.77Å; L773-V931 HydrophobicContact CB-CG2 3.56Å; L773-V931 HydrophobicContact CD2-CG2 3.84Å; L773-V931 HydrophobicContact CG-CG2 4.35Å; V931-S935 WeakPolarHBondContact CG1-OG 3.48Å
932	P	88.7	Confident	85.6	Confident	84 Å²	84	71.6 Å²	71.6	55%	0.545	37%	0.369	S	S	.	.			trans	-61	153.1	175	-22.9	32.6	0	0	0	112.2	C766 S935	C766-P932 WeakPolarHBondContact CB-O 3.26Å; P932-S935 WeakPolarHBondContact CD-OG 3.35Å; P932-S935 WeakPolarHBondContact O-CB 3.49Å; P932-S935 PolarHBondContact O-N 2.93Å; P932-S935 PolarHBondContact O-OG 3.33Å
933	A	84.1	Confident	85.7	Confident	32 Å²	32	64.3 Å²	64.3	26%	0.264	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	143.2	173.5	0	0	0	0	0	111.4	G767 P768 S935	G767-A933 CarbonylContact O-C 3.6Å; G767-A933 WeakPolarHBondContact O-CA 3.19Å; P768-A933 VanDerWaalsContact O-CB 3.24Å; P768-A933 WeakPolarHBondContact O-CB 3.32Å; A933-S935 PolarHBondContact O-N 2.69Å
934	N	85.5	Confident	85.4	Confident	118 Å²	118	63.9 Å²	63.9	63%	0.631	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	20.2	177.9	-56.7	-40.5	0	0	0	115	C766 G767	C766-N934 WeakPolarHBondContact O-CA 3.36Å; C766-N934 PolarHBondContact O-N 3.47Å; G767-N934 PolarHBondContact O-N 3.37Å
935	S	90.4	Very high	84.8	Confident	32 Å²	32	57.2 Å²	57.2	22%	0.224	31%	0.306	C	S	.	.			trans	-99.7	157.4	177.8	72.1	0	0	0	0	112.2	C766 V931 P932 A933	C766-S935 WeakPolarHBondContact CB-O 3.33Å; C766-S935 PolarHBondContact N-O 2.76Å; V931-S935 WeakPolarHBondContact CG1-OG 3.48Å; P932-S935 WeakPolarHBondContact CD-OG 3.35Å; P932-S935 WeakPolarHBondContact O-CB 3.49Å; P932-S935 PolarHBondContact O-N 2.93Å; P932-S935 PolarHBondContact O-OG 3.33Å; A933-S935 PolarHBondContact O-N 2.69Å
936	V	90.1	Very high	83.8	Confident	77 Å²	77	57.4 Å²	57.4	47%	0.467	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127	-179.2	-171.1	0	0	0	0	109.6	M763 A764 I765	M763-V936 HydrophobicContact CB-CG1 3.99Å; M763-V936 HydrophobicContact CE-CG1 3.44Å; M763-V936 VanDerWaalsContact CE-CG1 3.44Å; A764-V936 WeakPolarHBondContact O-CA 3.3Å; I765-V936 HydrophobicContact CG1-CG1 4.19Å; I765-V936 HydrophobicContact CG1-CG2 4.23Å; I765-V936 HydrophobicContact CG2-CG2 4.46Å
937	T	89.9	Confident	82.9	Confident	25 Å²	25	63 Å²	63	15%	0.153	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.2	178	-58.8	0	0	0	0	110.1	A764 L773 F926 L939	A764-T937 PolarHBondContact N-O 2.73Å; A764-T937 PolarHBondContact O-N 3.27Å; L773-T937 HydrophobicContact CD2-CG2 4.01Å; F926-T937 HydrophobicContact CE2-CG2 4.49Å; T937-L939 HydrophobicContact CG2-CD2 4.39Å
938	P	91	Very high	82.1	Confident	46 Å²	46	65.9 Å²	65.9	30%	0.299	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	136.2	172.8	30.1	-32.9	0	0	0	110.9	M763 Y940	M763-P938 HydrophobicContact CE-CB 4.25Å; M763-P938 HydrophobicContact SD-CB 3.76Å; P938-Y940 HydrophobicContact CB-CE2 4.15Å
939	L	88.7	Confident	81.1	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	142.3	175.3	-60.3	172.9	0	0	0	109.1	K761 V762 A764 L773 P775 F926 T937 F941	K761-L939 CarbonylContact C-O 3.49Å; K761-L939 WeakPolarHBondContact CA-O 3.46Å; V762-L939 PolarHBondContact N-O 3.32Å; V762-L939 WeakPolarHBondContact O-CB 3.4Å; V762-L939 PolarHBondContact O-N 3.37Å; A764-L939 HydrophobicContact CB-CD1 3.96Å; L773-L939 HydrophobicContact CD2-CD1 4.41Å; L773-L939 HydrophobicContact CD2-CD2 4.36Å; P775-L939 HydrophobicContact CB-CD1 3.7Å; P775-L939 HydrophobicContact CG-CD1 3.73Å; P775-L939 HydrophobicContact CG-CD2 4.01Å; F926-L939 HydrophobicContact CD2-CD2 3.56Å; F926-L939 HydrophobicContact CE1-CD2 4.46Å; F926-L939 HydrophobicContact CE2-CD2 3.36Å; F926-L939 HydrophobicContact CG-CD2 4.21Å; F926-L939 HydrophobicContact CZ-CD2 3.86Å; T937-L939 HydrophobicContact CG2-CD2 4.39Å; L939-F941 HydrophobicContact CB-CE2 4.14Å; L939-F941 HydrophobicContact CD1-CE2 4.47Å
940	Y	87.7	Confident	79.9	Confident	33 Å²	33	59.4 Å²	59.4	13%	0.129	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	116	179.1	-62.5	-91	0	0	0	109.7	L759 F760 K761 C911 Y912 F915 P938	L759-Y940 HydrophobicContact CD2-CD1 4.03Å; L759-Y940 HydrophobicContact CG-CD1 4.47Å; F760-Y940 CarbonylContact O-C 3.58Å; F760-Y940 WeakPolarHBondContact O-CA 3.25Å; K761-Y940 HydrophobicContact CB-CD1 4.08Å; K761-Y940 HydrophobicContact CB-CE1 3.99Å; K761-Y940 HydrophobicContact CD-CE1 3.82Å; K761-Y940 HydrophobicContact CG-CD1 4.2Å; K761-Y940 HydrophobicContact CG-CE1 3.77Å; C911-Y940 CarbonylContact C-O 3.52Å; C911-Y940 WeakPolarHBondContact CA-O 3.24Å; Y912-Y940 PolarHBondContact N-O 3.13Å; Y912-Y940 PolarHBondContact O-N 3.01Å; F915-Y940 HydrophobicContact CB-CD1 4.22Å; F915-Y940 HydrophobicContact CB-CE1 3.77Å; F915-Y940 HydrophobicContact CB-CE2 4.38Å; F915-Y940 HydrophobicContact CD2-CD1 4.25Å; F915-Y940 HydrophobicContact CD2-CE1 4.04Å; F915-Y940 HydrophobicContact CG-CE1 4.42Å; P938-Y940 HydrophobicContact CB-CE2 4.15Å
941	F	85.5	Confident	78.7	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.009	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.6	178.9	-72.3	-86	0	0	0	111.3	W749 L759 F760 V762 P775 M777 A909 Q910 C911 L939	W749-F941 HydrophobicContact CZ2-CB 4.14Å; L759-F941 CarbonylContact C-O 3.57Å; L759-F941 WeakPolarHBondContact CA-O 3.41Å; F760-F941 PolarHBondContact N-O 3.18Å; F760-F941 PolarHBondContact O-N 2.63Å; V762-F941 HydrophobicContact CB-CD2 4.38Å; V762-F941 HydrophobicContact CB-CE2 4.18Å; V762-F941 HydrophobicContact CG2-CD2 3.85Å; V762-F941 HydrophobicContact CG2-CE2 3.97Å; P775-F941 HydrophobicContact CB-CZ 4.13Å; M777-F941 HydrophobicContact CB-CD1 3.85Å; M777-F941 HydrophobicContact CB-CE1 3.57Å; M777-F941 HydrophobicContact CB-CZ 4.22Å; M777-F941 HydrophobicContact CE-CB 3.47Å; M777-F941 VanDerWaalsContact CE-CB 3.47Å; M777-F941 HydrophobicContact CE-CD1 3.75Å; M777-F941 HydrophobicContact CE-CD2 4.37Å; M777-F941 HydrophobicContact CE-CG 3.62Å; M777-F941 HydrophobicContact SD-CD1 4.28Å; M777-F941 HydrophobicContact SD-CG 4.24Å; A909-F941 HydrophobicContact CB-CD1 4.07Å; Q910-F941 CarbonylContact O-C 3.52Å; Q910-F941 VanDerWaalsContact O-CA 3.26Å; Q910-F941 WeakPolarHBondContact O-CA 3.32Å; C911-F941 HydrophobicContact CB-CD1 3.91Å; C911-F941 HydrophobicContact CB-CE1 3.66Å; C911-F941 HydrophobicContact CB-CZ 4.25Å; L939-F941 HydrophobicContact CB-CE2 4.14Å; L939-F941 HydrophobicContact CD1-CE2 4.47Å
942	V	82.3	Confident	77	Confident	28 Å²	28	58 Å²	58	17%	0.17	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.6	174.4	-176.8	0	0	0	0	110.1	L758 L759 Q910 Y912 A918	L758-V942 HydrophobicContact CB-CG1 4.23Å; L758-V942 CarbonylContact O-C 3.56Å; L758-V942 VanDerWaalsContact O-CA 3.24Å; L758-V942 WeakPolarHBondContact O-CA 3.48Å; L759-V942 HydrophobicContact CD1-CG2 3.6Å; Q910-V942 PolarHBondContact N-O 3.08Å; Q910-V942 PolarHBondContact O-N 3.48Å; Y912-V942 HydrophobicContact CD2-CG2 3.85Å; Y912-V942 HydrophobicContact CE2-CB 4.1Å; Y912-V942 HydrophobicContact CE2-CG2 3.6Å; A918-V942 HydrophobicContact CB-CG2 3.91Å
943	G	73.6	Confident	75	Confident	9 Å²	9	56.7 Å²	56.7	9%	0.093	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-74.8	163.3	-179.7	0	0	0	0	0	115.8	W749 L758	W749-G943 VanDerWaalsContact CH2-N 3.27Å; L758-G943 PolarHBondContact O-N 2.71Å
944	P	72.7	Confident	72.8	Confident	12 Å²	12	63.2 Å²	63.2	8%	0.078	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-66.5	141.1	-179.3	26.6	-31.1	0	0	0	111.4	F779 I907 R948 L949	F779-P944 HydrophobicContact CD2-CG 4.35Å; F779-P944 HydrophobicContact CE2-CG 4.24Å; I907-P944 HydrophobicContact CG2-CB 3.64Å; I907-P944 HydrophobicContact CG2-CG 3.96Å; P944-R948 HydrophobicContact CB-CB 4.29Å; P944-L949 HydrophobicContact CB-CG 4.46Å; P944-L949 HydrophobicContact CG-CD1 4.36Å; P944-L949 HydrophobicContact CG-CD2 4.19Å; P944-L949 HydrophobicContact CG-CG 4.16Å
945	S	70.8	Confident	70.4	Confident	48 Å²	48	59.9 Å²	59.9	34%	0.336	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-63	159.6	172.9	64.7	0	0	0	0	111.1	D947 R948 L949	S945-D947 PolarHBondContact O-N 3.48Å; S945-R948 PolarHBondContact O-N 3.41Å; S945-R948 VanDerWaalsContact O-N 3.08Å; S945-L949 PolarHBondContact O-N 2.88Å
946	K	65.5	Low	68	Low	131 Å²	131	61.8 Å²	61.8	57%	0.57	35%	0.354	S	S	*	.	H	α-helix	trans	-55.3	-38.5	-178.6	-156.4	178	-178.9	-178.9	0	111.7	R948 L949	K946-R948 VanDerWaalsContact C-N 3.31Å; K946-R948 PolarHBondContact O-N 2.84Å; K946-L949 PolarHBondContact O-N 3.09Å
947	D	67	Low	65.7	Low	147 Å²	147	61.3 Å²	61.3	79%	0.786	34%	0.343	S	S	*	.	H	α-helix	trans	-67.5	-29.8	-178.3	-44.3	-42.7	0	0	0	113.1	S945	S945-D947 PolarHBondContact O-N 3.48Å
948	R	67.8	Low	63.5	Low	154 Å²	154	62.9 Å²	62.9	58%	0.581	35%	0.348	S	S	*	.	H	α-helix	trans	-79.5	-19.3	178.6	-74.4	-168.9	-176.5	-168.3	1.6	113.6	P944 S945 K946	P944-R948 HydrophobicContact CB-CB 4.29Å; S945-R948 PolarHBondContact O-N 3.41Å; S945-R948 VanDerWaalsContact O-N 3.08Å; K946-R948 VanDerWaalsContact C-N 3.31Å; K946-R948 PolarHBondContact O-N 2.84Å
949	L	64.1	Low	61.4	Low	18 Å²	18	62.8 Å²	62.8	9%	0.094	34%	0.343	C	S	.	.	H	α-helix	trans	-76.9	-27.8	179.8	-79.2	156.6	0	0	0	111.7	I907 P944 S945 K946 F951 F959	I907-L949 HydrophobicContact CD1-CD2 4.15Å; P944-L949 HydrophobicContact CB-CG 4.46Å; P944-L949 HydrophobicContact CG-CD1 4.36Å; P944-L949 HydrophobicContact CG-CD2 4.19Å; P944-L949 HydrophobicContact CG-CG 4.16Å; S945-L949 PolarHBondContact O-N 2.88Å; K946-L949 PolarHBondContact O-N 3.09Å; L949-F951 WeakPolarHBondContact O-CD2 3.36Å; L949-F951 WeakPolarHBondContact O-CE2 3.24Å; L949-F951 WeakPolarHBondContact O-CG 3.32Å; L949-F951 PolarHBondContact O-N 2.96Å; L949-F959 HydrophobicContact CD2-CE1 4.12Å; L949-F959 HydrophobicContact CD2-CE2 4.01Å; L949-F959 HydrophobicContact CD2-CZ 3.41Å; L949-F959 VanDerWaalsContact CD2-CZ 3.41Å
950	G	60.9	Low	59.2	Low	66 Å²	66	65 Å²	65	68%	0.68	35%	0.354	S	S	*	.			trans	66.2	-2	169.6	0	0	0	0	0	116.8
951	F	60.8	Low	57	Low	64 Å²	64	64.1 Å²	64.1	28%	0.281	35%	0.351	S	S	.	.	S	Bend	trans	-124.5	145.5	-179.7	-41.2	-66.5	0	0	0	110.5	F821 L903 L949 C953	F821-F951 HydrophobicContact CD1-CE1 4.06Å; F821-F951 HydrophobicContact CE1-CD1 4.4Å; F821-F951 AromaticContact CE1-CE1 3.72Å; F821-F951 HydrophobicContact CE1-CE1 3.72Å; F821-F951 HydrophobicContact CE1-CZ 4.07Å; F821-F951 HydrophobicContact CZ-CE1 4.45Å; F821-F951 HydrophobicContact CZ-CZ 4.37Å; L903-F951 HydrophobicContact CD2-CE2 3.81Å; L903-F951 HydrophobicContact CD2-CZ 4.02Å; L949-F951 WeakPolarHBondContact O-CD2 3.36Å; L949-F951 WeakPolarHBondContact O-CE2 3.24Å; L949-F951 WeakPolarHBondContact O-CG 3.32Å; L949-F951 PolarHBondContact O-N 2.96Å; F951-C953 PolarHBondContact O-N 2.74Å; F951-C953 PolarHBondContact O-SG 3.01Å; F951-C953 VanDerWaalsContact O-SG 3.39Å
952	P	50.6	Low	54.9	Low	90 Å²	90	64.9 Å²	64.9	58%	0.584	36%	0.356	S	S	*	.			trans	-61.4	113.3	178	23.6	-30.2	0	0	0	109.9	L954 W957	P952-L954 PolarHBondContact O-N 2.83Å; P952-W957 PolarHBondContact O-NE1 2.81Å
953	C	46.1	Very low	52.9	Low	56 Å²	56	63.9 Å²	63.9	38%	0.378	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	28.9	-172.1	-30.8	0	0	0	0	113.6	F951	F951-C953 PolarHBondContact O-N 2.74Å; F951-C953 PolarHBondContact O-SG 3.01Å; F951-C953 VanDerWaalsContact O-SG 3.39Å
954	L	38	Very low	51.4	Low	169 Å²	169	66 Å²	66	89%	0.885	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-6.5	-170.2	-79.1	165.3	0	0	0	114.4	P952	P952-L954 PolarHBondContact O-N 2.83Å
955	A	34.6	Very low	49.9	Very low	48 Å²	48	66.3 Å²	66.3	40%	0.397	36%	0.359	S	S	.	.	S	Bend	trans	-112.1	152.7	170.5	0	0	0	0	0	110.1	W957	A955-W957 HydrophobicContact CB-CD2 4.29Å; A955-W957 HydrophobicContact CB-CZ2 4Å; A955-W957 PolarHBondContact O-N 2.8Å; A955-W957 PolarHBondContact O-NE1 2.81Å
956	T	41.5	Very low	48.2	Very low	73 Å²	73	68.1 Å²	68.1	45%	0.448	37%	0.372	S	S	.	.			trans	-62.9	87.1	169.7	37.2	0	0	0	0	109.2	L982	T956-L982 HydrophobicContact CG2-CB 4.42Å; T956-L982 HydrophobicContact CG2-CD1 4.37Å
957	W	40.4	Very low	46.7	Very low	66 Å²	66	64 Å²	64	25%	0.25	36%	0.362	C	S	.	.			trans	-89.9	118.3	178	-56.9	104.9	0	0	0	108.9	L782 V784 P952 A955 F959	L782-W957 HydrophobicContact CD1-CB 3.78Å; L782-W957 HydrophobicContact CD1-CD2 3.67Å; L782-W957 HydrophobicContact CD1-CE3 3.31Å; L782-W957 HydrophobicContact CD1-CG 3.89Å; L782-W957 HydrophobicContact CD1-CZ3 4.05Å; L782-W957 HydrophobicContact CD2-CD2 4.47Å; L782-W957 HydrophobicContact CD2-CE3 3.73Å; L782-W957 HydrophobicContact CD2-CH2 4.19Å; L782-W957 HydrophobicContact CD2-CZ3 3.53Å; L782-W957 HydrophobicContact CG-CD2 4.28Å; L782-W957 HydrophobicContact CG-CE3 3.45Å; L782-W957 VanDerWaalsContact CG-CE3 3.45Å; L782-W957 HydrophobicContact CG-CZ3 3.71Å; V784-W957 HydrophobicContact CB-CZ3 4.14Å; V784-W957 HydrophobicContact CG1-CH2 4.38Å; V784-W957 HydrophobicContact CG1-CZ3 3.95Å; V784-W957 HydrophobicContact CG2-CE3 4.36Å; V784-W957 HydrophobicContact CG2-CH2 4.48Å; V784-W957 HydrophobicContact CG2-CZ3 3.58Å; P952-W957 PolarHBondContact O-NE1 2.81Å; A955-W957 HydrophobicContact CB-CD2 4.29Å; A955-W957 HydrophobicContact CB-CZ2 4Å; A955-W957 PolarHBondContact O-N 2.8Å; A955-W957 PolarHBondContact O-NE1 2.81Å; W957-F959 HydrophobicContact CB-CE2 4.48Å
958	F	44.4	Very low	45.1	Very low	58 Å²	58	57.4 Å²	57.4	25%	0.254	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	136.7	174.6	-61.4	-87.6	0	0	0	109.2	C783 P979	C783-F958 HydrophobicContact CB-CB 4.44Å; C783-F958 WeakPolarHBondContact CB-O 3.45Å; C783-F958 PolarHBondContact N-O 2.82Å; F958-P979 HydrophobicContact CE2-CB 4.25Å; F958-P979 HydrophobicContact CZ-CB 4.25Å
959	F	46.3	Very low	43.4	Very low	45 Å²	45	56.5 Å²	56.5	20%	0.197	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.9	176	-64.5	-86.8	0	0	0	111	F779 L782 L949 W957	F779-F959 HydrophobicContact CB-CD1 4.1Å; F779-F959 HydrophobicContact CD1-CB 3.28Å; F779-F959 AromaticContact CD1-CD1 3.69Å; F779-F959 HydrophobicContact CD1-CD1 3.69Å; F779-F959 AromaticContact CD1-CD2 3.97Å; F779-F959 HydrophobicContact CD1-CD2 3.97Å; F779-F959 AromaticContact CD1-CG 3.39Å; F779-F959 HydrophobicContact CD1-CG 3.39Å; F779-F959 HydrophobicContact CE1-CB 3.7Å; F779-F959 HydrophobicContact CE1-CD2 4.2Å; F779-F959 AromaticContact CE1-CG 3.98Å; F779-F959 HydrophobicContact CE1-CG 3.98Å; F779-F959 HydrophobicContact CG-CB 4.44Å; F779-F959 HydrophobicContact CG-CD1 4.33Å; F779-F959 HydrophobicContact CG-CG 4.42Å; L782-F959 HydrophobicContact CD1-CE1 4.11Å; L782-F959 HydrophobicContact CD1-CZ 4.22Å; L949-F959 HydrophobicContact CD2-CE1 4.12Å; L949-F959 HydrophobicContact CD2-CE2 4.01Å; L949-F959 HydrophobicContact CD2-CZ 3.41Å; L949-F959 VanDerWaalsContact CD2-CZ 3.41Å; W957-F959 HydrophobicContact CB-CE2 4.48Å
960	Q	43.1	Very low	41.8	Very low	49 Å²	49	57.4 Å²	57.4	23%	0.229	34%	0.338	C	S	.	.			trans	-84.2	129.6	171.7	-112.8	-179	5.3	0	0	110.7	F974	Q960-F974 HydrophobicContact CG-CB 4.29Å; Q960-F974 HydrophobicContact CG-CD2 4.46Å
961	L	41.2	Very low	40.4	Very low	13 Å²	13	58.4 Å²	58.4	7%	0.068	33%	0.327	C	S	.	.			trans	-122.9	110.7	-176.4	-73	166.8	0	0	0	110	M777 S778 F779	M777-L961 HydrophobicContact CE-CD1 4.14Å; M777-L961 HydrophobicContact CG-CB 4.06Å; M777-L961 HydrophobicContact CG-CD1 3.97Å; M777-L961 HydrophobicContact CG-CD2 3.48Å; M777-L961 VanDerWaalsContact CG-CD2 3.48Å; M777-L961 HydrophobicContact CG-CG 4.03Å; M777-L961 HydrophobicContact SD-CB 4.5Å; M777-L961 HydrophobicContact SD-CD1 3.76Å; M777-L961 HydrophobicContact SD-CD2 4.4Å; M777-L961 HydrophobicContact SD-CG 4.44Å; S778-L961 VanDerWaalsContact O-CD2 3.24Å; S778-L961 WeakPolarHBondContact O-CD2 3.32Å; F779-L961 HydrophobicContact CD1-CD2 3.76Å; F779-L961 HydrophobicContact CD1-CG 4.31Å; F779-L961 HydrophobicContact CD2-CD2 4Å; F779-L961 HydrophobicContact CE1-CD1 3.81Å; F779-L961 HydrophobicContact CE1-CD2 3.57Å; F779-L961 HydrophobicContact CE1-CG 3.89Å; F779-L961 HydrophobicContact CE2-CD2 3.83Å; F779-L961 HydrophobicContact CG-CD2 3.89Å; F779-L961 HydrophobicContact CZ-CD1 3.83Å; F779-L961 HydrophobicContact CZ-CD2 3.52Å; F779-L961 HydrophobicContact CZ-CG 4.13Å
962	P	42.4	Very low	38.7	Very low	19 Å²	19	57.3 Å²	57.3	12%	0.123	33%	0.327	C	S	.	.			trans	-82.5	131	160.3	27.1	-23.4	0	0	0	109.6	S778 R780	S778-P962 WeakPolarHBondContact O-CD 3.47Å; R780-P962 VanDerWaalsContact NE-CG 3.28Å
963	I	40.3	Very low	37.7	Very low	7 Å²	7	58.3 Å²	58.3	4%	0.036	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	108.5	164.9	-62.3	167.4	0	0	0	106.6	A742 I747 T776 H965 S970	A742-I963 HydrophobicContact CB-CD1 4.08Å; I747-I963 HydrophobicContact CD1-CD1 3.86Å; T776-I963 WeakPolarHBondContact O-CA 3.31Å; I963-H965 PolarHBondContact O-N 2.85Å; I963-S970 PolarHBondContact O-OG 3.08Å
964	N	41.1	Very low	36.8	Very low	53 Å²	53	59.4 Å²	59.4	28%	0.283	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	108.8	173.9	-93.5	-6.7	0	0	0	107.7	T776	T776-N964 PolarHBondContact N-O 3.02Å; T776-N964 PolarHBondContact O-N 2.74Å; T776-N964 VanDerWaalsContact O-N 3.13Å; T776-N964 WeakPolarHBondContact OG1-CB 3.19Å; T776-N964 PolarHBondContact OG1-O 2.94Å; T776-N964 VanDerWaalsContact OG1-O 3.13Å
965	H	41.5	Very low	36.2	Very low	19 Å²	19	55.1 Å²	55.1	9%	0.088	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	149.9	157.1	-73.6	-82.7	0	0	0	108.5	L773 I963 A967 C968	L773-H965 WeakPolarHBondContact CD1-CE1 3.2Å; L773-H965 WeakPolarHBondContact CD1-ND1 3.43Å; I963-H965 PolarHBondContact O-N 2.85Å; H965-A967 PolarHBondContact O-N 3.04Å; H965-C968 HydrophobicContact CB-CB 4.41Å; H965-C968 PolarHBondContact N-O 2.71Å; H965-C968 PolarHBondContact O-N 2.86Å
966	S	34.7	Very low	35.9	Very low	85 Å²	85	54.8 Å²	54.8	59%	0.594	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	5.2	-170.1	40	0	0	0	0	117.2	E772	E772-S966 PolarHBondContact O-OG 2.89Å
967	A	33.6	Very low	35	Very low	44 Å²	44	58 Å²	58	36%	0.364	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.9	1.9	167.4	0	0	0	0	0	114.3	T667 H965	T667-A967 HydrophobicContact CG2-CB 4.5Å; H965-A967 PolarHBondContact O-N 3.04Å
968	C	33.6	Very low	34.3	Very low	9 Å²	9	61.2 Å²	61.2	6%	0.061	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	109.3	-167.4	-153.8	0	0	0	0	110.4	T667 H965 S970	T667-C968 WeakPolarHBondContact OG1-CB 3.36Å; T667-C968 PolarHBondContact OG1-SG 3.48Å; H965-C968 HydrophobicContact CB-CB 4.41Å; H965-C968 PolarHBondContact N-O 2.71Å; H965-C968 PolarHBondContact O-N 2.86Å; C968-S970 VanDerWaalsContact C-N 3.27Å; C968-S970 PolarHBondContact O-N 3.42Å; C968-S970 VanDerWaalsContact O-N 3.12Å
969	Q	32.7	Very low	33.6	Very low	135 Å²	135	61.8 Å²	61.8	63%	0.631	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	84.9	159.9	-74.5	-176.9	-9.1	0	0	107.1	I971	Q969-I971 HydrophobicContact CB-CG1 4.32Å; Q969-I971 PolarHBondContact O-N 3.38Å
970	S	30.8	Very low	32.5	Very low	37 Å²	37	63.8 Å²	63.8	26%	0.259	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	95.1	158	34.9	0	0	0	0	106.6	I963 C968 C972	I963-S970 PolarHBondContact O-OG 3.08Å; C968-S970 VanDerWaalsContact C-N 3.27Å; C968-S970 PolarHBondContact O-N 3.42Å; C968-S970 VanDerWaalsContact O-N 3.12Å; S970-C972 PolarHBondContact O-N 2.82Å
971	I	29.9	Very low	31.7	Very low	88 Å²	88	66.8 Å²	66.8	45%	0.451	37%	0.372	S	S	.	.			trans	-68.3	89.1	171.3	-57.8	-171.8	0	0	0	106.6	W689 Q969 K973	W689-I971 HydrophobicContact CH2-CD1 3.85Å; W689-I971 HydrophobicContact CH2-CG1 4.32Å; Q969-I971 HydrophobicContact CB-CG1 4.32Å; Q969-I971 PolarHBondContact O-N 3.38Å; I971-K973 VanDerWaalsContact C-N 3.26Å; I971-K973 HydrophobicContact CG2-CD 4.41Å; I971-K973 HydrophobicContact CG2-CG 3.89Å; I971-K973 PolarHBondContact O-N 2.86Å
972	C	26.7	Very low	31	Very low	41 Å²	41	70.1 Å²	70.1	28%	0.277	39%	0.39	S	S	.	.			trans	-75.8	86.1	165.3	-64.4	0	0	0	0	107.2	E745 S970	E745-C972 PolarHBondContact O-SG 2.83Å; S970-C972 PolarHBondContact O-N 2.82Å
973	K	27.8	Very low	30.3	Very low	111 Å²	111	78.9 Å²	78.9	48%	0.483	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-80.3	116.4	163.1	-92.8	-179	174.6	-170.2	0	107.4	I971 S975	I971-K973 VanDerWaalsContact C-N 3.26Å; I971-K973 HydrophobicContact CG2-CD 4.41Å; I971-K973 HydrophobicContact CG2-CG 3.89Å; I971-K973 PolarHBondContact O-N 2.86Å; K973-S975 PolarHBondContact O-N 2.81Å
974	F	27.6	Very low	29.6	Very low	79 Å²	79	85.3 Å²	85.3	35%	0.346	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-58.1	123.5	167.6	-110.4	-93.6	0	0	0	109.9	I747 Q960	I747-F974 VanDerWaalsContact O-CE2 3.23Å; I747-F974 WeakPolarHBondContact O-CE2 3.11Å; I747-F974 WeakPolarHBondContact O-CZ 3.4Å; Q960-F974 HydrophobicContact CG-CB 4.29Å; Q960-F974 HydrophobicContact CG-CD2 4.46Å
975	S	26.4	Very low	29	Very low	79 Å²	79	85.7 Å²	85.7	55%	0.552	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-88	120.2	153	-173.9	0	0	0	0	107	K973 H977	K973-S975 PolarHBondContact O-N 2.81Å; S975-H977 VanDerWaalsContact C-N 3.27Å; S975-H977 PolarHBondContact O-N 2.81Å
976	P	27.7	Very low	28.3	Very low	41 Å²	41	93.9 Å²	93.9	27%	0.266	50%	0.502	S	S	.	.			trans	-83.1	78	179.2	33.7	-29	0	0	0	108.3	P830 F898 N978	P830-P976 HydrophobicContact CB-CG 3.62Å; P830-P976 HydrophobicContact CG-CG 3.47Å; P830-P976 VanDerWaalsContact CG-CG 3.47Å; F898-P976 HydrophobicContact CD2-CG 4.18Å; F898-P976 HydrophobicContact CE2-CB 3.59Å; F898-P976 HydrophobicContact CE2-CG 3.39Å; F898-P976 HydrophobicContact CZ-CB 3.69Å; F898-P976 HydrophobicContact CZ-CG 4.04Å; P976-N978 PolarHBondContact O-N 2.78Å
977	H	23.5	Very low	28.1	Very low	140 Å²	140	98.6 Å²	98.6	65%	0.648	51%	0.512	S	S	*	.			trans	-78.5	107.6	157.1	-74.3	-55.2	0	0	0	107.7	S975	S975-H977 VanDerWaalsContact C-N 3.27Å; S975-H977 PolarHBondContact O-N 2.81Å
978	N	25.2	Very low	27.9	Very low	134 Å²	134	99.2 Å²	99.2	72%	0.717	51%	0.511	S	S	*	.			trans	72.3	96.1	173.3	-73.9	-20.9	0	0	0	119.3	P976 T980	P976-N978 PolarHBondContact O-N 2.78Å; N978-T980 PolarHBondContact OD1-OG1 3.02Å
979	P	29	Very low	27.7	Very low	70 Å²	70	105.5 Å²	105.5	46%	0.455	54%	0.539	S	S	.	.			trans	-99.7	55.5	142.4	41.3	-31.8	0	0	0	109.5	F898 F958	F898-P979 HydrophobicContact CE1-CG 4.46Å; F898-P979 HydrophobicContact CZ-CG 3.98Å; F958-P979 HydrophobicContact CE2-CB 4.25Å; F958-P979 HydrophobicContact CZ-CB 4.25Å
980	T	24.6	Very low	27.7	Very low	87 Å²	87	107 Å²	107	53%	0.534	54%	0.544	S	S	.	.			trans	-127.2	65.4	176	29.4	0	0	0	0	108.5	N978	N978-T980 PolarHBondContact OD1-OG1 3.02Å
981	L	26.5	Very low	27.8	Very low	111 Å²	111	111.6 Å²	111.6	58%	0.581	56%	0.561	S	S	*	*			trans	174.3	80.8	161.2	-100.3	145.1	0	0	0	108.9	T985	L981-T985 HydrophobicContact CD2-CG2 4.33Å
982	L	25.5	Very low	27.9	Very low	84 Å²	84	113.1 Å²	113.1	44%	0.44	57%	0.569	S	S	.	*	S	Bend	trans	-152.2	9.2	162.8	-105.9	156.4	0	0	0	114.6	V750 T956	V750-L982 HydrophobicContact CG1-CD1 4.07Å; T956-L982 HydrophobicContact CG2-CB 4.42Å; T956-L982 HydrophobicContact CG2-CD1 4.37Å
983	Q	27.4	Very low	28.2	Very low	203 Å²	203	120.2 Å²	120.2	95%	0.949	59%	0.59	S	S	*	*	S	Bend	trans	-120.2	5.9	164.3	-88.6	-174.5	-11.8	0	0	113.7
984	Q	26.6	Very low	28.5	Very low	142 Å²	142	119.4 Å²	119.4	66%	0.664	59%	0.591	S	S	*	*	S	Bend	trans	-114.3	-3.3	175	-79.4	-172.1	-16	0	0	114.2	E986 K987 T988	Q984-E986 PolarHBondContact O-N 3.08Å; Q984-K987 PolarHBondContact O-N 3.21Å; Q984-T988 PolarHBondContact O-N 2.88Å; Q984-T988 PolarHBondContact O-OG1 2.81Å
985	T	26.9	Very low	28.9	Very low	60 Å²	60	118.7 Å²	118.7	37%	0.368	60%	0.595	S	S	.	*	H	α-helix	trans	-67.5	-15.8	-175.4	24.7	0	0	0	0	114.8	L981 K987	L981-T985 HydrophobicContact CD2-CG2 4.33Å; T985-K987 VanDerWaalsContact C-N 3.35Å
986	E	28.6	Very low	29.2	Very low	192 Å²	192	117.2 Å²	117.2	90%	0.897	59%	0.588	S	S	*	*	H	α-helix	trans	-80.1	-11.8	171	-78.2	-174.8	161.6	0	0	114	Q984	Q984-E986 PolarHBondContact O-N 3.08Å
987	K	29.2	Very low	29.7	Very low	184 Å²	184	117.7 Å²	117.7	80%	0.8	59%	0.59	S	S	*	*	H	α-helix	trans	-107.1	-25.1	176.4	-78.6	-174.8	176.6	179.6	0	113.9	Q984 T985	Q984-K987 PolarHBondContact O-N 3.21Å; T985-K987 VanDerWaalsContact C-N 3.35Å
988	T	29.9	Very low	30.2	Very low	56 Å²	56	119.5 Å²	119.5	34%	0.344	59%	0.591	S	S	.	*	H	α-helix	trans	-83.8	-24.2	178.8	10	0	0	0	0	114.3	Q984 K990 H991 L992	Q984-T988 PolarHBondContact O-N 2.88Å; Q984-T988 PolarHBondContact O-OG1 2.81Å; T988-K990 PolarHBondContact O-N 2.94Å; T988-H991 PolarHBondContact O-N 3.46Å; T988-L992 PolarHBondContact O-N 3.38Å
989	E	29.8	Very low	30.6	Very low	141 Å²	141	118.1 Å²	118.1	66%	0.659	58%	0.582	S	S	*	*	H	α-helix	trans	-62.7	-32.8	175	-83.6	-171	160.9	0	0	112.3	W993	E989-W993 WeakPolarHBondContact O-CB 3.49Å; E989-W993 PolarHBondContact O-N 3.13Å
990	K	32.7	Very low	30.9	Very low	168 Å²	168	119 Å²	119	73%	0.73	59%	0.587	S	S	*	*	H	α-helix	trans	-69.4	-34.2	176.3	-141.4	176.4	-174.2	-179.3	0	112.5	T988 D994	T988-K990 PolarHBondContact O-N 2.94Å; K990-D994 WeakPolarHBondContact O-CB 3.26Å; K990-D994 PolarHBondContact O-N 2.96Å; K990-D994 VanDerWaalsContact O-N 3.15Å
991	H	32.6	Very low	31.3	Very low	132 Å²	132	120.9 Å²	120.9	61%	0.611	59%	0.59	S	S	*	*	H	α-helix	trans	-83.5	-32.1	-178.5	-126.1	-41.4	0	0	0	113.2	T988 C995	T988-H991 PolarHBondContact O-N 3.46Å; H991-C995 WeakPolarHBondContact O-CB 3.42Å; H991-C995 PolarHBondContact O-N 2.93Å; H991-C995 PolarHBondContact O-SG 3.47Å
992	L	31.1	Very low	31.6	Very low	121 Å²	121	121.3 Å²	121.3	63%	0.634	59%	0.592	S	S	*	*	H	α-helix	trans	-73.7	-34.3	172.9	-83.7	158.3	0	0	0	112	T988 A996	T988-L992 PolarHBondContact O-N 3.38Å; L992-A996 VanDerWaalsContact O-CB 3.22Å; L992-A996 WeakPolarHBondContact O-CB 3.37Å; L992-A996 PolarHBondContact O-N 3.19Å
993	W	33.5	Very low	31.9	Very low	190 Å²	190	121.4 Å²	121.4	72%	0.72	60%	0.596	S	S	*	*	H	α-helix	trans	-66.7	-41.2	169.5	-115	91.6	0	0	0	111.9	E989 C995 A996 V997	E989-W993 WeakPolarHBondContact O-CB 3.49Å; E989-W993 PolarHBondContact O-N 3.13Å; W993-C995 PolarHBondContact O-N 3.45Å; W993-A996 PolarHBondContact O-N 3.02Å; W993-V997 HydrophobicContact CE3-CG2 3.43Å; W993-V997 VanDerWaalsContact CE3-CG2 3.43Å; W993-V997 HydrophobicContact CZ3-CG2 3.54Å; W993-V997 WeakPolarHBondContact O-CB 3.24Å; W993-V997 WeakPolarHBondContact O-CG2 3.4Å; W993-V997 PolarHBondContact O-N 3.05Å
994	D	35.1	Very low	32.1	Very low	93 Å²	93	119 Å²	119	50%	0.497	58%	0.582	S	S	.	*	H	α-helix	trans	-67.4	-34.4	175.8	-83.2	-16.7	0	0	0	112.9	K990 R998	K990-D994 WeakPolarHBondContact O-CB 3.26Å; K990-D994 PolarHBondContact O-N 2.96Å; K990-D994 VanDerWaalsContact O-N 3.15Å; D994-R998 WeakPolarHBondContact O-CB 3.4Å; D994-R998 WeakPolarHBondContact O-CG 3.4Å; D994-R998 PolarHBondContact O-N 3.4Å
995	C	34.6	Very low	32.4	Very low	64 Å²	64	117 Å²	117	43%	0.432	58%	0.575	S	S	.	*	H	α-helix	trans	-73.4	-39	173.4	-78.2	0	0	0	0	112.5	H991 W993 R998 I999	H991-C995 WeakPolarHBondContact O-CB 3.42Å; H991-C995 PolarHBondContact O-N 2.93Å; H991-C995 PolarHBondContact O-SG 3.47Å; W993-C995 PolarHBondContact O-N 3.45Å; C995-R998 PolarHBondContact O-N 2.78Å; C995-I999 WeakPolarHBondContact O-CB 3.46Å; C995-I999 VanDerWaalsContact O-CG1 3.28Å; C995-I999 WeakPolarHBondContact O-CG1 3.48Å; C995-I999 PolarHBondContact O-N 2.75Å
996	A	32.7	Very low	32.6	Very low	49 Å²	49	121 Å²	121	41%	0.405	59%	0.59	S	S	.	*	H	α-helix	trans	-66.1	-39	173.9	0	0	0	0	0	111.1	L992 W993 I999 T1000	L992-A996 VanDerWaalsContact O-CB 3.22Å; L992-A996 WeakPolarHBondContact O-CB 3.37Å; L992-A996 PolarHBondContact O-N 3.19Å; W993-A996 PolarHBondContact O-N 3.02Å; A996-I999 PolarHBondContact O-N 2.8Å; A996-T1000 WeakPolarHBondContact O-CB 3.46Å; A996-T1000 PolarHBondContact O-N 3.05Å; A996-T1000 PolarHBondContact O-OG1 3.37Å
997	V	38	Very low	32.6	Very low	50 Å²	50	119 Å²	119	30%	0.303	59%	0.585	S	S	.	*	H	α-helix	trans	-66.7	-37.2	174	170.5	0	0	0	0	111.4	W993 T1000 Q1001	W993-V997 HydrophobicContact CE3-CG2 3.43Å; W993-V997 VanDerWaalsContact CE3-CG2 3.43Å; W993-V997 HydrophobicContact CZ3-CG2 3.54Å; W993-V997 WeakPolarHBondContact O-CB 3.24Å; W993-V997 WeakPolarHBondContact O-CG2 3.4Å; W993-V997 PolarHBondContact O-N 3.05Å; V997-T1000 PolarHBondContact O-N 3.11Å; V997-Q1001 WeakPolarHBondContact O-CB 3.12Å; V997-Q1001 VanDerWaalsContact O-CG 3.25Å; V997-Q1001 WeakPolarHBondContact O-CG 3.07Å; V997-Q1001 PolarHBondContact O-N 2.84Å
998	R	34.9	Very low	32.7	Very low	178 Å²	178	116.7 Å²	116.7	67%	0.672	58%	0.581	S	S	*	*	H	α-helix	trans	-70.8	-36.5	174.1	-80.7	179.6	174.8	-174.3	-0.7	113.6	D994 C995 Q1001 L1002	D994-R998 WeakPolarHBondContact O-CB 3.4Å; D994-R998 WeakPolarHBondContact O-CG 3.4Å; D994-R998 PolarHBondContact O-N 3.4Å; C995-R998 PolarHBondContact O-N 2.78Å; R998-Q1001 PolarHBondContact O-N 2.92Å; R998-L1002 WeakPolarHBondContact O-CG 3.48Å; R998-L1002 PolarHBondContact O-N 2.79Å
999	I	34.3	Very low	32.6	Very low	105 Å²	105	121.1 Å²	121.1	54%	0.538	60%	0.601	S	S	.	*	H	α-helix	trans	-71.3	-36.2	174.3	-68.5	168.3	0	0	0	110.4	C995 A996 Q1001 L1002 V1003	C995-I999 WeakPolarHBondContact O-CB 3.46Å; C995-I999 VanDerWaalsContact O-CG1 3.28Å; C995-I999 WeakPolarHBondContact O-CG1 3.48Å; C995-I999 PolarHBondContact O-N 2.75Å; A996-I999 PolarHBondContact O-N 2.8Å; I999-Q1001 VanDerWaalsContact C-N 3.29Å; I999-Q1001 PolarHBondContact O-N 2.91Å; I999-L1002 PolarHBondContact O-N 2.88Å; I999-V1003 HydrophobicContact CG2-CG2 4.28Å; I999-V1003 WeakPolarHBondContact O-CB 3.06Å; I999-V1003 VanDerWaalsContact O-CG2 3.25Å; I999-V1003 WeakPolarHBondContact O-CG2 3.42Å; I999-V1003 PolarHBondContact O-N 3.4Å
1000	T	34	Very low	32.5	Very low	88 Å²	88	123.4 Å²	123.4	54%	0.54	61%	0.612	S	S	.	*	H	α-helix	trans	-71.9	-24.3	173.8	-41.5	0	0	0	0	112	A996 V997 K1004	A996-T1000 WeakPolarHBondContact O-CB 3.46Å; A996-T1000 PolarHBondContact O-N 3.05Å; A996-T1000 PolarHBondContact O-OG1 3.37Å; V997-T1000 PolarHBondContact O-N 3.11Å; T1000-K1004 PolarHBondContact O-N 3.21Å
1001	Q	33.4	Very low	32.3	Very low	128 Å²	128	125.2 Å²	125.2	60%	0.598	62%	0.62	S	S	*	*	H	α-helix	trans	-77.7	-27.7	169.5	-77.6	176.6	-13.8	0	0	113.1	V997 R998 I999	V997-Q1001 WeakPolarHBondContact O-CB 3.12Å; V997-Q1001 VanDerWaalsContact O-CG 3.25Å; V997-Q1001 WeakPolarHBondContact O-CG 3.07Å; V997-Q1001 PolarHBondContact O-N 2.84Å; R998-Q1001 PolarHBondContact O-N 2.92Å; I999-Q1001 VanDerWaalsContact C-N 3.29Å; I999-Q1001 PolarHBondContact O-N 2.91Å
1002	L	32.8	Very low	32.1	Very low	120 Å²	120	124.7 Å²	124.7	63%	0.628	63%	0.632	S	S	*	*	H	α-helix	trans	-82	-30.7	173.8	-76.9	163	0	0	0	112.8	R998 I999 K1004 I1005	R998-L1002 WeakPolarHBondContact O-CG 3.48Å; R998-L1002 PolarHBondContact O-N 2.79Å; I999-L1002 PolarHBondContact O-N 2.88Å; L1002-K1004 VanDerWaalsContact C-N 3.28Å; L1002-K1004 PolarHBondContact O-N 2.87Å; L1002-I1005 WeakPolarHBondContact O-CB 3.46Å; L1002-I1005 PolarHBondContact O-N 3.26Å
1003	V	31.5	Very low	31.8	Very low	86 Å²	86	122.6 Å²	122.6	52%	0.521	64%	0.639	S	S	.	*	H	α-helix	trans	-76.8	-14.5	175.7	174.5	0	0	0	0	112.2	I999 I1005 Q1006	I999-V1003 HydrophobicContact CG2-CG2 4.28Å; I999-V1003 WeakPolarHBondContact O-CB 3.06Å; I999-V1003 VanDerWaalsContact O-CG2 3.25Å; I999-V1003 WeakPolarHBondContact O-CG2 3.42Å; I999-V1003 PolarHBondContact O-N 3.4Å; V1003-I1005 PolarHBondContact O-N 3.17Å; V1003-Q1006 PolarHBondContact O-N 2.63Å
1004	K	31.1	Very low	31.5	Very low	152 Å²	152	118 Å²	118	66%	0.661	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	4.4	166.6	-86.6	-174	173.9	-175.9	0	114.9	T1000 L1002	T1000-K1004 PolarHBondContact O-N 3.21Å; L1002-K1004 VanDerWaalsContact C-N 3.28Å; L1002-K1004 PolarHBondContact O-N 2.87Å
1005	I	33.9	Very low	31.1	Very low	99 Å²	99	120.6 Å²	120.6	51%	0.508	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.4	-9.7	172.5	-62.7	177.7	0	0	0	111.7	L1002 V1003 L1008	L1002-I1005 WeakPolarHBondContact O-CB 3.46Å; L1002-I1005 PolarHBondContact O-N 3.26Å; V1003-I1005 PolarHBondContact O-N 3.17Å; I1005-L1008 PolarHBondContact O-N 3.14Å
1006	Q	30	Very low	30.9	Very low	146 Å²	146	124.4 Å²	124.4	68%	0.682	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-82.2	-16.1	173	-121.4	172.8	-13.2	0	0	113.8	V1003 L1008	V1003-Q1006 PolarHBondContact O-N 2.63Å; Q1006-L1008 PolarHBondContact O-N 3.13Å
1007	D	29.8	Very low	30.8	Very low	148 Å²	148	129.6 Å²	129.6	79%	0.791	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-81.2	7	170.1	-73.9	-26.4	0	0	0	113.4
1008	L	30.6	Very low	30.4	Very low	137 Å²	137	132.5 Å²	132.5	72%	0.717	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-117.2	2.1	-177.9	-98.1	158.2	0	0	0	115	I1005 Q1006	I1005-L1008 PolarHBondContact O-N 3.14Å; Q1006-L1008 PolarHBondContact O-N 3.13Å
1009	L	27.5	Very low	30.2	Very low	148 Å²	148	133.9 Å²	133.9	78%	0.775	73%	0.725	S	S	*	*	S	Bend	trans	-135.5	25.3	-173.9	-78.1	169.9	0	0	0	116.5
1010	Q	27.9	Very low	30.2	Very low	189 Å²	189	133.5 Å²	133.5	88%	0.883	73%	0.729	S	S	*	*			trans	-131.2	58.9	158.6	-80.5	-169.7	-12.3	0	0	111.6
1011	F	29.2	Very low	30.2	Very low	206 Å²	206	133.8 Å²	133.8	90%	0.904	73%	0.731	S	S	*	*	S	Bend	trans	-130.7	125.7	145	-105.2	-87.4	0	0	0	107.7
1012	S	27.6	Very low	30.3	Very low	122 Å²	122	133 Å²	133	85%	0.853	73%	0.734	S	S	*	*			trans	-46.5	131.6	-175.1	52.8	0	0	0	0	115
1013	G	26	Very low	30.4	Very low	76 Å²	76	131.4 Å²	131.4	78%	0.784	73%	0.733	S	S	*	*			trans	149.7	86.5	153.6	0	0	0	0	0	117.3
1014	A	26.1	Very low	30.5	Very low	95 Å²	95	134.3 Å²	134.3	79%	0.785	74%	0.741	S	S	*	*			trans	78.6	130.3	147	0	0	0	0	0	122.2
1015	N	28.2	Very low	30.8	Very low	147 Å²	147	132.2 Å²	132.2	79%	0.786	74%	0.736	S	S	*	*			trans	82.7	105	149.6	-66.6	2.5	0	0	0	121.2
1016	D	29.4	Very low	31	Very low	144 Å²	144	131.5 Å²	131.5	77%	0.77	74%	0.737	S	S	*	*				31.3	103.1	126.6	-58.7	-17.4	0	0	0	118.1
1017	D	29.7	Very low	31.3	Very low	158 Å²	158	131.8 Å²	131.8	85%	0.845	74%	0.738	S	S	*	*			trans	150	86.5	136.2	-81	-22.7	0	0	0	111.5
1018	C	29.8	Very low	31.5	Very low	110 Å²	110	133.6 Å²	133.6	74%	0.743	74%	0.735	S	S	*	*			trans	-156.5	67.5	165.2	-95.1	0	0	0	0	111.7
1019	F	30.7	Very low	31.8	Very low	208 Å²	208	130.6 Å²	130.6	91%	0.912	72%	0.722	S	S	*	*			trans	-100.4	5.1	173.4	-118.6	-88.2	0	0	0	118.7
1020	P	34	Very low	32.1	Very low	97 Å²	97	127 Å²	127	63%	0.63	71%	0.709	S	S	*	*	S	Bend	trans	-100.4	-12.2	175.3	-2.4	22.5	0	0	0	116.9
1021	V	35.4	Very low	32.5	Very low	93 Å²	93	125.8 Å²	125.8	56%	0.564	70%	0.698	S	S	*	*	H	α-helix	trans	-83.4	-21.8	-168.3	-178.1	0	0	0	0	113.4	I1025	V1021-I1025 HydrophobicContact CG1-CD1 4.35Å
1022	V	34.6	Very low	32.6	Very low	111 Å²	111	123 Å²	123	67%	0.673	69%	0.685	S	S	*	*	H	α-helix	trans	-75.3	-30.8	-176.4	-179.5	0	0	0	0	112.4	T1026	V1022-T1026 PolarHBondContact O-OG1 3.26Å; V1022-T1026 VanDerWaalsContact O-OG1 3.06Å
1023	S	34.7	Very low	32.8	Very low	88 Å²	88	124.3 Å²	124.3	62%	0.615	68%	0.676	S	S	*	*	H	α-helix	trans	-76.1	-28.9	-175.3	-164.6	0	0	0	0	114.1
1024	Q	35.2	Very low	33.2	Very low	147 Å²	147	127.7 Å²	127.7	69%	0.687	68%	0.676	S	S	*	*	H	α-helix	trans	-79.9	-25.2	-179.2	-76.1	-177.7	-9.4	0	0	113.1	Y1028	Q1024-Y1028 PolarHBondContact O-N 3.31Å
1025	I	35.8	Very low	33.3	Very low	107 Å²	107	130.4 Å²	130.4	55%	0.549	67%	0.673	S	S	.	*	H	α-helix	trans	-73.4	-32.8	176.5	-63.6	173.5	0	0	0	110.3	V1021 V1029	V1021-I1025 HydrophobicContact CG1-CD1 4.35Å; I1025-V1029 HydrophobicContact CG2-CG2 4.41Å; I1025-V1029 WeakPolarHBondContact O-CB 3.48Å; I1025-V1029 VanDerWaalsContact O-CG2 3.22Å; I1025-V1029 WeakPolarHBondContact O-CG2 3.39Å; I1025-V1029 PolarHBondContact O-N 3.48Å; I1025-V1029 VanDerWaalsContact O-N 3.17Å
1026	T	38.9	Very low	33.3	Very low	85 Å²	85	127.1 Å²	127.1	52%	0.521	66%	0.66	S	S	.	*	H	α-helix	trans	-69.4	-39.4	178.7	-34.8	0	0	0	0	112.4	V1022 V1029 S1030	V1022-T1026 PolarHBondContact O-OG1 3.26Å; V1022-T1026 VanDerWaalsContact O-OG1 3.06Å; T1026-V1029 PolarHBondContact O-N 3.25Å; T1026-S1030 WeakPolarHBondContact O-CB 3.41Å; T1026-S1030 PolarHBondContact O-N 3.14Å; T1026-S1030 PolarHBondContact O-OG 3.12Å
1027	E	36.7	Very low	33.2	Very low	151 Å²	151	125.9 Å²	125.9	71%	0.706	66%	0.663	S	S	*	*	H	α-helix	trans	-66.8	-40.4	176.8	-101.1	-176.5	157.9	0	0	112.8	V1029 S1030 Y1031	E1027-V1029 VanDerWaalsContact C-N 3.35Å; E1027-V1029 PolarHBondContact O-N 3.33Å; E1027-S1030 PolarHBondContact O-N 2.54Å; E1027-Y1031 PolarHBondContact O-N 3.18Å
1028	Y	33.7	Very low	33.1	Very low	186 Å²	186	126.2 Å²	126.2	73%	0.729	66%	0.657	S	S	*	*	H	α-helix	trans	-69	-34.9	179.5	-122.3	-87.3	0	0	0	112.5	Q1024 F1032	Q1024-Y1028 PolarHBondContact O-N 3.31Å; Y1028-F1032 PolarHBondContact O-N 3.13Å
1029	V	35.7	Very low	33.1	Very low	75 Å²	75	125.3 Å²	125.3	46%	0.455	65%	0.651	S	S	.	*	H	α-helix	trans	-72.1	-41	175.7	173.7	0	0	0	0	110.7	I1025 T1026 E1027 Y1031 F1032 F1033	I1025-V1029 HydrophobicContact CG2-CG2 4.41Å; I1025-V1029 WeakPolarHBondContact O-CB 3.48Å; I1025-V1029 VanDerWaalsContact O-CG2 3.22Å; I1025-V1029 WeakPolarHBondContact O-CG2 3.39Å; I1025-V1029 PolarHBondContact O-N 3.48Å; I1025-V1029 VanDerWaalsContact O-N 3.17Å; T1026-V1029 PolarHBondContact O-N 3.25Å; E1027-V1029 VanDerWaalsContact C-N 3.35Å; E1027-V1029 PolarHBondContact O-N 3.33Å; V1029-Y1031 PolarHBondContact O-N 3.02Å; V1029-F1032 PolarHBondContact O-N 2.99Å; V1029-F1033 HydrophobicContact CG1-CD2 3.81Å; V1029-F1033 HydrophobicContact CG1-CE2 3.91Å; V1029-F1033 WeakPolarHBondContact O-CD2 3.14Å; V1029-F1033 PolarHBondContact O-N 3.45Å; V1029-F1033 VanDerWaalsContact O-N 3.09Å
1030	S	35.4	Very low	33	Very low	71 Å²	71	119.9 Å²	119.9	50%	0.497	64%	0.639	S	S	.	*	H	α-helix	trans	-65.4	-35.3	176.1	-79.3	0	0	0	0	113.6	T1026 E1027 F1033	T1026-S1030 WeakPolarHBondContact O-CB 3.41Å; T1026-S1030 PolarHBondContact O-N 3.14Å; T1026-S1030 PolarHBondContact O-OG 3.12Å; E1027-S1030 PolarHBondContact O-N 2.54Å; S1030-F1033 PolarHBondContact O-N 2.68Å
1031	Y	34.7	Very low	32.8	Very low	164 Å²	164	120.7 Å²	120.7	64%	0.643	64%	0.642	S	S	*	*	H	α-helix	trans	-66.9	-37.8	176	-172.1	-97.8	0	0	0	112.3	E1027 V1029	E1027-Y1031 PolarHBondContact O-N 3.18Å; V1029-Y1031 PolarHBondContact O-N 3.02Å
1032	F	32	Very low	32.4	Very low	148 Å²	148	125.2 Å²	125.2	65%	0.649	65%	0.654	S	S	*	*	H	α-helix	trans	-74.7	-29.9	179	-137.5	-89	0	0	0	112.9	Y1028 V1029 N1034	Y1028-F1032 PolarHBondContact O-N 3.13Å; V1029-F1032 PolarHBondContact O-N 2.99Å; F1032-N1034 VanDerWaalsContact C-N 3.31Å; F1032-N1034 PolarHBondContact O-N 2.83Å
1033	F	32.9	Very low	32.2	Very low	149 Å²	149	126 Å²	126	65%	0.654	65%	0.653	S	S	*	*	H	α-helix	trans	-66	-28.8	176.9	-104.8	-88.3	0	0	0	113.6	V1029 S1030	V1029-F1033 HydrophobicContact CG1-CD2 3.81Å; V1029-F1033 HydrophobicContact CG1-CE2 3.91Å; V1029-F1033 WeakPolarHBondContact O-CD2 3.14Å; V1029-F1033 PolarHBondContact O-N 3.45Å; V1029-F1033 VanDerWaalsContact O-N 3.09Å; S1030-F1033 PolarHBondContact O-N 2.68Å
1034	N	33.4	Very low	32	Very low	148 Å²	148	128.9 Å²	128.9	79%	0.791	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-9.5	-176.1	-79.2	-18	0	0	0	114.9	F1032	F1032-N1034 VanDerWaalsContact C-N 3.31Å; F1032-N1034 PolarHBondContact O-N 2.83Å
1035	Q	29	Very low	31.6	Very low	151 Å²	151	126.4 Å²	126.4	71%	0.706	65%	0.652	S	S	*	*	S	Bend	trans	-108.4	-8.9	-171.6	-76.6	-99.7	-18.2	0	0	114.8
1036	C	27.5	Very low	31.3	Very low	78 Å²	78	124 Å²	124	53%	0.527	65%	0.648	S	S	.	*			trans	-138.9	93.5	-172.2	-94.8	0	0	0	0	113.1	F1038	C1036-F1038 PolarHBondContact O-N 3.42Å; C1036-F1038 VanDerWaalsContact O-N 3.09Å
1037	S	27.5	Very low	30.8	Very low	119 Å²	119	128.1 Å²	128.1	83%	0.832	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	7	177	43.1	0	0	0	0	115.3
1038	F	27.4	Very low	30.7	Very low	164 Å²	164	125.1 Å²	125.1	72%	0.719	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	2.1	-173.6	-113.4	-91.6	0	0	0	116.1	C1036	C1036-F1038 PolarHBondContact O-N 3.42Å; C1036-F1038 VanDerWaalsContact O-N 3.09Å
1039	C	29.2	Very low	30.7	Very low	92 Å²	92	124.7 Å²	124.7	62%	0.622	65%	0.654	S	S	*	*			trans	-107.9	12.6	-175.7	-82.2	0	0	0	0	115.8	V1041	C1039-V1041 VanDerWaalsContact C-N 3.35Å; C1039-V1041 PolarHBondContact O-N 3.15Å
1040	S	28.2	Very low	30.5	Very low	93 Å²	93	129.2 Å²	129.2	65%	0.65	67%	0.668	S	S	*	*	H	α-helix	trans	-73.4	-18.5	-174.9	51.7	0	0	0	0	115.1
1041	V	30	Very low	30.4	Very low	115 Å²	115	136.7 Å²	136.7	70%	0.697	69%	0.692	S	S	*	*	H	α-helix	trans	-91.7	-30	-173.9	-177.6	0	0	0	0	113.3	C1039	C1039-V1041 VanDerWaalsContact C-N 3.35Å; C1039-V1041 PolarHBondContact O-N 3.15Å
1042	F	28.5	Very low	30.2	Very low	187 Å²	187	135.4 Å²	135.4	82%	0.82	69%	0.694	S	S	*	*	H	α-helix	trans	-81.8	-26.3	-176	-112.7	-88.9	0	0	0	113.8
1043	M	29.6	Very low	30.1	Very low	129 Å²	129	134.7 Å²	134.7	64%	0.635	70%	0.696	S	S	*	*	H	α-helix	trans	-88.5	-18	179.4	-78.8	-111.8	-91.2	0	0	114	C1045 A1046 W1047	M1043-C1045 VanDerWaalsContact C-N 3.31Å; M1043-C1045 PolarHBondContact O-N 2.83Å; M1043-A1046 PolarHBondContact O-N 2.81Å; M1043-W1047 PolarHBondContact O-N 3.21Å
1044	F	30.1	Very low	29.9	Very low	148 Å²	148	133.9 Å²	133.9	65%	0.649	70%	0.699	S	S	*	*	H	α-helix	trans	-69	-31.3	176	-145.1	-91.9	0	0	0	112.2	S1048	F1044-S1048 PolarHBondContact O-N 2.64Å
1045	C	28	Very low	29.7	Very low	95 Å²	95	133.1 Å²	133.1	64%	0.642	69%	0.693	S	S	*	*	H	α-helix	trans	-72.1	-32.8	172.5	-73.5	0	0	0	0	112.9	M1043	M1043-C1045 VanDerWaalsContact C-N 3.31Å; M1043-C1045 PolarHBondContact O-N 2.83Å
1046	A	29.1	Very low	29.8	Very low	55 Å²	55	131.9 Å²	131.9	46%	0.455	69%	0.693	S	S	.	*	H	α-helix	trans	-74.5	-33.8	176.2	0	0	0	0	0	112	M1043 Q1049 F1050	M1043-A1046 PolarHBondContact O-N 2.81Å; A1046-Q1049 PolarHBondContact O-N 2.85Å; A1046-F1050 PolarHBondContact O-N 3.36Å
1047	W	29.1	Very low	29.9	Very low	173 Å²	173	135.5 Å²	135.5	66%	0.655	70%	0.704	S	S	*	*	H	α-helix	trans	-75.2	-27.9	178.9	-154.6	57.3	0	0	0	113.2	M1043 Q1049 F1050 K1051	M1043-W1047 PolarHBondContact O-N 3.21Å; W1047-Q1049 VanDerWaalsContact C-N 3.3Å; W1047-Q1049 PolarHBondContact O-N 2.6Å; W1047-F1050 PolarHBondContact O-N 3.46Å; W1047-K1051 PolarHBondContact O-N 3.08Å
1048	S	33.3	Very low	30.1	Very low	87 Å²	87	136.7 Å²	136.7	61%	0.608	69%	0.694	S	S	*	*	H	α-helix	trans	-73.4	-15.8	172.2	171.2	0	0	0	0	114.2	F1044	F1044-S1048 PolarHBondContact O-N 2.64Å
1049	Q	34.6	Very low	30.3	Very low	178 Å²	178	134.6 Å²	134.6	83%	0.832	69%	0.693	S	S	*	*	H	α-helix	trans	-98.2	-8.7	171.3	-81.3	-170.3	-27.3	0	0	113	A1046 W1047	A1046-Q1049 PolarHBondContact O-N 2.85Å; W1047-Q1049 VanDerWaalsContact C-N 3.3Å; W1047-Q1049 PolarHBondContact O-N 2.6Å
1050	F	32.1	Very low	30.4	Very low	170 Å²	170	138.2 Å²	138.2	75%	0.746	70%	0.698	S	S	*	*	H	α-helix	trans	-98.8	-7.5	179.1	-144.2	-90.5	0	0	0	113.2	A1046 W1047	A1046-F1050 PolarHBondContact O-N 3.36Å; W1047-F1050 PolarHBondContact O-N 3.46Å
1051	K	32.1	Very low	30.6	Very low	228 Å²	228	142.3 Å²	142.3	99%	0.991	70%	0.703	S	S	*	*			trans	-97.8	0	163.7	-120.4	-169.4	-177.4	-176.4	0	108.7	W1047	W1047-K1051 PolarHBondContact O-N 3.08Å

Retrieved 1,051 of 1,051 residues in 1729.2 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).