A0A077Z3V3_TRITR Loading...

Fibulin 1

AlphaFold DB , UniProt , Accession A0A077Z3V3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 894 aa.

						>A0A077Z3V3_TRITR|A0A077Z3V3
MASDIHLANGRHVGACCLNGRKTYAASKQCLFSENNDIACARITTVCCLTALYETKCDEGKSVAVAEEDCNGLDAPGREHTKECCHCCLLGRETLKRNEACNPPSHVSRRCKQAFVSCCGDGGEPSDNDDKVRMFSATTTDVNERYSIQLFVRFTAATISDSGRCSENKNFCEQICDDSDPAVVQLVSVLTRTVERAPVSFQLAKSPCLSKVNYENACAINSCLTGDAASECSLFGKCGRILMPLDVDECVQGSSTCDATTQVCENTPGSYRCNCLNGFSWNATIGRCVDIDECLLYRDDCIVGQRCINTVGSWRCIRTLSCGTGYYLDSETDTCVADRSCKARRCFADIDECMLGTHNCGPGFTCRNAHGSFRCERRLCPTGQQWDSGNQRCIASVTCSPGFHPGSDGKCQGELDPFQFFIAYWSHYSDVNECHLPDACPSGQKCRNTQGSYYCENSESSCPSGYERSTVDGNCVDIDECSRGTHTCPEANMCVNTVGSYHCRCPTGYRFNPSTKQCEDIDECRQNLASCHQRCVNTPGSYQCACERGYTLGVDGSTCLDIDECALYKFQGSGLCAGQCVNTPGSFECRCPHGFQLGKDGRTCEDIDECANGMCSGHDQICINMYGGYKCEQIVCPPNYVKDTRFKNRCNRLSQTCSPFDHQCLHSPVSLLYNFISLPSNVNFQDFGLSALPLITLKGPTDLDTSVQYELQLLETRVGRHGVRPATRASFAVQKMSGPNSAVLNLVESLQGPQDVVLDLIMHFHHSGTFGGRSTAKIFLFVSAFKENNFTEILVREGYTCRKSCYPLDISCLANMTASISYQFISLPSVELIKSPLEIGRIYPESRTPRPYFVKYEIDYPSRSYFALEQKENVGTSSVCLLACLLGSSSSRLP
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.4	Very low	39.9	Very low	182 Å²	182	131.9 Å²	131.9	90%	0.897	74%	0.74	S	S	*	*				0	-1.2	0	-68.2	-167.8	178.1	0	0	117.1
2	A	33.9	Very low	42.1	Very low	96 Å²	96	130.3 Å²	130.3	79%	0.793	72%	0.722	S	S	*	*			trans	-88.1	2.3	175.1	0	0	0	0	0	114.6
3	S	38.2	Very low	44.3	Very low	47 Å²	47	125.5 Å²	125.5	33%	0.329	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.9	-21.2	-175.7	-43.2	0	0	0	0	114.2	R97	S3-R97 PolarHBondContact OG-NH1 3.14Å; S3-R97 PolarHBondContact OG-NH2 3.23Å
4	D	40	Very low	46.7	Very low	148 Å²	148	119.9 Å²	119.9	79%	0.791	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	12.5	-167.9	-61.5	-39.5	0	0	0	114.1
5	I	41.9	Very low	48.9	Very low	97 Å²	97	116.3 Å²	116.3	50%	0.497	67%	0.674	S	S	.	*			trans	-108.3	62.1	175.1	-47.3	178.8	0	0	0	109.1	L7 I43	I5-L7 PolarHBondContact O-N 2.93Å; I5-I43 HydrophobicContact CD1-CG1 4.37Å
6	H	35.6	Very low	51	Low	178 Å²	178	109.3 Å²	109.3	82%	0.824	63%	0.633	S	S	*	*			trans	-90.2	75.7	167.5	-95.8	-64	0	0	0	110.1
7	L	40.5	Very low	52.9	Low	164 Å²	164	104.9 Å²	104.9	86%	0.859	61%	0.61	S	S	*	*	S	Bend	trans	-148.9	115.3	163.2	-95.2	147.9	0	0	0	109	I5	I5-L7 PolarHBondContact O-N 2.93Å
8	A	31.4	Very low	54.7	Low	87 Å²	87	104.8 Å²	104.8	72%	0.719	61%	0.606	S	S	*	*	S	Bend	trans	69.8	105.8	168.1	0	0	0	0	0	118.9
9	N	42.8	Very low	56.2	Low	136 Å²	136	103 Å²	103	73%	0.727	59%	0.594	S	S	*	*			trans	47.5	102.4	159.4	-72.2	-18.3	0	0	0	117.3	R11 H12	N9-R11 PolarHBondContact O-N 2.76Å; N9-H12 PolarHBondContact O-N 2.92Å
10	G	46.1	Very low	57.6	Low	79 Å²	79	97.9 Å²	97.9	81%	0.814	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-0.7	174.9	0	0	0	0	0	117.3
11	R	49.9	Very low	58.9	Low	237 Å²	237	97.1 Å²	97.1	89%	0.894	55%	0.552	S	S	*	*	H	α-helix	trans	-80.6	-19.9	168.9	-86.9	-176.8	173.5	175.9	-1.6	114.3	N9	N9-R11 PolarHBondContact O-N 2.76Å
12	H	66.1	Low	61.2	Low	113 Å²	113	94.5 Å²	94.5	52%	0.523	54%	0.536	S	S	.	.	H	α-helix	trans	-85	-34.9	-177.7	-117	-94.1	0	0	0	113.5	N9 G14 A15 C16	N9-H12 PolarHBondContact O-N 2.92Å; H12-G14 PolarHBondContact O-N 3.13Å; H12-A15 PolarHBondContact O-N 2.9Å; H12-C16 PolarHBondContact O-N 2.85Å; H12-C16 VanDerWaalsContact O-N 3.14Å; H12-C16 PolarHBondContact O-SG 3.12Å
13	V	71.4	Confident	63.5	Low	68 Å²	68	92 Å²	92	41%	0.412	51%	0.51	S	S	.	.	H	α-helix	trans	-59.9	-45.3	-175.6	-178.3	0	0	0	0	112.1	A15 C16 C17 I43	V13-A15 PolarHBondContact O-N 3.21Å; V13-C16 PolarHBondContact O-N 2.76Å; V13-C17 WeakPolarHBondContact O-CB 3.43Å; V13-C17 PolarHBondContact O-N 3.35Å; V13-I43 HydrophobicContact CB-CD1 4.45Å; V13-I43 HydrophobicContact CG1-CD1 4.23Å; V13-I43 HydrophobicContact CG1-CG2 4.26Å; V13-I43 HydrophobicContact CG2-CD1 4.15Å
14	G	77.1	Confident	65.6	Low	46 Å²	46	90.4 Å²	90.4	47%	0.474	50%	0.498	S	S	.	.	H	α-helix	trans	-61.1	-42.1	-180	0	0	0	0	0	112.8	H12 L18	H12-G14 PolarHBondContact O-N 3.13Å; G14-L18 WeakPolarHBondContact O-CB 3.44Å; G14-L18 PolarHBondContact O-N 3.2Å
15	A	81	Confident	67.7	Low	67 Å²	67	86.7 Å²	86.7	55%	0.554	49%	0.487	S	S	*	.	H	α-helix	trans	-67.8	-44.5	179.6	0	0	0	0	0	112.2	H12 V13 L18 N19	H12-A15 PolarHBondContact O-N 2.9Å; V13-A15 PolarHBondContact O-N 3.21Å; A15-L18 PolarHBondContact O-N 3.1Å; A15-N19 PolarHBondContact O-N 3.05Å
16	C	82.1	Confident	69.6	Low	4 Å²	4	86.3 Å²	86.3	3%	0.027	50%	0.499	C	S	.	.	H	α-helix	trans	-60.8	-45.2	176.1	-61.4	0	0	0	0	111.4	H12 V13 L18 N19 G20 C40 I43 T44	H12-C16 PolarHBondContact O-N 2.85Å; H12-C16 VanDerWaalsContact O-N 3.14Å; H12-C16 PolarHBondContact O-SG 3.12Å; V13-C16 PolarHBondContact O-N 2.76Å; C16-L18 PolarHBondContact O-N 3.4Å; C16-N19 WeakPolarHBondContact O-CB 3.03Å; C16-N19 PolarHBondContact O-N 3.35Å; C16-G20 PolarHBondContact O-N 3.46Å; C16-G20 VanDerWaalsContact O-N 3.09Å; C16-C40 HydrophobicContact CB-CB 4.08Å; C16-C40 WeakPolarHBondContact CB-SG 3.39Å; C16-C40 WeakPolarHBondContact SG-CA 3.43Å; C16-C40 WeakPolarHBondContact SG-CB 3.48Å; C16-C40 CovalentContact SG-SG 2.03Å; C16-C40 PolarHBondContact SG-SG 2.96Å; C16-I43 HydrophobicContact CB-CB 4.01Å; C16-I43 HydrophobicContact CB-CG2 3.75Å; C16-T44 PolarHBondContact O-OG1 2.87Å
17	C	82.8	Confident	71.8	Confident	34 Å²	34	80.5 Å²	80.5	23%	0.23	48%	0.478	C	S	.	.	H	α-helix	trans	-64.1	-41.4	178.1	-171	0	0	0	0	112.5	V13 N19 G20 R21 I43 C47	V13-C17 WeakPolarHBondContact O-CB 3.43Å; V13-C17 PolarHBondContact O-N 3.35Å; C17-N19 PolarHBondContact O-N 3.38Å; C17-G20 PolarHBondContact O-N 2.99Å; C17-R21 PolarHBondContact O-N 2.98Å; C17-I43 HydrophobicContact CB-CG2 4.06Å; C17-C47 WeakPolarHBondContact CA-SG 3.21Å; C17-C47 HydrophobicContact CB-CB 3.87Å; C17-C47 WeakPolarHBondContact CB-SG 3.48Å; C17-C47 WeakPolarHBondContact O-CB 3.48Å; C17-C47 WeakPolarHBondContact SG-CB 3.5Å; C17-C47 CovalentContact SG-SG 2.03Å; C17-C47 PolarHBondContact SG-SG 2.9Å
18	L	85.1	Confident	73.8	Confident	103 Å²	103	78.7 Å²	78.7	54%	0.539	46%	0.463	S	S	.	.	H	α-helix	trans	-61	-36.8	175.6	-141.4	99	0	0	0	111.5	G14 A15 C16 K22	G14-L18 WeakPolarHBondContact O-CB 3.44Å; G14-L18 PolarHBondContact O-N 3.2Å; A15-L18 PolarHBondContact O-N 3.1Å; C16-L18 PolarHBondContact O-N 3.4Å; L18-K22 WeakPolarHBondContact O-CB 3.13Å; L18-K22 VanDerWaalsContact O-CG 3.32Å; L18-K22 WeakPolarHBondContact O-CG 3.23Å; L18-K22 PolarHBondContact O-N 3.4Å
19	N	84.1	Confident	76	Confident	71 Å²	71	79.8 Å²	79.8	38%	0.38	45%	0.453	S	S	.	.	H	α-helix	trans	-66.9	-41.1	177	-159.2	34.2	0	0	0	111.8	A15 C16 C17 K22 T23	A15-N19 PolarHBondContact O-N 3.05Å; C16-N19 WeakPolarHBondContact O-CB 3.03Å; C16-N19 PolarHBondContact O-N 3.35Å; C17-N19 PolarHBondContact O-N 3.38Å; N19-K22 PolarHBondContact O-N 3.15Å; N19-T23 WeakPolarHBondContact O-CB 3.29Å; N19-T23 PolarHBondContact O-N 2.88Å; N19-T23 PolarHBondContact O-OG1 3.5Å
20	G	83	Confident	77.7	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-60.8	-48	174.7	0	0	0	0	0	112.4	C16 C17 K22 T23 Y24 T44	C16-G20 PolarHBondContact O-N 3.46Å; C16-G20 VanDerWaalsContact O-N 3.09Å; C17-G20 PolarHBondContact O-N 2.99Å; G20-K22 PolarHBondContact O-N 2.91Å; G20-T23 WeakPolarHBondContact O-CB 3.41Å; G20-T23 PolarHBondContact O-N 2.82Å; G20-Y24 PolarHBondContact O-N 2.83Å; G20-Y24 VanDerWaalsContact O-N 3.1Å; G20-T44 WeakPolarHBondContact CA-O 3.48Å
21	R	85.6	Confident	78.6	Confident	82 Å²	82	76.8 Å²	76.8	31%	0.309	42%	0.42	S	S	.	.	H	α-helix	trans	-61.6	-39.8	174.7	-79.8	-171.3	153.8	-167.4	-3.9	112.8	C17 A25 A51 E54 H106	C17-R21 PolarHBondContact O-N 2.98Å; R21-A25 WeakPolarHBondContact O-CB 3.16Å; R21-A25 PolarHBondContact O-N 3.2Å; R21-A51 HydrophobicContact CG-CB 4.11Å; R21-E54 IonicContact CZ-OE2 2.73Å; R21-E54 IonicContact NE-OE2 3.04Å; R21-E54 IonicContact NH2-OE1 2.75Å; R21-E54 PolarHBondContact NH2-OE1 2.89Å; R21-E54 IonicContact NH2-OE2 2.6Å; R21-E54 PolarHBondContact NH2-OE2 2.73Å; R21-H106 PolarHBondContact NH2-O 2.9Å
22	K	85.8	Confident	79.2	Confident	128 Å²	128	70.1 Å²	70.1	56%	0.557	40%	0.397	S	S	*	.	H	α-helix	trans	-64.2	-40.5	174.5	-80	178	177.1	-179.2	0	112.4	L18 N19 G20 A25 A26	L18-K22 WeakPolarHBondContact O-CB 3.13Å; L18-K22 VanDerWaalsContact O-CG 3.32Å; L18-K22 WeakPolarHBondContact O-CG 3.23Å; L18-K22 PolarHBondContact O-N 3.4Å; N19-K22 PolarHBondContact O-N 3.15Å; G20-K22 PolarHBondContact O-N 2.91Å; K22-A25 PolarHBondContact O-N 2.79Å; K22-A26 WeakPolarHBondContact O-CB 3.36Å; K22-A26 PolarHBondContact O-N 2.85Å
23	T	82.6	Confident	78.5	Confident	42 Å²	42	69.7 Å²	69.7	26%	0.258	41%	0.407	S	S	.	.	H	α-helix	trans	-61.3	-46.6	178.6	-55.5	0	0	0	0	110.6	N19 G20 A26 S27	N19-T23 WeakPolarHBondContact O-CB 3.29Å; N19-T23 PolarHBondContact O-N 2.88Å; N19-T23 PolarHBondContact O-OG1 3.5Å; G20-T23 WeakPolarHBondContact O-CB 3.41Å; G20-T23 PolarHBondContact O-N 2.82Å; T23-A26 PolarHBondContact O-N 3.13Å; T23-S27 PolarHBondContact O-N 2.06Å; T23-S27 PolarHBondContact O-OG 3.32Å
24	Y	83.1	Confident	77.7	Confident	15 Å²	15	75.6 Å²	75.6	6%	0.059	43%	0.43	C	S	.	.	H	α-helix	trans	-63.3	-45	173.5	-179	-100.4	0	0	0	112.2	G20 A26 K28 A51 L52 T55	G20-Y24 PolarHBondContact O-N 2.83Å; G20-Y24 VanDerWaalsContact O-N 3.1Å; Y24-A26 PolarHBondContact O-N 3.04Å; Y24-K28 HydrophobicContact CE1-CD 4.45Å; Y24-K28 VanDerWaalsContact O-CA 3.27Å; Y24-K28 WeakPolarHBondContact O-CA 3.16Å; Y24-K28 PolarHBondContact O-N 3.44Å; Y24-A51 HydrophobicContact CD1-CB 3.56Å; Y24-A51 HydrophobicContact CE1-CB 4.39Å; Y24-A51 HydrophobicContact CG-CB 3.83Å; Y24-L52 HydrophobicContact CD2-CB 3.91Å; Y24-L52 HydrophobicContact CD2-CD1 4.42Å; Y24-L52 HydrophobicContact CE2-CB 3.62Å; Y24-L52 HydrophobicContact CE2-CD1 3.47Å; Y24-L52 VanDerWaalsContact CE2-CD1 3.47Å; Y24-L52 HydrophobicContact CE2-CG 4.14Å; Y24-T55 HydrophobicContact CE1-CG2 4.23Å; Y24-T55 WeakPolarHBondContact CE1-OG1 3.45Å; Y24-T55 VanDerWaalsContact OH-CB 3.31Å; Y24-T55 WeakPolarHBondContact OH-CB 3.36Å; Y24-T55 PolarHBondContact OH-OG1 3.49Å
25	A	83	Confident	76.7	Confident	69 Å²	69	77.6 Å²	77.6	57%	0.57	43%	0.43	S	S	*	.	H	α-helix	trans	-60.1	-34.6	178.9	0	0	0	0	0	112.8	R21 K22	R21-A25 WeakPolarHBondContact O-CB 3.16Å; R21-A25 PolarHBondContact O-N 3.2Å; K22-A25 PolarHBondContact O-N 2.79Å
26	A	83.4	Confident	75.5	Confident	90 Å²	90	82.8 Å²	82.8	74%	0.744	45%	0.448	S	S	*	.	H	α-helix	trans	-81.1	-44.4	-179.6	0	0	0	0	0	113.5	K22 T23 Y24	K22-A26 WeakPolarHBondContact O-CB 3.36Å; K22-A26 PolarHBondContact O-N 2.85Å; T23-A26 PolarHBondContact O-N 3.13Å; Y24-A26 PolarHBondContact O-N 3.04Å
27	S	81.7	Confident	75	Confident	55 Å²	55	85.9 Å²	85.9	39%	0.385	47%	0.465	S	S	.	.	H	α-helix	trans	-105.8	-12.3	-169.8	65	0	0	0	0	114.5	T23 Q29	T23-S27 PolarHBondContact O-N 2.06Å; T23-S27 PolarHBondContact O-OG 3.32Å; S27-Q29 PolarHBondContact O-N 2.92Å; S27-Q29 PolarHBondContact OG-N 3.02Å; S27-Q29 PolarHBondContact OG-O 3Å
28	K	82.3	Confident	74.4	Confident	126 Å²	126	90.1 Å²	90.1	55%	0.548	48%	0.484	S	S	.	.	S	Bend	trans	54	14.6	-167.5	-60.4	-63.9	-173.4	172.9	0	113.9	Y24	Y24-K28 HydrophobicContact CE1-CD 4.45Å; Y24-K28 VanDerWaalsContact O-CA 3.27Å; Y24-K28 WeakPolarHBondContact O-CA 3.16Å; Y24-K28 PolarHBondContact O-N 3.44Å
29	Q	77.6	Confident	73.7	Confident	111 Å²	111	87.7 Å²	87.7	52%	0.519	48%	0.479	S	S	.	.	S	Bend	trans	-133.8	154.6	-179	-66.9	-177.9	-15.3	0	0	108.9	S27 L31	S27-Q29 PolarHBondContact O-N 2.92Å; S27-Q29 PolarHBondContact OG-N 3.02Å; S27-Q29 PolarHBondContact OG-O 3Å; Q29-L31 HydrophobicContact CB-CD1 4.48Å; Q29-L31 HydrophobicContact CB-CG 4.22Å
30	C	77.4	Confident	73.3	Confident	28 Å²	28	85.2 Å²	85.2	19%	0.189	47%	0.467	C	S	.	.			trans	-107.3	69.9	173.7	-71	0	0	0	0	109.2	F32 C48 L49	C30-F32 HydrophobicContact CB-CE2 4.07Å; C30-F32 HydrophobicContact CB-CZ 3.7Å; C30-F32 VanDerWaalsContact O-CE2 3.32Å; C30-F32 WeakPolarHBondContact O-CE2 3.43Å; C30-C48 WeakPolarHBondContact CA-SG 3.35Å; C30-C48 HydrophobicContact CB-CB 4.04Å; C30-C48 WeakPolarHBondContact CB-SG 3.39Å; C30-C48 WeakPolarHBondContact SG-CB 3.11Å; C30-C48 PolarHBondContact SG-O 3.41Å; C30-C48 VanDerWaalsContact SG-O 3.33Å; C30-C48 CovalentContact SG-SG 2.05Å; C30-C48 PolarHBondContact SG-SG 3.24Å; C30-L49 HydrophobicContact CB-CD2 4.44Å
31	L	66.4	Low	73	Confident	124 Å²	124	86.7 Å²	86.7	65%	0.649	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-90.7	120	173.2	-65.9	172.2	0	0	0	108.6	Q29	Q29-L31 HydrophobicContact CB-CD1 4.48Å; Q29-L31 HydrophobicContact CB-CG 4.22Å
32	F	61.3	Low	72.5	Confident	96 Å²	96	91.3 Å²	91.3	42%	0.421	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-96	124.3	-176.7	-59.2	-67.2	0	0	0	111.1	C30 T45 C48	C30-F32 HydrophobicContact CB-CE2 4.07Å; C30-F32 HydrophobicContact CB-CZ 3.7Å; C30-F32 VanDerWaalsContact O-CE2 3.32Å; C30-F32 WeakPolarHBondContact O-CE2 3.43Å; F32-T45 VanDerWaalsContact CD1-OG1 3.26Å; F32-T45 WeakPolarHBondContact CD1-OG1 3.39Å; F32-T45 HydrophobicContact CD2-CG2 4.25Å; F32-T45 HydrophobicContact CE1-CG2 4.13Å; F32-T45 WeakPolarHBondContact CE1-OG1 3.27Å; F32-T45 HydrophobicContact CE2-CG2 3.46Å; F32-T45 VanDerWaalsContact CE2-CG2 3.46Å; F32-T45 WeakPolarHBondContact CE2-OG1 3.42Å; F32-T45 VanDerWaalsContact CZ-CB 3.48Å; F32-T45 HydrophobicContact CZ-CG2 3.41Å; F32-T45 VanDerWaalsContact CZ-CG2 3.41Å; F32-T45 VanDerWaalsContact CZ-OG1 3.28Å; F32-T45 WeakPolarHBondContact CZ-OG1 3.44Å; F32-C48 HydrophobicContact CE1-CB 4.07Å; F32-C48 HydrophobicContact CZ-CB 4.1Å
33	S	52.4	Low	72.2	Confident	104 Å²	104	86.2 Å²	86.2	73%	0.727	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-85.8	142.2	167	172	0	0	0	0	109.3	N35	S33-N35 VanDerWaalsContact C-N 3.33Å; S33-N35 PolarHBondContact O-N 3.24Å
34	E	54.1	Low	72.2	Confident	193 Å²	193	84.6 Å²	84.6	90%	0.902	47%	0.465	S	S	*	.			trans	-59.4	87.8	176.2	-67.4	-177.6	160.1	0	0	111.2
35	N	55.9	Low	72	Confident	88 Å²	88	85.7 Å²	85.7	47%	0.471	47%	0.473	S	S	.	.			trans	-84.6	130.3	165.3	-98.8	-22.5	0	0	0	109.1	S33 D37	S33-N35 VanDerWaalsContact C-N 3.33Å; S33-N35 PolarHBondContact O-N 3.24Å; N35-D37 PolarHBondContact O-N 2.73Å
36	N	55.8	Low	71.8	Confident	175 Å²	175	86.6 Å²	86.6	94%	0.936	47%	0.471	S	S	*	.	S	Bend	trans	-59.9	-12.3	-179.3	-81.1	-18.1	0	0	0	115
37	D	71.8	Confident	71.8	Confident	70 Å²	70	83 Å²	83	37%	0.374	44%	0.441	S	S	.	.			trans	-99.2	96.9	175.6	-175.1	-15.6	0	0	0	110.3	N35 A39 C40 A41	N35-D37 PolarHBondContact O-N 2.73Å; D37-A39 PolarHBondContact O-N 2.75Å; D37-A39 PolarHBondContact OD1-N 3.08Å; D37-A39 VanDerWaalsContact OD1-N 3.13Å; D37-C40 HydrophobicContact CB-CB 3.82Å; D37-C40 VanDerWaalsContact CG-CB 3.46Å; D37-C40 PolarHBondContact O-N 2.78Å; D37-C40 PolarHBondContact OD1-N 2.85Å; D37-C40 VanDerWaalsContact OD1-N 3.09Å; D37-C40 WeakPolarHBondContact OD2-CB 3.36Å; D37-A41 WeakPolarHBondContact O-CB 3.39Å; D37-A41 PolarHBondContact O-N 3.41Å
38	I	70.3	Confident	72	Confident	123 Å²	123	80.4 Å²	80.4	63%	0.631	42%	0.423	S	S	*	.	H	α-helix	trans	-57.7	-36.7	-178.2	-60.9	172.4	0	0	0	111.7	A41 R42	I38-A41 PolarHBondContact O-N 2.83Å; I38-R42 WeakPolarHBondContact O-CG 3.21Å; I38-R42 PolarHBondContact O-N 2.97Å
39	A	69.9	Low	71.8	Confident	52 Å²	52	77.3 Å²	77.3	43%	0.43	41%	0.412	S	S	.	.	H	α-helix	trans	-70	-46.3	179.8	0	0	0	0	0	110.4	D37 A41 R42 I43	D37-A39 PolarHBondContact O-N 2.75Å; D37-A39 PolarHBondContact OD1-N 3.08Å; D37-A39 VanDerWaalsContact OD1-N 3.13Å; A39-A41 VanDerWaalsContact C-N 3.31Å; A39-A41 PolarHBondContact O-N 2.84Å; A39-R42 PolarHBondContact O-N 2.99Å; A39-I43 VanDerWaalsContact O-CG1 3.31Å; A39-I43 WeakPolarHBondContact O-CG1 3.42Å; A39-I43 PolarHBondContact O-N 3.23Å
40	C	76.7	Confident	71.8	Confident	19 Å²	19	73.4 Å²	73.4	13%	0.128	40%	0.396	C	S	.	.	H	α-helix	trans	-63.3	-37	174.7	-166	0	0	0	0	111.9	C16 D37 I43 T44	C16-C40 HydrophobicContact CB-CB 4.08Å; C16-C40 WeakPolarHBondContact CB-SG 3.39Å; C16-C40 WeakPolarHBondContact SG-CA 3.43Å; C16-C40 WeakPolarHBondContact SG-CB 3.48Å; C16-C40 CovalentContact SG-SG 2.03Å; C16-C40 PolarHBondContact SG-SG 2.96Å; D37-C40 HydrophobicContact CB-CB 3.82Å; D37-C40 VanDerWaalsContact CG-CB 3.46Å; D37-C40 PolarHBondContact O-N 2.78Å; D37-C40 PolarHBondContact OD1-N 2.85Å; D37-C40 VanDerWaalsContact OD1-N 3.09Å; D37-C40 WeakPolarHBondContact OD2-CB 3.36Å; C40-I43 PolarHBondContact O-N 3.06Å; C40-T44 VanDerWaalsContact O-CB 3.26Å; C40-T44 WeakPolarHBondContact O-CB 3.37Å; C40-T44 PolarHBondContact O-N 2.99Å; C40-T44 PolarHBondContact O-OG1 3.28Å
41	A	75.4	Confident	72	Confident	30 Å²	30	72.4 Å²	72.4	25%	0.248	39%	0.389	C	S	.	.	H	α-helix	trans	-61.9	-48.3	175.6	0	0	0	0	0	111.5	D37 I38 A39 I43 T44 T45	D37-A41 WeakPolarHBondContact O-CB 3.39Å; D37-A41 PolarHBondContact O-N 3.41Å; I38-A41 PolarHBondContact O-N 2.83Å; A39-A41 VanDerWaalsContact C-N 3.31Å; A39-A41 PolarHBondContact O-N 2.84Å; A41-I43 PolarHBondContact O-N 3.19Å; A41-T44 WeakPolarHBondContact O-CB 3.47Å; A41-T44 PolarHBondContact O-N 2.73Å; A41-T45 PolarHBondContact O-N 3.48Å; A41-T45 PolarHBondContact O-OG1 3.19Å; A41-T45 VanDerWaalsContact O-OG1 3.07Å
42	R	76.5	Confident	72.6	Confident	180 Å²	180	68.6 Å²	68.6	68%	0.679	37%	0.369	S	S	*	.	H	α-helix	trans	-59.2	-45.7	175	-73.8	-179.3	176.8	-168.6	-1.3	112.3	I38 A39 T44 T45 V46	I38-R42 WeakPolarHBondContact O-CG 3.21Å; I38-R42 PolarHBondContact O-N 2.97Å; A39-R42 PolarHBondContact O-N 2.99Å; R42-T44 VanDerWaalsContact C-N 3.34Å; R42-T44 PolarHBondContact O-N 3.25Å; R42-T45 PolarHBondContact O-N 3.21Å; R42-V46 WeakPolarHBondContact O-CG2 3.06Å; R42-V46 PolarHBondContact O-N 2.79Å
43	I	79.2	Confident	73.1	Confident	20 Å²	20	69.6 Å²	69.6	10%	0.103	37%	0.371	C	S	.	.	H	α-helix	trans	-63	-41.8	177.3	-65.6	163.7	0	0	0	110.8	I5 V13 C16 C17 A39 C40 A41 T45 V46 C47	I5-I43 HydrophobicContact CD1-CG1 4.37Å; V13-I43 HydrophobicContact CB-CD1 4.45Å; V13-I43 HydrophobicContact CG1-CD1 4.23Å; V13-I43 HydrophobicContact CG1-CG2 4.26Å; V13-I43 HydrophobicContact CG2-CD1 4.15Å; C16-I43 HydrophobicContact CB-CB 4.01Å; C16-I43 HydrophobicContact CB-CG2 3.75Å; C17-I43 HydrophobicContact CB-CG2 4.06Å; A39-I43 VanDerWaalsContact O-CG1 3.31Å; A39-I43 WeakPolarHBondContact O-CG1 3.42Å; A39-I43 PolarHBondContact O-N 3.23Å; C40-I43 PolarHBondContact O-N 3.06Å; A41-I43 PolarHBondContact O-N 3.19Å; I43-T45 VanDerWaalsContact C-N 3.31Å; I43-T45 PolarHBondContact O-N 3.5Å; I43-V46 PolarHBondContact O-N 2.6Å; I43-C47 WeakPolarHBondContact O-CB 3.41Å; I43-C47 PolarHBondContact O-N 2.86Å; I43-C47 PolarHBondContact O-SG 2.58Å
44	T	81.6	Confident	74.2	Confident	9 Å²	9	65.7 Å²	65.7	6%	0.055	34%	0.341	C	S	.	.	H	α-helix	trans	-61	-42.3	175.9	-58.3	0	0	0	0	110.5	C16 G20 C40 A41 R42 C48	C16-T44 PolarHBondContact O-OG1 2.87Å; G20-T44 WeakPolarHBondContact CA-O 3.48Å; C40-T44 VanDerWaalsContact O-CB 3.26Å; C40-T44 WeakPolarHBondContact O-CB 3.37Å; C40-T44 PolarHBondContact O-N 2.99Å; C40-T44 PolarHBondContact O-OG1 3.28Å; A41-T44 WeakPolarHBondContact O-CB 3.47Å; A41-T44 PolarHBondContact O-N 2.73Å; R42-T44 VanDerWaalsContact C-N 3.34Å; R42-T44 PolarHBondContact O-N 3.25Å; T44-C48 VanDerWaalsContact O-CB 3.28Å; T44-C48 WeakPolarHBondContact O-CB 3.1Å; T44-C48 PolarHBondContact O-N 2.87Å
45	T	79	Confident	75.2	Confident	38 Å²	38	58.1 Å²	58.1	23%	0.233	31%	0.308	C	S	.	.	H	α-helix	trans	-63.4	-50.7	176.8	-61.3	0	0	0	0	112.9	F32 A41 R42 I43 C47 C48 L49	F32-T45 VanDerWaalsContact CD1-OG1 3.26Å; F32-T45 WeakPolarHBondContact CD1-OG1 3.39Å; F32-T45 HydrophobicContact CD2-CG2 4.25Å; F32-T45 HydrophobicContact CE1-CG2 4.13Å; F32-T45 WeakPolarHBondContact CE1-OG1 3.27Å; F32-T45 HydrophobicContact CE2-CG2 3.46Å; F32-T45 VanDerWaalsContact CE2-CG2 3.46Å; F32-T45 WeakPolarHBondContact CE2-OG1 3.42Å; F32-T45 VanDerWaalsContact CZ-CB 3.48Å; F32-T45 HydrophobicContact CZ-CG2 3.41Å; F32-T45 VanDerWaalsContact CZ-CG2 3.41Å; F32-T45 VanDerWaalsContact CZ-OG1 3.28Å; F32-T45 WeakPolarHBondContact CZ-OG1 3.44Å; A41-T45 PolarHBondContact O-N 3.48Å; A41-T45 PolarHBondContact O-OG1 3.19Å; A41-T45 VanDerWaalsContact O-OG1 3.07Å; R42-T45 PolarHBondContact O-N 3.21Å; I43-T45 VanDerWaalsContact C-N 3.31Å; I43-T45 PolarHBondContact O-N 3.5Å; T45-C47 VanDerWaalsContact C-N 3.35Å; T45-C47 PolarHBondContact O-N 2.82Å; T45-C48 PolarHBondContact O-N 2.05Å; T45-L49 HydrophobicContact CG2-CD1 4Å; T45-L49 WeakPolarHBondContact O-CG 3.37Å; T45-L49 PolarHBondContact O-N 2.99Å
46	V	80.2	Confident	75.9	Confident	87 Å²	87	56.9 Å²	56.9	53%	0.527	30%	0.299	S	S	.	.	H	α-helix	trans	-57.7	-49.9	177.1	174.2	0	0	0	0	110	R42 I43 C48 L49 T50	R42-V46 WeakPolarHBondContact O-CG2 3.06Å; R42-V46 PolarHBondContact O-N 2.79Å; I43-V46 PolarHBondContact O-N 2.6Å; V46-C48 VanDerWaalsContact C-N 3.35Å; V46-C48 PolarHBondContact O-N 2.96Å; V46-L49 PolarHBondContact O-N 3.26Å; V46-T50 PolarHBondContact O-N 3.14Å; V46-T50 PolarHBondContact O-OG1 3.21Å
47	C	83.4	Confident	76.7	Confident	16 Å²	16	48.6 Å²	48.6	11%	0.108	26%	0.255	C	S	.	.	H	α-helix	trans	-69.9	-26.6	-178.2	-69.2	0	0	0	0	114.5	C17 I43 T45 A51	C17-C47 WeakPolarHBondContact CA-SG 3.21Å; C17-C47 HydrophobicContact CB-CB 3.87Å; C17-C47 WeakPolarHBondContact CB-SG 3.48Å; C17-C47 WeakPolarHBondContact O-CB 3.48Å; C17-C47 WeakPolarHBondContact SG-CB 3.5Å; C17-C47 CovalentContact SG-SG 2.03Å; C17-C47 PolarHBondContact SG-SG 2.9Å; I43-C47 WeakPolarHBondContact O-CB 3.41Å; I43-C47 PolarHBondContact O-N 2.86Å; I43-C47 PolarHBondContact O-SG 2.58Å; T45-C47 VanDerWaalsContact C-N 3.35Å; T45-C47 PolarHBondContact O-N 2.82Å; C47-A51 PolarHBondContact O-N 2.78Å
48	C	84.2	Confident	76.9	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-68.5	-47.6	170.7	-171.7	0	0	0	0	111	C30 F32 T44 T45 V46 A51 L52	C30-C48 WeakPolarHBondContact CA-SG 3.35Å; C30-C48 HydrophobicContact CB-CB 4.04Å; C30-C48 WeakPolarHBondContact CB-SG 3.39Å; C30-C48 WeakPolarHBondContact SG-CB 3.11Å; C30-C48 PolarHBondContact SG-O 3.41Å; C30-C48 VanDerWaalsContact SG-O 3.33Å; C30-C48 CovalentContact SG-SG 2.05Å; C30-C48 PolarHBondContact SG-SG 3.24Å; F32-C48 HydrophobicContact CE1-CB 4.07Å; F32-C48 HydrophobicContact CZ-CB 4.1Å; T44-C48 VanDerWaalsContact O-CB 3.28Å; T44-C48 WeakPolarHBondContact O-CB 3.1Å; T44-C48 PolarHBondContact O-N 2.87Å; T45-C48 PolarHBondContact O-N 2.05Å; V46-C48 VanDerWaalsContact C-N 3.35Å; V46-C48 PolarHBondContact O-N 2.96Å; C48-A51 WeakPolarHBondContact O-CB 3.38Å; C48-A51 PolarHBondContact O-N 2.95Å; C48-L52 PolarHBondContact O-N 3.04Å
49	L	79	Confident	76.9	Confident	60 Å²	60	49.2 Å²	49.2	31%	0.314	26%	0.255	S	S	.	.	H	α-helix	trans	-63.8	-41.6	177.4	-71	172.1	0	0	0	111.7	C30 T45 V46 A51 L52 Y53	C30-L49 HydrophobicContact CB-CD2 4.44Å; T45-L49 HydrophobicContact CG2-CD1 4Å; T45-L49 WeakPolarHBondContact O-CG 3.37Å; T45-L49 PolarHBondContact O-N 2.99Å; V46-L49 PolarHBondContact O-N 3.26Å; L49-A51 VanDerWaalsContact C-N 3.27Å; L49-A51 PolarHBondContact O-N 3.09Å; L49-L52 HydrophobicContact CD2-CD2 4.25Å; L49-L52 WeakPolarHBondContact O-CB 3.41Å; L49-L52 PolarHBondContact O-N 2.82Å; L49-L52 VanDerWaalsContact O-N 3.15Å; L49-Y53 HydrophobicContact CB-CD2 4.4Å; L49-Y53 HydrophobicContact CB-CE2 4.12Å; L49-Y53 WeakPolarHBondContact O-CD2 3.44Å; L49-Y53 PolarHBondContact O-N 2.67Å
50	T	77.5	Confident	76.3	Confident	30 Å²	30	48.4 Å²	48.4	18%	0.184	25%	0.251	C	S	.	.	H	α-helix	trans	-56.7	-43	173.2	-53.5	0	0	0	0	110.9	V46 Y53 E54	V46-T50 PolarHBondContact O-N 3.14Å; V46-T50 PolarHBondContact O-OG1 3.21Å; T50-Y53 PolarHBondContact O-N 3.42Å; T50-E54 HydrophobicContact CG2-CG 4.47Å; T50-E54 WeakPolarHBondContact O-CB 3.29Å; T50-E54 VanDerWaalsContact O-CG 3.29Å; T50-E54 WeakPolarHBondContact O-CG 3.46Å; T50-E54 PolarHBondContact O-N 2.65Å
51	A	80.6	Confident	75.2	Confident	6 Å²	6	56.2 Å²	56.2	5%	0.05	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-42.4	176.2	0	0	0	0	0	112.4	R21 Y24 C47 C48 L49 E54 T55	R21-A51 HydrophobicContact CG-CB 4.11Å; Y24-A51 HydrophobicContact CD1-CB 3.56Å; Y24-A51 HydrophobicContact CE1-CB 4.39Å; Y24-A51 HydrophobicContact CG-CB 3.83Å; C47-A51 PolarHBondContact O-N 2.78Å; C48-A51 WeakPolarHBondContact O-CB 3.38Å; C48-A51 PolarHBondContact O-N 2.95Å; L49-A51 VanDerWaalsContact C-N 3.27Å; L49-A51 PolarHBondContact O-N 3.09Å; A51-E54 PolarHBondContact O-N 3.35Å; A51-T55 WeakPolarHBondContact O-CB 3.46Å; A51-T55 PolarHBondContact O-N 2.84Å; A51-T55 PolarHBondContact O-OG1 3.35Å
52	L	79.9	Confident	74.1	Confident	45 Å²	45	57.7 Å²	57.7	24%	0.236	29%	0.292	C	S	.	.	H	α-helix	trans	-57.2	-50.1	173.9	172.3	70.7	0	0	0	111.5	Y24 C48 L49 T55 K56	Y24-L52 HydrophobicContact CD2-CB 3.91Å; Y24-L52 HydrophobicContact CD2-CD1 4.42Å; Y24-L52 HydrophobicContact CE2-CB 3.62Å; Y24-L52 HydrophobicContact CE2-CD1 3.47Å; Y24-L52 VanDerWaalsContact CE2-CD1 3.47Å; Y24-L52 HydrophobicContact CE2-CG 4.14Å; C48-L52 PolarHBondContact O-N 3.04Å; L49-L52 HydrophobicContact CD2-CD2 4.25Å; L49-L52 WeakPolarHBondContact O-CB 3.41Å; L49-L52 PolarHBondContact O-N 2.82Å; L49-L52 VanDerWaalsContact O-N 3.15Å; L52-T55 PolarHBondContact O-N 2.8Å; L52-K56 HydrophobicContact CD1-CG 4.49Å; L52-K56 WeakPolarHBondContact O-CG 3.46Å; L52-K56 PolarHBondContact O-N 2.73Å
53	Y	71.6	Confident	73.1	Confident	116 Å²	116	53.3 Å²	53.3	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-68.8	-35.2	-179.2	-67.8	-57.4	0	0	0	113.1	L49 T50 T55 K56 C57	L49-Y53 HydrophobicContact CB-CD2 4.4Å; L49-Y53 HydrophobicContact CB-CE2 4.12Å; L49-Y53 WeakPolarHBondContact O-CD2 3.44Å; L49-Y53 PolarHBondContact O-N 2.67Å; T50-Y53 PolarHBondContact O-N 3.42Å; Y53-T55 VanDerWaalsContact C-N 3.33Å; Y53-K56 PolarHBondContact O-N 3.11Å; Y53-C57 VanDerWaalsContact O-CB 3.28Å; Y53-C57 WeakPolarHBondContact O-CB 3.35Å; Y53-C57 PolarHBondContact O-N 2.83Å
54	E	75.3	Confident	71.8	Confident	23 Å²	23	52.7 Å²	52.7	11%	0.107	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-41.6	171.3	-77.9	174.8	150.3	0	0	111.4	R21 T50 A51 C57 D58 V107	R21-E54 IonicContact CZ-OE2 2.73Å; R21-E54 IonicContact NE-OE2 3.04Å; R21-E54 IonicContact NH2-OE1 2.75Å; R21-E54 PolarHBondContact NH2-OE1 2.89Å; R21-E54 IonicContact NH2-OE2 2.6Å; R21-E54 PolarHBondContact NH2-OE2 2.73Å; T50-E54 HydrophobicContact CG2-CG 4.47Å; T50-E54 WeakPolarHBondContact O-CB 3.29Å; T50-E54 VanDerWaalsContact O-CG 3.29Å; T50-E54 WeakPolarHBondContact O-CG 3.46Å; T50-E54 PolarHBondContact O-N 2.65Å; A51-E54 PolarHBondContact O-N 3.35Å; E54-C57 WeakPolarHBondContact O-CB 3.44Å; E54-C57 PolarHBondContact O-N 2.88Å; E54-D58 PolarHBondContact O-N 3.22Å; E54-V107 WeakPolarHBondContact OE1-CG1 3.25Å
55	T	76.5	Confident	70.5	Confident	33 Å²	33	56.6 Å²	56.6	20%	0.202	31%	0.306	C	S	.	.	H	α-helix	trans	-69.7	-40.5	179.7	-43.3	0	0	0	0	111.1	Y24 A51 L52 Y53 C57 D58 E59	Y24-T55 HydrophobicContact CE1-CG2 4.23Å; Y24-T55 WeakPolarHBondContact CE1-OG1 3.45Å; Y24-T55 VanDerWaalsContact OH-CB 3.31Å; Y24-T55 WeakPolarHBondContact OH-CB 3.36Å; Y24-T55 PolarHBondContact OH-OG1 3.49Å; A51-T55 WeakPolarHBondContact O-CB 3.46Å; A51-T55 PolarHBondContact O-N 2.84Å; A51-T55 PolarHBondContact O-OG1 3.35Å; L52-T55 PolarHBondContact O-N 2.8Å; Y53-T55 VanDerWaalsContact C-N 3.33Å; T55-C57 VanDerWaalsContact C-N 3.35Å; T55-C57 PolarHBondContact O-N 3.39Å; T55-D58 PolarHBondContact O-N 3.34Å; T55-E59 WeakPolarHBondContact O-CG 3.45Å; T55-E59 PolarHBondContact O-N 2.99Å; T55-E59 VanDerWaalsContact O-N 3.1Å
56	K	69.7	Low	69.1	Low	63 Å²	63	57.4 Å²	57.4	27%	0.274	32%	0.317	S	S	.	.	H	α-helix	trans	-61	-40.5	170.6	-72	-80.1	-173.8	178.7	0	112.1	L52 Y53 D58 E59 H80	L52-K56 HydrophobicContact CD1-CG 4.49Å; L52-K56 WeakPolarHBondContact O-CG 3.46Å; L52-K56 PolarHBondContact O-N 2.73Å; Y53-K56 PolarHBondContact O-N 3.11Å; K56-D58 VanDerWaalsContact C-N 3.28Å; K56-D58 PolarHBondContact O-N 2.77Å; K56-E59 PolarHBondContact O-N 2.67Å; K56-E59 VanDerWaalsContact O-N 3.13Å; K56-H80 PolarHBondContact NZ-ND1 3.44Å
57	C	72.8	Confident	67.8	Low	1 Å²	1	59.2 Å²	59.2	1%	0.007	32%	0.32	C	S	.	.	H	α-helix	trans	-61.2	-35.7	173.8	176.9	0	0	0	0	112.3	Y53 E54 T55 E59 C84 R110	Y53-C57 VanDerWaalsContact O-CB 3.28Å; Y53-C57 WeakPolarHBondContact O-CB 3.35Å; Y53-C57 PolarHBondContact O-N 2.83Å; E54-C57 WeakPolarHBondContact O-CB 3.44Å; E54-C57 PolarHBondContact O-N 2.88Å; T55-C57 VanDerWaalsContact C-N 3.35Å; T55-C57 PolarHBondContact O-N 3.39Å; C57-E59 VanDerWaalsContact C-N 3.35Å; C57-C84 VanDerWaalsContact CA-SG 3.56Å; C57-C84 HydrophobicContact CB-CB 4.03Å; C57-C84 WeakPolarHBondContact CB-SG 3.19Å; C57-C84 WeakPolarHBondContact SG-CB 3.33Å; C57-C84 CovalentContact SG-SG 2.03Å; C57-C84 PolarHBondContact SG-SG 2.78Å; C57-R110 WeakPolarHBondContact O-CD 3.32Å; C57-R110 PolarHBondContact O-NH1 3.48Å
58	D	75.2	Confident	66.4	Low	82 Å²	82	63.9 Å²	63.9	44%	0.439	34%	0.34	S	S	.	.	H	α-helix	trans	-75.7	-19.2	174.8	-72.6	-18.2	0	0	0	113.9	E54 T55 K56 S108 R110	E54-D58 PolarHBondContact O-N 3.22Å; T55-D58 PolarHBondContact O-N 3.34Å; K56-D58 VanDerWaalsContact C-N 3.28Å; K56-D58 PolarHBondContact O-N 2.77Å; D58-S108 WeakPolarHBondContact OD1-CB 3.44Å; D58-S108 PolarHBondContact OD1-OG 3.36Å; D58-S108 WeakPolarHBondContact OD2-CB 3.36Å; D58-S108 PolarHBondContact OD2-OG 2.88Å; D58-R110 PolarHBondContact O-NH1 2.86Å
59	E	70.7	Confident	65	Low	124 Å²	124	68.1 Å²	68.1	58%	0.579	36%	0.363	S	S	*	.	H	α-helix	trans	-82.1	-25.8	-178.6	-75.6	171.3	-174	0	0	114.8	T55 K56 C57	T55-E59 WeakPolarHBondContact O-CG 3.45Å; T55-E59 PolarHBondContact O-N 2.99Å; T55-E59 VanDerWaalsContact O-N 3.1Å; K56-E59 PolarHBondContact O-N 2.67Å; K56-E59 VanDerWaalsContact O-N 3.13Å; C57-E59 VanDerWaalsContact C-N 3.35Å
60	G	57.7	Low	64.1	Low	34 Å²	34	65.9 Å²	65.9	35%	0.351	35%	0.352	S	S	.	.			trans	92.9	47.1	150.3	0	0	0	0	0	122.2	E83 R110	G60-E83 VanDerWaalsContact C-OE2 3.24Å; G60-E83 WeakPolarHBondContact CA-OE2 3.2Å; G60-E83 PolarHBondContact N-OE1 3.03Å; G60-E83 PolarHBondContact N-OE2 2.87Å; G60-R110 VanDerWaalsContact N-NH1 3.13Å
61	K	53.9	Low	62.9	Low	184 Å²	184	70 Å²	70	80%	0.8	37%	0.373	S	S	*	.	S	Bend	trans	-117.3	3.3	172.2	-54.5	-175.2	174.1	-178.6	0	117.7	E83	K61-E83 WeakPolarHBondContact CA-OE1 3.42Å; K61-E83 WeakPolarHBondContact CA-OE2 3.4Å; K61-E83 WeakPolarHBondContact CB-OE1 3.31Å; K61-E83 PolarHBondContact N-OE1 2.98Å; K61-E83 PolarHBondContact N-OE2 2.75Å
62	S	51.7	Low	61.4	Low	60 Å²	60	72.4 Å²	72.4	42%	0.42	40%	0.398	S	S	.	.			trans	-168.8	107.7	165.9	-94.1	0	0	0	0	114.3	E83	S62-E83 VanDerWaalsContact N-CD 3.29Å; S62-E83 PolarHBondContact N-OE2 2.81Å; S62-E83 CarbonylContact O-C 3.58Å; S62-E83 WeakPolarHBondContact O-CA 3.26Å; S62-E83 WeakPolarHBondContact O-CB 3.49Å; S62-E83 PolarHBondContact O-N 2.75Å
63	V	54.6	Low	59.4	Low	88 Å²	88	77 Å²	77	53%	0.533	42%	0.422	S	S	.	.			trans	-86.6	122.9	170.5	-177.7	0	0	0	0	108.8	V65	V63-V65 PolarHBondContact O-N 2.97Å; V63-V65 VanDerWaalsContact O-N 3.08Å
64	A	53.3	Low	58	Low	8 Å²	8	79.1 Å²	79.1	7%	0.066	44%	0.441	C	S	.	.			trans	-59.4	112.5	168.2	0	0	0	0	0	109.2	C88	A64-C88 HydrophobicContact CB-CB 4.02Å
65	V	53.5	Low	56.1	Low	90 Å²	90	80.3 Å²	80.3	55%	0.545	46%	0.455	S	S	.	.			trans	-84.5	152.2	175.7	-125.6	0	0	0	0	109.1	V63 E67 E68	V63-V65 PolarHBondContact O-N 2.97Å; V63-V65 VanDerWaalsContact O-N 3.08Å; V65-E67 PolarHBondContact O-N 2.86Å; V65-E68 PolarHBondContact O-N 2.81Å
66	A	49.4	Very low	54.4	Low	56 Å²	56	82.7 Å²	82.7	46%	0.463	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	136.9	169.9	0	0	0	0	0	109.3
67	E	52.2	Low	53.4	Low	124 Å²	124	83 Å²	83	58%	0.579	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	-14.1	-176.9	-51.4	-179.5	174.9	0	0	117.8	V65	V65-E67 PolarHBondContact O-N 2.86Å
68	E	55.5	Low	52.3	Low	114 Å²	114	91.4 Å²	91.4	53%	0.533	52%	0.524	S	S	.	.			trans	-80.5	139	171.2	-77.8	-168.9	165.9	0	0	112.7	V65 R92	V65-E68 PolarHBondContact O-N 2.81Å; E68-R92 PolarHBondContact O-NH1 2.9Å
69	D	55.4	Low	51.2	Low	89 Å²	89	94.9 Å²	94.9	48%	0.476	54%	0.537	S	S	.	.			trans	-83.9	126.6	171.3	-172.3	-6.2	0	0	0	109.6	N71 K82	D69-N71 HydrophobicContact CB-CB 4.48Å; D69-N71 PolarHBondContact O-N 2.77Å; D69-N71 VanDerWaalsContact O-N 3.11Å; D69-N71 WeakPolarHBondContact OD1-CB 3.42Å; D69-N71 PolarHBondContact OD1-N 2.75Å; D69-N71 PolarHBondContact OD1-ND2 2.83Å; D69-N71 PolarHBondContact OD1-OD1 3.46Å; D69-N71 VanDerWaalsContact OD2-CB 3.29Å; D69-N71 WeakPolarHBondContact OD2-CB 3.46Å; D69-N71 PolarHBondContact OD2-ND2 2.92Å; D69-K82 PolarHBondContact O-NZ 2.87Å
70	C	59.1	Low	50.2	Low	14 Å²	14	95.2 Å²	95.2	10%	0.095	54%	0.538	C	S	.	.			trans	-66.8	-3.9	172.4	-74	0	0	0	0	112.5	G72 C85 L89	C70-G72 PolarHBondContact O-N 2.81Å; C70-C85 VanDerWaalsContact CA-SG 3.53Å; C70-C85 HydrophobicContact CB-CB 4.3Å; C70-C85 WeakPolarHBondContact CB-SG 3.43Å; C70-C85 WeakPolarHBondContact SG-CB 3.33Å; C70-C85 CovalentContact SG-SG 2.04Å; C70-C85 PolarHBondContact SG-SG 2.8Å; C70-L89 HydrophobicContact CB-CD1 3.86Å; C70-L89 HydrophobicContact CB-CD2 4.03Å; C70-L89 HydrophobicContact CB-CG 4.04Å
71	N	53.2	Low	49.8	Very low	117 Å²	117	97.6 Å²	97.6	63%	0.626	55%	0.547	S	S	*	.			trans	-66.6	89.6	179.8	-65.5	-20	0	0	0	112.1	D69	D69-N71 HydrophobicContact CB-CB 4.48Å; D69-N71 PolarHBondContact O-N 2.77Å; D69-N71 VanDerWaalsContact O-N 3.11Å; D69-N71 WeakPolarHBondContact OD1-CB 3.42Å; D69-N71 PolarHBondContact OD1-N 2.75Å; D69-N71 PolarHBondContact OD1-ND2 2.83Å; D69-N71 PolarHBondContact OD1-OD1 3.46Å; D69-N71 VanDerWaalsContact OD2-CB 3.29Å; D69-N71 WeakPolarHBondContact OD2-CB 3.46Å; D69-N71 PolarHBondContact OD2-ND2 2.92Å
72	G	49.2	Very low	49.8	Very low	55 Å²	55	93.1 Å²	93.1	57%	0.567	53%	0.527	S	S	*	.			trans	-153	50.7	163	0	0	0	0	0	107	C70	C70-G72 PolarHBondContact O-N 2.81Å
73	L	37.5	Very low	50.2	Low	142 Å²	142	91.1 Å²	91.1	74%	0.743	51%	0.511	S	S	*	.			trans	-85.8	143.8	173.9	-71.3	158.8	0	0	0	107.8
74	D	40.8	Very low	51	Low	160 Å²	160	87.2 Å²	87.2	86%	0.856	49%	0.488	S	S	*	.			trans	86.9	24.8	168.6	-52	-24.4	0	0	0	120.3
75	A	36.9	Very low	52	Low	48 Å²	48	87.6 Å²	87.6	40%	0.397	49%	0.49	S	S	.	.			trans	-104.7	116.5	162.4	0	0	0	0	0	112	G77 R78	A75-G77 PolarHBondContact O-N 3.48Å; A75-R78 HydrophobicContact CB-CB 4.38Å; A75-R78 HydrophobicContact CB-CG 4.27Å; A75-R78 PolarHBondContact O-N 3.45Å
76	P	40.1	Very low	53	Low	83 Å²	83	87.3 Å²	87.3	54%	0.539	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	129.6	168.8	-19.6	30	0	0	0	110.3
77	G	48	Very low	54.4	Low	70 Å²	70	85 Å²	85	72%	0.722	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.8	-0.2	179.7	0	0	0	0	0	116.5	A75	A75-G77 PolarHBondContact O-N 3.48Å
78	R	50.6	Low	55.8	Low	178 Å²	178	79.2 Å²	79.2	67%	0.672	44%	0.436	S	S	*	.			trans	-100.6	20.4	172	-75.2	-168.6	176.7	175.2	0.2	114.5	A75 H80 T81	A75-R78 HydrophobicContact CB-CB 4.38Å; A75-R78 HydrophobicContact CB-CG 4.27Å; A75-R78 PolarHBondContact O-N 3.45Å; R78-H80 PolarHBondContact O-N 3.35Å; R78-T81 PolarHBondContact O-N 3.34Å; R78-T81 PolarHBondContact O-OG1 3.17Å
79	E	51.6	Low	56.9	Low	154 Å²	154	77.3 Å²	77.3	72%	0.72	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-2.7	-177.4	-61.4	176.1	-173.7	0	0	115.2
80	H	49.3	Very low	58	Low	131 Å²	131	75.9 Å²	75.9	61%	0.606	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	4.4	-173.2	-64.2	-29.2	0	0	0	114.7	K56 R78	K56-H80 PolarHBondContact NZ-ND1 3.44Å; R78-H80 PolarHBondContact O-N 3.35Å
81	T	50.4	Low	59.2	Low	85 Å²	85	75.2 Å²	75.2	52%	0.521	42%	0.417	S	S	.	.	S	Bend	trans	-109.5	6.8	-160.7	55.3	0	0	0	0	117.8	R78	R78-T81 PolarHBondContact O-N 3.34Å; R78-T81 PolarHBondContact O-OG1 3.17Å
82	K	54.4	Low	60.6	Low	90 Å²	90	73.8 Å²	73.8	39%	0.391	40%	0.402	S	S	.	.			trans	-143.2	87.8	170.2	-66.9	-168.6	178.6	178.6	0	112.2	D69 C85	D69-K82 PolarHBondContact O-NZ 2.87Å; K82-C85 HydrophobicContact CB-CB 4.01Å
83	E	58.9	Low	62	Low	18 Å²	18	74.6 Å²	74.6	8%	0.084	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	148.8	175.9	-46.1	176.9	166.6	0	0	111.3	G60 K61 S62 C85	G60-E83 VanDerWaalsContact C-OE2 3.24Å; G60-E83 WeakPolarHBondContact CA-OE2 3.2Å; G60-E83 PolarHBondContact N-OE1 3.03Å; G60-E83 PolarHBondContact N-OE2 2.87Å; K61-E83 WeakPolarHBondContact CA-OE1 3.42Å; K61-E83 WeakPolarHBondContact CA-OE2 3.4Å; K61-E83 WeakPolarHBondContact CB-OE1 3.31Å; K61-E83 PolarHBondContact N-OE1 2.98Å; K61-E83 PolarHBondContact N-OE2 2.75Å; S62-E83 VanDerWaalsContact N-CD 3.29Å; S62-E83 PolarHBondContact N-OE2 2.81Å; S62-E83 CarbonylContact O-C 3.58Å; S62-E83 WeakPolarHBondContact O-CA 3.26Å; S62-E83 WeakPolarHBondContact O-CB 3.49Å; S62-E83 PolarHBondContact O-N 2.75Å; E83-C85 PolarHBondContact O-N 2.84Å
84	C	71.8	Confident	64.2	Low	6 Å²	6	68.8 Å²	68.8	4%	0.041	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	2.1	-178	-44.8	0	0	0	0	117.7	C57 H86 C87 C88 A114	C57-C84 VanDerWaalsContact CA-SG 3.56Å; C57-C84 HydrophobicContact CB-CB 4.03Å; C57-C84 WeakPolarHBondContact CB-SG 3.19Å; C57-C84 WeakPolarHBondContact SG-CB 3.33Å; C57-C84 CovalentContact SG-SG 2.03Å; C57-C84 PolarHBondContact SG-SG 2.78Å; C84-H86 PolarHBondContact O-N 2.79Å; C84-C87 WeakPolarHBondContact O-CB 3.46Å; C84-C87 PolarHBondContact O-N 3.46Å; C84-C88 PolarHBondContact O-N 2.82Å; C84-C88 VanDerWaalsContact O-N 3.14Å; C84-A114 HydrophobicContact CB-CB 3.76Å
85	C	74.5	Confident	66.1	Low	16 Å²	16	65.6 Å²	65.6	11%	0.108	34%	0.344	C	S	.	.	H	α-helix	trans	-55.2	-40.5	178.7	-129.7	0	0	0	0	112.1	C70 K82 E83 C87 C88 L89	C70-C85 VanDerWaalsContact CA-SG 3.53Å; C70-C85 HydrophobicContact CB-CB 4.3Å; C70-C85 WeakPolarHBondContact CB-SG 3.43Å; C70-C85 WeakPolarHBondContact SG-CB 3.33Å; C70-C85 CovalentContact SG-SG 2.04Å; C70-C85 PolarHBondContact SG-SG 2.8Å; K82-C85 HydrophobicContact CB-CB 4.01Å; E83-C85 PolarHBondContact O-N 2.84Å; C85-C87 VanDerWaalsContact C-N 3.28Å; C85-C87 PolarHBondContact O-N 3.29Å; C85-C88 WeakPolarHBondContact O-CB 3.34Å; C85-C88 PolarHBondContact O-N 2.89Å; C85-L89 WeakPolarHBondContact O-CG 3.49Å; C85-L89 PolarHBondContact O-N 3.3Å
86	H	74.1	Confident	68.1	Low	83 Å²	83	72 Å²	72	38%	0.384	36%	0.363	S	S	.	.	H	α-helix	trans	-60	-38.4	178	-170.1	46.2	0	0	0	112.5	C84 L90	C84-H86 PolarHBondContact O-N 2.79Å; H86-L90 PolarHBondContact O-N 3.36Å; H86-L90 VanDerWaalsContact O-N 3.07Å
87	C	79.4	Confident	70	Confident	9 Å²	9	74 Å²	74	6%	0.061	36%	0.36	C	S	.	.	H	α-helix	trans	-69.3	-39.4	176.9	-55.2	0	0	0	0	111.9	C84 C85 L90 G91 C111 A114 F115	C84-C87 WeakPolarHBondContact O-CB 3.46Å; C84-C87 PolarHBondContact O-N 3.46Å; C85-C87 VanDerWaalsContact C-N 3.28Å; C85-C87 PolarHBondContact O-N 3.29Å; C87-L90 PolarHBondContact O-N 3.12Å; C87-G91 PolarHBondContact O-N 3.13Å; C87-G91 VanDerWaalsContact O-N 3.09Å; C87-C111 HydrophobicContact CB-CB 3.99Å; C87-C111 WeakPolarHBondContact CB-O 3.27Å; C87-C111 WeakPolarHBondContact CB-SG 3.22Å; C87-C111 VanDerWaalsContact SG-CA 3.54Å; C87-C111 WeakPolarHBondContact SG-CB 3.42Å; C87-C111 CovalentContact SG-SG 2.02Å; C87-C111 PolarHBondContact SG-SG 3.33Å; C87-A114 HydrophobicContact CB-CB 4.08Å; C87-F115 WeakPolarHBondContact O-CA 3.36Å
88	C	80.4	Confident	71.4	Confident	2 Å²	2	78.1 Å²	78.1	1%	0.014	37%	0.366	C	S	.	.	H	α-helix	trans	-64.2	-44.5	174.7	176.2	0	0	0	0	112.1	A64 C84 C85 L90 G91 R92 C118	A64-C88 HydrophobicContact CB-CB 4.02Å; C84-C88 PolarHBondContact O-N 2.82Å; C84-C88 VanDerWaalsContact O-N 3.14Å; C85-C88 WeakPolarHBondContact O-CB 3.34Å; C85-C88 PolarHBondContact O-N 2.89Å; C88-L90 VanDerWaalsContact C-N 3.3Å; C88-L90 PolarHBondContact O-N 3.16Å; C88-G91 WeakPolarHBondContact O-CA 3.49Å; C88-G91 PolarHBondContact O-N 3.4Å; C88-G91 VanDerWaalsContact O-N 3.12Å; C88-R92 PolarHBondContact O-N 2.88Å; C88-C118 VanDerWaalsContact CA-SG 3.58Å; C88-C118 HydrophobicContact CB-CB 3.82Å; C88-C118 WeakPolarHBondContact CB-SG 3.22Å; C88-C118 VanDerWaalsContact O-CB 3.25Å; C88-C118 WeakPolarHBondContact O-CB 3.27Å; C88-C118 WeakPolarHBondContact SG-CB 3.25Å; C88-C118 CovalentContact SG-SG 2.02Å; C88-C118 PolarHBondContact SG-SG 2.81Å
89	L	78.9	Confident	72.7	Confident	74 Å²	74	75 Å²	75	39%	0.387	36%	0.359	S	S	.	.	H	α-helix	trans	-60	-40	174.9	-74.2	170.7	0	0	0	112.1	C70 C85 G91 R92 E93	C70-L89 HydrophobicContact CB-CD1 3.86Å; C70-L89 HydrophobicContact CB-CD2 4.03Å; C70-L89 HydrophobicContact CB-CG 4.04Å; C85-L89 WeakPolarHBondContact O-CG 3.49Å; C85-L89 PolarHBondContact O-N 3.3Å; L89-G91 VanDerWaalsContact C-N 3.32Å; L89-G91 PolarHBondContact O-N 2.73Å; L89-R92 PolarHBondContact O-N 2.92Å; L89-E93 PolarHBondContact O-N 3.38Å
90	L	79.7	Confident	74.1	Confident	59 Å²	59	71.1 Å²	71.1	31%	0.309	35%	0.353	S	S	.	.	H	α-helix	trans	-63.9	-37.7	175.4	-151.2	83.5	0	0	0	111.8	H86 C87 C88 E93 T94 P104 F115	H86-L90 PolarHBondContact O-N 3.36Å; H86-L90 VanDerWaalsContact O-N 3.07Å; C87-L90 PolarHBondContact O-N 3.12Å; C88-L90 VanDerWaalsContact C-N 3.3Å; C88-L90 PolarHBondContact O-N 3.16Å; L90-E93 PolarHBondContact O-N 3.46Å; L90-T94 PolarHBondContact O-N 3.26Å; L90-T94 PolarHBondContact O-OG1 3.21Å; L90-P104 HydrophobicContact CD2-CG 4.07Å; L90-F115 HydrophobicContact CB-CD2 3.99Å; L90-F115 HydrophobicContact CB-CE2 4.04Å; L90-F115 HydrophobicContact CD2-CD2 4.1Å; L90-F115 HydrophobicContact CD2-CE2 3.9Å; L90-F115 HydrophobicContact CG-CD2 4.4Å; L90-F115 HydrophobicContact CG-CE2 4.07Å
91	G	84	Confident	75.7	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63	-44.5	171.6	0	0	0	0	0	112.6	C87 C88 L89 T94 L95 C119	C87-G91 PolarHBondContact O-N 3.13Å; C87-G91 VanDerWaalsContact O-N 3.09Å; C88-G91 WeakPolarHBondContact O-CA 3.49Å; C88-G91 PolarHBondContact O-N 3.4Å; C88-G91 VanDerWaalsContact O-N 3.12Å; L89-G91 VanDerWaalsContact C-N 3.32Å; L89-G91 PolarHBondContact O-N 2.73Å; G91-T94 WeakPolarHBondContact CA-OG1 3.39Å; G91-T94 PolarHBondContact O-N 2.98Å; G91-T94 PolarHBondContact O-OG1 2.86Å; G91-L95 PolarHBondContact O-N 2.97Å; G91-L95 VanDerWaalsContact O-N 3.08Å; G91-C119 WeakPolarHBondContact O-CB 3.36Å; G91-C119 PolarHBondContact O-SG 3.05Å; G91-C119 VanDerWaalsContact O-SG 3.37Å
92	R	82.5	Confident	77.2	Confident	86 Å²	86	68.9 Å²	68.9	33%	0.325	35%	0.345	S	S	.	.	H	α-helix	trans	-65	-38.9	175	-79.2	179.6	157.2	163.6	-4.2	112.9	E68 C88 L89 L95 K96 C118	E68-R92 PolarHBondContact O-NH1 2.9Å; C88-R92 PolarHBondContact O-N 2.88Å; L89-R92 PolarHBondContact O-N 2.92Å; R92-L95 PolarHBondContact O-N 3.44Å; R92-K96 WeakPolarHBondContact O-CG 3.2Å; R92-K96 PolarHBondContact O-N 3.07Å; R92-C118 HydrophobicContact CG-CB 4.24Å; R92-C118 WeakPolarHBondContact CG-O 3.35Å
93	E	79	Confident	78.4	Confident	72 Å²	72	66.4 Å²	66.4	34%	0.336	34%	0.338	S	S	.	.	H	α-helix	trans	-65.8	-39.1	175.8	-83.8	-169.7	-178.8	0	0	112.4	L89 L90 K96 R97	L89-E93 PolarHBondContact O-N 3.38Å; L90-E93 PolarHBondContact O-N 3.46Å; E93-K96 PolarHBondContact O-N 3.28Å; E93-R97 WeakPolarHBondContact O-CG 3.49Å; E93-R97 PolarHBondContact O-N 3.26Å
94	T	83.2	Confident	79.3	Confident	21 Å²	21	68.3 Å²	68.3	13%	0.129	35%	0.352	C	S	.	.	H	α-helix	trans	-67.4	-38.3	176.9	39.9	0	0	0	0	111.7	L90 G91 R97 N98 E99 F115 C119	L90-T94 PolarHBondContact O-N 3.26Å; L90-T94 PolarHBondContact O-OG1 3.21Å; G91-T94 WeakPolarHBondContact CA-OG1 3.39Å; G91-T94 PolarHBondContact O-N 2.98Å; G91-T94 PolarHBondContact O-OG1 2.86Å; T94-R97 PolarHBondContact O-N 2.93Å; T94-N98 PolarHBondContact O-N 3.2Å; T94-E99 PolarHBondContact O-N 3.08Å; T94-E99 VanDerWaalsContact O-N 3.16Å; T94-F115 HydrophobicContact CG2-CE2 4.27Å; T94-F115 HydrophobicContact CG2-CZ 3.91Å; T94-F115 VanDerWaalsContact OG1-CZ 3.24Å; T94-F115 WeakPolarHBondContact OG1-CZ 3.4Å; T94-C119 PolarHBondContact OG1-SG 2.52Å; T94-C119 VanDerWaalsContact OG1-SG 3.35Å
95	L	80.3	Confident	79.4	Confident	92 Å²	92	72.3 Å²	72.3	48%	0.482	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-45.8	169.1	-175.7	64.3	0	0	0	111.9	G91 R92 R97 N98 C119	G91-L95 PolarHBondContact O-N 2.97Å; G91-L95 VanDerWaalsContact O-N 3.08Å; R92-L95 PolarHBondContact O-N 3.44Å; L95-R97 PolarHBondContact O-N 2.98Å; L95-N98 PolarHBondContact O-N 3.4Å; L95-N98 VanDerWaalsContact O-N 3.1Å; L95-C119 WeakPolarHBondContact CD1-O 3.5Å
96	K	79.8	Confident	79.3	Confident	184 Å²	184	78.4 Å²	78.4	80%	0.8	41%	0.407	S	S	*	.	H	α-helix	trans	-61.2	-24.2	175.7	-76.5	-177.9	-179.6	-175.3	0	113.5	R92 E93	R92-K96 WeakPolarHBondContact O-CG 3.2Å; R92-K96 PolarHBondContact O-N 3.07Å; E93-K96 PolarHBondContact O-N 3.28Å
97	R	79.8	Confident	79.3	Confident	123 Å²	123	75.4 Å²	75.4	46%	0.464	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	1	178.3	-70.9	174	-177.5	-117.6	-3.5	113.8	S3 E93 T94 L95 E99	S3-R97 PolarHBondContact OG-NH1 3.14Å; S3-R97 PolarHBondContact OG-NH2 3.23Å; E93-R97 WeakPolarHBondContact O-CG 3.49Å; E93-R97 PolarHBondContact O-N 3.26Å; T94-R97 PolarHBondContact O-N 2.93Å; L95-R97 PolarHBondContact O-N 2.98Å; R97-E99 HydrophobicContact CB-CG 4.08Å; R97-E99 PolarHBondContact O-N 3.4Å
98	N	76.1	Confident	79.1	Confident	158 Å²	158	75.9 Å²	75.9	85%	0.845	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	29.6	-171.8	-77.9	-7.8	0	0	0	113.5	T94 L95	T94-N98 PolarHBondContact O-N 3.2Å; L95-N98 PolarHBondContact O-N 3.4Å; L95-N98 VanDerWaalsContact O-N 3.1Å
99	E	79.2	Confident	79.1	Confident	112 Å²	112	85.6 Å²	85.6	52%	0.523	43%	0.434	S	S	.	.			trans	-90.1	152.3	175.5	-70.1	176.7	-174.3	0	0	110.7	T94 R97 C101	T94-E99 PolarHBondContact O-N 3.08Å; T94-E99 VanDerWaalsContact O-N 3.16Å; R97-E99 HydrophobicContact CB-CG 4.08Å; R97-E99 PolarHBondContact O-N 3.4Å; E99-C101 PolarHBondContact O-N 3.31Å
100	A	80.2	Confident	79.1	Confident	72 Å²	72	86.3 Å²	86.3	60%	0.595	43%	0.431	S	S	*	.			trans	-61.5	135.6	175.5	0	0	0	0	0	110.7	N102	A100-N102 PolarHBondContact O-N 3.05Å
101	C	82.6	Confident	79.2	Confident	43 Å²	43	83.7 Å²	83.7	29%	0.291	42%	0.418	S	S	.	.			trans	-69.8	58	-177.3	-70.6	0	0	0	0	114.4	E99 P103 C119	E99-C101 PolarHBondContact O-N 3.31Å; C101-P103 WeakPolarHBondContact O-CD 3.33Å; C101-C119 WeakPolarHBondContact CA-SG 3.5Å; C101-C119 HydrophobicContact CB-CB 3.7Å; C101-C119 WeakPolarHBondContact CB-SG 3.16Å; C101-C119 WeakPolarHBondContact SG-CB 3.47Å; C101-C119 PolarHBondContact SG-O 3.48Å; C101-C119 CovalentContact SG-SG 2.03Å; C101-C119 PolarHBondContact SG-SG 3.21Å
102	N	82.8	Confident	79.2	Confident	127 Å²	127	87.5 Å²	87.5	68%	0.679	44%	0.435	S	S	*	.			trans	-100.8	109.2	179.2	-69.1	-34.5	0	0	0	109.6	A100	A100-N102 PolarHBondContact O-N 3.05Å
103	P	79.1	Confident	79.1	Confident	38 Å²	38	88.8 Å²	88.8	25%	0.247	45%	0.445	C	S	.	.			trans	-65.6	149.1	178	25.3	-32.5	0	0	0	111.2	C101 V107 K112 F115 V116	C101-P103 WeakPolarHBondContact O-CD 3.33Å; P103-V107 HydrophobicContact CB-CG2 4.25Å; P103-K112 HydrophobicContact CB-CB 4.42Å; P103-K112 HydrophobicContact CB-CG 4.01Å; P103-K112 HydrophobicContact CG-CB 4.22Å; P103-K112 HydrophobicContact CG-CD 4.46Å; P103-K112 HydrophobicContact CG-CG 3.98Å; P103-F115 HydrophobicContact CB-CB 4.18Å; P103-F115 HydrophobicContact CB-CD1 3.65Å; P103-F115 HydrophobicContact CB-CD2 4.46Å; P103-F115 HydrophobicContact CB-CE1 4.15Å; P103-F115 HydrophobicContact CB-CG 3.84Å; P103-F115 HydrophobicContact CG-CD1 4.28Å; P103-V116 HydrophobicContact CG-CG2 4.35Å
104	P	78	Confident	79.1	Confident	58 Å²	58	85.4 Å²	85.4	38%	0.377	43%	0.429	S	S	.	.			trans	-55.8	141.4	176.9	-23.1	31.8	0	0	0	112.5	L90 H106 V107	L90-P104 HydrophobicContact CD2-CG 4.07Å; P104-H106 PolarHBondContact O-N 2.99Å; P104-H106 VanDerWaalsContact O-N 3.09Å; P104-V107 HydrophobicContact CB-CG1 4.14Å; P104-V107 HydrophobicContact CG-CG1 4.31Å; P104-V107 WeakPolarHBondContact O-CG2 3.46Å; P104-V107 PolarHBondContact O-N 2.84Å
105	S	75.1	Confident	79.2	Confident	90 Å²	90	84.6 Å²	84.6	63%	0.629	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-26.3	-175.3	53.4	0	0	0	0	113.9
106	H	71.4	Confident	79.4	Confident	144 Å²	144	83.7 Å²	83.7	67%	0.667	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	13	-173.3	-58.8	-68.2	0	0	0	115.6	R21 P104	R21-H106 PolarHBondContact NH2-O 2.9Å; P104-H106 PolarHBondContact O-N 2.99Å; P104-H106 VanDerWaalsContact O-N 3.09Å
107	V	73.5	Confident	79.2	Confident	20 Å²	20	77.6 Å²	77.6	12%	0.121	40%	0.402	C	S	.	.	S	Bend	trans	-93	155.1	174.5	-64.1	0	0	0	0	111.9	E54 P103 P104 C111 K112	E54-V107 WeakPolarHBondContact OE1-CG1 3.25Å; P103-V107 HydrophobicContact CB-CG2 4.25Å; P104-V107 HydrophobicContact CB-CG1 4.14Å; P104-V107 HydrophobicContact CG-CG1 4.31Å; P104-V107 WeakPolarHBondContact O-CG2 3.46Å; P104-V107 PolarHBondContact O-N 2.84Å; V107-C111 HydrophobicContact CB-CB 3.99Å; V107-C111 HydrophobicContact CG2-CB 4.46Å; V107-K112 HydrophobicContact CG2-CD 4.28Å; V107-K112 HydrophobicContact CG2-CG 3.39Å; V107-K112 VanDerWaalsContact O-CE 3.29Å; V107-K112 WeakPolarHBondContact O-CE 3.28Å
108	S	76.2	Confident	79.2	Confident	19 Å²	19	72.3 Å²	72.3	13%	0.133	38%	0.384	C	S	.	.			trans	-67.4	164.9	179.4	81.1	0	0	0	0	113.5	D58 R110 C111 K112	D58-S108 WeakPolarHBondContact OD1-CB 3.44Å; D58-S108 PolarHBondContact OD1-OG 3.36Å; D58-S108 WeakPolarHBondContact OD2-CB 3.36Å; D58-S108 PolarHBondContact OD2-OG 2.88Å; S108-R110 VanDerWaalsContact C-N 3.31Å; S108-R110 PolarHBondContact O-N 2.86Å; S108-C111 PolarHBondContact O-N 2.98Å; S108-C111 WeakPolarHBondContact OG-CB 3.43Å; S108-C111 PolarHBondContact OG-N 2.04Å; S108-K112 WeakPolarHBondContact O-CG 3.32Å; S108-K112 PolarHBondContact O-N 3.46Å
109	R	80.5	Confident	79.5	Confident	206 Å²	206	64.8 Å²	64.8	78%	0.777	34%	0.344	S	S	*	.	H	α-helix	trans	-59.6	-40.8	-179.3	-172.3	178.7	-178.8	176.9	0.7	112.1	K112 Q113	R109-K112 PolarHBondContact O-N 2.83Å; R109-Q113 WeakPolarHBondContact O-CG 3.37Å; R109-Q113 PolarHBondContact O-N 2.88Å; R109-Q113 VanDerWaalsContact O-N 3.16Å
110	R	78.7	Confident	78.8	Confident	88 Å²	88	61.1 Å²	61.1	33%	0.332	34%	0.336	S	S	.	.	H	α-helix	trans	-69.8	-39.9	177.3	-82.4	-173.6	175.5	156.9	-0.6	112.4	C57 D58 G60 S108 K112 Q113 A114	C57-R110 WeakPolarHBondContact O-CD 3.32Å; C57-R110 PolarHBondContact O-NH1 3.48Å; D58-R110 PolarHBondContact O-NH1 2.86Å; G60-R110 VanDerWaalsContact N-NH1 3.13Å; S108-R110 VanDerWaalsContact C-N 3.31Å; S108-R110 PolarHBondContact O-N 2.86Å; R110-K112 VanDerWaalsContact C-N 3.31Å; R110-K112 PolarHBondContact O-N 3.05Å; R110-Q113 WeakPolarHBondContact O-CB 3.34Å; R110-Q113 PolarHBondContact O-N 3.43Å; R110-Q113 VanDerWaalsContact O-N 3.17Å; R110-A114 PolarHBondContact O-N 3.27Å
111	C	80.4	Confident	77.5	Confident	5 Å²	5	65.9 Å²	65.9	3%	0.034	35%	0.351	C	S	.	.	H	α-helix	trans	-62.2	-39.6	174.4	-176.7	0	0	0	0	111.7	C87 V107 S108 Q113 A114 F115	C87-C111 HydrophobicContact CB-CB 3.99Å; C87-C111 WeakPolarHBondContact CB-O 3.27Å; C87-C111 WeakPolarHBondContact CB-SG 3.22Å; C87-C111 VanDerWaalsContact SG-CA 3.54Å; C87-C111 WeakPolarHBondContact SG-CB 3.42Å; C87-C111 CovalentContact SG-SG 2.02Å; C87-C111 PolarHBondContact SG-SG 3.33Å; V107-C111 HydrophobicContact CB-CB 3.99Å; V107-C111 HydrophobicContact CG2-CB 4.46Å; S108-C111 PolarHBondContact O-N 2.98Å; S108-C111 WeakPolarHBondContact OG-CB 3.43Å; S108-C111 PolarHBondContact OG-N 2.04Å; C111-Q113 PolarHBondContact O-N 3.41Å; C111-A114 PolarHBondContact O-N 2.66Å; C111-F115 VanDerWaalsContact O-CB 3.3Å; C111-F115 WeakPolarHBondContact O-CB 3.44Å; C111-F115 PolarHBondContact O-N 3.05Å
112	K	84.6	Confident	75.5	Confident	79 Å²	79	67.8 Å²	67.8	34%	0.343	38%	0.378	S	S	.	.	H	α-helix	trans	-59.4	-44.1	172.6	-69.9	-179.6	-178.2	177.2	0	111.9	P103 V107 S108 R109 R110 F115 V116	P103-K112 HydrophobicContact CB-CB 4.42Å; P103-K112 HydrophobicContact CB-CG 4.01Å; P103-K112 HydrophobicContact CG-CB 4.22Å; P103-K112 HydrophobicContact CG-CD 4.46Å; P103-K112 HydrophobicContact CG-CG 3.98Å; V107-K112 HydrophobicContact CG2-CD 4.28Å; V107-K112 HydrophobicContact CG2-CG 3.39Å; V107-K112 VanDerWaalsContact O-CE 3.29Å; V107-K112 WeakPolarHBondContact O-CE 3.28Å; S108-K112 WeakPolarHBondContact O-CG 3.32Å; S108-K112 PolarHBondContact O-N 3.46Å; R109-K112 PolarHBondContact O-N 2.83Å; R110-K112 VanDerWaalsContact C-N 3.31Å; R110-K112 PolarHBondContact O-N 3.05Å; K112-F115 PolarHBondContact O-N 3.04Å; K112-V116 WeakPolarHBondContact O-CG2 3.42Å; K112-V116 PolarHBondContact O-N 3.47Å
113	Q	80.6	Confident	73.1	Confident	114 Å²	114	65 Å²	65	53%	0.533	38%	0.379	S	S	.	.	H	α-helix	trans	-62.6	-47.5	177.8	-72.5	173.1	-34	0	0	111.9	R109 R110 C111 F115 V116 S117	R109-Q113 WeakPolarHBondContact O-CG 3.37Å; R109-Q113 PolarHBondContact O-N 2.88Å; R109-Q113 VanDerWaalsContact O-N 3.16Å; R110-Q113 WeakPolarHBondContact O-CB 3.34Å; R110-Q113 PolarHBondContact O-N 3.43Å; R110-Q113 VanDerWaalsContact O-N 3.17Å; C111-Q113 PolarHBondContact O-N 3.41Å; Q113-F115 VanDerWaalsContact C-N 3.34Å; Q113-F115 PolarHBondContact O-N 3.35Å; Q113-V116 PolarHBondContact O-N 2.78Å; Q113-S117 VanDerWaalsContact O-CB 3.28Å; Q113-S117 WeakPolarHBondContact O-CB 3.43Å; Q113-S117 PolarHBondContact O-N 3.19Å
114	A	79.1	Confident	70.8	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-62.9	-39.6	176.9	0	0	0	0	0	112.2	C84 C87 R110 C111 C118	C84-A114 HydrophobicContact CB-CB 3.76Å; C87-A114 HydrophobicContact CB-CB 4.08Å; R110-A114 PolarHBondContact O-N 3.27Å; C111-A114 PolarHBondContact O-N 2.66Å; A114-C118 WeakPolarHBondContact O-CB 3.42Å; A114-C118 PolarHBondContact O-N 3.43Å; A114-C118 PolarHBondContact O-SG 3.14Å; A114-C118 VanDerWaalsContact O-SG 3.4Å
115	F	84.9	Confident	68.5	Low	4 Å²	4	75.3 Å²	75.3	2%	0.018	43%	0.43	C	S	.	.	H	α-helix	trans	-60.4	-51.9	175.4	-178.9	-79.8	0	0	0	111.6	C87 L90 T94 P103 C111 K112 Q113 C118 C119	C87-F115 WeakPolarHBondContact O-CA 3.36Å; L90-F115 HydrophobicContact CB-CD2 3.99Å; L90-F115 HydrophobicContact CB-CE2 4.04Å; L90-F115 HydrophobicContact CD2-CD2 4.1Å; L90-F115 HydrophobicContact CD2-CE2 3.9Å; L90-F115 HydrophobicContact CG-CD2 4.4Å; L90-F115 HydrophobicContact CG-CE2 4.07Å; T94-F115 HydrophobicContact CG2-CE2 4.27Å; T94-F115 HydrophobicContact CG2-CZ 3.91Å; T94-F115 VanDerWaalsContact OG1-CZ 3.24Å; T94-F115 WeakPolarHBondContact OG1-CZ 3.4Å; P103-F115 HydrophobicContact CB-CB 4.18Å; P103-F115 HydrophobicContact CB-CD1 3.65Å; P103-F115 HydrophobicContact CB-CD2 4.46Å; P103-F115 HydrophobicContact CB-CE1 4.15Å; P103-F115 HydrophobicContact CB-CG 3.84Å; P103-F115 HydrophobicContact CG-CD1 4.28Å; C111-F115 VanDerWaalsContact O-CB 3.3Å; C111-F115 WeakPolarHBondContact O-CB 3.44Å; C111-F115 PolarHBondContact O-N 3.05Å; K112-F115 PolarHBondContact O-N 3.04Å; Q113-F115 VanDerWaalsContact C-N 3.34Å; Q113-F115 PolarHBondContact O-N 3.35Å; F115-C118 PolarHBondContact O-N 2.79Å; F115-C119 HydrophobicContact CD1-CB 4.38Å; F115-C119 HydrophobicContact CE1-CB 4.18Å; F115-C119 WeakPolarHBondContact O-CB 3.39Å; F115-C119 PolarHBondContact O-N 2.82Å
116	V	84.3	Confident	66.4	Low	74 Å²	74	76.7 Å²	76.7	45%	0.448	44%	0.439	S	S	.	.	H	α-helix	trans	-65.4	-43	-178.7	176.5	0	0	0	0	110.8	P103 K112 Q113 C118 C119 G120	P103-V116 HydrophobicContact CG-CG2 4.35Å; K112-V116 WeakPolarHBondContact O-CG2 3.42Å; K112-V116 PolarHBondContact O-N 3.47Å; Q113-V116 PolarHBondContact O-N 2.78Å; V116-C118 PolarHBondContact O-N 2.97Å; V116-C119 PolarHBondContact O-N 2.96Å; V116-C119 VanDerWaalsContact O-N 3.15Å; V116-G120 PolarHBondContact O-N 3.36Å
117	S	76.6	Confident	64.5	Low	55 Å²	55	76.5 Å²	76.5	39%	0.385	44%	0.443	S	S	.	.	H	α-helix	trans	-60.4	-27.9	179.1	-171.9	0	0	0	0	113.6	Q113	Q113-S117 VanDerWaalsContact O-CB 3.28Å; Q113-S117 WeakPolarHBondContact O-CB 3.43Å; Q113-S117 PolarHBondContact O-N 3.19Å
118	C	79.7	Confident	62.6	Low	12 Å²	12	81.3 Å²	81.3	8%	0.081	47%	0.468	C	S	.	.	H	α-helix	trans	-100.4	-11.7	179	-63.9	0	0	0	0	113.6	C88 R92 A114 F115 V116	C88-C118 VanDerWaalsContact CA-SG 3.58Å; C88-C118 HydrophobicContact CB-CB 3.82Å; C88-C118 WeakPolarHBondContact CB-SG 3.22Å; C88-C118 VanDerWaalsContact O-CB 3.25Å; C88-C118 WeakPolarHBondContact O-CB 3.27Å; C88-C118 WeakPolarHBondContact SG-CB 3.25Å; C88-C118 CovalentContact SG-SG 2.02Å; C88-C118 PolarHBondContact SG-SG 2.81Å; R92-C118 HydrophobicContact CG-CB 4.24Å; R92-C118 WeakPolarHBondContact CG-O 3.35Å; A114-C118 WeakPolarHBondContact O-CB 3.42Å; A114-C118 PolarHBondContact O-N 3.43Å; A114-C118 PolarHBondContact O-SG 3.14Å; A114-C118 VanDerWaalsContact O-SG 3.4Å; F115-C118 PolarHBondContact O-N 2.79Å; V116-C118 PolarHBondContact O-N 2.97Å
119	C	81.8	Confident	60.6	Low	1 Å²	1	86.5 Å²	86.5	1%	0.007	50%	0.495	C	S	.	.	H	α-helix	trans	-92.8	-27.4	177.5	-165.3	0	0	0	0	112.5	G91 T94 L95 C101 F115 V116	G91-C119 WeakPolarHBondContact O-CB 3.36Å; G91-C119 PolarHBondContact O-SG 3.05Å; G91-C119 VanDerWaalsContact O-SG 3.37Å; T94-C119 PolarHBondContact OG1-SG 2.52Å; T94-C119 VanDerWaalsContact OG1-SG 3.35Å; L95-C119 WeakPolarHBondContact CD1-O 3.5Å; C101-C119 WeakPolarHBondContact CA-SG 3.5Å; C101-C119 HydrophobicContact CB-CB 3.7Å; C101-C119 WeakPolarHBondContact CB-SG 3.16Å; C101-C119 WeakPolarHBondContact SG-CB 3.47Å; C101-C119 PolarHBondContact SG-O 3.48Å; C101-C119 CovalentContact SG-SG 2.03Å; C101-C119 PolarHBondContact SG-SG 3.21Å; F115-C119 HydrophobicContact CD1-CB 4.38Å; F115-C119 HydrophobicContact CE1-CB 4.18Å; F115-C119 WeakPolarHBondContact O-CB 3.39Å; F115-C119 PolarHBondContact O-N 2.82Å; V116-C119 PolarHBondContact O-N 2.96Å; V116-C119 VanDerWaalsContact O-N 3.15Å
120	G	64.8	Low	58.3	Low	34 Å²	34	82.9 Å²	82.9	35%	0.351	49%	0.491	S	S	.	.	S	Bend	trans	-130.8	131.1	179.1	0	0	0	0	0	112.7	V116 G122	V116-G120 PolarHBondContact O-N 3.36Å; G120-G122 PolarHBondContact O-N 2.76Å
121	D	51.8	Low	56.2	Low	172 Å²	172	88 Å²	88	92%	0.92	52%	0.515	S	S	*	.			trans	-48.3	126.9	159.7	-95	-27.8	0	0	0	108.5	G123	D121-G123 PolarHBondContact O-N 2.89Å
122	G	41.2	Very low	53.7	Low	83 Å²	83	92.6 Å²	92.6	86%	0.856	54%	0.543	S	S	*	.	S	Bend	trans	-58.5	105.5	-178	0	0	0	0	0	112.6	G120	G120-G122 PolarHBondContact O-N 2.76Å
123	G	33	Very low	51	Low	69 Å²	69	98.4 Å²	98.4	71%	0.711	56%	0.563	S	S	*	*			trans	56.6	142.4	141.3	0	0	0	0	0	119.1	D121	D121-G123 PolarHBondContact O-N 2.89Å
124	E	31.5	Very low	48.4	Very low	190 Å²	190	99.1 Å²	99.1	89%	0.888	57%	0.568	S	S	*	*			cis	-165.3	158.1	5	-88.4	180	143.1	0	0	106.1
125	P	29.3	Very low	45.9	Very low	123 Å²	123	108.2 Å²	108.2	80%	0.799	61%	0.608	S	S	*	*			trans	-100.4	123	168.2	33.5	-22.3	0	0	0	111.5
126	S	29.8	Very low	43	Very low	118 Å²	118	113 Å²	113	83%	0.825	64%	0.642	S	S	*	*			trans	170.6	125.8	142.6	63	0	0	0	0	113.9
127	D	32.9	Very low	40.4	Very low	140 Å²	140	113.5 Å²	113.5	75%	0.749	65%	0.653	S	S	*	*			trans	75.1	118.5	135.5	-124.9	14.2	0	0	0	123.1
128	N	33.2	Very low	38	Very low	121 Å²	121	116.8 Å²	116.8	65%	0.647	67%	0.672	S	S	*	*			trans	69.1	119.7	145.5	-70.7	-28.9	0	0	0	124.2
129	D	32.9	Very low	35.4	Very low	128 Å²	128	121.8 Å²	121.8	68%	0.684	70%	0.702	S	S	*	*				77.2	115	127.9	-70.1	-20.2	0	0	0	122.4
130	D	33.9	Very low	32.8	Very low	130 Å²	130	127.9 Å²	127.9	70%	0.695	74%	0.739	S	S	*	*			trans	63.2	104	130.1	-73.3	-22.8	0	0	0	119.7
131	K	33.5	Very low	31.1	Very low	195 Å²	195	133.4 Å²	133.4	85%	0.848	76%	0.76	S	S	*	*				-170	111.3	105.2	-94.5	156.2	-171.9	178.7	0	109.7
132	V	28.2	Very low	29.9	Very low	103 Å²	103	130.8 Å²	130.8	62%	0.624	75%	0.75	S	S	*	*				66.8	122.6	78.4	168.9	0	0	0	0	110
133	R	27.3	Very low	29.4	Very low	201 Å²	201	133.5 Å²	133.5	76%	0.758	75%	0.746	S	S	*	*			cis	-173.7	151.9	13.6	-106.7	168	-178.7	-168.1	2.4	109.1
134	M	25.9	Very low	29.1	Very low	128 Å²	128	138.5 Å²	138.5	63%	0.631	75%	0.75	S	S	*	*			trans	58.4	131	138.1	-66.2	-165.9	-86.5	0	0	119.6
135	F	27.3	Very low	29	Very low	192 Å²	192	137 Å²	137	84%	0.842	74%	0.736	S	S	*	*				-149.2	145	56.6	-103.5	-94.1	0	0	0	114.1
136	S	25.1	Very low	28.9	Very low	105 Å²	105	141.2 Å²	141.2	73%	0.734	74%	0.738	S	S	*	*			trans	-89.8	148.5	178.9	53.7	0	0	0	0	113.9
137	A	28.9	Very low	28.7	Very low	83 Å²	83	140.6 Å²	140.6	69%	0.686	73%	0.734	S	S	*	*			trans	179.3	101.3	136.1	0	0	0	0	0	108.2
138	T	25.2	Very low	28.6	Very low	125 Å²	125	141.6 Å²	141.6	77%	0.767	74%	0.737	S	S	*	*				57.2	121	106.8	56	0	0	0	0	113.3
139	T	26	Very low	28.2	Very low	117 Å²	117	144 Å²	144	72%	0.718	75%	0.745	S	S	*	*			cis	-177.4	156.8	31.6	25.2	0	0	0	0	110.1
140	T	26.8	Very low	27.9	Very low	129 Å²	129	144.8 Å²	144.8	79%	0.791	75%	0.748	S	S	*	*			trans	82.5	132.7	144.4	48.1	0	0	0	0	123.1
141	D	28.9	Very low	27.5	Very low	149 Å²	149	144.4 Å²	144.4	80%	0.797	74%	0.741	S	S	*	*			trans	66.4	103.3	170.1	-82.2	-26.3	0	0	0	118.7
142	V	26.7	Very low	27.3	Very low	117 Å²	117	141.3 Å²	141.3	71%	0.709	74%	0.738	S	S	*	*				73.4	123.3	51.1	-160.6	0	0	0	0	114
143	N	30.2	Very low	27.1	Very low	141 Å²	141	146.3 Å²	146.3	75%	0.754	75%	0.745	S	S	*	*			trans	99.7	88.2	177.5	-58.5	-32.2	0	0	0	115.4
144	E	27.2	Very low	27.2	Very low	173 Å²	173	146 Å²	146	81%	0.808	75%	0.75	S	S	*	*				57.8	111.8	80.6	-71.9	-162.8	165.7	0	0	115.2
145	R	29.5	Very low	27.3	Very low	158 Å²	158	145.9 Å²	145.9	60%	0.596	76%	0.756	S	S	*	*				178.2	128.5	110.3	-90.7	-172.5	-166.2	178.9	11.7	113.1	G389 N390	R145-G389 PolarHBondContact NH1-O 3.23Å; R145-N390 PolarHBondContact NH1-OD1 3.09Å
146	Y	27.1	Very low	27.3	Very low	213 Å²	213	141.4 Å²	141.4	84%	0.835	76%	0.755	S	S	*	*			trans	41.4	109	142.1	-72.6	-96.9	0	0	0	120.5
147	S	27	Very low	27.5	Very low	105 Å²	105	141.3 Å²	141.3	73%	0.734	76%	0.76	S	S	*	*				178.6	133.3	101.1	-78	0	0	0	0	113
148	I	29.5	Very low	27.2	Very low	160 Å²	160	142.9 Å²	142.9	82%	0.821	76%	0.761	S	S	*	*			trans	80	96.9	156.6	-54.8	154.8	0	0	0	116.8
149	Q	24.3	Very low	27.3	Very low	173 Å²	173	144.3 Å²	144.3	81%	0.808	76%	0.763	S	S	*	*			trans	-78.8	121.1	150.1	-78.5	-172.4	-17.9	0	0	108.7
150	L	27	Very low	27.5	Very low	143 Å²	143	142.3 Å²	142.3	75%	0.749	75%	0.754	S	S	*	*			trans	-137	132.2	136.5	-135.9	107.6	0	0	0	108.5
151	F	25.1	Very low	27.7	Very low	123 Å²	123	144.9 Å²	144.9	54%	0.539	76%	0.762	S	S	.	*			trans	-68.7	123.6	-174	-104.7	-117.8	0	0	0	111.7
152	V	29.2	Very low	27.9	Very low	130 Å²	130	142 Å²	142	79%	0.788	75%	0.754	S	S	*	*			trans	-137.6	105.1	138.3	179.7	0	0	0	0	108.2	F154	V152-F154 HydrophobicContact CG1-CD2 4.05Å; V152-F154 PolarHBondContact O-N 3.31Å
153	R	24.8	Very low	28.2	Very low	207 Å²	207	140.1 Å²	140.1	78%	0.781	76%	0.758	S	S	*	*			trans	-66.7	117.9	160.8	-77.5	177.3	169.8	175.8	-2.3	108.4
154	F	29.4	Very low	28.2	Very low	196 Å²	196	145.1 Å²	145.1	86%	0.86	77%	0.767	S	S	*	*			trans	-130.7	116.1	143.1	-98.8	-80.6	0	0	0	109.3	V152	V152-F154 HydrophobicContact CG1-CD2 4.05Å; V152-F154 PolarHBondContact O-N 3.31Å
155	T	28.4	Very low	28.4	Very low	125 Å²	125	143 Å²	143	77%	0.767	77%	0.77	S	S	*	*			trans	-64.7	130.4	-179.7	39.2	0	0	0	0	112.5
156	A	27.5	Very low	28.4	Very low	98 Å²	98	140.4 Å²	140.4	81%	0.81	78%	0.776	S	S	*	*			trans	20.9	113.2	147.3	0	0	0	0	0	119
157	A	28	Very low	28.6	Very low	103 Å²	103	138.8 Å²	138.8	85%	0.851	78%	0.776	S	S	*	*			trans	-143.8	114.1	137.6	0	0	0	0	0	109.3
158	T	24.4	Very low	28.9	Very low	115 Å²	115	141 Å²	141	71%	0.706	78%	0.779	S	S	*	*			trans	-54.7	164.6	175.5	45.1	0	0	0	0	115.5
159	I	26.4	Very low	29.2	Very low	156 Å²	156	142.8 Å²	142.8	80%	0.8	78%	0.781	S	S	*	*			trans	86	132.9	156.2	-60.2	143	0	0	0	114
160	S	29.8	Very low	29.9	Very low	75 Å²	75	141.4 Å²	141.4	52%	0.524	78%	0.779	S	S	.	*			cis	-172	174.8	-7.4	57.1	0	0	0	0	107	S162	S160-S162 PolarHBondContact O-N 3.19Å; S160-S162 PolarHBondContact OG-OG 2.86Å
161	D	32.2	Very low	30.3	Very low	182 Å²	182	142.4 Å²	142.4	97%	0.973	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	35.7	173.8	-72.1	-37.6	0	0	0	116.5
162	S	31.6	Very low	30.4	Very low	90 Å²	90	141.3 Å²	141.3	63%	0.629	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.3	7.2	-169.1	64.7	0	0	0	0	118.7	S160	S160-S162 PolarHBondContact O-N 3.19Å; S160-S162 PolarHBondContact OG-OG 2.86Å
163	G	33.1	Very low	30.7	Very low	77 Å²	77	143.2 Å²	143.2	79%	0.794	79%	0.785	S	S	*	*			trans	51.8	64.2	156	0	0	0	0	0	119
164	R	31.4	Very low	31.2	Very low	245 Å²	245	141.1 Å²	141.1	93%	0.925	78%	0.784	S	S	*	*			trans	-145.3	128.3	161.1	-76.8	-167.7	-179.7	-168.1	0	113.5
165	C	30.2	Very low	31.4	Very low	130 Å²	130	138.5 Å²	138.5	88%	0.878	78%	0.777	S	S	*	*			trans	-83	136.6	172	-64.2	0	0	0	0	111.9
166	S	29.5	Very low	31.4	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	78%	0.781	S	S	*	*			trans	-128.3	130.3	172.7	-171.5	0	0	0	0	110.6
167	E	31.7	Very low	31.7	Very low	179 Å²	179	140.2 Å²	140.2	84%	0.836	78%	0.777	S	S	*	*	S	Bend	trans	64.1	64.8	154.5	-67	177.3	179.5	0	0	119.9
168	N	32.9	Very low	32.1	Very low	151 Å²	151	143.5 Å²	143.5	81%	0.807	78%	0.78	S	S	*	*				-168.5	112.7	125.2	-111.8	-32.4	0	0	0	110.9	N170	N168-N170 PolarHBondContact O-N 3.11Å
169	K	36.7	Very low	32.7	Very low	198 Å²	198	142.3 Å²	142.3	86%	0.861	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	3.2	-163.3	-86.2	178.6	173	177.2	0	117
170	N	39.4	Very low	33.1	Very low	143 Å²	143	139.5 Å²	139.5	77%	0.765	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	4.8	-175.1	-71.4	2.5	0	0	0	114.7	N168	N168-N170 PolarHBondContact O-N 3.11Å
171	F	34	Very low	33.7	Very low	164 Å²	164	138.7 Å²	138.7	72%	0.719	76%	0.756	S	S	*	*	S	Bend	trans	-103.8	-11.3	-176.5	-161.6	-104.9	0	0	0	114
172	C	28.9	Very low	33.8	Very low	100 Å²	100	133.2 Å²	133.2	68%	0.676	74%	0.736	S	S	*	*	S	Bend	trans	-99	6.4	-178.4	-69.6	0	0	0	0	114.6
173	E	35.5	Very low	34.1	Very low	171 Å²	171	133.5 Å²	133.5	80%	0.799	73%	0.733	S	S	*	*	S	Bend	trans	-104	6.3	178.1	-83.7	-177.4	162.7	0	0	114.2
174	Q	34.4	Very low	34.3	Very low	163 Å²	163	134.8 Å²	134.8	76%	0.762	73%	0.726	S	S	*	*	S	Bend	trans	-107.2	14	178.7	-81.6	-178	-12.8	0	0	114.7
175	I	32.7	Very low	34.4	Very low	140 Å²	140	130.3 Å²	130.3	72%	0.718	72%	0.715	S	S	*	*	S	Bend	trans	-114.1	37.9	-178	-44.6	-179.2	0	0	0	110.7
176	C	28.7	Very low	34.4	Very low	125 Å²	125	130.8 Å²	130.8	85%	0.845	71%	0.708	S	S	*	*			trans	-140.4	22.4	175.1	-67.9	0	0	0	0	112.4
177	D	34.1	Very low	34.6	Very low	135 Å²	135	130.9 Å²	130.9	72%	0.722	70%	0.704	S	S	*	*			trans	-110.7	109.9	-177.4	-147.9	-18.5	0	0	0	111.3	S179	D177-S179 VanDerWaalsContact C-N 3.3Å; D177-S179 PolarHBondContact O-N 2.82Å
178	D	35.9	Very low	34.5	Very low	172 Å²	172	125.7 Å²	125.7	92%	0.92	69%	0.688	S	S	*	*			trans	-77.2	56.2	-171.1	-83.2	-38.9	0	0	0	113.3
179	S	37	Very low	34.4	Very low	89 Å²	89	124.4 Å²	124.4	62%	0.622	69%	0.685	S	S	*	*			trans	-133.2	13.7	-169.7	41.5	0	0	0	0	117.9	D177	D177-S179 VanDerWaalsContact C-N 3.3Å; D177-S179 PolarHBondContact O-N 2.82Å
180	D	36	Very low	34.1	Very low	97 Å²	97	122.2 Å²	122.2	52%	0.519	68%	0.682	S	S	.	*			trans	-122.2	107.4	173.8	-159.9	-20.8	0	0	0	114.4	A182 V183	D180-A182 PolarHBondContact O-N 3.37Å; D180-A182 VanDerWaalsContact OD1-CB 3.3Å; D180-A182 WeakPolarHBondContact OD1-CB 3.43Å; D180-A182 PolarHBondContact OD1-N 2.85Å; D180-V183 HydrophobicContact CB-CG2 4.42Å; D180-V183 PolarHBondContact O-N 2.87Å
181	P	41.7	Very low	33.5	Very low	58 Å²	58	120.9 Å²	120.9	38%	0.377	68%	0.679	S	S	.	*	H	α-helix	trans	-69.6	-9	177.7	-17.3	32.3	0	0	0	114.6	V183 R298	P181-V183 VanDerWaalsContact C-N 3.31Å; P181-R298 VanDerWaalsContact CB-NH2 3.29Å
182	A	34.6	Very low	33.2	Very low	67 Å²	67	124.1 Å²	124.1	55%	0.554	69%	0.686	S	S	*	*	H	α-helix	trans	-78.3	-15.1	176	0	0	0	0	0	113.2	D180	D180-A182 PolarHBondContact O-N 3.37Å; D180-A182 VanDerWaalsContact OD1-CB 3.3Å; D180-A182 WeakPolarHBondContact OD1-CB 3.43Å; D180-A182 PolarHBondContact OD1-N 2.85Å
183	V	37.5	Very low	33.2	Very low	96 Å²	96	125.7 Å²	125.7	58%	0.582	69%	0.693	S	S	*	*	H	α-helix	trans	-94.1	-20.8	177.7	-177.6	0	0	0	0	111.9	D180 P181	D180-V183 HydrophobicContact CB-CG2 4.42Å; D180-V183 PolarHBondContact O-N 2.87Å; P181-V183 VanDerWaalsContact C-N 3.31Å
184	V	37	Very low	32.8	Very low	104 Å²	104	124.2 Å²	124.2	63%	0.63	70%	0.695	S	S	*	*	H	α-helix	trans	-78.4	-20.7	179.2	179.4	0	0	0	0	112.8
185	Q	34	Very low	32.4	Very low	152 Å²	152	125.4 Å²	125.4	71%	0.71	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-11.8	174.8	-81.5	-162.8	-14.6	0	0	114.9
186	L	31.2	Very low	32.2	Very low	139 Å²	139	129.9 Å²	129.9	73%	0.728	71%	0.709	S	S	*	*	S	Bend	trans	-85.8	-14.2	172.8	-119.2	93.7	0	0	0	113.4
187	V	32.5	Very low	32.2	Very low	106 Å²	106	128.7 Å²	128.7	64%	0.642	71%	0.708	S	S	*	*	S	Bend	trans	-103.6	-8.9	-178.3	-178.1	0	0	0	0	112.5
188	S	30.6	Very low	31.9	Very low	69 Å²	69	128 Å²	128	48%	0.483	71%	0.711	S	S	.	*	S	Bend	trans	-97.6	-0.6	176.9	66.3	0	0	0	0	114.8
189	V	30.4	Very low	31.6	Very low	124 Å²	124	126.2 Å²	126.2	75%	0.752	71%	0.706	S	S	*	*	S	Bend	trans	-101.2	-1.7	176.3	-179.4	0	0	0	0	112.5
190	L	29.8	Very low	31	Very low	153 Å²	153	127 Å²	127	80%	0.801	71%	0.711	S	S	*	*	S	Bend	trans	-108.7	12.9	178.9	-84.1	161.4	0	0	0	114.8
191	T	27.8	Very low	30.6	Very low	114 Å²	114	132.6 Å²	132.6	70%	0.699	73%	0.731	S	S	*	*	S	Bend	trans	-135.9	35.6	-174.7	39.8	0	0	0	0	114.9
192	R	27.5	Very low	29.8	Very low	232 Å²	232	137.9 Å²	137.9	88%	0.875	75%	0.751	S	S	*	*	S	Bend	trans	-134.1	57.9	172.2	-74.1	-170.9	179.8	-178.6	1.8	114
193	T	28.2	Very low	29.4	Very low	133 Å²	133	141.9 Å²	141.9	82%	0.816	76%	0.763	S	S	*	*			trans	-166.7	99.6	155.8	37.7	0	0	0	0	107.1
194	V	28.3	Very low	29	Very low	140 Å²	140	142.3 Å²	142.3	85%	0.848	78%	0.776	S	S	*	*			trans	175.1	80.7	144.2	177.2	0	0	0	0	106.1
195	E	25.7	Very low	28.7	Very low	188 Å²	188	147 Å²	147	88%	0.879	79%	0.788	S	S	*	*			trans	-98.7	100.9	151.2	-81.4	-173.3	165.5	0	0	106.3
196	R	27.2	Very low	28.6	Very low	235 Å²	235	145.2 Å²	145.2	89%	0.887	79%	0.792	S	S	*	*			trans	169.8	123.5	143.3	-92.9	163.2	-170.9	-163.4	3.6	111.2
197	A	29.2	Very low	28.8	Very low	99 Å²	99	144 Å²	144	82%	0.818	79%	0.792	S	S	*	*			trans	89.8	140.9	156.8	0	0	0	0	0	119.2
198	P	27.7	Very low	28.5	Very low	122 Å²	122	145.5 Å²	145.5	79%	0.792	81%	0.806	S	S	*	*			trans	-106	119.3	-159.1	34.3	-19.2	0	0	0	111.6
199	V	30.3	Very low	28.4	Very low	134 Å²	134	150.3 Å²	150.3	81%	0.812	83%	0.825	S	S	*	*			trans	-147	119.1	164.8	-169.7	0	0	0	0	110.4
200	S	24.6	Very low	28.3	Very low	105 Å²	105	150 Å²	150	73%	0.734	83%	0.829	S	S	*	*			trans	-65.1	125.2	169.4	46.6	0	0	0	0	112.3
201	F	26.4	Very low	28.2	Very low	214 Å²	214	152.3 Å²	152.3	94%	0.939	83%	0.833	S	S	*	*			trans	-150.9	132.4	154	-113.2	-84.9	0	0	0	111.4
202	Q	26	Very low	28.2	Very low	169 Å²	169	152.5 Å²	152.5	79%	0.79	83%	0.833	S	S	*	*			trans	-90.6	158.4	-173.6	-85.5	-171.8	-37.6	0	0	113.5
203	L	26.1	Very low	28.2	Very low	152 Å²	152	148.4 Å²	148.4	80%	0.796	83%	0.829	S	S	*	*			trans	82.9	113.1	149.4	-72.6	145.1	0	0	0	119.5
204	A	29.7	Very low	28.2	Very low	104 Å²	104	152.9 Å²	152.9	86%	0.86	83%	0.832	S	S	*	*				-169	135.3	92	0	0	0	0	0	111.9
205	K	29.2	Very low	28.1	Very low	204 Å²	204	154.2 Å²	154.2	89%	0.887	83%	0.829	S	S	*	*			trans	-93	144.3	-175.7	-73.9	175.7	170.8	179.3	0	112.7
206	S	33.5	Very low	28.2	Very low	114 Å²	114	152.5 Å²	152.5	80%	0.797	83%	0.826	S	S	*	*			trans	-176	159.1	135.6	69	0	0	0	0	111.3
207	P	33.8	Very low	28.2	Very low	113 Å²	113	146 Å²	146	73%	0.734	82%	0.822	S	S	*	*	S	Bend	cis	-136	110.6	-45.6	33.9	-15	0	0	0	111.9
208	C	27.5	Very low	28	Very low	138 Å²	138	147.8 Å²	147.8	93%	0.932	83%	0.828	S	S	*	*	S	Bend	trans	-148.1	25.8	164.1	-90.7	0	0	0	0	112.7
209	L	28.5	Very low	28	Very low	169 Å²	169	145.8 Å²	145.8	89%	0.885	82%	0.821	S	S	*	*			trans	-141.8	134.7	177.8	-83.3	162.3	0	0	0	110.1
210	S	27.6	Very low	27.9	Very low	118 Å²	118	146.3 Å²	146.3	83%	0.825	82%	0.818	S	S	*	*			trans	90.9	99	169.4	76.8	0	0	0	0	118.6
211	K	27.4	Very low	28.2	Very low	202 Å²	202	148.3 Å²	148.3	88%	0.878	82%	0.82	S	S	*	*			trans	-176.7	121.5	147.4	-103.4	-168.7	-175	-178.4	0	104.9
212	V	27.6	Very low	28.5	Very low	118 Å²	118	143.6 Å²	143.6	72%	0.715	81%	0.814	S	S	*	*			cis	-161.5	140.1	13.3	166	0	0	0	0	108
213	N	27.7	Very low	28.7	Very low	145 Å²	145	141.1 Å²	141.1	78%	0.775	81%	0.814	S	S	*	*			trans	18.2	124.6	152.6	-70.2	-19.3	0	0	0	121.3	E215	N213-E215 PolarHBondContact O-N 2.89Å
214	Y	28.8	Very low	28.9	Very low	227 Å²	227	141.7 Å²	141.7	89%	0.89	82%	0.817	S	S	*	*	S	Bend	trans	-47.7	117	134.4	-78.8	-100.8	0	0	0	110
215	E	26.7	Very low	29.2	Very low	169 Å²	169	143.7 Å²	143.7	79%	0.79	82%	0.819	S	S	*	*			trans	156.8	127	146.3	-88.5	174.7	-177.2	0	0	109.6	N213	N213-E215 PolarHBondContact O-N 2.89Å
216	N	26.8	Very low	29.2	Very low	152 Å²	152	137 Å²	137	81%	0.813	81%	0.807	S	S	*	*			trans	78.9	102.3	167.5	-49	-41.7	0	0	0	117.5
217	A	27.3	Very low	29.2	Very low	97 Å²	97	139.6 Å²	139.6	80%	0.802	81%	0.812	S	S	*	*				163.6	106.9	105.2	0	0	0	0	0	110.9	A219	A217-A219 PolarHBondContact O-N 2.93Å
218	C	25.3	Very low	29.4	Very low	138 Å²	138	139.3 Å²	139.3	93%	0.932	82%	0.819	S	S	*	*			trans	-49.7	123.9	150.1	-76.6	0	0	0	0	109.4
219	A	27.7	Very low	29.4	Very low	79 Å²	79	137.6 Å²	137.6	65%	0.653	82%	0.815	S	S	*	*			trans	-178.4	111.6	140.4	0	0	0	0	0	112.3	A217	A217-A219 PolarHBondContact O-N 2.93Å
220	I	28.1	Very low	29.5	Very low	146 Å²	146	134.9 Å²	134.9	75%	0.749	81%	0.81	S	S	*	*				86.1	120.2	124.6	-61.5	169.2	0	0	0	118.5
221	N	30	Very low	29.6	Very low	146 Å²	146	138 Å²	138	78%	0.781	81%	0.812	S	S	*	*			trans	79.5	120.2	161.1	-64	-16.2	0	0	0	116.6
222	S	33.8	Very low	29.7	Very low	116 Å²	116	134.2 Å²	134.2	81%	0.811	81%	0.809	S	S	*	*			cis	-160.8	129.8	39.9	-47.8	0	0	0	0	111.5
223	C	29.4	Very low	29.7	Very low	116 Å²	116	133.4 Å²	133.4	78%	0.784	81%	0.809	S	S	*	*			trans	-76.2	152.9	165.8	-59.2	0	0	0	0	110.9
224	L	31	Very low	29.8	Very low	165 Å²	165	133 Å²	133	86%	0.864	81%	0.806	S	S	*	*				154.7	88.5	119.9	-80	163.9	0	0	0	113.3
225	T	34.8	Very low	29.9	Very low	146 Å²	146	131.4 Å²	131.4	90%	0.896	80%	0.804	S	S	*	*			trans	-150.3	95.3	131.8	52	0	0	0	0	103.8
226	G	30.9	Very low	30	Very low	62 Å²	62	126.5 Å²	126.5	64%	0.639	80%	0.799	S	S	*	*				89.5	69.6	69.5	0	0	0	0	0	108.8
227	D	33.2	Very low	30.3	Very low	170 Å²	170	129.3 Å²	129.3	91%	0.909	80%	0.804	S	S	*	*			trans	174.4	135.4	133.3	-85.7	-25.3	0	0	0	112.7
228	A	36.9	Very low	30.3	Very low	107 Å²	107	131.5 Å²	131.5	88%	0.884	81%	0.812	S	S	*	*			trans	69	98.6	168.6	0	0	0	0	0	119.6
229	A	28.2	Very low	30.5	Very low	102 Å²	102	127.8 Å²	127.8	84%	0.843	80%	0.796	S	S	*	*			trans	-83.9	130.6	164.6	0	0	0	0	0	111.8
230	S	30.2	Very low	30.6	Very low	112 Å²	112	136.4 Å²	136.4	78%	0.783	81%	0.812	S	S	*	*			trans	-174.9	134	142.2	52.2	0	0	0	0	110.8
231	E	29.9	Very low	30.6	Very low	184 Å²	184	136.8 Å²	136.8	86%	0.86	81%	0.814	S	S	*	*			trans	103.1	127.6	162.4	-59	-167	149.9	0	0	119.6
232	C	29.2	Very low	30.8	Very low	122 Å²	122	137.7 Å²	137.7	82%	0.824	82%	0.818	S	S	*	*			trans	91.3	63.4	155.5	-64.4	0	0	0	0	119.7
233	S	27.9	Very low	30.8	Very low	101 Å²	101	140.7 Å²	140.7	71%	0.706	82%	0.821	S	S	*	*				-61.5	137.6	126.2	52.3	0	0	0	0	111
234	L	30.3	Very low	31.7	Very low	136 Å²	136	140.9 Å²	140.9	71%	0.712	82%	0.821	S	S	*	*			trans	135.9	119.2	147.6	-78.4	143.8	0	0	0	114.6
235	F	30.2	Very low	33.1	Very low	194 Å²	194	141 Å²	141	85%	0.851	82%	0.822	S	S	*	*			trans	65.2	125.9	163.2	-58.8	-74.7	0	0	0	116.9
236	G	29.1	Very low	34.8	Very low	66 Å²	66	137.4 Å²	137.4	68%	0.68	80%	0.797	S	S	*	*			cis	91.7	75.4	30.4	0	0	0	0	0	111.6
237	K	32.5	Very low	36.9	Very low	211 Å²	211	137.4 Å²	137.4	92%	0.917	79%	0.785	S	S	*	*			trans	150.5	126.1	141.8	-85.3	174.7	179.6	179.9	0	112.6
238	C	27.4	Very low	39.2	Very low	143 Å²	143	132.1 Å²	132.1	97%	0.966	76%	0.756	S	S	*	*			trans	-63	126.7	168.4	-64.3	0	0	0	0	111.2
239	G	29.7	Very low	41.5	Very low	59 Å²	59	128.6 Å²	128.6	61%	0.608	72%	0.722	S	S	*	*			trans	-139.5	132.2	165.9	0	0	0	0	0	108.2	I241	G239-I241 PolarHBondContact O-N 3.1Å
240	R	29.6	Very low	44.2	Very low	260 Å²	260	125.6 Å²	125.6	98%	0.981	69%	0.694	S	S	*	*			trans	-44	117.1	178.1	-73	171.3	169.4	168.3	-5	111.5
241	I	29.1	Very low	46.7	Very low	155 Å²	155	126 Å²	126	80%	0.795	69%	0.691	S	S	*	*			trans	-126.6	127.8	168	-63.7	172.4	0	0	0	106.1	G239 M243	G239-I241 PolarHBondContact O-N 3.1Å; I241-M243 PolarHBondContact O-N 3.45Å
242	L	32.5	Very low	48.8	Very low	164 Å²	164	123.8 Å²	123.8	86%	0.859	68%	0.681	S	S	*	*			trans	-45.4	130.7	175.2	-71	112.2	0	0	0	109.8
243	M	34	Very low	50.5	Low	180 Å²	180	121 Å²	121	89%	0.887	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-54.1	128.7	174.4	-71.2	-177.8	177.3	0	0	108.1	I241 L245	I241-M243 PolarHBondContact O-N 3.45Å; M243-L245 PolarHBondContact O-N 2.78Å
244	P	49.5	Very low	52.4	Low	120 Å²	120	119.1 Å²	119.1	78%	0.779	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-60.1	135.7	174.7	27.8	-32	0	0	0	107.2	D246	P244-D246 PolarHBondContact O-N 3.27Å
245	L	59.5	Low	54.3	Low	167 Å²	167	114.3 Å²	114.3	87%	0.874	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-53.8	128.4	169.5	-86.3	112.1	0	0	0	107.8	M243 V247	M243-L245 PolarHBondContact O-N 2.78Å; L245-V247 PolarHBondContact O-N 3.01Å
246	D	71	Confident	56.8	Low	70 Å²	70	110.8 Å²	110.8	37%	0.374	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-50.6	128.9	168.7	-174.3	47.4	0	0	0	109.2	P244 N266 G269	P244-D246 PolarHBondContact O-N 3.27Å; D246-N266 PolarHBondContact OD2-ND2 2.82Å; D246-G269 PolarHBondContact OD1-N 2.78Å
247	V	74.3	Confident	59.3	Low	63 Å²	63	108.6 Å²	108.6	38%	0.382	61%	0.606	S	S	.	*			trans	-91.7	115.5	178.7	170.7	0	0	0	0	106.8	L245 E249 Q252	L245-V247 PolarHBondContact O-N 3.01Å; V247-E249 PolarHBondContact O-N 2.77Å; V247-Q252 VanDerWaalsContact CG1-CD 3.47Å; V247-Q252 HydrophobicContact CG1-CG 4.4Å; V247-Q252 VanDerWaalsContact CG1-OE1 3.24Å
248	D	82.8	Confident	61.7	Low	59 Å²	59	101.7 Å²	101.7	32%	0.316	58%	0.579	S	S	.	*			trans	-70.6	92.4	175.2	-170.8	-27.9	0	0	0	110.4	C250 V251 Q252	D248-C250 PolarHBondContact O-N 3.49Å; D248-C250 WeakPolarHBondContact OD1-CA 3.47Å; D248-C250 VanDerWaalsContact OD1-CB 3.29Å; D248-C250 WeakPolarHBondContact OD1-CB 3.47Å; D248-C250 PolarHBondContact OD1-N 3.45Å; D248-C250 VanDerWaalsContact OD1-N 3.09Å; D248-V251 HydrophobicContact CB-CB 4.2Å; D248-V251 HydrophobicContact CB-CG2 4.31Å; D248-V251 VanDerWaalsContact CG-CG2 3.46Å; D248-V251 PolarHBondContact O-N 2.61Å; D248-V251 PolarHBondContact OD1-N 3.42Å; D248-V251 VanDerWaalsContact OD2-CG2 3.28Å; D248-V251 WeakPolarHBondContact OD2-CG2 3.36Å; D248-Q252 PolarHBondContact O-N 2.85Å
249	E	85.4	Confident	64.2	Low	33 Å²	33	99.3 Å²	99.3	15%	0.154	57%	0.57	C	S	.	*	H	α-helix	trans	-66.5	-22	-179.4	-66.2	99.3	171.3	0	0	113.1	V247 G253 S254 S255 N266 Y271	V247-E249 PolarHBondContact O-N 2.77Å; E249-G253 PolarHBondContact O-N 3.28Å; E249-S254 WeakPolarHBondContact CA-OG 3.04Å; E249-S254 WeakPolarHBondContact CB-OG 3.35Å; E249-S254 VanDerWaalsContact CG-OG 3.26Å; E249-S254 WeakPolarHBondContact CG-OG 3.34Å; E249-S254 PolarHBondContact O-N 3.27Å; E249-S255 PolarHBondContact O-N 2.73Å; E249-N266 PolarHBondContact OE2-OD1 3.35Å; E249-Y271 HydrophobicContact CB-CD1 3.41Å; E249-Y271 VanDerWaalsContact CB-CD1 3.41Å; E249-Y271 HydrophobicContact CB-CE1 4.07Å; E249-Y271 HydrophobicContact CB-CG 3.97Å; E249-Y271 HydrophobicContact CG-CD1 3.74Å; E249-Y271 HydrophobicContact CG-CE1 4.28Å
250	C	84.8	Confident	66.5	Low	39 Å²	39	101.4 Å²	101.4	26%	0.264	57%	0.571	S	S	.	*	H	α-helix	trans	-71.5	-33.6	175.2	-56.9	0	0	0	0	111.4	D248 C264 N266	D248-C250 PolarHBondContact O-N 3.49Å; D248-C250 WeakPolarHBondContact OD1-CA 3.47Å; D248-C250 VanDerWaalsContact OD1-CB 3.29Å; D248-C250 WeakPolarHBondContact OD1-CB 3.47Å; D248-C250 PolarHBondContact OD1-N 3.45Å; D248-C250 VanDerWaalsContact OD1-N 3.09Å; C250-C264 WeakPolarHBondContact CA-SG 3.39Å; C250-C264 HydrophobicContact CB-CB 3.75Å; C250-C264 WeakPolarHBondContact CB-SG 3.4Å; C250-C264 WeakPolarHBondContact SG-CB 3.33Å; C250-C264 CovalentContact SG-SG 2.04Å; C250-C264 PolarHBondContact SG-SG 2.81Å; C250-N266 PolarHBondContact SG-N 3Å; C250-N266 VanDerWaalsContact SG-N 3.42Å
251	V	82.9	Confident	69.1	Low	119 Å²	119	89.8 Å²	89.8	72%	0.721	53%	0.529	S	S	*	.	H	α-helix	trans	-86.7	-32.1	177.2	176.6	0	0	0	0	112.1	D248 G253	D248-V251 HydrophobicContact CB-CB 4.2Å; D248-V251 HydrophobicContact CB-CG2 4.31Å; D248-V251 VanDerWaalsContact CG-CG2 3.46Å; D248-V251 PolarHBondContact O-N 2.61Å; D248-V251 PolarHBondContact OD1-N 3.42Å; D248-V251 VanDerWaalsContact OD2-CG2 3.28Å; D248-V251 WeakPolarHBondContact OD2-CG2 3.36Å; V251-G253 VanDerWaalsContact C-N 3.31Å; V251-G253 PolarHBondContact O-N 3.48Å
252	Q	72.8	Confident	71.9	Confident	138 Å²	138	83.5 Å²	83.5	65%	0.645	50%	0.496	S	S	*	.	H	α-helix	trans	-81.5	-4.2	-179.6	-70.6	-166.8	7.3	0	0	114.7	V247 D248 S254	V247-Q252 VanDerWaalsContact CG1-CD 3.47Å; V247-Q252 HydrophobicContact CG1-CG 4.4Å; V247-Q252 VanDerWaalsContact CG1-OE1 3.24Å; D248-Q252 PolarHBondContact O-N 2.85Å; Q252-S254 PolarHBondContact O-N 3.36Å
253	G	65.5	Low	74.6	Confident	64 Å²	64	78.7 Å²	78.7	66%	0.66	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	17.7	179	0	0	0	0	0	114.1	E249 V251	E249-G253 PolarHBondContact O-N 3.28Å; V251-G253 VanDerWaalsContact C-N 3.31Å; V251-G253 PolarHBondContact O-N 3.48Å
254	S	67.3	Low	77.2	Confident	62 Å²	62	71.6 Å²	71.6	43%	0.434	44%	0.441	S	S	.	.			trans	-89.8	-3.8	173.6	60	0	0	0	0	112.9	E249 Q252	E249-S254 WeakPolarHBondContact CA-OG 3.04Å; E249-S254 WeakPolarHBondContact CB-OG 3.35Å; E249-S254 VanDerWaalsContact CG-OG 3.26Å; E249-S254 WeakPolarHBondContact CG-OG 3.34Å; E249-S254 PolarHBondContact O-N 3.27Å; Q252-S254 PolarHBondContact O-N 3.36Å
255	S	70.6	Confident	79	Confident	34 Å²	34	69.5 Å²	69.5	24%	0.238	42%	0.421	C	S	.	.			trans	-68.5	136.4	173.4	73.2	0	0	0	0	112.2	E249 C257 C264 Y271	E249-S255 PolarHBondContact O-N 2.73Å; S255-C257 VanDerWaalsContact C-N 3.27Å; S255-C264 WeakPolarHBondContact CB-SG 3.36Å; S255-Y271 VanDerWaalsContact CA-CZ 3.5Å
256	T	82	Confident	80.1	Confident	120 Å²	120	64.2 Å²	64.2	74%	0.736	39%	0.394	S	S	*	.			trans	-89.9	11.7	174.9	54.7	0	0	0	0	112.9	Y271	T256-Y271 PolarHBondContact N-OH 3.04Å; T256-Y271 PolarHBondContact OG1-OH 3.32Å
257	C	81.8	Confident	80.7	Confident	20 Å²	20	62.7 Å²	62.7	14%	0.135	39%	0.387	C	S	.	.			trans	-67.4	139	-179	-53.9	0	0	0	0	111.4	S255 A259 Q262 C264 C273	S255-C257 VanDerWaalsContact C-N 3.27Å; C257-A259 PolarHBondContact O-N 3.42Å; C257-A259 VanDerWaalsContact O-N 3.14Å; C257-Q262 HydrophobicContact CB-CB 4.26Å; C257-C264 HydrophobicContact CB-CB 4.38Å; C257-C273 WeakPolarHBondContact CA-SG 3.4Å; C257-C273 HydrophobicContact CB-CB 3.77Å; C257-C273 WeakPolarHBondContact CB-SG 3.24Å; C257-C273 VanDerWaalsContact SG-CA 3.56Å; C257-C273 WeakPolarHBondContact SG-CB 3.3Å; C257-C273 CovalentContact SG-SG 2.03Å; C257-C273 PolarHBondContact SG-SG 2.82Å
258	D	83.6	Confident	80.8	Confident	67 Å²	67	65.9 Å²	65.9	36%	0.358	41%	0.409	S	S	.	.			trans	-74.1	102.4	173.3	177	3.9	0	0	0	110.2	T260 T261 Q262	D258-T260 VanDerWaalsContact CG-OG1 3.3Å; D258-T260 PolarHBondContact O-N 2.74Å; D258-T260 WeakPolarHBondContact OD1-CB 3.05Å; D258-T260 PolarHBondContact OD1-N 3.44Å; D258-T260 PolarHBondContact OD1-OG1 2.99Å; D258-T260 PolarHBondContact OD2-OG1 3.24Å; D258-T261 PolarHBondContact O-N 3.09Å; D258-T261 PolarHBondContact OD2-OG1 3.13Å; D258-Q262 WeakPolarHBondContact O-CA 3.39Å; D258-Q262 WeakPolarHBondContact O-CB 3.23Å; D258-Q262 PolarHBondContact O-N 3.29Å
259	A	79	Confident	80.3	Confident	93 Å²	93	66.1 Å²	66.1	77%	0.769	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-14.6	-178.4	0	0	0	0	0	114.7	C257	C257-A259 PolarHBondContact O-N 3.42Å; C257-A259 VanDerWaalsContact O-N 3.14Å
260	T	79.6	Confident	80.2	Confident	103 Å²	103	67.4 Å²	67.4	63%	0.632	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-23	177.9	65.1	0	0	0	0	113.9	D258	D258-T260 VanDerWaalsContact CG-OG1 3.3Å; D258-T260 PolarHBondContact O-N 2.74Å; D258-T260 WeakPolarHBondContact OD1-CB 3.05Å; D258-T260 PolarHBondContact OD1-N 3.44Å; D258-T260 PolarHBondContact OD1-OG1 2.99Å; D258-T260 PolarHBondContact OD2-OG1 3.24Å
261	T	84	Confident	80.3	Confident	15 Å²	15	68 Å²	68	9%	0.092	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.9	-7.3	-173.4	64.3	0	0	0	0	113.9	D258 C275 L276 F279	D258-T261 PolarHBondContact O-N 3.09Å; D258-T261 PolarHBondContact OD2-OG1 3.13Å; T261-C275 WeakPolarHBondContact O-CA 3.41Å; T261-L276 PolarHBondContact O-N 3.21Å; T261-F279 HydrophobicContact CG2-CD1 3.84Å; T261-F279 HydrophobicContact CG2-CE1 3.53Å; T261-F279 HydrophobicContact CG2-CZ 4.14Å
262	Q	88.1	Confident	80.4	Confident	23 Å²	23	67.7 Å²	67.7	11%	0.107	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	149.4	-174.4	-67.4	170.7	-8.8	0	0	112.8	C257 D258 C273 N274 C288	C257-Q262 HydrophobicContact CB-CB 4.26Å; D258-Q262 WeakPolarHBondContact O-CA 3.39Å; D258-Q262 WeakPolarHBondContact O-CB 3.23Å; D258-Q262 PolarHBondContact O-N 3.29Å; Q262-C273 HydrophobicContact CB-CB 4.26Å; Q262-C273 HydrophobicContact CG-CB 4.37Å; Q262-N274 CarbonylContact C-O 3.6Å; Q262-N274 WeakPolarHBondContact CA-O 3.4Å; Q262-C288 HydrophobicContact CG-CB 4.22Å; Q262-C288 WeakPolarHBondContact CG-SG 3.37Å; Q262-C288 PolarHBondContact NE2-SG 3.37Å
263	V	88.1	Confident	81.1	Confident	63 Å²	63	63 Å²	63	38%	0.382	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.5	167.1	65.9	0	0	0	0	109.6	C273 N274 L276	V263-C273 WeakPolarHBondContact O-CA 3.48Å; V263-N274 HydrophobicContact CG1-CB 3.87Å; V263-N274 PolarHBondContact N-O 3.45Å; V263-N274 PolarHBondContact O-N 3.48Å; V263-L276 HydrophobicContact CB-CD2 4.03Å
264	C	88.6	Confident	82.2	Confident	32 Å²	32	62.2 Å²	62.2	22%	0.216	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	126.6	174.9	-173.6	0	0	0	0	109.5	C250 S255 C257	C250-C264 WeakPolarHBondContact CA-SG 3.39Å; C250-C264 HydrophobicContact CB-CB 3.75Å; C250-C264 WeakPolarHBondContact CB-SG 3.4Å; C250-C264 WeakPolarHBondContact SG-CB 3.33Å; C250-C264 CovalentContact SG-SG 2.04Å; C250-C264 PolarHBondContact SG-SG 2.81Å; S255-C264 WeakPolarHBondContact CB-SG 3.36Å; C257-C264 HydrophobicContact CB-CB 4.38Å
265	E	87.7	Confident	83.3	Confident	75 Å²	75	60.9 Å²	60.9	35%	0.35	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.1	171	-72.5	-169.2	-147.2	0	0	110.4	Y271 R272 N274	E265-Y271 WeakPolarHBondContact O-CA 3.49Å; E265-R272 HydrophobicContact CB-CG 4.12Å; E265-R272 VanDerWaalsContact CD-NH2 3.33Å; E265-R272 PolarHBondContact N-O 2.64Å; E265-R272 PolarHBondContact O-N 2.03Å; E265-R272 IonicContact OE1-NH2 3.59Å; E265-R272 IonicContact OE2-CZ 2.9Å; E265-R272 IonicContact OE2-NH1 2.79Å; E265-R272 PolarHBondContact OE2-NH1 3.28Å; E265-R272 IonicContact OE2-NH2 2.71Å; E265-R272 PolarHBondContact OE2-NH2 3.22Å; E265-N274 PolarHBondContact OE1-ND2 2.85Å
266	N	83.3	Confident	84	Confident	56 Å²	56	62.3 Å²	62.3	30%	0.299	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	135.6	176.3	-171.7	51.3	0	0	0	110.5	D246 E249 C250 S270	D246-N266 PolarHBondContact OD2-ND2 2.82Å; E249-N266 PolarHBondContact OE2-OD1 3.35Å; C250-N266 PolarHBondContact SG-N 3Å; C250-N266 VanDerWaalsContact SG-N 3.42Å; N266-S270 PolarHBondContact OD1-O 3.38Å
267	T	81.6	Confident	84.2	Confident	38 Å²	38	64.2 Å²	64.2	23%	0.233	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	148.5	179.4	56.1	0	0	0	0	109.4	G269 S270 R272	T267-G269 PolarHBondContact O-N 3.15Å; T267-S270 CarbonylContact C-O 3.55Å; T267-S270 WeakPolarHBondContact CA-O 3.36Å; T267-S270 PolarHBondContact N-O 2.97Å; T267-S270 CarbonylContact O-C 3.37Å; T267-S270 PolarHBondContact O-N 3.28Å; T267-S270 PolarHBondContact OG1-O 3.25Å; T267-R272 HydrophobicContact CG2-CG 4.34Å
268	P	77	Confident	84.3	Confident	131 Å²	131	64 Å²	64	85%	0.851	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	108.2	-178.6	-25.3	35	0	0	0	112.3
269	G	73.2	Confident	84.5	Confident	64 Å²	64	62.1 Å²	62.1	66%	0.66	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	6.4	-176.8	0	0	0	0	0	116.2	D246 T267	D246-G269 PolarHBondContact OD1-N 2.78Å; T267-G269 PolarHBondContact O-N 3.15Å
270	S	82.1	Confident	84.9	Confident	59 Å²	59	60.1 Å²	60.1	41%	0.413	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170	-173.5	178.6	-157.8	0	0	0	0	113.2	N266 T267	N266-S270 PolarHBondContact OD1-O 3.38Å; T267-S270 CarbonylContact C-O 3.55Å; T267-S270 WeakPolarHBondContact CA-O 3.36Å; T267-S270 PolarHBondContact N-O 2.97Å; T267-S270 CarbonylContact O-C 3.37Å; T267-S270 PolarHBondContact O-N 3.28Å; T267-S270 PolarHBondContact OG1-O 3.25Å
271	Y	87	Confident	85.2	Confident	52 Å²	52	62.1 Å²	62.1	20%	0.204	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	156.3	167.3	64.4	-80.5	0	0	0	109.9	E249 S255 T256 E265	E249-Y271 HydrophobicContact CB-CD1 3.41Å; E249-Y271 VanDerWaalsContact CB-CD1 3.41Å; E249-Y271 HydrophobicContact CB-CE1 4.07Å; E249-Y271 HydrophobicContact CB-CG 3.97Å; E249-Y271 HydrophobicContact CG-CD1 3.74Å; E249-Y271 HydrophobicContact CG-CE1 4.28Å; S255-Y271 VanDerWaalsContact CA-CZ 3.5Å; T256-Y271 PolarHBondContact N-OH 3.04Å; T256-Y271 PolarHBondContact OG1-OH 3.32Å; E265-Y271 WeakPolarHBondContact O-CA 3.49Å
272	R	86.3	Confident	85.3	Confident	112 Å²	112	63.5 Å²	63.5	42%	0.423	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.9	170.5	76	-174.3	-162.7	-72.4	0.5	111.3	E265 T267 N274	E265-R272 HydrophobicContact CB-CG 4.12Å; E265-R272 VanDerWaalsContact CD-NH2 3.33Å; E265-R272 PolarHBondContact N-O 2.64Å; E265-R272 PolarHBondContact O-N 2.03Å; E265-R272 IonicContact OE1-NH2 3.59Å; E265-R272 IonicContact OE2-CZ 2.9Å; E265-R272 IonicContact OE2-NH1 2.79Å; E265-R272 PolarHBondContact OE2-NH1 3.28Å; E265-R272 IonicContact OE2-NH2 2.71Å; E265-R272 PolarHBondContact OE2-NH2 3.22Å; T267-R272 HydrophobicContact CG2-CG 4.34Å; R272-N274 PolarHBondContact NH2-ND2 3.07Å
273	C	87.5	Confident	84.8	Confident	39 Å²	39	66.4 Å²	66.4	26%	0.264	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.1	177	-49	0	0	0	0	109.3	C257 Q262 V263	C257-C273 WeakPolarHBondContact CA-SG 3.4Å; C257-C273 HydrophobicContact CB-CB 3.77Å; C257-C273 WeakPolarHBondContact CB-SG 3.24Å; C257-C273 VanDerWaalsContact SG-CA 3.56Å; C257-C273 WeakPolarHBondContact SG-CB 3.3Å; C257-C273 CovalentContact SG-SG 2.03Å; C257-C273 PolarHBondContact SG-SG 2.82Å; Q262-C273 HydrophobicContact CB-CB 4.26Å; Q262-C273 HydrophobicContact CG-CB 4.37Å; V263-C273 WeakPolarHBondContact O-CA 3.48Å
274	N	88.4	Confident	84.2	Confident	48 Å²	48	69.9 Å²	69.9	26%	0.257	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	144.1	174.9	-62.7	-28.4	0	0	0	109.3	Q262 V263 E265 R272	Q262-N274 CarbonylContact C-O 3.6Å; Q262-N274 WeakPolarHBondContact CA-O 3.4Å; V263-N274 HydrophobicContact CG1-CB 3.87Å; V263-N274 PolarHBondContact N-O 3.45Å; V263-N274 PolarHBondContact O-N 3.48Å; E265-N274 PolarHBondContact OE1-ND2 2.85Å; R272-N274 PolarHBondContact NH2-ND2 3.07Å
275	C	88.8	Confident	83.7	Confident	34 Å²	34	72.7 Å²	72.7	23%	0.23	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	142.8	174.8	-60.1	0	0	0	0	111	T261 F279 C288	T261-C275 WeakPolarHBondContact O-CA 3.41Å; C275-F279 HydrophobicContact CB-CB 4.03Å; C275-C288 WeakPolarHBondContact CA-SG 3.31Å; C275-C288 HydrophobicContact CB-CB 3.83Å; C275-C288 WeakPolarHBondContact CB-SG 3.44Å; C275-C288 WeakPolarHBondContact SG-CB 2.97Å; C275-C288 CovalentContact SG-SG 2.03Å; C275-C288 PolarHBondContact SG-SG 3.42Å
276	L	87.3	Confident	83.3	Confident	64 Å²	64	71.3 Å²	71.3	34%	0.335	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-64.7	157.1	170.5	-70.9	169.8	0	0	0	110.5	T261 V263 G278 F279	T261-L276 PolarHBondContact O-N 3.21Å; V263-L276 HydrophobicContact CB-CD2 4.03Å; L276-G278 PolarHBondContact O-N 3.44Å; L276-F279 HydrophobicContact CB-CD2 3.81Å; L276-F279 HydrophobicContact CB-CE2 4.22Å; L276-F279 WeakPolarHBondContact O-CB 3.11Å; L276-F279 PolarHBondContact O-N 3.42Å
277	N	85.3	Confident	83.5	Confident	161 Å²	161	75.4 Å²	75.4	86%	0.861	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	136.8	170.4	-72.6	-28	0	0	0	109.9
278	G	83.2	Confident	83.8	Confident	16 Å²	16	73.9 Å²	73.9	17%	0.165	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	-0.2	-171.7	0	0	0	0	0	114.1	L276 I291	L276-G278 PolarHBondContact O-N 3.44Å; G278-I291 PolarHBondContact O-N 2.81Å
279	F	89.4	Confident	84.4	Confident	26 Å²	26	69.4 Å²	69.4	11%	0.114	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.7	176.2	-60.5	-98.1	0	0	0	111.6	T261 C275 L276 C288 V289 D290 V311 G312	T261-F279 HydrophobicContact CG2-CD1 3.84Å; T261-F279 HydrophobicContact CG2-CE1 3.53Å; T261-F279 HydrophobicContact CG2-CZ 4.14Å; C275-F279 HydrophobicContact CB-CB 4.03Å; L276-F279 HydrophobicContact CB-CD2 3.81Å; L276-F279 HydrophobicContact CB-CE2 4.22Å; L276-F279 WeakPolarHBondContact O-CB 3.11Å; L276-F279 PolarHBondContact O-N 3.42Å; F279-C288 HydrophobicContact CB-CB 4.12Å; F279-V289 CarbonylContact C-O 3.37Å; F279-V289 VanDerWaalsContact CA-O 3.29Å; F279-V289 WeakPolarHBondContact CA-O 3.02Å; F279-D290 HydrophobicContact CD1-CB 4.4Å; F279-D290 HydrophobicContact CE1-CB 4.32Å; F279-V311 HydrophobicContact CE1-CG1 3.95Å; F279-V311 HydrophobicContact CZ-CG1 3.72Å; F279-G312 VanDerWaalsContact CE2-CA 3.48Å
280	S	87.1	Confident	85.1	Confident	52 Å²	52	68.5 Å²	68.5	36%	0.364	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146.7	176.4	65.6	0	0	0	0	111.3	N282 C288 V289	S280-N282 PolarHBondContact O-N 3.47Å; S280-C288 CarbonylContact O-C 3.58Å; S280-C288 WeakPolarHBondContact O-CA 3.38Å; S280-V289 PolarHBondContact N-O 2.88Å; S280-V289 WeakPolarHBondContact O-CG2 3.47Å; S280-V289 PolarHBondContact O-N 2.03Å
281	W	86.1	Confident	85.2	Confident	144 Å²	144	67.8 Å²	67.8	55%	0.545	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	119.8	178.4	-178.8	-105.7	0	0	0	111	G286	W281-G286 VanDerWaalsContact CH2-C 3.5Å; W281-G286 WeakPolarHBondContact CH2-O 3.31Å
282	N	86.2	Confident	85.1	Confident	44 Å²	44	67.7 Å²	67.7	24%	0.235	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	99.7	172.1	-168.6	-41.1	0	0	0	110.3	S280 T284 I285 G286 R287 V289	S280-N282 PolarHBondContact O-N 3.47Å; N282-T284 PolarHBondContact O-N 3.47Å; N282-T284 VanDerWaalsContact O-N 3.14Å; N282-T284 WeakPolarHBondContact OD1-CB 3.05Å; N282-T284 PolarHBondContact OD1-N 3.24Å; N282-I285 HydrophobicContact CB-CB 4.36Å; N282-I285 HydrophobicContact CB-CD1 4.44Å; N282-I285 HydrophobicContact CB-CG1 4.43Å; N282-I285 VanDerWaalsContact ND2-CD1 3.34Å; N282-I285 WeakPolarHBondContact ND2-CD1 3.27Å; N282-I285 PolarHBondContact O-N 2.89Å; N282-I285 VanDerWaalsContact O-N 3.14Å; N282-I285 PolarHBondContact OD1-N 3.43Å; N282-G286 PolarHBondContact O-N 3.46Å; N282-R287 PolarHBondContact N-O 2.94Å; N282-V289 HydrophobicContact CB-CG1 3.85Å; N282-V289 HydrophobicContact CB-CG2 3.91Å
283	A	76.4	Confident	85.1	Confident	84 Å²	84	63.3 Å²	63.3	69%	0.694	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-23.7	-179.6	0	0	0	0	0	114.1
284	T	76.6	Confident	84.9	Confident	137 Å²	137	63 Å²	63	84%	0.84	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-34	179.2	-45.5	0	0	0	0	111.8	N282	N282-T284 PolarHBondContact O-N 3.47Å; N282-T284 VanDerWaalsContact O-N 3.14Å; N282-T284 WeakPolarHBondContact OD1-CB 3.05Å; N282-T284 PolarHBondContact OD1-N 3.24Å
285	I	77.6	Confident	84.5	Confident	91 Å²	91	66.9 Å²	66.9	47%	0.467	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-14.5	-175.6	-46.7	173	0	0	0	111.4	N282 R287	N282-I285 HydrophobicContact CB-CB 4.36Å; N282-I285 HydrophobicContact CB-CD1 4.44Å; N282-I285 HydrophobicContact CB-CG1 4.43Å; N282-I285 VanDerWaalsContact ND2-CD1 3.34Å; N282-I285 WeakPolarHBondContact ND2-CD1 3.27Å; N282-I285 PolarHBondContact O-N 2.89Å; N282-I285 VanDerWaalsContact O-N 3.14Å; N282-I285 PolarHBondContact OD1-N 3.43Å; I285-R287 HydrophobicContact CB-CG 4.2Å; I285-R287 HydrophobicContact CG2-CG 3.86Å
286	G	79.8	Confident	83.9	Confident	45 Å²	45	70 Å²	70	46%	0.464	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	29.4	179.4	0	0	0	0	0	113.9	W281 N282	W281-G286 VanDerWaalsContact CH2-C 3.5Å; W281-G286 WeakPolarHBondContact CH2-O 3.31Å; N282-G286 PolarHBondContact O-N 3.46Å
287	R	86.3	Confident	82.9	Confident	142 Å²	142	76.7 Å²	76.7	54%	0.536	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	161	-179.7	67.9	-177.1	179.8	-177.5	-1.6	112.1	N282 I285 V289	N282-R287 PolarHBondContact N-O 2.94Å; I285-R287 HydrophobicContact CB-CG 4.2Å; I285-R287 HydrophobicContact CG2-CG 3.86Å; R287-V289 HydrophobicContact CG-CG1 4.31Å
288	C	87.7	Confident	82.1	Confident	6 Å²	6	75.4 Å²	75.4	4%	0.041	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	130.6	170.7	-62.3	0	0	0	0	109.6	Q262 C275 F279 S280	Q262-C288 HydrophobicContact CG-CB 4.22Å; Q262-C288 WeakPolarHBondContact CG-SG 3.37Å; Q262-C288 PolarHBondContact NE2-SG 3.37Å; C275-C288 WeakPolarHBondContact CA-SG 3.31Å; C275-C288 HydrophobicContact CB-CB 3.83Å; C275-C288 WeakPolarHBondContact CB-SG 3.44Å; C275-C288 WeakPolarHBondContact SG-CB 2.97Å; C275-C288 CovalentContact SG-SG 2.03Å; C275-C288 PolarHBondContact SG-SG 3.42Å; F279-C288 HydrophobicContact CB-CB 4.12Å; S280-C288 CarbonylContact O-C 3.58Å; S280-C288 WeakPolarHBondContact O-CA 3.38Å
289	V	89.3	Confident	81.3	Confident	38 Å²	38	76.7 Å²	76.7	23%	0.23	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	143.9	176.3	-62.4	0	0	0	0	109	F279 S280 N282 R287 I291	F279-V289 CarbonylContact C-O 3.37Å; F279-V289 VanDerWaalsContact CA-O 3.29Å; F279-V289 WeakPolarHBondContact CA-O 3.02Å; S280-V289 PolarHBondContact N-O 2.88Å; S280-V289 WeakPolarHBondContact O-CG2 3.47Å; S280-V289 PolarHBondContact O-N 2.03Å; N282-V289 HydrophobicContact CB-CG1 3.85Å; N282-V289 HydrophobicContact CB-CG2 3.91Å; R287-V289 HydrophobicContact CG-CG1 4.31Å; V289-I291 PolarHBondContact O-N 2.85Å
290	D	89.1	Confident	80.5	Confident	45 Å²	45	82.2 Å²	82.2	24%	0.241	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.3	135.7	174.2	-175	59.1	0	0	0	111.4	F279 N309 V311 G312	F279-D290 HydrophobicContact CD1-CB 4.4Å; F279-D290 HydrophobicContact CE1-CB 4.32Å; D290-N309 PolarHBondContact OD2-ND2 3.09Å; D290-N309 PolarHBondContact OD2-OD1 3.04Å; D290-V311 WeakPolarHBondContact OD1-CA 3.26Å; D290-G312 PolarHBondContact OD1-N 3.45Å
291	I	84.2	Confident	79.6	Confident	43 Å²	43	81 Å²	81	22%	0.221	42%	0.418	C	S	.	.			trans	-81.1	119.1	174	-64.7	174	0	0	0	106.6	G278 V289 E293 L296 N309	G278-I291 PolarHBondContact O-N 2.81Å; V289-I291 PolarHBondContact O-N 2.85Å; I291-E293 HydrophobicContact CG2-CG 4.04Å; I291-E293 PolarHBondContact O-N 2.92Å; I291-L296 HydrophobicContact CG2-CD1 3.48Å; I291-L296 VanDerWaalsContact CG2-CD1 3.48Å; I291-N309 PolarHBondContact O-OD1 3.36Å
292	D	84.6	Confident	78.3	Confident	51 Å²	51	79.1 Å²	79.1	27%	0.273	42%	0.417	S	S	.	.			trans	-80.5	90.9	172.6	-167.7	-34.8	0	0	0	109.6	C294 L295 L296	D292-C294 PolarHBondContact O-N 2.83Å; D292-C294 WeakPolarHBondContact OD1-CB 3.5Å; D292-C294 PolarHBondContact OD1-N 2.81Å; D292-L295 HydrophobicContact CB-CB 4.02Å; D292-L295 HydrophobicContact CB-CD1 3.91Å; D292-L295 HydrophobicContact CB-CG 4.08Å; D292-L295 VanDerWaalsContact CG-CG 3.42Å; D292-L295 PolarHBondContact O-N 2.85Å; D292-L295 VanDerWaalsContact O-N 3.16Å; D292-L295 PolarHBondContact OD1-N 3.26Å; D292-L295 VanDerWaalsContact OD2-CD1 3.24Å; D292-L295 WeakPolarHBondContact OD2-CD1 2.94Å; D292-L295 WeakPolarHBondContact OD2-CG 3.4Å; D292-L296 WeakPolarHBondContact O-CG 3.02Å; D292-L296 PolarHBondContact O-N 2.96Å; D292-L296 VanDerWaalsContact O-N 3.14Å
293	E	87.1	Confident	76.6	Confident	19 Å²	19	84.4 Å²	84.4	9%	0.089	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-25.7	-178	-60.8	92.8	161.5	0	0	112.6	I291 L296 Y297 R298 N309 W314	I291-E293 HydrophobicContact CG2-CG 4.04Å; I291-E293 PolarHBondContact O-N 2.92Å; E293-L296 PolarHBondContact O-N 3.17Å; E293-Y297 PolarHBondContact O-N 3.33Å; E293-R298 HydrophobicContact CB-CB 4.38Å; E293-R298 PolarHBondContact O-N 3.38Å; E293-N309 PolarHBondContact OE2-OD1 3.4Å; E293-W314 HydrophobicContact CB-CB 4.13Å; E293-W314 VanDerWaalsContact CB-CD1 3.45Å; E293-W314 HydrophobicContact CB-CD2 4.43Å; E293-W314 HydrophobicContact CB-CG 3.71Å; E293-W314 HydrophobicContact CG-CG 4.07Å
294	C	81.9	Confident	75.4	Confident	33 Å²	33	81.8 Å²	81.8	22%	0.223	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-32.9	175.4	-50.2	0	0	0	0	112.2	D292 C307 I308 N309	D292-C294 PolarHBondContact O-N 2.83Å; D292-C294 WeakPolarHBondContact OD1-CB 3.5Å; D292-C294 PolarHBondContact OD1-N 2.81Å; C294-C307 WeakPolarHBondContact CA-SG 3.42Å; C294-C307 HydrophobicContact CB-CB 3.75Å; C294-C307 WeakPolarHBondContact CB-SG 3.26Å; C294-C307 WeakPolarHBondContact SG-CB 3.35Å; C294-C307 CovalentContact SG-SG 2.04Å; C294-C307 PolarHBondContact SG-SG 3.06Å; C294-I308 VanDerWaalsContact SG-C 3.55Å; C294-N309 PolarHBondContact SG-N 2.68Å
295	L	81.8	Confident	74.8	Confident	130 Å²	130	78 Å²	78	68%	0.681	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-26.2	173.8	-72.3	178.5	0	0	0	112.9	D292	D292-L295 HydrophobicContact CB-CB 4.02Å; D292-L295 HydrophobicContact CB-CD1 3.91Å; D292-L295 HydrophobicContact CB-CG 4.08Å; D292-L295 VanDerWaalsContact CG-CG 3.42Å; D292-L295 PolarHBondContact O-N 2.85Å; D292-L295 VanDerWaalsContact O-N 3.16Å; D292-L295 PolarHBondContact OD1-N 3.26Å; D292-L295 VanDerWaalsContact OD2-CD1 3.24Å; D292-L295 WeakPolarHBondContact OD2-CD1 2.94Å; D292-L295 WeakPolarHBondContact OD2-CG 3.4Å
296	L	75.9	Confident	74.5	Confident	99 Å²	99	80.9 Å²	80.9	52%	0.518	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	0.9	-178.6	-67.1	175.2	0	0	0	113.9	I291 D292 E293 R298	I291-L296 HydrophobicContact CG2-CD1 3.48Å; I291-L296 VanDerWaalsContact CG2-CD1 3.48Å; D292-L296 WeakPolarHBondContact O-CG 3.02Å; D292-L296 PolarHBondContact O-N 2.96Å; D292-L296 VanDerWaalsContact O-N 3.14Å; E293-L296 PolarHBondContact O-N 3.17Å; L296-R298 HydrophobicContact CB-CG 4.36Å; L296-R298 PolarHBondContact O-N 3.2Å
297	Y	65.4	Low	74.5	Confident	205 Å²	205	79.9 Å²	79.9	80%	0.804	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	36.1	-173.9	-59.8	-86	0	0	0	112.5	E293	E293-Y297 PolarHBondContact O-N 3.33Å
298	R	69.2	Low	74.3	Confident	134 Å²	134	75.2 Å²	75.2	51%	0.506	38%	0.381	S	S	.	.			trans	-105	12.7	175.6	-75	-168.8	-176.1	-170.7	2.4	112.5	P181 E293 L296	P181-R298 VanDerWaalsContact CB-NH2 3.29Å; E293-R298 HydrophobicContact CB-CB 4.38Å; E293-R298 PolarHBondContact O-N 3.38Å; L296-R298 HydrophobicContact CB-CG 4.36Å; L296-R298 PolarHBondContact O-N 3.2Å
299	D	65.7	Low	73.9	Confident	42 Å²	42	77.1 Å²	77.1	23%	0.225	39%	0.39	C	S	.	.			trans	-79.4	117.6	170.4	61.1	-63.7	0	0	0	110.1	C301 C307 W314	D299-C301 HydrophobicContact CB-CB 4.46Å; D299-C301 PolarHBondContact O-N 2.05Å; D299-C301 WeakPolarHBondContact OD2-CB 3.41Å; D299-C307 HydrophobicContact CB-CB 3.95Å; D299-C307 WeakPolarHBondContact CB-SG 3.3Å; D299-C307 WeakPolarHBondContact OD2-CB 3.03Å; D299-W314 HydrophobicContact CB-CD2 4.04Å; D299-W314 HydrophobicContact CB-CE3 3.53Å; D299-W314 HydrophobicContact CB-CZ3 3.78Å
300	D	72.7	Confident	73.6	Confident	143 Å²	143	77.2 Å²	77.2	77%	0.765	39%	0.391	S	S	*	.			trans	-72.7	36.2	167.5	-55.2	-48.5	0	0	0	111.7	W314	D300-W314 HydrophobicContact CB-CH2 3.66Å; D300-W314 HydrophobicContact CB-CZ2 4.31Å; D300-W314 VanDerWaalsContact N-CZ3 3.27Å
301	C	67.3	Low	73.3	Confident	26 Å²	26	81 Å²	81	18%	0.176	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-74.1	130.3	176	-67.5	0	0	0	0	110.7	D299 Q305 C316	D299-C301 HydrophobicContact CB-CB 4.46Å; D299-C301 PolarHBondContact O-N 2.05Å; D299-C301 WeakPolarHBondContact OD2-CB 3.41Å; C301-Q305 HydrophobicContact CB-CB 4.3Å; C301-C316 WeakPolarHBondContact CA-SG 3.04Å; C301-C316 HydrophobicContact CB-CB 3.95Å; C301-C316 WeakPolarHBondContact CB-SG 3.41Å; C301-C316 VanDerWaalsContact SG-CA 3.55Å; C301-C316 WeakPolarHBondContact SG-CB 3.42Å; C301-C316 CovalentContact SG-SG 2.04Å; C301-C316 PolarHBondContact SG-SG 3.26Å
302	I	60	Low	73.1	Confident	104 Å²	104	80 Å²	80	53%	0.533	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-75.7	154.9	177.7	52.8	161.5	0	0	0	111.3	G304 Q305	I302-G304 PolarHBondContact O-N 2.86Å; I302-Q305 HydrophobicContact CD1-CG 4.46Å; I302-Q305 HydrophobicContact CG1-CG 3.83Å; I302-Q305 WeakPolarHBondContact O-CB 3.28Å; I302-Q305 PolarHBondContact O-N 2.94Å
303	V	49.3	Very low	73.1	Confident	156 Å²	156	80.4 Å²	80.4	95%	0.945	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	122	174	-177.1	0	0	0	0	109.8
304	G	52.2	Low	72.9	Confident	29 Å²	29	82.5 Å²	82.5	30%	0.299	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.3	7.2	-172.5	0	0	0	0	0	115.1	I302 T319	I302-G304 PolarHBondContact O-N 2.86Å; G304-T319 PolarHBondContact O-N 2.98Å; G304-T319 VanDerWaalsContact O-N 3.11Å; G304-T319 PolarHBondContact O-OG1 2.93Å; G304-T319 VanDerWaalsContact O-OG1 3.12Å
305	Q	63.5	Low	72.8	Confident	58 Å²	58	87.7 Å²	87.7	27%	0.271	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	150.5	168.4	-63.4	175.2	-19	0	0	110.7	C301 I302 C316 I317 R318	C301-Q305 HydrophobicContact CB-CB 4.3Å; I302-Q305 HydrophobicContact CD1-CG 4.46Å; I302-Q305 HydrophobicContact CG1-CG 3.83Å; I302-Q305 WeakPolarHBondContact O-CB 3.28Å; I302-Q305 PolarHBondContact O-N 2.94Å; Q305-C316 HydrophobicContact CB-CB 3.9Å; Q305-C316 HydrophobicContact CG-CB 4.28Å; Q305-I317 CarbonylContact C-O 3.48Å; Q305-I317 VanDerWaalsContact CA-O 3.26Å; Q305-I317 WeakPolarHBondContact CA-O 3.28Å; Q305-R318 HydrophobicContact CG-CG 4.01Å
306	R	72.5	Confident	72.2	Confident	150 Å²	150	83.4 Å²	83.4	57%	0.566	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	135.2	168.4	63.9	178.3	-73.5	-160.4	0.9	109.9	C316 I317 T319	R306-C316 WeakPolarHBondContact O-CA 3.48Å; R306-I317 HydrophobicContact CG-CB 4.11Å; R306-I317 WeakPolarHBondContact CG-O 3.49Å; R306-I317 PolarHBondContact N-O 3.15Å; R306-I317 PolarHBondContact O-N 2.67Å; R306-T319 HydrophobicContact CB-CG2 3.7Å; R306-T319 HydrophobicContact CG-CG2 3.62Å
307	C	78.8	Confident	71.6	Confident	24 Å²	24	80.5 Å²	80.5	16%	0.162	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	139.7	170.7	-177.1	0	0	0	0	110.6	C294 D299	C294-C307 WeakPolarHBondContact CA-SG 3.42Å; C294-C307 HydrophobicContact CB-CB 3.75Å; C294-C307 WeakPolarHBondContact CB-SG 3.26Å; C294-C307 WeakPolarHBondContact SG-CB 3.35Å; C294-C307 CovalentContact SG-SG 2.04Å; C294-C307 PolarHBondContact SG-SG 3.06Å; D299-C307 HydrophobicContact CB-CB 3.95Å; D299-C307 WeakPolarHBondContact CB-SG 3.3Å; D299-C307 WeakPolarHBondContact OD2-CB 3.03Å
308	I	81.3	Confident	71.1	Confident	44 Å²	44	77.8 Å²	77.8	23%	0.226	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	115.5	166.5	-60.8	-165.1	0	0	0	107.2	C294 T310 W314 R315 I317	C294-I308 VanDerWaalsContact SG-C 3.55Å; I308-T310 HydrophobicContact CG2-CG2 4.47Å; I308-W314 WeakPolarHBondContact O-CA 3.38Å; I308-R315 HydrophobicContact CB-CG 4.09Å; I308-R315 PolarHBondContact N-O 2.83Å; I308-R315 PolarHBondContact O-N 2.83Å; I308-I317 HydrophobicContact CD1-CD1 3.26Å; I308-I317 HydrophobicContact CD1-CG1 3.75Å; I308-I317 HydrophobicContact CG1-CD1 4.19Å; I308-I317 HydrophobicContact CG1-CG1 4.14Å
309	N	79.6	Confident	70.4	Confident	46 Å²	46	75.5 Å²	75.5	25%	0.246	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	135.8	172.8	-176.6	32.2	0	0	0	109.5	D290 I291 E293 C294 S313	D290-N309 PolarHBondContact OD2-ND2 3.09Å; D290-N309 PolarHBondContact OD2-OD1 3.04Å; I291-N309 PolarHBondContact O-OD1 3.36Å; E293-N309 PolarHBondContact OE2-OD1 3.4Å; C294-N309 PolarHBondContact SG-N 2.68Å; N309-S313 PolarHBondContact OD1-O 2.9Å
310	T	83.7	Confident	69.8	Low	41 Å²	41	79.8 Å²	79.8	25%	0.252	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154.8	179.2	57.7	0	0	0	0	109	I308 G312 S313 W314 R315	I308-T310 HydrophobicContact CG2-CG2 4.47Å; T310-G312 PolarHBondContact O-N 2.68Å; T310-S313 CarbonylContact C-O 3.55Å; T310-S313 VanDerWaalsContact C-O 3.27Å; T310-S313 VanDerWaalsContact CA-O 3.3Å; T310-S313 WeakPolarHBondContact CA-O 2.99Å; T310-S313 PolarHBondContact N-O 3.39Å; T310-S313 CarbonylContact O-C 3.39Å; T310-S313 PolarHBondContact O-N 2.9Å; T310-S313 PolarHBondContact OG1-O 2.9Å; T310-W314 PolarHBondContact OG1-N 2.93Å; T310-R315 HydrophobicContact CG2-CG 4.25Å
311	V	82.9	Confident	68.9	Low	125 Å²	125	78.6 Å²	78.6	76%	0.758	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	112.8	-177.5	-179.8	0	0	0	0	110.5	F279 D290	F279-V311 HydrophobicContact CE1-CG1 3.95Å; F279-V311 HydrophobicContact CZ-CG1 3.72Å; D290-V311 WeakPolarHBondContact OD1-CA 3.26Å
312	G	79.1	Confident	68.3	Low	22 Å²	22	78.5 Å²	78.5	23%	0.227	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	6.5	-177.3	0	0	0	0	0	115.5	F279 D290 T310	F279-G312 VanDerWaalsContact CE2-CA 3.48Å; D290-G312 PolarHBondContact OD1-N 3.45Å; T310-G312 PolarHBondContact O-N 2.68Å
313	S	84.2	Confident	67.6	Low	59 Å²	59	75 Å²	75	41%	0.413	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	-174	-177.3	-158.5	0	0	0	0	112.7	N309 T310	N309-S313 PolarHBondContact OD1-O 2.9Å; T310-S313 CarbonylContact C-O 3.55Å; T310-S313 VanDerWaalsContact C-O 3.27Å; T310-S313 VanDerWaalsContact CA-O 3.3Å; T310-S313 WeakPolarHBondContact CA-O 2.99Å; T310-S313 PolarHBondContact N-O 3.39Å; T310-S313 CarbonylContact O-C 3.39Å; T310-S313 PolarHBondContact O-N 2.9Å; T310-S313 PolarHBondContact OG1-O 2.9Å
314	W	84	Confident	67.3	Low	63 Å²	63	73.3 Å²	73.3	24%	0.239	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	157.1	172.9	51.9	-75.7	0	0	0	109.2	E293 D299 D300 I308 T310 C316	E293-W314 HydrophobicContact CB-CB 4.13Å; E293-W314 VanDerWaalsContact CB-CD1 3.45Å; E293-W314 HydrophobicContact CB-CD2 4.43Å; E293-W314 HydrophobicContact CB-CG 3.71Å; E293-W314 HydrophobicContact CG-CG 4.07Å; D299-W314 HydrophobicContact CB-CD2 4.04Å; D299-W314 HydrophobicContact CB-CE3 3.53Å; D299-W314 HydrophobicContact CB-CZ3 3.78Å; D300-W314 HydrophobicContact CB-CH2 3.66Å; D300-W314 HydrophobicContact CB-CZ2 4.31Å; D300-W314 VanDerWaalsContact N-CZ3 3.27Å; I308-W314 WeakPolarHBondContact O-CA 3.38Å; T310-W314 PolarHBondContact OG1-N 2.93Å; W314-C316 WeakPolarHBondContact CZ3-SG 3.28Å
315	R	78.9	Confident	67.1	Low	141 Å²	141	73.8 Å²	73.8	53%	0.532	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.3	175.1	71.2	-179.2	-173.2	-150.3	3.2	111.7	I308 T310	I308-R315 HydrophobicContact CB-CG 4.09Å; I308-R315 PolarHBondContact N-O 2.83Å; I308-R315 PolarHBondContact O-N 2.83Å; T310-R315 HydrophobicContact CG2-CG 4.25Å
316	C	70.7	Confident	66.6	Low	40 Å²	40	72.7 Å²	72.7	27%	0.27	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127.6	175.4	-51.2	0	0	0	0	110.6	C301 Q305 R306 W314	C301-C316 WeakPolarHBondContact CA-SG 3.04Å; C301-C316 HydrophobicContact CB-CB 3.95Å; C301-C316 WeakPolarHBondContact CB-SG 3.41Å; C301-C316 VanDerWaalsContact SG-CA 3.55Å; C301-C316 WeakPolarHBondContact SG-CB 3.42Å; C301-C316 CovalentContact SG-SG 2.04Å; C301-C316 PolarHBondContact SG-SG 3.26Å; Q305-C316 HydrophobicContact CB-CB 3.9Å; Q305-C316 HydrophobicContact CG-CB 4.28Å; R306-C316 WeakPolarHBondContact O-CA 3.48Å; W314-C316 WeakPolarHBondContact CZ3-SG 3.28Å
317	I	62.5	Low	66.1	Low	39 Å²	39	71.5 Å²	71.5	20%	0.2	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.2	172.2	-55.9	-158.6	0	0	0	108.8	Q305 R306 I308 T319	Q305-I317 CarbonylContact C-O 3.48Å; Q305-I317 VanDerWaalsContact CA-O 3.26Å; Q305-I317 WeakPolarHBondContact CA-O 3.28Å; R306-I317 HydrophobicContact CG-CB 4.11Å; R306-I317 WeakPolarHBondContact CG-O 3.49Å; R306-I317 PolarHBondContact N-O 3.15Å; R306-I317 PolarHBondContact O-N 2.67Å; I308-I317 HydrophobicContact CD1-CD1 3.26Å; I308-I317 HydrophobicContact CD1-CG1 3.75Å; I308-I317 HydrophobicContact CG1-CD1 4.19Å; I308-I317 HydrophobicContact CG1-CG1 4.14Å; I317-T319 PolarHBondContact O-N 3.35Å
318	R	54.7	Low	65.1	Low	148 Å²	148	74.8 Å²	74.8	56%	0.558	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	134.7	174.9	-92.1	-177.4	172.6	147.2	-7.3	111.1	Q305	Q305-R318 HydrophobicContact CG-CG 4.01Å
319	T	55.4	Low	64.2	Low	86 Å²	86	74.5 Å²	74.5	53%	0.528	41%	0.413	S	S	.	.			trans	-100.8	-6.5	176.5	47.9	0	0	0	0	113.5	G304 R306 I317	G304-T319 PolarHBondContact O-N 2.98Å; G304-T319 VanDerWaalsContact O-N 3.11Å; G304-T319 PolarHBondContact O-OG1 2.93Å; G304-T319 VanDerWaalsContact O-OG1 3.12Å; R306-T319 HydrophobicContact CB-CG2 3.7Å; R306-T319 HydrophobicContact CG-CG2 3.62Å; I317-T319 PolarHBondContact O-N 3.35Å
320	L	52.3	Low	62.9	Low	132 Å²	132	77.6 Å²	77.6	69%	0.691	44%	0.438	S	S	*	.	S	Bend	trans	-94.3	139.2	177.9	-105.4	83.7	0	0	0	113
321	S	53.8	Low	61.6	Low	118 Å²	118	84.1 Å²	84.1	83%	0.825	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-62	146.2	176.4	-47.2	0	0	0	0	112.7
322	C	54.4	Low	60.6	Low	23 Å²	23	81.9 Å²	81.9	16%	0.155	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-58.7	145.1	169.1	-63.2	0	0	0	0	110.7	L328 C335	C322-L328 PolarHBondContact SG-N 3.36Å; C322-C335 HydrophobicContact CB-CB 3.81Å; C322-C335 WeakPolarHBondContact CB-SG 3.32Å; C322-C335 VanDerWaalsContact SG-CA 3.52Å; C322-C335 WeakPolarHBondContact SG-CB 3.15Å; C322-C335 CovalentContact SG-SG 2.04Å; C322-C335 PolarHBondContact SG-SG 3.25Å
323	G	46.6	Very low	59.5	Low	30 Å²	30	85.6 Å²	85.6	31%	0.309	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-57.2	160.7	178.3	0	0	0	0	0	113	G325 Y326	G323-G325 PolarHBondContact O-N 3.23Å; G323-G325 VanDerWaalsContact O-N 3.14Å; G323-Y326 PolarHBondContact O-N 2.58Å; G323-Y326 VanDerWaalsContact O-N 3.07Å
324	T	43.3	Very low	57.8	Low	122 Å²	122	86.1 Å²	86.1	75%	0.748	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	119.9	179.9	34.7	0	0	0	0	111.9	I350	T324-I350 WeakPolarHBondContact OG1-CD1 3.4Å
325	G	47.3	Very low	56.4	Low	39 Å²	39	85 Å²	85	40%	0.402	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.4	-4.4	-177.3	0	0	0	0	0	115.1	G323 D338	G323-G325 PolarHBondContact O-N 3.23Å; G323-G325 VanDerWaalsContact O-N 3.14Å; G325-D338 PolarHBondContact O-N 3.49Å
326	Y	53.7	Low	55.5	Low	34 Å²	34	80.1 Å²	80.1	13%	0.133	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	149.3	-179.4	-64.7	-90.1	0	0	0	111.8	G323 V336 A337 H370	G323-Y326 PolarHBondContact O-N 2.58Å; G323-Y326 VanDerWaalsContact O-N 3.07Å; Y326-V336 CarbonylContact C-O 3.58Å; Y326-V336 VanDerWaalsContact CA-O 3.31Å; Y326-V336 WeakPolarHBondContact CA-O 3.26Å; Y326-A337 HydrophobicContact CD1-CB 4.15Å; Y326-A337 HydrophobicContact CE1-CB 3.79Å; Y326-H370 AromaticContact CE1-CE1 3.33Å; Y326-H370 WeakPolarHBondContact CE1-CE1 3.37Å; Y326-H370 AromaticContact CE1-ND1 3.19Å; Y326-H370 WeakPolarHBondContact CE1-ND1 3.33Å; Y326-H370 AromaticContact CZ-CE1 3.49Å; Y326-H370 VanDerWaalsContact CZ-CE1 3.49Å; Y326-H370 AromaticContact CZ-ND1 3.5Å; Y326-H370 PolarHBondContact OH-CE1 2.99Å; Y326-H370 PolarHBondContact OH-ND1 3.02Å; Y326-H370 VanDerWaalsContact OH-ND1 3.15Å; Y326-H370 PolarHBondContact OH-NE2 2.67Å; Y326-H370 VanDerWaalsContact OH-NE2 3.13Å
327	Y	60.2	Low	54.9	Low	126 Å²	126	80.5 Å²	80.5	49%	0.494	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	151	170.6	66	-85.1	0	0	0	110.2	D329 C335 V336 D338	Y327-D329 PolarHBondContact O-N 2.88Å; Y327-C335 CarbonylContact O-C 3.59Å; Y327-C335 WeakPolarHBondContact O-CA 3.1Å; Y327-V336 HydrophobicContact CD1-CG2 4.04Å; Y327-V336 VanDerWaalsContact CD1-O 3.28Å; Y327-V336 WeakPolarHBondContact CD1-O 3.02Å; Y327-V336 HydrophobicContact CD2-CG2 3.62Å; Y327-V336 HydrophobicContact CE1-CB 4.36Å; Y327-V336 HydrophobicContact CE1-CG2 3.69Å; Y327-V336 HydrophobicContact CE2-CG2 3.24Å; Y327-V336 HydrophobicContact CG-CG2 4.01Å; Y327-V336 PolarHBondContact N-O 3.27Å; Y327-V336 VanDerWaalsContact O-CG2 3.27Å; Y327-V336 WeakPolarHBondContact O-CG2 3.39Å; Y327-V336 PolarHBondContact O-N 3.5Å; Y327-D338 HydrophobicContact CD1-CB 4.27Å
328	L	58.6	Low	54.5	Low	93 Å²	93	82.3 Å²	82.3	49%	0.487	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	118.6	178.3	-174.7	69.1	0	0	0	109	C322 S330	C322-L328 PolarHBondContact SG-N 3.36Å; L328-S330 PolarHBondContact O-N 3.1Å
329	D	62	Low	54.6	Low	38 Å²	38	86.7 Å²	86.7	20%	0.203	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	112.7	169.7	179.3	-0.6	0	0	0	109.3	Y327 E331 T332 D333 T334 V336	Y327-D329 PolarHBondContact O-N 2.88Å; D329-E331 PolarHBondContact O-N 3.17Å; D329-E331 PolarHBondContact OD1-N 3.16Å; D329-T332 WeakPolarHBondContact CB-OG1 3.1Å; D329-T332 PolarHBondContact O-N 3.01Å; D329-T332 WeakPolarHBondContact OD2-CG2 3.32Å; D329-T332 PolarHBondContact OD2-OG1 3.17Å; D329-D333 WeakPolarHBondContact O-CA 3.36Å; D329-D333 PolarHBondContact O-N 3.46Å; D329-T334 WeakPolarHBondContact CB-O 3.42Å; D329-T334 PolarHBondContact N-O 2.86Å; D329-V336 HydrophobicContact CB-CG1 4.28Å; D329-V336 HydrophobicContact CB-CG2 3.83Å
330	S	52	Low	54.5	Low	110 Å²	110	86.8 Å²	86.8	77%	0.769	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-15.8	-178.8	53.5	0	0	0	0	114.5	L328	L328-S330 PolarHBondContact O-N 3.1Å
331	E	57.7	Low	54.4	Low	179 Å²	179	82.9 Å²	82.9	84%	0.836	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-30.7	177.6	-70.5	-174.7	168.5	0	0	112.5	D329	D329-E331 PolarHBondContact O-N 3.17Å; D329-E331 PolarHBondContact OD1-N 3.16Å
332	T	61.9	Low	54.1	Low	77 Å²	77	87.6 Å²	87.6	47%	0.472	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-8.4	-174.7	63.2	0	0	0	0	114.2	D329 T334	D329-T332 WeakPolarHBondContact CB-OG1 3.1Å; D329-T332 PolarHBondContact O-N 3.01Å; D329-T332 WeakPolarHBondContact OD2-CG2 3.32Å; D329-T332 PolarHBondContact OD2-OG1 3.17Å; T332-T334 PolarHBondContact O-N 3.5Å; T332-T334 PolarHBondContact OG1-N 3.13Å; T332-T334 PolarHBondContact OG1-OG1 3.42Å
333	D	55.1	Low	53.6	Low	101 Å²	101	89.1 Å²	89.1	54%	0.54	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	29.6	-169.8	-79.3	-28.4	0	0	0	112.6	D329	D329-D333 WeakPolarHBondContact O-CA 3.36Å; D329-D333 PolarHBondContact O-N 3.46Å
334	T	48.3	Very low	53.5	Low	69 Å²	69	99.4 Å²	99.4	42%	0.423	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	149.2	178.8	67.1	0	0	0	0	112.6	D329 T332	D329-T334 WeakPolarHBondContact CB-O 3.42Å; D329-T334 PolarHBondContact N-O 2.86Å; T332-T334 PolarHBondContact O-N 3.5Å; T332-T334 PolarHBondContact OG1-N 3.13Å; T332-T334 PolarHBondContact OG1-OG1 3.42Å
335	C	55.5	Low	53.6	Low	40 Å²	40	105.1 Å²	105.1	27%	0.27	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	117.2	172.8	-67.7	0	0	0	0	110.1	C322 Y327	C322-C335 HydrophobicContact CB-CB 3.81Å; C322-C335 WeakPolarHBondContact CB-SG 3.32Å; C322-C335 VanDerWaalsContact SG-CA 3.52Å; C322-C335 WeakPolarHBondContact SG-CB 3.15Å; C322-C335 CovalentContact SG-SG 2.04Å; C322-C335 PolarHBondContact SG-SG 3.25Å; Y327-C335 CarbonylContact O-C 3.59Å; Y327-C335 WeakPolarHBondContact O-CA 3.1Å
336	V	60.6	Low	53.7	Low	39 Å²	39	105.7 Å²	105.7	24%	0.236	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	140.9	-178.2	-78	0	0	0	0	110.8	Y326 Y327 D329	Y326-V336 CarbonylContact C-O 3.58Å; Y326-V336 VanDerWaalsContact CA-O 3.31Å; Y326-V336 WeakPolarHBondContact CA-O 3.26Å; Y327-V336 HydrophobicContact CD1-CG2 4.04Å; Y327-V336 VanDerWaalsContact CD1-O 3.28Å; Y327-V336 WeakPolarHBondContact CD1-O 3.02Å; Y327-V336 HydrophobicContact CD2-CG2 3.62Å; Y327-V336 HydrophobicContact CE1-CB 4.36Å; Y327-V336 HydrophobicContact CE1-CG2 3.69Å; Y327-V336 HydrophobicContact CE2-CG2 3.24Å; Y327-V336 HydrophobicContact CG-CG2 4.01Å; Y327-V336 PolarHBondContact N-O 3.27Å; Y327-V336 VanDerWaalsContact O-CG2 3.27Å; Y327-V336 WeakPolarHBondContact O-CG2 3.39Å; Y327-V336 PolarHBondContact O-N 3.5Å; D329-V336 HydrophobicContact CB-CG1 4.28Å; D329-V336 HydrophobicContact CB-CG2 3.83Å
337	A	56.1	Low	53.4	Low	48 Å²	48	111.5 Å²	111.5	40%	0.397	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.2	135.3	-177.6	0	0	0	0	0	111.3	Y326 R339	Y326-A337 HydrophobicContact CD1-CB 4.15Å; Y326-A337 HydrophobicContact CE1-CB 3.79Å; A337-R339 PolarHBondContact O-N 2.89Å; A337-R339 VanDerWaalsContact O-N 3.11Å
338	D	54.9	Low	53.1	Low	76 Å²	76	109.3 Å²	109.3	41%	0.406	56%	0.563	S	S	.	*			trans	-69.3	106.1	175.8	-174.6	-1.2	0	0	0	111.3	G325 Y327 S340 C341	G325-D338 PolarHBondContact O-N 3.49Å; Y327-D338 HydrophobicContact CD1-CB 4.27Å; D338-S340 PolarHBondContact O-N 2.76Å; D338-S340 VanDerWaalsContact O-N 3.11Å; D338-S340 VanDerWaalsContact OD1-CB 3.25Å; D338-S340 WeakPolarHBondContact OD1-CB 3.18Å; D338-S340 PolarHBondContact OD1-N 3.07Å; D338-S340 PolarHBondContact OD1-OG 2.71Å; D338-S340 PolarHBondContact OD2-OG 3.18Å; D338-C341 PolarHBondContact O-N 3.28Å
339	R	57.1	Low	52.9	Low	241 Å²	241	106.8 Å²	106.8	91%	0.909	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-4.3	179.1	-65	-174.5	-169.3	-179.6	4.9	113.6	A337	A337-R339 PolarHBondContact O-N 2.89Å; A337-R339 VanDerWaalsContact O-N 3.11Å
340	S	52.9	Low	53	Low	88 Å²	88	108.5 Å²	108.5	62%	0.615	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-8.2	-179.1	74.8	0	0	0	0	114.4	D338 K342	D338-S340 PolarHBondContact O-N 2.76Å; D338-S340 VanDerWaalsContact O-N 3.11Å; D338-S340 VanDerWaalsContact OD1-CB 3.25Å; D338-S340 WeakPolarHBondContact OD1-CB 3.18Å; D338-S340 PolarHBondContact OD1-N 3.07Å; D338-S340 PolarHBondContact OD1-OG 2.71Å; D338-S340 PolarHBondContact OD2-OG 3.18Å; S340-K342 PolarHBondContact O-N 3.14Å
341	C	49.4	Very low	54.1	Low	50 Å²	50	105.9 Å²	105.9	34%	0.338	54%	0.536	S	S	.	.			trans	-76.8	93	179.7	-126.8	0	0	0	0	112.3	D338 A343 C346	D338-C341 PolarHBondContact O-N 3.28Å; C341-A343 PolarHBondContact O-N 2.79Å; C341-C346 HydrophobicContact CB-CB 3.43Å; C341-C346 VanDerWaalsContact CB-CB 3.43Å; C341-C346 WeakPolarHBondContact CB-SG 3.09Å; C341-C346 WeakPolarHBondContact SG-CB 3.11Å; C341-C346 CovalentContact SG-SG 2.06Å; C341-C346 PolarHBondContact SG-SG 3.26Å
342	K	48	Very low	54.8	Low	217 Å²	217	98.7 Å²	98.7	94%	0.943	50%	0.503	S	S	*	.			trans	-72.2	0.1	176.3	-83.8	179.7	177.3	174	0	115.2	S340	S340-K342 PolarHBondContact O-N 3.14Å
343	A	43.6	Very low	55.5	Low	55 Å²	55	96.6 Å²	96.6	46%	0.455	49%	0.491	S	S	.	.	S	Bend	trans	-98.2	129.2	-178.6	0	0	0	0	0	111.2	C341 R345 C346 F347	C341-A343 PolarHBondContact O-N 2.79Å; A343-R345 PolarHBondContact O-N 3.15Å; A343-C346 PolarHBondContact O-N 2.71Å; A343-F347 WeakPolarHBondContact O-CE2 3.32Å
344	R	45.1	Very low	56.6	Low	246 Å²	246	99.1 Å²	99.1	93%	0.928	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	8.1	177.5	-82.3	-176.6	174.6	175.6	-1.9	116
345	R	46.2	Very low	57.7	Low	241 Å²	241	101.2 Å²	101.2	91%	0.909	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-4.1	178.1	-78.4	-172.9	-171.1	171.7	2.7	114.8	A343 F347	A343-R345 PolarHBondContact O-N 3.15Å; R345-F347 VanDerWaalsContact C-N 3.32Å
346	C	48	Very low	58.4	Low	51 Å²	51	101.9 Å²	101.9	35%	0.345	52%	0.522	S	S	.	.	S	Bend	trans	-90.5	13.2	177	-40.4	0	0	0	0	113.9	C341 A343	C341-C346 HydrophobicContact CB-CB 3.43Å; C341-C346 VanDerWaalsContact CB-CB 3.43Å; C341-C346 WeakPolarHBondContact CB-SG 3.09Å; C341-C346 WeakPolarHBondContact SG-CB 3.11Å; C341-C346 CovalentContact SG-SG 2.06Å; C341-C346 PolarHBondContact SG-SG 3.26Å; A343-C346 PolarHBondContact O-N 2.71Å
347	F	47.2	Very low	58.8	Low	156 Å²	156	104.5 Å²	104.5	68%	0.684	54%	0.539	S	S	*	.			trans	-110.3	4.3	-167.4	-68.6	-79.4	0	0	0	114.8	A343 R345	A343-F347 WeakPolarHBondContact O-CE2 3.32Å; R345-F347 VanDerWaalsContact C-N 3.32Å
348	A	55.5	Low	59.7	Low	80 Å²	80	105.4 Å²	105.4	66%	0.661	53%	0.534	S	S	*	.			trans	-105.9	115.2	178.2	0	0	0	0	0	108.6	I350	A348-I350 PolarHBondContact O-N 2.84Å
349	D	54.8	Low	60.4	Low	40 Å²	40	108.1 Å²	108.1	21%	0.214	55%	0.549	C	S	.	.			trans	-49.4	131.6	158.4	-171.3	42.4	0	0	0	109.5	D351 N368 G371	D349-D351 PolarHBondContact O-N 3.34Å; D349-N368 PolarHBondContact OD2-ND2 3.11Å; D349-G371 PolarHBondContact OD1-N 2.95Å
350	I	64	Low	60.9	Low	75 Å²	75	97.5 Å²	97.5	39%	0.385	51%	0.512	S	S	.	.			trans	-81.2	112.1	178.1	-66.5	178.2	0	0	0	106	T324 A348 E352 L355	T324-I350 WeakPolarHBondContact OG1-CD1 3.4Å; A348-I350 PolarHBondContact O-N 2.84Å; I350-E352 HydrophobicContact CG2-CG 4.31Å; I350-E352 PolarHBondContact O-N 2.03Å; I350-L355 HydrophobicContact CG2-CD1 3.35Å
351	D	74.2	Confident	61.4	Low	55 Å²	55	94.9 Å²	94.9	29%	0.294	50%	0.499	S	S	.	.			trans	-76.2	89.3	178	-169.8	-27.1	0	0	0	110.2	D349 C353 M354 L355	D349-D351 PolarHBondContact O-N 3.34Å; D351-C353 PolarHBondContact O-N 3.46Å; D351-C353 WeakPolarHBondContact OD1-CA 3.29Å; D351-C353 VanDerWaalsContact OD1-CB 3.28Å; D351-C353 WeakPolarHBondContact OD1-CB 3.41Å; D351-C353 PolarHBondContact OD1-N 2.98Å; D351-C353 VanDerWaalsContact OD1-N 3.13Å; D351-M354 HydrophobicContact CB-CB 3.93Å; D351-M354 HydrophobicContact CB-CG 4.05Å; D351-M354 PolarHBondContact O-N 3.47Å; D351-M354 VanDerWaalsContact O-N 3.09Å; D351-M354 PolarHBondContact OD1-N 3.32Å; D351-M354 WeakPolarHBondContact OD2-CG 3.47Å; D351-L355 WeakPolarHBondContact O-CG 3.41Å; D351-L355 PolarHBondContact O-N 3.29Å
352	E	72.3	Confident	62.1	Low	28 Å²	28	96.4 Å²	96.4	13%	0.131	51%	0.508	C	S	.	.	H	α-helix	trans	-66	-21.3	-179.4	-57.5	93.1	166.1	0	0	112.4	I350 G356 T357 N368 S372 F373	I350-E352 HydrophobicContact CG2-CG 4.31Å; I350-E352 PolarHBondContact O-N 2.03Å; E352-G356 PolarHBondContact O-N 3.4Å; E352-G356 VanDerWaalsContact O-N 3.12Å; E352-T357 WeakPolarHBondContact CA-OG1 3.4Å; E352-T357 WeakPolarHBondContact CB-OG1 3.29Å; E352-T357 PolarHBondContact O-N 2.71Å; E352-N368 PolarHBondContact OE2-OD1 2.79Å; E352-S372 VanDerWaalsContact OE2-C 3.22Å; E352-S372 VanDerWaalsContact OE2-O 3.1Å; E352-F373 HydrophobicContact CB-CB 4.39Å; E352-F373 HydrophobicContact CB-CD1 3.59Å; E352-F373 HydrophobicContact CB-CE1 4.24Å; E352-F373 HydrophobicContact CB-CG 4.2Å; E352-F373 HydrophobicContact CG-CD1 3.84Å; E352-F373 HydrophobicContact CG-CE1 4.39Å
353	C	77.4	Confident	62.7	Low	32 Å²	32	86.6 Å²	86.6	22%	0.216	47%	0.469	C	S	.	.	H	α-helix	trans	-70.4	-37.8	173.1	-55.1	0	0	0	0	111.5	D351 C366 R367 N368	D351-C353 PolarHBondContact O-N 3.46Å; D351-C353 WeakPolarHBondContact OD1-CA 3.29Å; D351-C353 VanDerWaalsContact OD1-CB 3.28Å; D351-C353 WeakPolarHBondContact OD1-CB 3.41Å; D351-C353 PolarHBondContact OD1-N 2.98Å; D351-C353 VanDerWaalsContact OD1-N 3.13Å; C353-C366 WeakPolarHBondContact CA-SG 3.45Å; C353-C366 HydrophobicContact CB-CB 3.77Å; C353-C366 WeakPolarHBondContact CB-SG 2.92Å; C353-C366 WeakPolarHBondContact SG-CB 3.35Å; C353-C366 CovalentContact SG-SG 2.04Å; C353-C366 PolarHBondContact SG-SG 2.92Å; C353-R367 PolarHBondContact SG-N 3.09Å; C353-R367 VanDerWaalsContact SG-N 3.42Å; C353-N368 PolarHBondContact SG-N 3.01Å
354	M	77.9	Confident	64	Low	155 Å²	155	88.3 Å²	88.3	76%	0.764	47%	0.466	S	S	*	.	H	α-helix	trans	-77.5	-31.9	175.3	-72.2	-69.2	-67.4	0	0	113	D351 G356	D351-M354 HydrophobicContact CB-CB 3.93Å; D351-M354 HydrophobicContact CB-CG 4.05Å; D351-M354 PolarHBondContact O-N 3.47Å; D351-M354 VanDerWaalsContact O-N 3.09Å; D351-M354 PolarHBondContact OD1-N 3.32Å; D351-M354 WeakPolarHBondContact OD2-CG 3.47Å; M354-G356 VanDerWaalsContact C-N 3.33Å
355	L	71.5	Confident	65.5	Low	113 Å²	113	79.6 Å²	79.6	59%	0.592	44%	0.44	S	S	*	.	H	α-helix	trans	-80.9	-11.7	178.3	-70.6	169	0	0	0	113.7	I350 D351 T357	I350-L355 HydrophobicContact CG2-CD1 3.35Å; D351-L355 WeakPolarHBondContact O-CG 3.41Å; D351-L355 PolarHBondContact O-N 3.29Å; L355-T357 HydrophobicContact CB-CG2 4.04Å; L355-T357 PolarHBondContact O-N 2.72Å
356	G	70.6	Confident	67	Low	53 Å²	53	69.2 Å²	69.2	55%	0.546	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	17	-176.1	0	0	0	0	0	113.5	E352 M354 H358	E352-G356 PolarHBondContact O-N 3.4Å; E352-G356 VanDerWaalsContact O-N 3.12Å; M354-G356 VanDerWaalsContact C-N 3.33Å; G356-H358 VanDerWaalsContact C-N 3.29Å
357	T	68.3	Low	68.6	Low	95 Å²	95	73.3 Å²	73.3	58%	0.583	41%	0.413	S	S	*	.			trans	-89	4.6	179.8	53	0	0	0	0	112.7	E352 L355	E352-T357 WeakPolarHBondContact CA-OG1 3.4Å; E352-T357 WeakPolarHBondContact CB-OG1 3.29Å; E352-T357 PolarHBondContact O-N 2.71Å; L355-T357 HydrophobicContact CB-CG2 4.04Å; L355-T357 PolarHBondContact O-N 2.72Å
358	H	73.8	Confident	69.8	Low	66 Å²	66	68.5 Å²	68.5	31%	0.306	39%	0.394	S	S	.	.			trans	-75.9	151.6	176.8	69.2	73.2	0	0	0	112.6	G356 C360 C366 F373	G356-H358 VanDerWaalsContact C-N 3.29Å; H358-C360 PolarHBondContact ND1-N 2.72Å; H358-C366 HydrophobicContact CB-CB 4.33Å; H358-C366 VanDerWaalsContact CB-SG 3.51Å; H358-F373 HydrophobicContact CB-CD1 4.37Å; H358-F373 HydrophobicContact CB-CD2 3.65Å; H358-F373 HydrophobicContact CB-CE1 4.29Å; H358-F373 HydrophobicContact CB-CE2 3.56Å; H358-F373 HydrophobicContact CB-CG 4.08Å; H358-F373 HydrophobicContact CB-CZ 3.91Å
359	N	69.5	Low	70.3	Confident	134 Å²	134	66.2 Å²	66.2	72%	0.717	38%	0.375	S	S	*	.			trans	-103.6	22.2	176.1	67.1	-10.2	0	0	0	113.7	G361 F373	N359-G361 PolarHBondContact O-N 2.84Å; N359-F373 VanDerWaalsContact OD1-CE2 3.27Å; N359-F373 WeakPolarHBondContact OD1-CE2 3.07Å; N359-F373 VanDerWaalsContact OD1-CZ 3.23Å; N359-F373 WeakPolarHBondContact OD1-CZ 3.39Å
360	C	67.8	Low	70.6	Confident	18 Å²	18	70.6 Å²	70.6	12%	0.122	39%	0.394	C	S	.	.			trans	-61.9	120.9	176.6	-57.8	0	0	0	0	112	H358 F364 C375	H358-C360 PolarHBondContact ND1-N 2.72Å; C360-F364 HydrophobicContact CB-CB 4.12Å; C360-C375 WeakPolarHBondContact CA-SG 3.24Å; C360-C375 HydrophobicContact CB-CB 3.81Å; C360-C375 WeakPolarHBondContact CB-SG 3.19Å; C360-C375 WeakPolarHBondContact SG-CA 3.44Å; C360-C375 WeakPolarHBondContact SG-CB 3.38Å; C360-C375 CovalentContact SG-SG 2.04Å; C360-C375 PolarHBondContact SG-SG 2.91Å
361	G	64	Low	70.4	Confident	33 Å²	33	67.2 Å²	67.2	34%	0.34	38%	0.378	S	S	.	.			trans	-64.6	166.9	178.1	0	0	0	0	0	113.3	N359 G363 F364	N359-G361 PolarHBondContact O-N 2.84Å; G361-G363 PolarHBondContact O-N 2.8Å; G361-F364 PolarHBondContact O-N 2.83Å
362	P	63.2	Low	69.8	Low	81 Å²	81	66.5 Å²	66.5	53%	0.526	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-15.8	-167.7	16.8	-28.8	0	0	0	116.2	W386 Q391	P362-W386 WeakPolarHBondContact O-CH2 3.04Å; P362-W386 WeakPolarHBondContact O-CZ2 3.31Å; P362-Q391 HydrophobicContact CB-CG 4.01Å; P362-Q391 VanDerWaalsContact CB-NE2 3.33Å
363	G	62	Low	69.8	Low	12 Å²	12	67 Å²	67	12%	0.124	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	15.9	174.5	0	0	0	0	0	115.9	G361 R378 W386	G361-G363 PolarHBondContact O-N 2.8Å; G363-R378 PolarHBondContact O-N 3.05Å; G363-W386 VanDerWaalsContact CA-CZ2 3.47Å
364	F	69.6	Low	69.5	Low	90 Å²	90	71 Å²	71	40%	0.395	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.5	-176.6	-66.5	-102.2	0	0	0	111.3	C360 G361 C375 E376 R377	C360-F364 HydrophobicContact CB-CB 4.12Å; G361-F364 PolarHBondContact O-N 2.83Å; F364-C375 HydrophobicContact CB-CB 3.97Å; F364-C375 HydrophobicContact CD1-CB 4.13Å; F364-C375 HydrophobicContact CG-CB 4.33Å; F364-E376 CarbonylContact C-O 3.57Å; F364-E376 WeakPolarHBondContact CA-O 3.02Å; F364-E376 WeakPolarHBondContact CB-O 3.29Å; F364-R377 HydrophobicContact CD1-CG 4.07Å; F364-R377 HydrophobicContact CE1-CB 4.46Å; F364-R377 HydrophobicContact CE1-CG 3.54Å; F364-R377 HydrophobicContact CZ-CG 3.96Å
365	T	77.5	Confident	69.2	Low	64 Å²	64	66 Å²	66	39%	0.393	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.5	171.7	-53.1	0	0	0	0	108.9	E376 R378	T365-E376 PolarHBondContact N-O 2.85Å; T365-E376 PolarHBondContact O-N 3.37Å; T365-R378 WeakPolarHBondContact OG1-CG 3.5Å
366	C	77.7	Confident	69.1	Low	23 Å²	23	63.9 Å²	63.9	16%	0.155	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	131.9	171.3	-172.3	0	0	0	0	110.3	C353 H358	C353-C366 WeakPolarHBondContact CA-SG 3.45Å; C353-C366 HydrophobicContact CB-CB 3.77Å; C353-C366 WeakPolarHBondContact CB-SG 2.92Å; C353-C366 WeakPolarHBondContact SG-CB 3.35Å; C353-C366 CovalentContact SG-SG 2.04Å; C353-C366 PolarHBondContact SG-SG 2.92Å; H358-C366 HydrophobicContact CB-CB 4.33Å; H358-C366 VanDerWaalsContact CB-SG 3.51Å
367	R	82	Confident	68.5	Low	137 Å²	137	70.7 Å²	70.7	52%	0.517	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.4	167.5	-102.9	-156.4	177.8	-134.9	-2.1	109.5	C353 F373 R374 E376	C353-R367 PolarHBondContact SG-N 3.09Å; C353-R367 VanDerWaalsContact SG-N 3.42Å; R367-F373 CarbonylContact O-C 3.59Å; R367-F373 WeakPolarHBondContact O-CA 3.47Å; R367-R374 HydrophobicContact CB-CG 3.61Å; R367-R374 VanDerWaalsContact CD-NH2 3.31Å; R367-R374 PolarHBondContact N-O 3.11Å; R367-R374 PolarHBondContact O-N 3.26Å; R367-E376 VanDerWaalsContact CD-OE2 3.28Å; R367-E376 WeakPolarHBondContact CD-OE2 3.36Å; R367-E376 IonicContact NE-OE2 3.39Å; R367-E376 PolarHBondContact NE-OE2 3.45Å
368	N	71.6	Confident	68.4	Low	55 Å²	55	72.2 Å²	72.2	29%	0.294	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	137.6	177	-170	42.9	0	0	0	110.4	D349 E352 C353 S372	D349-N368 PolarHBondContact OD2-ND2 3.11Å; E352-N368 PolarHBondContact OE2-OD1 2.79Å; C353-N368 PolarHBondContact SG-N 3.01Å; N368-S372 PolarHBondContact OD1-O 3.28Å
369	A	65.8	Low	67.7	Low	32 Å²	32	76.9 Å²	76.9	26%	0.264	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.5	-179	0	0	0	0	0	109.4	G371 S372	A369-G371 PolarHBondContact O-N 2.93Å; A369-S372 CarbonylContact C-O 3.59Å; A369-S372 VanDerWaalsContact C-O 3.3Å; A369-S372 WeakPolarHBondContact CA-O 3.39Å; A369-S372 PolarHBondContact N-O 3.21Å; A369-S372 CarbonylContact O-C 3.59Å; A369-S372 PolarHBondContact O-N 2.97Å
370	H	62.3	Low	67.4	Low	131 Å²	131	71.7 Å²	71.7	61%	0.606	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	110	-175	-161.3	-99.2	0	0	0	111.4	Y326	Y326-H370 AromaticContact CE1-CE1 3.33Å; Y326-H370 WeakPolarHBondContact CE1-CE1 3.37Å; Y326-H370 AromaticContact CE1-ND1 3.19Å; Y326-H370 WeakPolarHBondContact CE1-ND1 3.33Å; Y326-H370 AromaticContact CZ-CE1 3.49Å; Y326-H370 VanDerWaalsContact CZ-CE1 3.49Å; Y326-H370 AromaticContact CZ-ND1 3.5Å; Y326-H370 PolarHBondContact OH-CE1 2.99Å; Y326-H370 PolarHBondContact OH-ND1 3.02Å; Y326-H370 VanDerWaalsContact OH-ND1 3.15Å; Y326-H370 PolarHBondContact OH-NE2 2.67Å; Y326-H370 VanDerWaalsContact OH-NE2 3.13Å
371	G	59	Low	67.1	Low	5 Å²	5	74.7 Å²	74.7	5%	0.052	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	10	-174	0	0	0	0	0	116	D349 A369	D349-G371 PolarHBondContact OD1-N 2.95Å; A369-G371 PolarHBondContact O-N 2.93Å
372	S	62	Low	66.4	Low	39 Å²	39	78.3 Å²	78.3	27%	0.273	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172	-165.8	-179.1	-161.5	0	0	0	0	113.7	E352 N368 A369	E352-S372 VanDerWaalsContact OE2-C 3.22Å; E352-S372 VanDerWaalsContact OE2-O 3.1Å; N368-S372 PolarHBondContact OD1-O 3.28Å; A369-S372 CarbonylContact C-O 3.59Å; A369-S372 VanDerWaalsContact C-O 3.3Å; A369-S372 WeakPolarHBondContact CA-O 3.39Å; A369-S372 PolarHBondContact N-O 3.21Å; A369-S372 CarbonylContact O-C 3.59Å; A369-S372 PolarHBondContact O-N 2.97Å
373	F	73.1	Confident	65.9	Low	39 Å²	39	75.3 Å²	75.3	17%	0.171	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	159.7	166	62.2	-82.5	0	0	0	110.3	E352 H358 N359 R367	E352-F373 HydrophobicContact CB-CB 4.39Å; E352-F373 HydrophobicContact CB-CD1 3.59Å; E352-F373 HydrophobicContact CB-CE1 4.24Å; E352-F373 HydrophobicContact CB-CG 4.2Å; E352-F373 HydrophobicContact CG-CD1 3.84Å; E352-F373 HydrophobicContact CG-CE1 4.39Å; H358-F373 HydrophobicContact CB-CD1 4.37Å; H358-F373 HydrophobicContact CB-CD2 3.65Å; H358-F373 HydrophobicContact CB-CE1 4.29Å; H358-F373 HydrophobicContact CB-CE2 3.56Å; H358-F373 HydrophobicContact CB-CG 4.08Å; H358-F373 HydrophobicContact CB-CZ 3.91Å; N359-F373 VanDerWaalsContact OD1-CE2 3.27Å; N359-F373 WeakPolarHBondContact OD1-CE2 3.07Å; N359-F373 VanDerWaalsContact OD1-CZ 3.23Å; N359-F373 WeakPolarHBondContact OD1-CZ 3.39Å; R367-F373 CarbonylContact O-C 3.59Å; R367-F373 WeakPolarHBondContact O-CA 3.47Å
374	R	69.3	Low	65.9	Low	116 Å²	116	78.2 Å²	78.2	44%	0.438	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.3	172.5	73.1	-179.2	-166.6	-135.5	9.7	110.6	R367 E376	R367-R374 HydrophobicContact CB-CG 3.61Å; R367-R374 VanDerWaalsContact CD-NH2 3.31Å; R367-R374 PolarHBondContact N-O 3.11Å; R367-R374 PolarHBondContact O-N 3.26Å; R374-E376 HydrophobicContact CG-CG 4.15Å; R374-E376 IonicContact CZ-OE1 3.06Å; R374-E376 IonicContact NE-OE1 2.73Å; R374-E376 PolarHBondContact NE-OE1 3.01Å; R374-E376 IonicContact NH2-OE1 2.63Å; R374-E376 PolarHBondContact NH2-OE1 2.86Å
375	C	72.6	Confident	65.2	Low	49 Å²	49	80.3 Å²	80.3	33%	0.331	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	106.4	173.5	-57.6	0	0	0	0	108.8	C360 F364	C360-C375 WeakPolarHBondContact CA-SG 3.24Å; C360-C375 HydrophobicContact CB-CB 3.81Å; C360-C375 WeakPolarHBondContact CB-SG 3.19Å; C360-C375 WeakPolarHBondContact SG-CA 3.44Å; C360-C375 WeakPolarHBondContact SG-CB 3.38Å; C360-C375 CovalentContact SG-SG 2.04Å; C360-C375 PolarHBondContact SG-SG 2.91Å; F364-C375 HydrophobicContact CB-CB 3.97Å; F364-C375 HydrophobicContact CD1-CB 4.13Å; F364-C375 HydrophobicContact CG-CB 4.33Å
376	E	69	Low	64.5	Low	69 Å²	69	80.6 Å²	80.6	32%	0.322	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	143.7	173.1	-62.4	-171.7	145.3	0	0	109.2	F364 T365 R367 R374 R378	F364-E376 CarbonylContact C-O 3.57Å; F364-E376 WeakPolarHBondContact CA-O 3.02Å; F364-E376 WeakPolarHBondContact CB-O 3.29Å; T365-E376 PolarHBondContact N-O 2.85Å; T365-E376 PolarHBondContact O-N 3.37Å; R367-E376 VanDerWaalsContact CD-OE2 3.28Å; R367-E376 WeakPolarHBondContact CD-OE2 3.36Å; R367-E376 IonicContact NE-OE2 3.39Å; R367-E376 PolarHBondContact NE-OE2 3.45Å; R374-E376 HydrophobicContact CG-CG 4.15Å; R374-E376 IonicContact CZ-OE1 3.06Å; R374-E376 IonicContact NE-OE1 2.73Å; R374-E376 PolarHBondContact NE-OE1 3.01Å; R374-E376 IonicContact NH2-OE1 2.63Å; R374-E376 PolarHBondContact NH2-OE1 2.86Å; E376-R378 PolarHBondContact O-N 3.5Å
377	R	59.4	Low	63.9	Low	197 Å²	197	81.2 Å²	81.2	74%	0.743	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55	133.1	170.9	-82.5	-177.2	167.2	172.2	-2.9	109.4	F364 L379	F364-R377 HydrophobicContact CD1-CG 4.07Å; F364-R377 HydrophobicContact CE1-CB 4.46Å; F364-R377 HydrophobicContact CE1-CG 3.54Å; F364-R377 HydrophobicContact CZ-CG 3.96Å; R377-L379 PolarHBondContact O-N 3.43Å
378	R	65.9	Low	62.4	Low	126 Å²	126	79.8 Å²	79.8	48%	0.475	41%	0.407	S	S	.	.			trans	-58.9	105.4	170.2	-103.1	-177.2	161.4	172.5	-7.7	107.8	G363 T365 E376 C380 W386	G363-R378 PolarHBondContact O-N 3.05Å; T365-R378 WeakPolarHBondContact OG1-CG 3.5Å; E376-R378 PolarHBondContact O-N 3.5Å; R378-C380 PolarHBondContact O-N 3.44Å; R378-W386 HydrophobicContact CB-CE3 4.17Å; R378-W386 HydrophobicContact CB-CZ3 4.31Å
379	L	59.5	Low	61.9	Low	165 Å²	165	79.1 Å²	79.1	86%	0.864	41%	0.413	S	S	*	.			trans	-72.3	107.5	172.5	-77.8	156.9	0	0	0	107.4	R377	R377-L379 PolarHBondContact O-N 3.43Å
380	C	62.8	Low	61.7	Low	25 Å²	25	80.6 Å²	80.6	17%	0.169	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-65.6	143.7	169.2	-65.5	0	0	0	0	109.6	R378 Q384 C393	R378-C380 PolarHBondContact O-N 3.44Å; C380-Q384 HydrophobicContact CB-CB 3.77Å; C380-Q384 WeakPolarHBondContact CB-O 3.06Å; C380-C393 WeakPolarHBondContact CA-SG 3.38Å; C380-C393 HydrophobicContact CB-CB 3.65Å; C380-C393 WeakPolarHBondContact CB-SG 3.43Å; C380-C393 VanDerWaalsContact SG-CA 3.56Å; C380-C393 WeakPolarHBondContact SG-CB 3.49Å; C380-C393 CovalentContact SG-SG 2.04Å; C380-C393 PolarHBondContact SG-SG 2.77Å
381	P	60.7	Low	61.9	Low	80 Å²	80	80.3 Å²	80.3	52%	0.519	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-49.4	148.6	173.2	-23.7	31.3	0	0	0	111.2	G383 Q384	P381-G383 PolarHBondContact O-N 2.87Å; P381-G383 VanDerWaalsContact O-N 3.13Å; P381-Q384 PolarHBondContact O-N 3.4Å
382	T	49.3	Very low	62.2	Low	109 Å²	109	87.2 Å²	87.2	67%	0.669	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	120.6	-179.6	-38.7	0	0	0	0	110.7	S407	T382-S407 VanDerWaalsContact CG2-O 3.23Å; T382-S407 WeakPolarHBondContact CG2-O 3.43Å
383	G	53.1	Low	62.1	Low	18 Å²	18	87.1 Å²	87.1	19%	0.186	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.4	6.7	-174.9	0	0	0	0	0	116	P381 S396	P381-G383 PolarHBondContact O-N 2.87Å; P381-G383 VanDerWaalsContact O-N 3.13Å; G383-S396 PolarHBondContact O-N 3.12Å; G383-S396 PolarHBondContact O-OG 2.99Å
384	Q	62.5	Low	61.6	Low	73 Å²	73	88.2 Å²	88.2	34%	0.341	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.2	174.8	-60	-172.1	-0.9	0	0	111.7	C380 P381 C393 I394	C380-Q384 HydrophobicContact CB-CB 3.77Å; C380-Q384 WeakPolarHBondContact CB-O 3.06Å; P381-Q384 PolarHBondContact O-N 3.4Å; Q384-C393 HydrophobicContact CB-CB 4.14Å; Q384-I394 CarbonylContact C-O 3.19Å; Q384-I394 WeakPolarHBondContact CA-O 3.31Å; Q384-I394 WeakPolarHBondContact CB-O 3.41Å
385	Q	54	Low	61	Low	134 Å²	134	84.9 Å²	84.9	63%	0.626	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	148.4	172.7	-81.3	-175.3	-16.8	0	0	110.7	D387 C393 I394	Q385-D387 PolarHBondContact O-N 3.47Å; Q385-C393 WeakPolarHBondContact O-CA 3.06Å; Q385-I394 PolarHBondContact N-O 3.21Å; Q385-I394 VanDerWaalsContact O-CG1 3.24Å; Q385-I394 WeakPolarHBondContact O-CG1 3.02Å; Q385-I394 PolarHBondContact O-N 3.37Å
386	W	62.7	Low	60.1	Low	71 Å²	71	85.9 Å²	85.9	27%	0.269	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	119.5	177.5	-179.4	-96.7	0	0	0	110.7	P362 G363 R378 Q391	P362-W386 WeakPolarHBondContact O-CH2 3.04Å; P362-W386 WeakPolarHBondContact O-CZ2 3.31Å; G363-W386 VanDerWaalsContact CA-CZ2 3.47Å; R378-W386 HydrophobicContact CB-CE3 4.17Å; R378-W386 HydrophobicContact CB-CZ3 4.31Å; W386-Q391 WeakPolarHBondContact CH2-O 3.44Å; W386-Q391 HydrophobicContact CZ2-CB 4.33Å
387	D	64.9	Low	59.4	Low	36 Å²	36	84.4 Å²	84.4	19%	0.193	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	108.7	173.7	-177.5	-2.3	0	0	0	110	Q385 G389 N390 Q391 R392 I394	Q385-D387 PolarHBondContact O-N 3.47Å; D387-G389 PolarHBondContact O-N 2.91Å; D387-G389 WeakPolarHBondContact OD1-CA 3.44Å; D387-G389 PolarHBondContact OD1-N 2.97Å; D387-N390 HydrophobicContact CB-CB 4.48Å; D387-N390 PolarHBondContact O-N 3.17Å; D387-N390 PolarHBondContact OD1-N 3Å; D387-N390 VanDerWaalsContact OD2-CB 3.32Å; D387-N390 WeakPolarHBondContact OD2-CB 3.41Å; D387-N390 PolarHBondContact OD2-ND2 2.92Å; D387-Q391 PolarHBondContact O-N 2.57Å; D387-R392 PolarHBondContact N-O 2.02Å; D387-I394 HydrophobicContact CB-CD1 3.79Å; D387-I394 HydrophobicContact CB-CG1 3.88Å; D387-I394 HydrophobicContact CB-CG2 3.86Å
388	S	51.7	Low	59.2	Low	107 Å²	107	82 Å²	82	75%	0.748	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-26	177.2	55.5	0	0	0	0	112.8
389	G	60	Low	58.7	Low	40 Å²	40	77.4 Å²	77.4	41%	0.412	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-28.8	-179.5	0	0	0	0	0	114.2	R145 D387	R145-G389 PolarHBondContact NH1-O 3.23Å; D387-G389 PolarHBondContact O-N 2.91Å; D387-G389 WeakPolarHBondContact OD1-CA 3.44Å; D387-G389 PolarHBondContact OD1-N 2.97Å
390	N	62.7	Low	58.6	Low	64 Å²	64	73.7 Å²	73.7	34%	0.342	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	3.9	-178.2	-68.7	-47.7	0	0	0	114.2	R145 D387 R392	R145-N390 PolarHBondContact NH1-OD1 3.09Å; D387-N390 HydrophobicContact CB-CB 4.48Å; D387-N390 PolarHBondContact O-N 3.17Å; D387-N390 PolarHBondContact OD1-N 3Å; D387-N390 VanDerWaalsContact OD2-CB 3.32Å; D387-N390 WeakPolarHBondContact OD2-CB 3.41Å; D387-N390 PolarHBondContact OD2-ND2 2.92Å; N390-R392 HydrophobicContact CB-CG 3.93Å; N390-R392 PolarHBondContact O-N 2.03Å; N390-R392 VanDerWaalsContact O-N 3.15Å
391	Q	64.7	Low	58.2	Low	125 Å²	125	78.9 Å²	78.9	58%	0.584	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	36.3	179.8	-60	-171.7	-22	0	0	114	P362 W386 D387	P362-Q391 HydrophobicContact CB-CG 4.01Å; P362-Q391 VanDerWaalsContact CB-NE2 3.33Å; W386-Q391 WeakPolarHBondContact CH2-O 3.44Å; W386-Q391 HydrophobicContact CZ2-CB 4.33Å; D387-Q391 PolarHBondContact O-N 2.57Å
392	R	65.5	Low	58.1	Low	150 Å²	150	78.3 Å²	78.3	57%	0.566	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.2	155.1	-178.3	66.6	-176.5	179	168.7	-1.6	111.3	D387 N390 I394	D387-R392 PolarHBondContact N-O 2.02Å; N390-R392 HydrophobicContact CB-CG 3.93Å; N390-R392 PolarHBondContact O-N 2.03Å; N390-R392 VanDerWaalsContact O-N 3.15Å; R392-I394 HydrophobicContact CG-CG2 3.98Å; R392-I394 PolarHBondContact O-N 3.43Å
393	C	61.7	Low	58.4	Low	37 Å²	37	78.5 Å²	78.5	25%	0.25	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	121.5	165.7	-67	0	0	0	0	109	C380 Q384 Q385	C380-C393 WeakPolarHBondContact CA-SG 3.38Å; C380-C393 HydrophobicContact CB-CB 3.65Å; C380-C393 WeakPolarHBondContact CB-SG 3.43Å; C380-C393 VanDerWaalsContact SG-CA 3.56Å; C380-C393 WeakPolarHBondContact SG-CB 3.49Å; C380-C393 CovalentContact SG-SG 2.04Å; C380-C393 PolarHBondContact SG-SG 2.77Å; Q384-C393 HydrophobicContact CB-CB 4.14Å; Q385-C393 WeakPolarHBondContact O-CA 3.06Å
394	I	61.4	Low	58.5	Low	62 Å²	62	80.8 Å²	80.8	32%	0.318	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	140.7	174.8	56.1	169	0	0	0	108.9	Q384 Q385 D387 R392 S396	Q384-I394 CarbonylContact C-O 3.19Å; Q384-I394 WeakPolarHBondContact CA-O 3.31Å; Q384-I394 WeakPolarHBondContact CB-O 3.41Å; Q385-I394 PolarHBondContact N-O 3.21Å; Q385-I394 VanDerWaalsContact O-CG1 3.24Å; Q385-I394 WeakPolarHBondContact O-CG1 3.02Å; Q385-I394 PolarHBondContact O-N 3.37Å; D387-I394 HydrophobicContact CB-CD1 3.79Å; D387-I394 HydrophobicContact CB-CG1 3.88Å; D387-I394 HydrophobicContact CB-CG2 3.86Å; R392-I394 HydrophobicContact CG-CG2 3.98Å; R392-I394 PolarHBondContact O-N 3.43Å; I394-S396 PolarHBondContact O-N 3.26Å
395	A	56.4	Low	57.9	Low	46 Å²	46	79.7 Å²	79.7	38%	0.38	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	129	172.6	0	0	0	0	0	109.9	V397	A395-V397 PolarHBondContact O-N 3.36Å
396	S	53.9	Low	58.2	Low	69 Å²	69	73.6 Å²	73.6	48%	0.483	44%	0.44	S	S	.	.	S	Bend	trans	-73.9	-1.2	172.8	71.3	0	0	0	0	111.8	G383 I394	G383-S396 PolarHBondContact O-N 3.12Å; G383-S396 PolarHBondContact O-OG 2.99Å; I394-S396 PolarHBondContact O-N 3.26Å
397	V	55.2	Low	57.7	Low	39 Å²	39	75.1 Å²	75.1	24%	0.236	46%	0.461	C	S	.	.			trans	-132.3	109.2	-175.5	-168	0	0	0	0	109	A395 C399 C411	A395-V397 PolarHBondContact O-N 3.36Å; V397-C399 PolarHBondContact O-N 2.84Å; V397-C411 VanDerWaalsContact CG1-SG 3.6Å
398	T	54.4	Low	57.5	Low	145 Å²	145	77.5 Å²	77.5	89%	0.89	47%	0.474	S	S	*	.			trans	-76.5	95.7	165.3	44.5	0	0	0	0	108.7
399	C	55.3	Low	57.5	Low	30 Å²	30	74 Å²	74	20%	0.203	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-80.8	141.4	170.9	-62.1	0	0	0	0	110.1	V397 F403 C411	V397-C399 PolarHBondContact O-N 2.84Å; C399-F403 HydrophobicContact CB-CB 3.96Å; C399-F403 VanDerWaalsContact CB-O 3.3Å; C399-F403 WeakPolarHBondContact CB-O 3.23Å; C399-C411 VanDerWaalsContact CA-SG 3.52Å; C399-C411 HydrophobicContact CB-CB 3.9Å; C399-C411 WeakPolarHBondContact CB-SG 3.41Å; C399-C411 VanDerWaalsContact SG-CA 3.55Å; C399-C411 WeakPolarHBondContact SG-CB 3.33Å; C399-C411 CovalentContact SG-SG 2.04Å; C399-C411 PolarHBondContact SG-SG 3.37Å
400	S	56.8	Low	57.4	Low	88 Å²	88	78.8 Å²	78.8	62%	0.615	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-54.7	152.9	173.5	-60.4	0	0	0	0	111.5	G402 F403	S400-G402 PolarHBondContact O-N 3.34Å; S400-G402 VanDerWaalsContact O-N 3.16Å; S400-F403 PolarHBondContact O-N 3.25Å
401	P	55.5	Low	57.1	Low	134 Å²	134	78.5 Å²	78.5	87%	0.87	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	123.3	177	-25.3	33	0	0	0	111.6
402	G	58	Low	56.7	Low	67 Å²	67	76.5 Å²	76.5	69%	0.691	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.8	3.6	-177.7	0	0	0	0	0	116.5	S400	S400-G402 PolarHBondContact O-N 3.34Å; S400-G402 VanDerWaalsContact O-N 3.16Å
403	F	56.9	Low	56.1	Low	113 Å²	113	71.1 Å²	71.1	50%	0.496	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.9	176.9	-69.5	-101.3	0	0	0	111.3	C399 S400 C411 Q412 G413	C399-F403 HydrophobicContact CB-CB 3.96Å; C399-F403 VanDerWaalsContact CB-O 3.3Å; C399-F403 WeakPolarHBondContact CB-O 3.23Å; S400-F403 PolarHBondContact O-N 3.25Å; F403-C411 HydrophobicContact CB-CB 4.11Å; F403-Q412 WeakPolarHBondContact CA-O 3.29Å; F403-G413 VanDerWaalsContact CD1-CA 3.4Å; F403-G413 VanDerWaalsContact CD1-N 3.3Å
404	H	55	Low	55.3	Low	66 Å²	66	76 Å²	76	31%	0.306	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	143.9	176.9	52.8	42.9	0	0	0	111.1	G406 Q412 E414	H404-G406 PolarHBondContact O-N 3.47Å; H404-Q412 PolarHBondContact CE1-O 3.29Å; H404-Q412 VanDerWaalsContact CE1-O 3.28Å; H404-Q412 PolarHBondContact N-O 3.48Å; H404-Q412 PolarHBondContact ND1-O 2.03Å; H404-Q412 PolarHBondContact O-N 3.34Å; H404-E414 WeakPolarHBondContact NE2-CG 3.02Å; H404-E414 IonicContact NE2-OE1 3.99Å
405	P	50	Low	54.2	Low	51 Å²	51	81.1 Å²	81.1	33%	0.331	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	121.8	175.9	25.7	-30.8	0	0	0	110.7
406	G	59.3	Low	53.3	Low	6 Å²	6	83.7 Å²	83.7	6%	0.062	50%	0.502	C	S	.	.			trans	-75.2	168.4	173	0	0	0	0	0	112.7	H404 D408 G409 K410	H404-G406 PolarHBondContact O-N 3.47Å; G406-D408 PolarHBondContact O-N 3.37Å; G406-G409 PolarHBondContact O-N 3.37Å; G406-K410 PolarHBondContact N-O 3.43Å
407	S	53.2	Low	52.7	Low	102 Å²	102	84.7 Å²	84.7	71%	0.713	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-11.2	178.6	53.8	0	0	0	0	114.7	T382	T382-S407 VanDerWaalsContact CG2-O 3.23Å; T382-S407 WeakPolarHBondContact CG2-O 3.43Å
408	D	59.3	Low	51.8	Low	87 Å²	87	90.8 Å²	90.8	47%	0.465	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	4.2	175.5	67.2	-22.9	0	0	0	113.9	G406 K410 Q412	G406-D408 PolarHBondContact O-N 3.37Å; D408-K410 VanDerWaalsContact C-N 3.29Å; D408-K410 PolarHBondContact O-N 3.3Å; D408-K410 PolarHBondContact OD1-N 2.75Å; D408-K410 WeakPolarHBondContact OD2-CD 3.31Å; D408-Q412 PolarHBondContact OD1-NE2 3.05Å
409	G	52.8	Low	51.1	Low	33 Å²	33	91 Å²	91	34%	0.34	52%	0.522	S	S	.	.	S	Bend	trans	76.4	10.4	-177.8	0	0	0	0	0	114.6	G406	G406-G409 PolarHBondContact O-N 3.37Å
410	K	58	Low	50.1	Low	141 Å²	141	99.1 Å²	99.1	61%	0.613	55%	0.554	S	S	*	*	S	Bend	trans	-96.2	142.7	173.4	-64.5	-175	-172.9	166.7	0	111	G406 D408 Q412	G406-K410 PolarHBondContact N-O 3.43Å; D408-K410 VanDerWaalsContact C-N 3.29Å; D408-K410 PolarHBondContact O-N 3.3Å; D408-K410 PolarHBondContact OD1-N 2.75Å; D408-K410 WeakPolarHBondContact OD2-CD 3.31Å; K410-Q412 PolarHBondContact O-N 2.88Å; K410-Q412 VanDerWaalsContact O-N 3.16Å
411	C	55.3	Low	48.8	Very low	58 Å²	58	104 Å²	104	39%	0.392	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.1	111.4	170.2	-63.9	0	0	0	0	109.5	V397 C399 F403	V397-C411 VanDerWaalsContact CG1-SG 3.6Å; C399-C411 VanDerWaalsContact CA-SG 3.52Å; C399-C411 HydrophobicContact CB-CB 3.9Å; C399-C411 WeakPolarHBondContact CB-SG 3.41Å; C399-C411 VanDerWaalsContact SG-CA 3.55Å; C399-C411 WeakPolarHBondContact SG-CB 3.33Å; C399-C411 CovalentContact SG-SG 2.04Å; C399-C411 PolarHBondContact SG-SG 3.37Å; F403-C411 HydrophobicContact CB-CB 4.11Å
412	Q	57.5	Low	47.6	Very low	83 Å²	83	103.1 Å²	103.1	39%	0.388	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.6	133.1	176.3	-66.5	177.6	-1.8	0	0	108.4	F403 H404 D408 K410	F403-Q412 WeakPolarHBondContact CA-O 3.29Å; H404-Q412 PolarHBondContact CE1-O 3.29Å; H404-Q412 VanDerWaalsContact CE1-O 3.28Å; H404-Q412 PolarHBondContact N-O 3.48Å; H404-Q412 PolarHBondContact ND1-O 2.03Å; H404-Q412 PolarHBondContact O-N 3.34Å; D408-Q412 PolarHBondContact OD1-NE2 3.05Å; K410-Q412 PolarHBondContact O-N 2.88Å; K410-Q412 VanDerWaalsContact O-N 3.16Å
413	G	51.3	Low	46.3	Very low	37 Å²	37	103.6 Å²	103.6	38%	0.381	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	132.6	173.5	0	0	0	0	0	108.6	F403 L415	F403-G413 VanDerWaalsContact CD1-CA 3.4Å; F403-G413 VanDerWaalsContact CD1-N 3.3Å; G413-L415 PolarHBondContact O-N 2.99Å; G413-L415 VanDerWaalsContact O-N 3.11Å
414	E	45.3	Very low	45.1	Very low	138 Å²	138	109.2 Å²	109.2	65%	0.645	57%	0.568	S	S	*	*			trans	-72.6	106.2	177	-142.1	168.1	-157.2	0	0	108.3	H404 D416	H404-E414 WeakPolarHBondContact NE2-CG 3.02Å; H404-E414 IonicContact NE2-OE1 3.99Å; E414-D416 PolarHBondContact O-N 2.82Å
415	L	39.8	Very low	44	Very low	170 Å²	170	117 Å²	117	89%	0.89	60%	0.595	S	S	*	*			trans	-67.7	108	162	-87.1	155.9	0	0	0	107.3	G413	G413-L415 PolarHBondContact O-N 2.99Å; G413-L415 VanDerWaalsContact O-N 3.11Å
416	D	36.1	Very low	43.1	Very low	101 Å²	101	119.4 Å²	119.4	54%	0.54	61%	0.613	S	S	.	*			trans	5.6	105.6	164.9	-167.4	10.1	0	0	0	118	E414 F418	E414-D416 PolarHBondContact O-N 2.82Å; D416-F418 PolarHBondContact O-N 2.99Å; D416-F418 VanDerWaalsContact OD1-CB 3.27Å; D416-F418 WeakPolarHBondContact OD1-CB 3.44Å; D416-F418 PolarHBondContact OD1-N 2.79Å
417	P	40.9	Very low	42	Very low	89 Å²	89	127.2 Å²	127.2	58%	0.578	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-74.4	7.4	169.5	-15.5	30.6	0	0	0	115.5	Q419	P417-Q419 PolarHBondContact O-N 3.38Å; P417-Q419 VanDerWaalsContact O-N 3.14Å
418	F	37	Very low	41.6	Very low	168 Å²	168	133.3 Å²	133.3	74%	0.737	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-66.6	-8.1	175.7	-102.5	-93.2	0	0	0	114.7	D416	D416-F418 PolarHBondContact O-N 2.99Å; D416-F418 VanDerWaalsContact OD1-CB 3.27Å; D416-F418 WeakPolarHBondContact OD1-CB 3.44Å; D416-F418 PolarHBondContact OD1-N 2.79Å
419	Q	40.8	Very low	41.8	Very low	149 Å²	149	133.8 Å²	133.8	70%	0.696	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-107	4.2	-170.5	-139.6	76.2	38.7	0	0	116.4	P417	P417-Q419 PolarHBondContact O-N 3.38Å; P417-Q419 VanDerWaalsContact O-N 3.14Å
420	F	34.2	Very low	42.4	Very low	200 Å²	200	135.1 Å²	135.1	88%	0.877	67%	0.666	S	S	*	*	S	Bend	trans	-115.7	-3.7	-179.6	-125.7	-90.2	0	0	0	116
421	F	29.7	Very low	43.1	Very low	190 Å²	190	132.7 Å²	132.7	83%	0.833	66%	0.663	S	S	*	*	S	Bend	trans	-108.3	16.9	179.1	-138.3	-93.7	0	0	0	114.1	A423	F421-A423 PolarHBondContact O-N 2.81Å
422	I	29.8	Very low	44.3	Very low	116 Å²	116	132.4 Å²	132.4	60%	0.595	66%	0.657	S	S	*	*			trans	-99.4	60.6	171.4	-42.7	-177	0	0	0	108.8
423	A	30	Very low	45.6	Very low	78 Å²	78	130.3 Å²	130.3	65%	0.645	65%	0.647	S	S	*	*	S	Bend	trans	-158.9	23.4	174.8	0	0	0	0	0	115.7	F421	F421-A423 PolarHBondContact O-N 2.81Å
424	Y	31.8	Very low	47.2	Very low	230 Å²	230	130.2 Å²	130.2	90%	0.902	64%	0.641	S	S	*	*			trans	-151.6	63.3	163.8	-100.3	-82.1	0	0	0	110.7
425	W	32	Very low	49	Very low	230 Å²	230	131.1 Å²	131.1	87%	0.871	65%	0.645	S	S	*	*			trans	-76.5	121.4	163.5	-80	82.7	0	0	0	109.2
426	S	31.3	Very low	50.8	Low	102 Å²	102	128.2 Å²	128.2	71%	0.713	63%	0.629	S	S	*	*				-178.4	126.9	123.8	-154.4	0	0	0	0	110.9
427	H	35.5	Very low	52.8	Low	170 Å²	170	128.8 Å²	128.8	79%	0.787	64%	0.639	S	S	*	*			trans	67.8	99	169.4	-89.1	-86.3	0	0	0	118.2
428	Y	45.8	Very low	54.5	Low	230 Å²	230	131.9 Å²	131.9	90%	0.902	65%	0.65	S	S	*	*			trans	-150.1	124.4	138.7	-112.9	-83.3	0	0	0	110.5
429	S	62.9	Low	56.3	Low	96 Å²	96	124.6 Å²	124.6	67%	0.671	62%	0.621	S	S	*	*			trans	-67	152.2	173.3	54.6	0	0	0	0	110.4	V431	S429-V431 PolarHBondContact O-N 3.38Å
430	D	65.6	Low	58.1	Low	61 Å²	61	118.5 Å²	118.5	33%	0.326	60%	0.595	S	S	.	*			trans	-46	129	164.8	-174.7	51.5	0	0	0	111.3	N448 Q450 G451	D430-N448 PolarHBondContact OD2-ND2 3.12Å; D430-Q450 WeakPolarHBondContact OD1-CA 3.1Å; D430-G451 PolarHBondContact OD1-N 3.33Å
431	V	71.6	Confident	60.1	Low	90 Å²	90	113 Å²	113	55%	0.545	58%	0.579	S	S	.	*			trans	-90	112.1	176	173.9	0	0	0	0	106.4	S429 E433	S429-V431 PolarHBondContact O-N 3.38Å; V431-E433 PolarHBondContact O-N 3.11Å
432	N	81.7	Confident	62	Low	52 Å²	52	109.9 Å²	109.9	28%	0.278	58%	0.581	S	S	.	*			trans	-72.7	96.4	177.2	-179.6	1	0	0	0	110.8	C434 H435 N448	N432-C434 PolarHBondContact O-N 3.25Å; N432-C434 WeakPolarHBondContact OD1-CB 3.3Å; N432-C434 PolarHBondContact OD1-N 3.11Å; N432-C434 VanDerWaalsContact OD1-N 3.12Å; N432-H435 PolarHBondContact ND2-CD2 2.92Å; N432-H435 PolarHBondContact ND2-NE2 2.9Å; N432-H435 WeakPolarHBondContact O-CB 3.24Å; N432-H435 PolarHBondContact O-N 3.49Å; N432-H435 VanDerWaalsContact O-N 3.1Å; N432-N448 WeakPolarHBondContact CA-OD1 3.38Å; N432-N448 VanDerWaalsContact OD1-CB 3.29Å; N432-N448 WeakPolarHBondContact OD1-CB 3.38Å; N432-N448 PolarHBondContact OD1-OD1 2.03Å
433	E	83.8	Confident	63.7	Low	39 Å²	39	106.9 Å²	106.9	18%	0.182	58%	0.579	C	S	.	*	G	3₁₀ helix	trans	-66	-16.8	-177.5	-60	90.1	168.2	0	0	112.9	V431 H435 L436 A439 N448 Y453	V431-E433 PolarHBondContact O-N 3.11Å; E433-H435 PolarHBondContact O-N 3.33Å; E433-L436 HydrophobicContact CB-CD1 4.27Å; E433-L436 WeakPolarHBondContact O-CB 3.29Å; E433-L436 PolarHBondContact O-N 3.04Å; E433-A439 VanDerWaalsContact O-CB 3.31Å; E433-A439 WeakPolarHBondContact O-CB 3.29Å; E433-N448 PolarHBondContact OE2-OD1 3.21Å; E433-Y453 HydrophobicContact CB-CD1 3.26Å; E433-Y453 HydrophobicContact CB-CE1 3.73Å; E433-Y453 HydrophobicContact CB-CG 3.81Å; E433-Y453 HydrophobicContact CG-CD1 3.61Å; E433-Y453 HydrophobicContact CG-CE1 4.04Å
434	C	85.3	Confident	65.9	Low	36 Å²	36	106.7 Å²	106.7	24%	0.243	56%	0.564	C	S	.	*	G	3₁₀ helix	trans	-67.2	-3.6	172.4	-56.8	0	0	0	0	113.8	N432 C446 R447	N432-C434 PolarHBondContact O-N 3.25Å; N432-C434 WeakPolarHBondContact OD1-CB 3.3Å; N432-C434 PolarHBondContact OD1-N 3.11Å; N432-C434 VanDerWaalsContact OD1-N 3.12Å; C434-C446 WeakPolarHBondContact CA-SG 3.03Å; C434-C446 HydrophobicContact CB-CB 3.64Å; C434-C446 WeakPolarHBondContact CB-SG 3.38Å; C434-C446 WeakPolarHBondContact SG-CB 3.03Å; C434-C446 CovalentContact SG-SG 2.04Å; C434-C446 PolarHBondContact SG-SG 3.41Å; C434-R447 VanDerWaalsContact SG-C 3.57Å; C434-R447 PolarHBondContact SG-N 2.72Å
435	H	83.7	Confident	68.3	Low	157 Å²	157	101.2 Å²	101.2	73%	0.727	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-92.2	-4.1	169.3	-66.5	-41.5	0	0	0	113.8	N432 E433	N432-H435 PolarHBondContact ND2-CD2 2.92Å; N432-H435 PolarHBondContact ND2-NE2 2.9Å; N432-H435 WeakPolarHBondContact O-CB 3.24Å; N432-H435 PolarHBondContact O-N 3.49Å; N432-H435 VanDerWaalsContact O-N 3.1Å; E433-H435 PolarHBondContact O-N 3.33Å
436	L	77.9	Confident	70.7	Confident	108 Å²	108	91.9 Å²	91.9	57%	0.565	52%	0.515	S	S	*	.	S	Bend	trans	-83.4	141.6	173.9	-64.3	169	0	0	0	110.8	E433 A439	E433-L436 HydrophobicContact CB-CD1 4.27Å; E433-L436 WeakPolarHBondContact O-CB 3.29Å; E433-L436 PolarHBondContact O-N 3.04Å; L436-A439 PolarHBondContact O-N 3.07Å
437	P	78.1	Confident	73.3	Confident	113 Å²	113	92.4 Å²	92.4	73%	0.734	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	139.5	168.4	-16.2	28.5	0	0	0	109.9	A439	P437-A439 VanDerWaalsContact C-N 3.27Å; P437-A439 PolarHBondContact O-N 3.41Å
438	D	75.8	Confident	75.4	Confident	154 Å²	154	86.9 Å²	86.9	82%	0.824	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	24.5	179.4	-51.7	-42.5	0	0	0	115.6	C440	D438-C440 PolarHBondContact O-N 3.34Å
439	A	74.9	Confident	77	Confident	16 Å²	16	78.5 Å²	78.5	13%	0.132	45%	0.45	C	S	.	.	S	Bend	trans	-56.7	-33.5	175.3	0	0	0	0	0	113	E433 L436 P437 Y453	E433-A439 VanDerWaalsContact O-CB 3.31Å; E433-A439 WeakPolarHBondContact O-CB 3.29Å; L436-A439 PolarHBondContact O-N 3.07Å; P437-A439 VanDerWaalsContact C-N 3.27Å; P437-A439 PolarHBondContact O-N 3.41Å; A439-Y453 WeakPolarHBondContact O-CE2 3.04Å; A439-Y453 PolarHBondContact O-OH 3.39Å
440	C	78.6	Confident	77.6	Confident	21 Å²	21	83 Å²	83	14%	0.142	46%	0.461	C	S	.	.	S	Bend	trans	-129.4	147	172.7	-68	0	0	0	0	110.8	D438 Q444 C446 C455	D438-C440 PolarHBondContact O-N 3.34Å; C440-Q444 HydrophobicContact CB-CB 4.04Å; C440-C446 HydrophobicContact CB-CB 4.48Å; C440-C446 WeakPolarHBondContact SG-CA 3.48Å; C440-C446 WeakPolarHBondContact SG-CB 3.3Å; C440-C455 VanDerWaalsContact CA-SG 3.51Å; C440-C455 HydrophobicContact CB-CB 3.83Å; C440-C455 WeakPolarHBondContact CB-SG 3.24Å; C440-C455 WeakPolarHBondContact SG-CB 3.48Å; C440-C455 CovalentContact SG-SG 2.02Å; C440-C455 PolarHBondContact SG-SG 3.3Å
441	P	76.1	Confident	77.9	Confident	83 Å²	83	83.1 Å²	83.1	54%	0.539	48%	0.477	S	S	.	.			trans	-52.4	148.5	172.6	-24.1	32.1	0	0	0	112.5	G443 Q444	P441-G443 PolarHBondContact O-N 3.32Å; P441-Q444 PolarHBondContact O-N 2.95Å
442	S	69	Low	78.3	Confident	125 Å²	125	81.8 Å²	81.8	87%	0.874	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	114.2	177.3	-73.4	0	0	0	0	111
443	G	66.7	Low	78.5	Confident	53 Å²	53	83.7 Å²	83.7	55%	0.546	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	109.4	-2.7	-178.2	0	0	0	0	0	115.7	P441	P441-G443 PolarHBondContact O-N 3.32Å
444	Q	76.9	Confident	78.6	Confident	74 Å²	74	87.1 Å²	87.1	35%	0.346	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	151.4	173.4	-60.4	-176.6	-2.4	0	0	111.7	C440 P441 C455 E456 N457	C440-Q444 HydrophobicContact CB-CB 4.04Å; P441-Q444 PolarHBondContact O-N 2.95Å; Q444-C455 HydrophobicContact CB-CB 3.91Å; Q444-E456 CarbonylContact C-O 3.52Å; Q444-E456 WeakPolarHBondContact CA-O 3.17Å; Q444-N457 WeakPolarHBondContact CG-OD1 3.33Å; Q444-N457 PolarHBondContact NE2-OD1 2.93Å
445	K	80.7	Confident	78.4	Confident	116 Å²	116	87.2 Å²	87.2	50%	0.504	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.3	179.4	-180	-165	172.4	-166	0	109.8	C455 E456	K445-C455 CarbonylContact O-C 3.56Å; K445-E456 HydrophobicContact CB-CG 3.83Å; K445-E456 HydrophobicContact CD-CG 3.97Å; K445-E456 WeakPolarHBondContact CD-OE1 3.36Å; K445-E456 WeakPolarHBondContact CE-OE1 3.19Å; K445-E456 HydrophobicContact CG-CG 4.33Å; K445-E456 PolarHBondContact N-O 3.41Å; K445-E456 IonicContact NZ-OE1 2.78Å; K445-E456 PolarHBondContact NZ-OE1 3.03Å; K445-E456 PolarHBondContact O-N 3.47Å
446	C	82.5	Confident	77.9	Confident	34 Å²	34	82.5 Å²	82.5	23%	0.23	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	139.6	-178.2	-169	0	0	0	0	112.7	C434 C440	C434-C446 WeakPolarHBondContact CA-SG 3.03Å; C434-C446 HydrophobicContact CB-CB 3.64Å; C434-C446 WeakPolarHBondContact CB-SG 3.38Å; C434-C446 WeakPolarHBondContact SG-CB 3.03Å; C434-C446 CovalentContact SG-SG 2.04Å; C434-C446 PolarHBondContact SG-SG 3.41Å; C440-C446 HydrophobicContact CB-CB 4.48Å; C440-C446 WeakPolarHBondContact SG-CA 3.48Å; C440-C446 WeakPolarHBondContact SG-CB 3.3Å
447	R	86.3	Confident	77.1	Confident	112 Å²	112	81.4 Å²	81.4	42%	0.423	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	123.8	170.1	-77.9	-165.5	-178.4	-136	15.4	111	C434 Y453 Y454 E456	C434-R447 VanDerWaalsContact SG-C 3.57Å; C434-R447 PolarHBondContact SG-N 2.72Å; R447-Y453 CarbonylContact O-C 3.52Å; R447-Y453 VanDerWaalsContact O-CA 3.3Å; R447-Y453 WeakPolarHBondContact O-CA 3.28Å; R447-Y453 WeakPolarHBondContact O-CB 3.1Å; R447-Y454 HydrophobicContact CB-CD1 3.99Å; R447-Y454 HydrophobicContact CB-CD2 4.18Å; R447-Y454 HydrophobicContact CB-CE1 3.61Å; R447-Y454 HydrophobicContact CB-CE2 3.81Å; R447-Y454 HydrophobicContact CB-CG 4.28Å; R447-Y454 WeakPolarHBondContact CD-OH 3.49Å; R447-Y454 HydrophobicContact CG-CE2 4.19Å; R447-Y454 PolarHBondContact N-O 2.87Å; R447-Y454 PolarHBondContact O-N 3.09Å; R447-E456 IonicContact CZ-OE2 3.28Å; R447-E456 VanDerWaalsContact CZ-OE2 3.28Å; R447-E456 IonicContact NE-OE2 2.69Å; R447-E456 PolarHBondContact NE-OE2 3.03Å; R447-E456 IonicContact NH2-OE1 3.86Å; R447-E456 IonicContact NH2-OE2 3.01Å; R447-E456 PolarHBondContact NH2-OE2 3.2Å
448	N	79	Confident	76.1	Confident	55 Å²	55	80 Å²	80	29%	0.294	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	146.1	177.9	-167.8	50.4	0	0	0	112.3	D430 N432 E433 S452	D430-N448 PolarHBondContact OD2-ND2 3.12Å; N432-N448 WeakPolarHBondContact CA-OD1 3.38Å; N432-N448 VanDerWaalsContact OD1-CB 3.29Å; N432-N448 WeakPolarHBondContact OD1-CB 3.38Å; N432-N448 PolarHBondContact OD1-OD1 2.03Å; E433-N448 PolarHBondContact OE2-OD1 3.21Å; N448-S452 PolarHBondContact OD1-O 3.18Å
449	T	80	Confident	75.2	Confident	54 Å²	54	81.5 Å²	81.5	33%	0.331	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	156.4	173.7	53.6	0	0	0	0	109.7	G451 S452 Y454	T449-G451 PolarHBondContact O-N 3.14Å; T449-S452 CarbonylContact C-O 3.26Å; T449-S452 VanDerWaalsContact C-O 3.3Å; T449-S452 VanDerWaalsContact CA-O 3.29Å; T449-S452 WeakPolarHBondContact CA-O 3.44Å; T449-S452 PolarHBondContact N-O 2.88Å; T449-S452 PolarHBondContact O-N 3Å; T449-S452 WeakPolarHBondContact OG1-CB 3.18Å; T449-S452 PolarHBondContact OG1-O 3.22Å; T449-Y454 HydrophobicContact CG2-CD1 3.63Å; T449-Y454 HydrophobicContact CG2-CE1 3.61Å
450	Q	75.8	Confident	74.4	Confident	190 Å²	190	86 Å²	86	89%	0.888	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	105.9	-178.6	-172.3	174.6	-7.1	0	0	110.7	D430	D430-Q450 WeakPolarHBondContact OD1-CA 3.1Å
451	G	71.5	Confident	74	Confident	64 Å²	64	89.7 Å²	89.7	66%	0.66	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	9.5	-175.8	0	0	0	0	0	116	D430 T449	D430-G451 PolarHBondContact OD1-N 3.33Å; T449-G451 PolarHBondContact O-N 3.14Å
452	S	80.7	Confident	73.8	Confident	61 Å²	61	86.8 Å²	86.8	43%	0.427	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	-178.2	178.6	-163.8	0	0	0	0	112.8	N448 T449	N448-S452 PolarHBondContact OD1-O 3.18Å; T449-S452 CarbonylContact C-O 3.26Å; T449-S452 VanDerWaalsContact C-O 3.3Å; T449-S452 VanDerWaalsContact CA-O 3.29Å; T449-S452 WeakPolarHBondContact CA-O 3.44Å; T449-S452 PolarHBondContact N-O 2.88Å; T449-S452 PolarHBondContact O-N 3Å; T449-S452 WeakPolarHBondContact OG1-CB 3.18Å; T449-S452 PolarHBondContact OG1-O 3.22Å
453	Y	86.1	Confident	74.1	Confident	92 Å²	92	83.9 Å²	83.9	36%	0.361	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	161.3	168.8	70.2	-78.2	0	0	0	110.6	E433 A439 R447	E433-Y453 HydrophobicContact CB-CD1 3.26Å; E433-Y453 HydrophobicContact CB-CE1 3.73Å; E433-Y453 HydrophobicContact CB-CG 3.81Å; E433-Y453 HydrophobicContact CG-CD1 3.61Å; E433-Y453 HydrophobicContact CG-CE1 4.04Å; A439-Y453 WeakPolarHBondContact O-CE2 3.04Å; A439-Y453 PolarHBondContact O-OH 3.39Å; R447-Y453 CarbonylContact O-C 3.52Å; R447-Y453 VanDerWaalsContact O-CA 3.3Å; R447-Y453 WeakPolarHBondContact O-CA 3.28Å; R447-Y453 WeakPolarHBondContact O-CB 3.1Å
454	Y	84.8	Confident	74.9	Confident	111 Å²	111	87.1 Å²	87.1	44%	0.435	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	157.2	172.6	68.6	-86.8	0	0	0	111.4	R447 T449	R447-Y454 HydrophobicContact CB-CD1 3.99Å; R447-Y454 HydrophobicContact CB-CD2 4.18Å; R447-Y454 HydrophobicContact CB-CE1 3.61Å; R447-Y454 HydrophobicContact CB-CE2 3.81Å; R447-Y454 HydrophobicContact CB-CG 4.28Å; R447-Y454 WeakPolarHBondContact CD-OH 3.49Å; R447-Y454 HydrophobicContact CG-CE2 4.19Å; R447-Y454 PolarHBondContact N-O 2.87Å; R447-Y454 PolarHBondContact O-N 3.09Å; T449-Y454 HydrophobicContact CG2-CD1 3.63Å; T449-Y454 HydrophobicContact CG2-CE1 3.61Å
455	C	81.2	Confident	75.3	Confident	39 Å²	39	84.3 Å²	84.3	26%	0.264	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126	-178.5	-56	0	0	0	0	110.3	C440 Q444 K445	C440-C455 VanDerWaalsContact CA-SG 3.51Å; C440-C455 HydrophobicContact CB-CB 3.83Å; C440-C455 WeakPolarHBondContact CB-SG 3.24Å; C440-C455 WeakPolarHBondContact SG-CB 3.48Å; C440-C455 CovalentContact SG-SG 2.02Å; C440-C455 PolarHBondContact SG-SG 3.3Å; Q444-C455 HydrophobicContact CB-CB 3.91Å; K445-C455 CarbonylContact O-C 3.56Å
456	E	73.1	Confident	75.5	Confident	57 Å²	57	82.1 Å²	82.1	27%	0.266	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	134	172.5	78	-178.9	-158.8	0	0	110.6	Q444 K445 R447	Q444-E456 CarbonylContact C-O 3.52Å; Q444-E456 WeakPolarHBondContact CA-O 3.17Å; K445-E456 HydrophobicContact CB-CG 3.83Å; K445-E456 HydrophobicContact CD-CG 3.97Å; K445-E456 WeakPolarHBondContact CD-OE1 3.36Å; K445-E456 WeakPolarHBondContact CE-OE1 3.19Å; K445-E456 HydrophobicContact CG-CG 4.33Å; K445-E456 PolarHBondContact N-O 3.41Å; K445-E456 IonicContact NZ-OE1 2.78Å; K445-E456 PolarHBondContact NZ-OE1 3.03Å; K445-E456 PolarHBondContact O-N 3.47Å; R447-E456 IonicContact CZ-OE2 3.28Å; R447-E456 VanDerWaalsContact CZ-OE2 3.28Å; R447-E456 IonicContact NE-OE2 2.69Å; R447-E456 PolarHBondContact NE-OE2 3.03Å; R447-E456 IonicContact NH2-OE1 3.86Å; R447-E456 IonicContact NH2-OE2 3.01Å; R447-E456 PolarHBondContact NH2-OE2 3.2Å
457	N	61.9	Low	75.6	Confident	86 Å²	86	84.4 Å²	84.4	46%	0.46	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	133.3	173.1	-69.3	-35	0	0	0	109.7	Q444 E459	Q444-N457 WeakPolarHBondContact CG-OD1 3.33Å; Q444-N457 PolarHBondContact NE2-OD1 2.93Å; N457-E459 PolarHBondContact O-N 3.4Å
458	S	57	Low	75.4	Confident	83 Å²	83	87.1 Å²	87.1	58%	0.58	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-70.4	122.7	170.9	74.7	0	0	0	0	109.7	S460	S458-S460 PolarHBondContact O-N 3.17Å; S458-S460 VanDerWaalsContact O-N 3.09Å
459	E	57.3	Low	75.4	Confident	185 Å²	185	85.6 Å²	85.6	86%	0.864	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	110.5	178.5	-66.1	174	148.5	0	0	112.2	N457	N457-E459 PolarHBondContact O-N 3.4Å
460	S	58.1	Low	75.4	Confident	110 Å²	110	90 Å²	90	77%	0.769	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	144	-4.5	135.6	61.5	0	0	0	0	116.8	S458	S458-S460 PolarHBondContact O-N 3.17Å; S458-S460 VanDerWaalsContact O-N 3.09Å
461	S	69.8	Low	75.4	Confident	100 Å²	100	86.5 Å²	86.5	70%	0.699	50%	0.496	S	S	*	.			trans	-146.5	132.5	171.5	-178	0	0	0	0	111
462	C	72.4	Confident	75.4	Confident	22 Å²	22	88.8 Å²	88.8	15%	0.149	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-68.7	145.1	168.1	-65.1	0	0	0	0	110	Y466 C475	C462-Y466 WeakPolarHBondContact CB-O 3.38Å; C462-C475 WeakPolarHBondContact CA-SG 3.13Å; C462-C475 HydrophobicContact CB-CB 3.74Å; C462-C475 WeakPolarHBondContact CB-SG 3.44Å; C462-C475 WeakPolarHBondContact SG-CA 3.42Å; C462-C475 WeakPolarHBondContact SG-CB 3.06Å; C462-C475 CovalentContact SG-SG 2.04Å; C462-C475 PolarHBondContact SG-SG 3.41Å
463	P	75.6	Confident	75.1	Confident	64 Å²	64	87.6 Å²	87.6	42%	0.416	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-56.8	158.9	171.6	-22.2	32.9	0	0	0	111.5	G465 Y466	P463-G465 PolarHBondContact O-N 3.08Å; P463-Y466 HydrophobicContact CB-CD2 3.94Å; P463-Y466 HydrophobicContact CB-CE2 4.38Å; P463-Y466 HydrophobicContact CG-CD2 4.37Å; P463-Y466 WeakPolarHBondContact O-CB 3.07Å; P463-Y466 PolarHBondContact O-N 3.4Å
464	S	83.2	Confident	74.7	Confident	121 Å²	121	87.7 Å²	87.7	85%	0.846	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	135.9	172.3	-65.1	0	0	0	0	110.1
465	G	83.8	Confident	74.6	Confident	15 Å²	15	84.3 Å²	84.3	16%	0.155	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	-0.9	-171.2	0	0	0	0	0	114.5	P463 I478	P463-G465 PolarHBondContact O-N 3.08Å; G465-I478 PolarHBondContact O-N 3.16Å
466	Y	85.6	Confident	74.9	Confident	69 Å²	69	85.3 Å²	85.3	27%	0.271	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143.5	178.7	-62.7	-99.5	0	0	0	112	C462 P463 C475 V476 D477 V498 G499	C462-Y466 WeakPolarHBondContact CB-O 3.38Å; P463-Y466 HydrophobicContact CB-CD2 3.94Å; P463-Y466 HydrophobicContact CB-CE2 4.38Å; P463-Y466 HydrophobicContact CG-CD2 4.37Å; P463-Y466 WeakPolarHBondContact O-CB 3.07Å; P463-Y466 PolarHBondContact O-N 3.4Å; Y466-C475 HydrophobicContact CD1-CB 4.4Å; Y466-V476 CarbonylContact C-O 3.3Å; Y466-V476 WeakPolarHBondContact CA-O 3.45Å; Y466-V476 WeakPolarHBondContact CB-O 3.48Å; Y466-D477 HydrophobicContact CD1-CB 4.48Å; Y466-D477 HydrophobicContact CE1-CB 4.43Å; Y466-V498 HydrophobicContact CE1-CG1 4.05Å; Y466-V498 WeakPolarHBondContact OH-CG1 3.49Å; Y466-G499 VanDerWaalsContact CE2-CA 3.49Å
467	E	85.7	Confident	75.7	Confident	82 Å²	82	84.5 Å²	84.5	38%	0.383	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	155.9	171.5	67	-179.3	-177.8	0	0	111.6	S469 C475 V476 I478 R483	E467-S469 PolarHBondContact O-N 2.02Å; E467-C475 CarbonylContact O-C 3.58Å; E467-C475 WeakPolarHBondContact O-CA 3.34Å; E467-V476 HydrophobicContact CG-CG2 3.89Å; E467-V476 PolarHBondContact N-O 3.31Å; E467-V476 WeakPolarHBondContact O-CG2 2.94Å; E467-V476 PolarHBondContact O-N 2.04Å; E467-I478 HydrophobicContact CB-CD1 4.26Å; E467-I478 HydrophobicContact CB-CG1 3.85Å; E467-I478 HydrophobicContact CG-CG1 3.99Å; E467-R483 IonicContact OE1-NH1 2.95Å; E467-R483 IonicContact OE2-CZ 2.67Å; E467-R483 IonicContact OE2-NH1 3.55Å; E467-R483 PolarHBondContact OE2-NH1 3.14Å
468	R	80.6	Confident	77.1	Confident	169 Å²	169	82.1 Å²	82.1	64%	0.638	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	116.1	-178.4	-159.6	177.2	-162.7	177.8	3.1	109.5	T470 G473	R468-T470 PolarHBondContact O-N 3.38Å; R468-G473 WeakPolarHBondContact CG-O 3.27Å; R468-G473 PolarHBondContact NE-O 2.79Å
469	S	79.8	Confident	78.7	Confident	23 Å²	23	80.8 Å²	80.8	16%	0.161	47%	0.465	C	S	.	.			trans	-58	129.8	176.2	172.5	0	0	0	0	110.7	E467 V471 G473 N474	E467-S469 PolarHBondContact O-N 2.02Å; S469-V471 PolarHBondContact O-N 2.78Å; S469-V471 PolarHBondContact OG-N 3.01Å; S469-G473 WeakPolarHBondContact O-CA 3.43Å; S469-G473 PolarHBondContact O-N 3.47Å; S469-N474 WeakPolarHBondContact CB-O 3.5Å; S469-N474 PolarHBondContact N-O 3.05Å
470	T	78.8	Confident	80.4	Confident	146 Å²	146	73 Å²	73	90%	0.896	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-13.4	177.2	53.7	0	0	0	0	113.3	R468	R468-T470 PolarHBondContact O-N 3.38Å
471	V	77	Confident	82	Confident	117 Å²	117	69.4 Å²	69.4	71%	0.709	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-49.4	-177.1	-172.5	0	0	0	0	110.8	S469	S469-V471 PolarHBondContact O-N 2.78Å; S469-V471 PolarHBondContact OG-N 3.01Å
472	D	72.1	Confident	82.9	Confident	113 Å²	113	69.3 Å²	69.3	60%	0.604	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	-4.8	-168.6	-56.4	-45.2	0	0	0	113.9	N474	D472-N474 HydrophobicContact CB-CB 4.4Å; D472-N474 PolarHBondContact O-N 2.85Å
473	G	72.9	Confident	83.7	Confident	35 Å²	35	75 Å²	75	36%	0.361	42%	0.42	S	S	.	.			trans	68.5	-1.7	-175.8	0	0	0	0	0	114.9	R468 S469	R468-G473 WeakPolarHBondContact CG-O 3.27Å; R468-G473 PolarHBondContact NE-O 2.79Å; S469-G473 WeakPolarHBondContact O-CA 3.43Å; S469-G473 PolarHBondContact O-N 3.47Å
474	N	78.8	Confident	84.1	Confident	94 Å²	94	74.4 Å²	74.4	50%	0.503	43%	0.426	S	S	.	.			trans	-73.1	151.7	175.7	-70.6	-21.2	0	0	0	111.6	S469 D472 V476	S469-N474 WeakPolarHBondContact CB-O 3.5Å; S469-N474 PolarHBondContact N-O 3.05Å; D472-N474 HydrophobicContact CB-CB 4.4Å; D472-N474 PolarHBondContact O-N 2.85Å; N474-V476 PolarHBondContact O-N 3.31Å
475	C	82.2	Confident	84.4	Confident	40 Å²	40	72.7 Å²	72.7	27%	0.27	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	114	172.7	-64.2	0	0	0	0	109.6	C462 Y466 E467	C462-C475 WeakPolarHBondContact CA-SG 3.13Å; C462-C475 HydrophobicContact CB-CB 3.74Å; C462-C475 WeakPolarHBondContact CB-SG 3.44Å; C462-C475 WeakPolarHBondContact SG-CA 3.42Å; C462-C475 WeakPolarHBondContact SG-CB 3.06Å; C462-C475 CovalentContact SG-SG 2.04Å; C462-C475 PolarHBondContact SG-SG 3.41Å; Y466-C475 HydrophobicContact CD1-CB 4.4Å; E467-C475 CarbonylContact O-C 3.58Å; E467-C475 WeakPolarHBondContact O-CA 3.34Å
476	V	87.2	Confident	84.5	Confident	60 Å²	60	73.5 Å²	73.5	36%	0.364	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	146.3	173.6	-67.1	0	0	0	0	108.8	Y466 E467 N474	Y466-V476 CarbonylContact C-O 3.3Å; Y466-V476 WeakPolarHBondContact CA-O 3.45Å; Y466-V476 WeakPolarHBondContact CB-O 3.48Å; E467-V476 HydrophobicContact CG-CG2 3.89Å; E467-V476 PolarHBondContact N-O 3.31Å; E467-V476 WeakPolarHBondContact O-CG2 2.94Å; E467-V476 PolarHBondContact O-N 2.04Å; N474-V476 PolarHBondContact O-N 3.31Å
477	D	90.8	Very high	84.6	Confident	41 Å²	41	73.5 Å²	73.5	22%	0.219	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	138.6	176.3	179.4	54	0	0	0	111.4	Y466 D479 N496 T497 G499	Y466-D477 HydrophobicContact CD1-CB 4.48Å; Y466-D477 HydrophobicContact CE1-CB 4.43Å; D477-D479 PolarHBondContact O-N 3.08Å; D477-N496 PolarHBondContact OD2-ND2 2.85Å; D477-T497 VanDerWaalsContact OD1-O 3.13Å; D477-G499 PolarHBondContact OD1-N 3.45Å
478	I	90.3	Very high	84.6	Confident	35 Å²	35	70.3 Å²	70.3	18%	0.179	40%	0.404	C	S	.	.			trans	-82.7	110.9	174.2	-63.9	173.8	0	0	0	107.3	G465 E467 E480 R483 N496	G465-I478 PolarHBondContact O-N 3.16Å; E467-I478 HydrophobicContact CB-CD1 4.26Å; E467-I478 HydrophobicContact CB-CG1 3.85Å; E467-I478 HydrophobicContact CG-CG1 3.99Å; I478-E480 HydrophobicContact CG2-CG 4.12Å; I478-E480 PolarHBondContact O-N 3.19Å; I478-R483 VanDerWaalsContact CG2-CD 3.49Å; I478-N496 PolarHBondContact O-OD1 3.49Å
479	D	90.8	Very high	84.8	Confident	56 Å²	56	65.2 Å²	65.2	30%	0.299	39%	0.393	S	S	.	.			trans	-73.3	89.9	171.9	-174.1	-13.3	0	0	0	110.9	D477 C481 S482 R483 N496	D477-D479 PolarHBondContact O-N 3.08Å; D479-C481 PolarHBondContact O-N 3.05Å; D479-C481 WeakPolarHBondContact OD1-CA 3.35Å; D479-C481 VanDerWaalsContact OD1-CB 3.28Å; D479-C481 WeakPolarHBondContact OD1-CB 3.47Å; D479-C481 PolarHBondContact OD1-N 3.28Å; D479-S482 VanDerWaalsContact CG-CB 3.49Å; D479-S482 VanDerWaalsContact CG-OG 3.24Å; D479-S482 PolarHBondContact O-N 3.35Å; D479-S482 PolarHBondContact OD1-N 2.03Å; D479-S482 VanDerWaalsContact OD2-CB 3.32Å; D479-S482 WeakPolarHBondContact OD2-CB 3.23Å; D479-S482 PolarHBondContact OD2-OG 3.37Å; D479-R483 WeakPolarHBondContact O-CB 3.24Å; D479-R483 VanDerWaalsContact O-CG 3.31Å; D479-R483 WeakPolarHBondContact O-CG 3.41Å; D479-R483 PolarHBondContact O-N 2.86Å; D479-N496 WeakPolarHBondContact CA-ND2 3.46Å; D479-N496 WeakPolarHBondContact OD1-CB 2.99Å
480	E	92.4	Very high	85	Confident	22 Å²	22	69.8 Å²	69.8	10%	0.103	41%	0.412	C	S	.	.	H	α-helix	trans	-65.8	-20	-179.7	-60.4	98.9	159.6	0	0	112.9	I478 G484 T485 N496 S500 Y501	I478-E480 HydrophobicContact CG2-CG 4.12Å; I478-E480 PolarHBondContact O-N 3.19Å; E480-G484 PolarHBondContact O-N 3.15Å; E480-G484 VanDerWaalsContact O-N 3.08Å; E480-T485 WeakPolarHBondContact CA-OG1 2.97Å; E480-T485 WeakPolarHBondContact CB-OG1 3.19Å; E480-T485 PolarHBondContact O-N 2.02Å; E480-N496 PolarHBondContact OE2-OD1 3.36Å; E480-N496 VanDerWaalsContact OE2-OD1 3.08Å; E480-S500 VanDerWaalsContact OE2-C 3.26Å; E480-Y501 HydrophobicContact CB-CD1 3.66Å; E480-Y501 HydrophobicContact CB-CE1 4.33Å; E480-Y501 HydrophobicContact CB-CG 4.05Å; E480-Y501 HydrophobicContact CG-CD1 3.7Å; E480-Y501 HydrophobicContact CG-CE1 4.28Å; E480-Y501 WeakPolarHBondContact OE2-CB 3.33Å; E480-Y501 PolarHBondContact OE2-N 3.37Å
481	C	91.6	Very high	85.1	Confident	34 Å²	34	66.4 Å²	66.4	23%	0.23	40%	0.399	C	S	.	.	H	α-helix	trans	-74.5	-47.3	176.2	-53	0	0	0	0	111	D479 R483 G484 C494 V495 N496	D479-C481 PolarHBondContact O-N 3.05Å; D479-C481 WeakPolarHBondContact OD1-CA 3.35Å; D479-C481 VanDerWaalsContact OD1-CB 3.28Å; D479-C481 WeakPolarHBondContact OD1-CB 3.47Å; D479-C481 PolarHBondContact OD1-N 3.28Å; C481-R483 VanDerWaalsContact C-N 3.31Å; C481-R483 PolarHBondContact O-N 2.86Å; C481-G484 PolarHBondContact O-N 2.94Å; C481-C494 WeakPolarHBondContact CA-SG 2.98Å; C481-C494 HydrophobicContact CB-CB 3.69Å; C481-C494 WeakPolarHBondContact CB-SG 3Å; C481-C494 WeakPolarHBondContact SG-CB 3.32Å; C481-C494 PolarHBondContact SG-O 3.26Å; C481-C494 VanDerWaalsContact SG-O 3.41Å; C481-C494 CovalentContact SG-SG 2.04Å; C481-C494 PolarHBondContact SG-SG 3.05Å; C481-V495 VanDerWaalsContact SG-C 3.53Å; C481-V495 PolarHBondContact SG-N 3.46Å; C481-N496 HydrophobicContact CB-CB 4.47Å; C481-N496 PolarHBondContact SG-N 3.48Å
482	S	90.2	Very high	85.4	Confident	98 Å²	98	66.4 Å²	66.4	69%	0.685	40%	0.395	S	S	*	.	H	α-helix	trans	-67.2	-32.5	175.1	-69.1	0	0	0	0	112.5	D479	D479-S482 VanDerWaalsContact CG-CB 3.49Å; D479-S482 VanDerWaalsContact CG-OG 3.24Å; D479-S482 PolarHBondContact O-N 3.35Å; D479-S482 PolarHBondContact OD1-N 2.03Å; D479-S482 VanDerWaalsContact OD2-CB 3.32Å; D479-S482 WeakPolarHBondContact OD2-CB 3.23Å; D479-S482 PolarHBondContact OD2-OG 3.37Å
483	R	87.9	Confident	86.2	Confident	140 Å²	140	61.8 Å²	61.8	53%	0.528	37%	0.37	S	S	.	.	H	α-helix	trans	-81.4	-13.5	177.7	-66.8	176.4	75.1	117.3	-6.3	114.1	E467 I478 D479 C481 T485	E467-R483 IonicContact OE1-NH1 2.95Å; E467-R483 IonicContact OE2-CZ 2.67Å; E467-R483 IonicContact OE2-NH1 3.55Å; E467-R483 PolarHBondContact OE2-NH1 3.14Å; I478-R483 VanDerWaalsContact CG2-CD 3.49Å; D479-R483 WeakPolarHBondContact O-CB 3.24Å; D479-R483 VanDerWaalsContact O-CG 3.31Å; D479-R483 WeakPolarHBondContact O-CG 3.41Å; D479-R483 PolarHBondContact O-N 2.86Å; C481-R483 VanDerWaalsContact C-N 3.31Å; C481-R483 PolarHBondContact O-N 2.86Å; R483-T485 HydrophobicContact CB-CG2 4.09Å; R483-T485 PolarHBondContact O-N 2.04Å
484	G	85.7	Confident	87	Confident	53 Å²	53	60.9 Å²	60.9	55%	0.546	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	25.3	-174.3	0	0	0	0	0	113.7	E480 C481	E480-G484 PolarHBondContact O-N 3.15Å; E480-G484 VanDerWaalsContact O-N 3.08Å; C481-G484 PolarHBondContact O-N 2.94Å
485	T	88.1	Confident	87.6	Confident	84 Å²	84	58.5 Å²	58.5	52%	0.515	35%	0.347	S	S	.	.			trans	-92.6	1.5	179.6	50.7	0	0	0	0	113.3	E480 R483	E480-T485 WeakPolarHBondContact CA-OG1 2.97Å; E480-T485 WeakPolarHBondContact CB-OG1 3.19Å; E480-T485 PolarHBondContact O-N 2.02Å; R483-T485 HydrophobicContact CB-CG2 4.09Å; R483-T485 PolarHBondContact O-N 2.04Å
486	H	86.4	Confident	88.1	Confident	32 Å²	32	58.8 Å²	58.8	15%	0.148	35%	0.345	C	S	.	.			trans	-72.5	156.7	177.5	65.1	77.1	0	0	0	113.4	C488 C494 Y501	H486-C488 PolarHBondContact ND1-N 2.84Å; H486-C494 HydrophobicContact CB-CB 4.22Å; H486-C494 WeakPolarHBondContact CB-SG 3.46Å; H486-C494 VanDerWaalsContact CD2-SG 3.59Å; H486-C494 VanDerWaalsContact CG-SG 3.59Å; H486-Y501 HydrophobicContact CB-CD2 3.56Å; H486-Y501 HydrophobicContact CB-CE1 4.48Å; H486-Y501 HydrophobicContact CB-CE2 3.48Å; H486-Y501 VanDerWaalsContact CB-CE2 3.48Å; H486-Y501 HydrophobicContact CB-CG 4.12Å
487	T	87.3	Confident	88.2	Confident	70 Å²	70	58.3 Å²	58.3	43%	0.429	34%	0.342	S	S	.	.			trans	-101.9	21.4	174.4	63.5	0	0	0	0	114.5	Y501	T487-Y501 PolarHBondContact N-OH 3.28Å; T487-Y501 PolarHBondContact OG1-OH 3.3Å; T487-Y501 VanDerWaalsContact OG1-OH 3.09Å
488	C	86.3	Confident	88.1	Confident	14 Å²	14	62 Å²	62	10%	0.095	37%	0.366	C	S	.	.			trans	-69.4	153	176.9	-51.4	0	0	0	0	113.1	H486 M493 C503	H486-C488 PolarHBondContact ND1-N 2.84Å; C488-M493 HydrophobicContact CB-CB 4.28Å; C488-C503 WeakPolarHBondContact CA-SG 3.34Å; C488-C503 HydrophobicContact CB-CB 3.76Å; C488-C503 WeakPolarHBondContact CB-SG 3.38Å; C488-C503 WeakPolarHBondContact SG-CA 3.47Å; C488-C503 WeakPolarHBondContact SG-CB 3.02Å; C488-C503 CovalentContact SG-SG 2.03Å; C488-C503 PolarHBondContact SG-SG 3.04Å
489	P	85	Confident	87.9	Confident	62 Å²	62	61.3 Å²	61.3	40%	0.403	37%	0.368	S	S	.	.	S	Bend	trans	-62.7	-42.6	-177.4	-17.3	28.1	0	0	0	113.4	M493 F511	P489-M493 HydrophobicContact CB-SD 4.05Å; P489-M493 HydrophobicContact CG-CE 4.38Å; P489-M493 HydrophobicContact CG-SD 4.01Å; P489-F511 HydrophobicContact CG-CE2 4.21Å
490	E	84.3	Confident	87.9	Confident	119 Å²	119	61.4 Å²	61.4	56%	0.556	37%	0.373	S	S	*	.	S	Bend	trans	-125.6	151	175.9	-59.6	-179.9	-175.7	0	0	110	N492 M493	E490-N492 VanDerWaalsContact C-N 3.33Å; E490-N492 WeakPolarHBondContact CB-OD1 3.28Å; E490-N492 PolarHBondContact O-N 3.14Å; E490-N492 PolarHBondContact OE2-ND2 2.93Å; E490-N492 PolarHBondContact OE2-OD1 3.01Å; E490-M493 HydrophobicContact CB-CG 3.93Å; E490-M493 HydrophobicContact CB-SD 3.79Å; E490-M493 HydrophobicContact CG-SD 4.15Å; E490-M493 WeakPolarHBondContact O-CB 3.2Å; E490-M493 PolarHBondContact O-N 3.39Å
491	A	80.1	Confident	87.8	Confident	76 Å²	76	63 Å²	63	63%	0.628	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-65.2	-33.8	-175	0	0	0	0	0	113.5	M493 C494	A491-M493 PolarHBondContact O-N 3.23Å; A491-C494 PolarHBondContact O-N 2.84Å
492	N	83.6	Confident	87.7	Confident	117 Å²	117	65.7 Å²	65.7	63%	0.626	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-68.3	-9.1	176.8	60	-8.4	0	0	0	114.1	E490	E490-N492 VanDerWaalsContact C-N 3.33Å; E490-N492 WeakPolarHBondContact CB-OD1 3.28Å; E490-N492 PolarHBondContact O-N 3.14Å; E490-N492 PolarHBondContact OE2-ND2 2.93Å; E490-N492 PolarHBondContact OE2-OD1 3.01Å
493	M	88.3	Confident	87.7	Confident	16 Å²	16	62 Å²	62	8%	0.079	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-93.2	-12.6	-178.4	-54.8	177.9	72.6	0	0	112.9	C488 P489 E490 A491 V495 C503 R504 C505 C518	C488-M493 HydrophobicContact CB-CB 4.28Å; P489-M493 HydrophobicContact CB-SD 4.05Å; P489-M493 HydrophobicContact CG-CE 4.38Å; P489-M493 HydrophobicContact CG-SD 4.01Å; E490-M493 HydrophobicContact CB-CG 3.93Å; E490-M493 HydrophobicContact CB-SD 3.79Å; E490-M493 HydrophobicContact CG-SD 4.15Å; E490-M493 WeakPolarHBondContact O-CB 3.2Å; E490-M493 PolarHBondContact O-N 3.39Å; A491-M493 PolarHBondContact O-N 3.23Å; M493-V495 PolarHBondContact O-N 3.14Å; M493-C503 CarbonylContact O-C 3.45Å; M493-C503 WeakPolarHBondContact O-CA 3.07Å; M493-R504 WeakPolarHBondContact CE-O 3.33Å; M493-R504 PolarHBondContact O-N 3.2Å; M493-C505 HydrophobicContact CE-CB 4.33Å; M493-C518 HydrophobicContact CE-CB 4.45Å; M493-C518 WeakPolarHBondContact CE-SG 3.49Å
494	C	90.3	Very high	87.8	Confident	15 Å²	15	63.2 Å²	63.2	10%	0.101	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	127.5	179.7	-174.8	0	0	0	0	110.2	C481 H486 A491	C481-C494 WeakPolarHBondContact CA-SG 2.98Å; C481-C494 HydrophobicContact CB-CB 3.69Å; C481-C494 WeakPolarHBondContact CB-SG 3Å; C481-C494 WeakPolarHBondContact SG-CB 3.32Å; C481-C494 PolarHBondContact SG-O 3.26Å; C481-C494 VanDerWaalsContact SG-O 3.41Å; C481-C494 CovalentContact SG-SG 2.04Å; C481-C494 PolarHBondContact SG-SG 3.05Å; H486-C494 HydrophobicContact CB-CB 4.22Å; H486-C494 WeakPolarHBondContact CB-SG 3.46Å; H486-C494 VanDerWaalsContact CD2-SG 3.59Å; H486-C494 VanDerWaalsContact CG-SG 3.59Å; A491-C494 PolarHBondContact O-N 2.84Å
495	V	91.7	Very high	88	Confident	45 Å²	45	61.8 Å²	61.8	27%	0.273	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	113.3	169.4	-178.5	0	0	0	0	107.9	C481 M493 Y501 H502 R504	C481-V495 VanDerWaalsContact SG-C 3.53Å; C481-V495 PolarHBondContact SG-N 3.46Å; M493-V495 PolarHBondContact O-N 3.14Å; V495-Y501 WeakPolarHBondContact O-CA 3.03Å; V495-H502 VanDerWaalsContact CG1-CE1 3.42Å; V495-H502 WeakPolarHBondContact CG1-CE1 3.39Å; V495-H502 PolarHBondContact N-O 3.15Å; V495-H502 PolarHBondContact O-N 2.91Å; V495-H502 PolarHBondContact O-ND1 3.41Å; V495-R504 HydrophobicContact CG2-CB 3.85Å
496	N	91.5	Very high	88	Confident	45 Å²	45	61.4 Å²	61.4	24%	0.241	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	138.7	177.5	-173.6	44.8	0	0	0	109.8	D477 I478 D479 E480 C481 S500	D477-N496 PolarHBondContact OD2-ND2 2.85Å; I478-N496 PolarHBondContact O-OD1 3.49Å; D479-N496 WeakPolarHBondContact CA-ND2 3.46Å; D479-N496 WeakPolarHBondContact OD1-CB 2.99Å; E480-N496 PolarHBondContact OE2-OD1 3.36Å; E480-N496 VanDerWaalsContact OE2-OD1 3.08Å; C481-N496 HydrophobicContact CB-CB 4.47Å; C481-N496 PolarHBondContact SG-N 3.48Å; N496-S500 PolarHBondContact OD1-O 3.45Å
497	T	89.1	Confident	88	Confident	50 Å²	50	66.7 Å²	66.7	31%	0.307	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.6	178.9	46.8	0	0	0	0	109.1	D477 G499 S500 H502	D477-T497 VanDerWaalsContact OD1-O 3.13Å; T497-G499 PolarHBondContact O-N 2.65Å; T497-S500 CarbonylContact C-O 3.28Å; T497-S500 VanDerWaalsContact C-O 3.25Å; T497-S500 VanDerWaalsContact CA-O 3.26Å; T497-S500 WeakPolarHBondContact CA-O 3.39Å; T497-S500 WeakPolarHBondContact CB-O 3.49Å; T497-S500 PolarHBondContact N-O 2.85Å; T497-S500 CarbonylContact O-C 3.5Å; T497-S500 PolarHBondContact O-N 2.8Å; T497-S500 PolarHBondContact OG1-O 2.86Å; T497-H502 VanDerWaalsContact CG2-ND1 3.28Å; T497-H502 WeakPolarHBondContact CG2-ND1 3.07Å
498	V	88.9	Confident	88.1	Confident	118 Å²	118	64 Å²	64	72%	0.715	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	109.1	-178.5	176.1	0	0	0	0	110	Y466	Y466-V498 HydrophobicContact CE1-CG1 4.05Å; Y466-V498 WeakPolarHBondContact OH-CG1 3.49Å
499	G	86.5	Confident	88.4	Confident	22 Å²	22	66.8 Å²	66.8	23%	0.227	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.3	1.5	-177.9	0	0	0	0	0	116.5	Y466 D477 T497	Y466-G499 VanDerWaalsContact CE2-CA 3.49Å; D477-G499 PolarHBondContact OD1-N 3.45Å; T497-G499 PolarHBondContact O-N 2.65Å
500	S	90.1	Very high	88.6	Confident	58 Å²	58	69.6 Å²	69.6	41%	0.406	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	179.3	-178.7	-173.9	0	0	0	0	111.6	E480 N496 T497	E480-S500 VanDerWaalsContact OE2-C 3.26Å; N496-S500 PolarHBondContact OD1-O 3.45Å; T497-S500 CarbonylContact C-O 3.28Å; T497-S500 VanDerWaalsContact C-O 3.25Å; T497-S500 VanDerWaalsContact CA-O 3.26Å; T497-S500 WeakPolarHBondContact CA-O 3.39Å; T497-S500 WeakPolarHBondContact CB-O 3.49Å; T497-S500 PolarHBondContact N-O 2.85Å; T497-S500 CarbonylContact O-C 3.5Å; T497-S500 PolarHBondContact O-N 2.8Å; T497-S500 PolarHBondContact OG1-O 2.86Å
501	Y	90.5	Very high	88.8	Confident	56 Å²	56	66.8 Å²	66.8	22%	0.22	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	164.7	161.8	66.5	-76.5	0	0	0	111.2	E480 H486 T487 V495	E480-Y501 HydrophobicContact CB-CD1 3.66Å; E480-Y501 HydrophobicContact CB-CE1 4.33Å; E480-Y501 HydrophobicContact CB-CG 4.05Å; E480-Y501 HydrophobicContact CG-CD1 3.7Å; E480-Y501 HydrophobicContact CG-CE1 4.28Å; E480-Y501 WeakPolarHBondContact OE2-CB 3.33Å; E480-Y501 PolarHBondContact OE2-N 3.37Å; H486-Y501 HydrophobicContact CB-CD2 3.56Å; H486-Y501 HydrophobicContact CB-CE1 4.48Å; H486-Y501 HydrophobicContact CB-CE2 3.48Å; H486-Y501 VanDerWaalsContact CB-CE2 3.48Å; H486-Y501 HydrophobicContact CB-CG 4.12Å; T487-Y501 PolarHBondContact N-OH 3.28Å; T487-Y501 PolarHBondContact OG1-OH 3.3Å; T487-Y501 VanDerWaalsContact OG1-OH 3.09Å; V495-Y501 WeakPolarHBondContact O-CA 3.03Å
502	H	89.7	Confident	89.2	Confident	90 Å²	90	65 Å²	65	42%	0.417	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	153.1	164.7	66.4	-73.9	0	0	0	111.1	V495 T497	V495-H502 VanDerWaalsContact CG1-CE1 3.42Å; V495-H502 WeakPolarHBondContact CG1-CE1 3.39Å; V495-H502 PolarHBondContact N-O 3.15Å; V495-H502 PolarHBondContact O-N 2.91Å; V495-H502 PolarHBondContact O-ND1 3.41Å; T497-H502 VanDerWaalsContact CG2-ND1 3.28Å; T497-H502 WeakPolarHBondContact CG2-ND1 3.07Å
503	C	89.8	Confident	89.1	Confident	19 Å²	19	64.1 Å²	64.1	13%	0.128	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	116.1	178.5	-54.4	0	0	0	0	109.9	C488 M493 F511	C488-C503 WeakPolarHBondContact CA-SG 3.34Å; C488-C503 HydrophobicContact CB-CB 3.76Å; C488-C503 WeakPolarHBondContact CB-SG 3.38Å; C488-C503 WeakPolarHBondContact SG-CA 3.47Å; C488-C503 WeakPolarHBondContact SG-CB 3.02Å; C488-C503 CovalentContact SG-SG 2.03Å; C488-C503 PolarHBondContact SG-SG 3.04Å; M493-C503 CarbonylContact O-C 3.45Å; M493-C503 WeakPolarHBondContact O-CA 3.07Å; C503-F511 HydrophobicContact CB-CD2 4.05Å; C503-F511 HydrophobicContact CB-CE2 4.17Å; C503-F511 HydrophobicContact CB-CG 4.25Å; C503-F511 HydrophobicContact CB-CZ 4.46Å
504	R	90.6	Very high	89	Confident	167 Å²	167	68.8 Å²	68.8	63%	0.63	38%	0.38	S	S	*	.			trans	-89.8	106.7	176.1	-174.1	174.7	69.4	174.3	1.1	110	M493 V495	M493-R504 WeakPolarHBondContact CE-O 3.33Å; M493-R504 PolarHBondContact O-N 3.2Å; V495-R504 HydrophobicContact CG2-CB 3.85Å
505	C	90.2	Very high	88.8	Confident	22 Å²	22	71 Å²	71	15%	0.149	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-67.7	154.7	171.4	-67.6	0	0	0	0	112.1	M493 Y509 F511 C518	M493-C505 HydrophobicContact CE-CB 4.33Å; C505-Y509 WeakPolarHBondContact CB-O 3.39Å; C505-F511 WeakPolarHBondContact SG-CA 3.48Å; C505-F511 VanDerWaalsContact SG-CB 3.56Å; C505-F511 PolarHBondContact SG-N 3.1Å; C505-C518 VanDerWaalsContact CA-SG 3.57Å; C505-C518 HydrophobicContact CB-CB 3.85Å; C505-C518 WeakPolarHBondContact CB-SG 3.04Å; C505-C518 WeakPolarHBondContact SG-CB 3.03Å; C505-C518 CovalentContact SG-SG 2.03Å; C505-C518 PolarHBondContact SG-SG 2.97Å
506	P	86.9	Confident	88.5	Confident	76 Å²	76	74.5 Å²	74.5	49%	0.494	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-53.6	151.1	166.1	-22.6	33.1	0	0	0	111.1	G508 Y509	P506-G508 PolarHBondContact O-N 3.31Å; P506-Y509 HydrophobicContact CB-CD2 4.13Å; P506-Y509 PolarHBondContact O-N 3.43Å
507	T	88	Confident	88.3	Confident	143 Å²	143	78.1 Å²	78.1	88%	0.877	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	133.9	174.1	-51.2	0	0	0	0	110.3
508	G	89	Confident	88.3	Confident	14 Å²	14	77.3 Å²	77.3	14%	0.144	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	91	-5	-175.6	0	0	0	0	0	115	P506 I521	P506-G508 PolarHBondContact O-N 3.31Å; G508-I521 WeakPolarHBondContact O-CB 3.37Å; G508-I521 WeakPolarHBondContact O-CG1 3.4Å; G508-I521 PolarHBondContact O-N 3.35Å
509	Y	92.1	Very high	88.4	Confident	72 Å²	72	74.6 Å²	74.6	28%	0.282	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	149.4	178.6	-63.4	-102.6	0	0	0	111.4	C505 P506 E519 D520 P539 G540	C505-Y509 WeakPolarHBondContact CB-O 3.39Å; P506-Y509 HydrophobicContact CB-CD2 4.13Å; P506-Y509 PolarHBondContact O-N 3.43Å; Y509-E519 CarbonylContact C-O 3.57Å; Y509-E519 WeakPolarHBondContact CA-O 3.34Å; Y509-D520 HydrophobicContact CD1-CB 4.23Å; Y509-D520 HydrophobicContact CE1-CB 4.02Å; Y509-P539 VanDerWaalsContact OH-C 3.23Å; Y509-P539 WeakPolarHBondContact OH-CB 3.37Å; Y509-G540 PolarHBondContact OH-N 3.31Å
510	R	89.6	Confident	88.7	Confident	122 Å²	122	75.8 Å²	75.8	46%	0.46	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.4	173.6	67.2	-179.5	-176.8	-164	-0.7	111.2	N512 C518 E519 I521	R510-N512 PolarHBondContact O-N 3.39Å; R510-C518 WeakPolarHBondContact O-CA 3.42Å; R510-E519 PolarHBondContact N-O 3.11Å; R510-E519 PolarHBondContact O-N 2.85Å; R510-I521 HydrophobicContact CB-CD1 4.15Å; R510-I521 HydrophobicContact CB-CG1 3.93Å; R510-I521 HydrophobicContact CG-CG1 4.07Å
511	F	88.4	Confident	88.9	Confident	60 Å²	60	74.8 Å²	74.8	26%	0.263	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	122.1	175.8	-174.4	-109.7	0	0	0	109	P489 C503 C505 P513 K516	P489-F511 HydrophobicContact CG-CE2 4.21Å; C503-F511 HydrophobicContact CB-CD2 4.05Å; C503-F511 HydrophobicContact CB-CE2 4.17Å; C503-F511 HydrophobicContact CB-CG 4.25Å; C503-F511 HydrophobicContact CB-CZ 4.46Å; C505-F511 WeakPolarHBondContact SG-CA 3.48Å; C505-F511 VanDerWaalsContact SG-CB 3.56Å; C505-F511 PolarHBondContact SG-N 3.1Å; F511-P513 WeakPolarHBondContact O-CD 3.05Å; F511-K516 HydrophobicContact CZ-CB 4.46Å
512	N	87.8	Confident	89	Confident	37 Å²	37	73.7 Å²	73.7	20%	0.198	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	111.5	172.7	-178.9	-22.2	0	0	0	109.1	R510 S514 T515 K516 Q517 E519	R510-N512 PolarHBondContact O-N 3.39Å; N512-S514 PolarHBondContact O-N 2.86Å; N512-S514 VanDerWaalsContact O-N 3.16Å; N512-S514 VanDerWaalsContact OD1-CB 3.31Å; N512-S514 WeakPolarHBondContact OD1-CB 3.47Å; N512-S514 PolarHBondContact OD1-N 3.27Å; N512-T515 VanDerWaalsContact CB-OG1 3.27Å; N512-T515 WeakPolarHBondContact CB-OG1 3.25Å; N512-T515 PolarHBondContact O-N 3.1Å; N512-T515 PolarHBondContact OD1-N 3.2Å; N512-K516 WeakPolarHBondContact O-CA 3.47Å; N512-K516 PolarHBondContact O-N 3.05Å; N512-Q517 PolarHBondContact N-O 2.66Å; N512-E519 HydrophobicContact CB-CG 4.32Å; N512-E519 PolarHBondContact ND2-OE1 3.36Å; N512-E519 PolarHBondContact ND2-OE2 2.97Å
513	P	82.6	Confident	89.2	Confident	100 Å²	100	70.4 Å²	70.4	65%	0.649	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-24.8	-178	-21.4	32.4	0	0	0	113.6	F511	F511-P513 WeakPolarHBondContact O-CD 3.05Å
514	S	86	Confident	89.3	Confident	113 Å²	113	70.9 Å²	70.9	79%	0.79	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-43.2	-178	-52.7	0	0	0	0	111.8	N512	N512-S514 PolarHBondContact O-N 2.86Å; N512-S514 VanDerWaalsContact O-N 3.16Å; N512-S514 VanDerWaalsContact OD1-CB 3.31Å; N512-S514 WeakPolarHBondContact OD1-CB 3.47Å; N512-S514 PolarHBondContact OD1-N 3.27Å
515	T	86.6	Confident	89.4	Confident	63 Å²	63	72.9 Å²	72.9	39%	0.387	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-12.7	179.8	59.3	0	0	0	0	112.6	N512 Q517 E519	N512-T515 VanDerWaalsContact CB-OG1 3.27Å; N512-T515 WeakPolarHBondContact CB-OG1 3.25Å; N512-T515 PolarHBondContact O-N 3.1Å; N512-T515 PolarHBondContact OD1-N 3.2Å; T515-Q517 PolarHBondContact O-N 2.95Å; T515-E519 WeakPolarHBondContact CG2-OE1 3.48Å; T515-E519 PolarHBondContact OG1-OE1 3.31Å
516	K	85.1	Confident	89.4	Confident	117 Å²	117	75.7 Å²	75.7	51%	0.509	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	33.3	-172.7	-59	-175.4	178.6	-175.6	0	112.5	F511 N512	F511-K516 HydrophobicContact CZ-CB 4.46Å; N512-K516 WeakPolarHBondContact O-CA 3.47Å; N512-K516 PolarHBondContact O-N 3.05Å
517	Q	87.6	Confident	89.4	Confident	122 Å²	122	79.1 Å²	79.1	57%	0.57	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.9	159.1	-179.5	-71.3	179.4	43.1	0	0	110.4	N512 T515	N512-Q517 PolarHBondContact N-O 2.66Å; T515-Q517 PolarHBondContact O-N 2.95Å
518	C	88.9	Confident	89.4	Confident	32 Å²	32	77.2 Å²	77.2	22%	0.216	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	112.8	169.3	-68.7	0	0	0	0	108.7	M493 C505 R510	M493-C518 HydrophobicContact CE-CB 4.45Å; M493-C518 WeakPolarHBondContact CE-SG 3.49Å; C505-C518 VanDerWaalsContact CA-SG 3.57Å; C505-C518 HydrophobicContact CB-CB 3.85Å; C505-C518 WeakPolarHBondContact CB-SG 3.04Å; C505-C518 WeakPolarHBondContact SG-CB 3.03Å; C505-C518 CovalentContact SG-SG 2.03Å; C505-C518 PolarHBondContact SG-SG 2.97Å; R510-C518 WeakPolarHBondContact O-CA 3.42Å
519	E	91.1	Very high	89.3	Confident	62 Å²	62	77.6 Å²	77.6	29%	0.29	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	140.1	178.3	-71.5	169.2	-167.5	0	0	109.1	Y509 R510 N512 T515 I521	Y509-E519 CarbonylContact C-O 3.57Å; Y509-E519 WeakPolarHBondContact CA-O 3.34Å; R510-E519 PolarHBondContact N-O 3.11Å; R510-E519 PolarHBondContact O-N 2.85Å; N512-E519 HydrophobicContact CB-CG 4.32Å; N512-E519 PolarHBondContact ND2-OE1 3.36Å; N512-E519 PolarHBondContact ND2-OE2 2.97Å; T515-E519 WeakPolarHBondContact CG2-OE1 3.48Å; T515-E519 PolarHBondContact OG1-OE1 3.31Å; E519-I521 PolarHBondContact O-N 2.76Å
520	D	92.9	Very high	89.1	Confident	46 Å²	46	78.6 Å²	78.6	25%	0.246	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	135.2	175.4	-177.1	53.7	0	0	0	110.9	Y509 D522 N537 G540	Y509-D520 HydrophobicContact CD1-CB 4.23Å; Y509-D520 HydrophobicContact CE1-CB 4.02Å; D520-D522 PolarHBondContact O-N 2.81Å; D520-N537 PolarHBondContact OD2-ND2 2.91Å; D520-G540 PolarHBondContact OD1-N 3.03Å
521	I	92.5	Very high	89.1	Confident	37 Å²	37	74 Å²	74	19%	0.19	40%	0.395	C	S	.	.			trans	-83.4	106.7	175.3	-62.8	173.8	0	0	0	106.6	G508 R510 E519 E523 Q526 L528	G508-I521 WeakPolarHBondContact O-CB 3.37Å; G508-I521 WeakPolarHBondContact O-CG1 3.4Å; G508-I521 PolarHBondContact O-N 3.35Å; R510-I521 HydrophobicContact CB-CD1 4.15Å; R510-I521 HydrophobicContact CB-CG1 3.93Å; R510-I521 HydrophobicContact CG-CG1 4.07Å; E519-I521 PolarHBondContact O-N 2.76Å; I521-E523 VanDerWaalsContact C-N 3.33Å; I521-E523 HydrophobicContact CG2-CG 4.19Å; I521-E523 PolarHBondContact O-N 2.69Å; I521-Q526 VanDerWaalsContact CG2-NE2 3.31Å; I521-L528 HydrophobicContact CG2-CD1 4.12Å
522	D	93.2	Very high	89.2	Confident	33 Å²	33	77 Å²	77	18%	0.176	41%	0.409	C	S	.	.			trans	-69.7	91.4	173.7	-171.2	-27.7	0	0	0	109.8	D520 C524 R525 Q526 N537	D520-D522 PolarHBondContact O-N 2.81Å; D522-C524 PolarHBondContact O-N 3.2Å; D522-C524 WeakPolarHBondContact OD1-CB 3.29Å; D522-C524 PolarHBondContact OD1-N 3.07Å; D522-R525 HydrophobicContact CB-CB 4.16Å; D522-R525 PolarHBondContact O-N 3.22Å; D522-R525 PolarHBondContact OD1-N 2.96Å; D522-R525 WeakPolarHBondContact OD2-CD 3.33Å; D522-R525 VanDerWaalsContact OD2-CG 3.23Å; D522-R525 WeakPolarHBondContact OD2-CG 3.43Å; D522-R525 IonicContact OD2-CZ 3.58Å; D522-R525 IonicContact OD2-NE 2.71Å; D522-R525 IonicContact OD2-NH1 3.74Å; D522-Q526 WeakPolarHBondContact O-CB 3.49Å; D522-Q526 WeakPolarHBondContact O-CG 3.49Å; D522-Q526 PolarHBondContact O-N 2.92Å; D522-Q526 VanDerWaalsContact O-N 3.12Å; D522-Q526 PolarHBondContact O-NE2 2.68Å; D522-N537 WeakPolarHBondContact CA-OD1 3.39Å
523	E	93.5	Very high	89.3	Confident	21 Å²	21	77.7 Å²	77.7	10%	0.098	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-27.2	-176.2	-60.5	96.3	164.6	0	0	111.6	I521 N527 L528 A529 N537 S541 Y542	I521-E523 VanDerWaalsContact C-N 3.33Å; I521-E523 HydrophobicContact CG2-CG 4.19Å; I521-E523 PolarHBondContact O-N 2.69Å; E523-N527 PolarHBondContact O-N 3.48Å; E523-N527 VanDerWaalsContact O-N 3.15Å; E523-L528 HydrophobicContact CB-CB 3.99Å; E523-L528 HydrophobicContact CG-CB 4.29Å; E523-L528 PolarHBondContact O-N 2.83Å; E523-A529 HydrophobicContact CB-CB 4.28Å; E523-A529 PolarHBondContact O-N 3.31Å; E523-N537 PolarHBondContact N-OD1 2.88Å; E523-N537 PolarHBondContact OE2-OD1 3.49Å; E523-N537 VanDerWaalsContact OE2-OD1 3.1Å; E523-S541 VanDerWaalsContact OE2-C 3.26Å; E523-Y542 HydrophobicContact CB-CD1 3.66Å; E523-Y542 HydrophobicContact CB-CE1 4.32Å; E523-Y542 HydrophobicContact CB-CG 4.15Å; E523-Y542 HydrophobicContact CG-CD1 3.79Å; E523-Y542 HydrophobicContact CG-CE1 4.39Å
524	C	93	Very high	89.7	Confident	29 Å²	29	80.7 Å²	80.7	20%	0.196	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-43.9	176.2	-57.4	0	0	0	0	111.7	D522 Q526 C535 V536 N537	D522-C524 PolarHBondContact O-N 3.2Å; D522-C524 WeakPolarHBondContact OD1-CB 3.29Å; D522-C524 PolarHBondContact OD1-N 3.07Å; C524-Q526 VanDerWaalsContact C-N 3.35Å; C524-C535 WeakPolarHBondContact CA-SG 3.2Å; C524-C535 HydrophobicContact CB-CB 3.75Å; C524-C535 WeakPolarHBondContact CB-SG 3.24Å; C524-C535 WeakPolarHBondContact SG-CB 3.29Å; C524-C535 CovalentContact SG-SG 2.03Å; C524-C535 PolarHBondContact SG-SG 3.29Å; C524-V536 PolarHBondContact SG-N 2.76Å; C524-V536 VanDerWaalsContact SG-N 3.43Å; C524-N537 PolarHBondContact SG-N 3.33Å
525	R	92.8	Very high	90.1	Very high	210 Å²	210	77.1 Å²	77.1	79%	0.792	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-29.2	177	-79.2	-171.9	175.3	145.9	-7.4	113.4	D522 N527	D522-R525 HydrophobicContact CB-CB 4.16Å; D522-R525 PolarHBondContact O-N 3.22Å; D522-R525 PolarHBondContact OD1-N 2.96Å; D522-R525 WeakPolarHBondContact OD2-CD 3.33Å; D522-R525 VanDerWaalsContact OD2-CG 3.23Å; D522-R525 WeakPolarHBondContact OD2-CG 3.43Å; D522-R525 IonicContact OD2-CZ 3.58Å; D522-R525 IonicContact OD2-NE 2.71Å; D522-R525 IonicContact OD2-NH1 3.74Å; R525-N527 VanDerWaalsContact C-N 3.32Å
526	Q	90.3	Very high	90.4	Very high	81 Å²	81	77 Å²	77	38%	0.379	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-0.3	-179.6	-70.1	174.1	81.4	0	0	113.2	I521 D522 C524 L528	I521-Q526 VanDerWaalsContact CG2-NE2 3.31Å; D522-Q526 WeakPolarHBondContact O-CB 3.49Å; D522-Q526 WeakPolarHBondContact O-CG 3.49Å; D522-Q526 PolarHBondContact O-N 2.92Å; D522-Q526 VanDerWaalsContact O-N 3.12Å; D522-Q526 PolarHBondContact O-NE2 2.68Å; C524-Q526 VanDerWaalsContact C-N 3.35Å; Q526-L528 HydrophobicContact CB-CD1 3.86Å; Q526-L528 HydrophobicContact CB-CG 3.89Å; Q526-L528 PolarHBondContact O-N 2.79Å
527	N	86.4	Confident	90.8	Very high	148 Å²	148	73.9 Å²	73.9	79%	0.791	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	34.6	-173.3	-59.5	-48.7	0	0	0	112.9	E523 R525	E523-N527 PolarHBondContact O-N 3.48Å; E523-N527 VanDerWaalsContact O-N 3.15Å; R525-N527 VanDerWaalsContact C-N 3.32Å
528	L	87.8	Confident	91	Very high	102 Å²	102	69.5 Å²	69.5	53%	0.534	35%	0.354	S	S	.	.			trans	-90.6	-14.4	174.5	-65.9	172.3	0	0	0	112	I521 E523 Q526	I521-L528 HydrophobicContact CG2-CD1 4.12Å; E523-L528 HydrophobicContact CB-CB 3.99Å; E523-L528 HydrophobicContact CG-CB 4.29Å; E523-L528 PolarHBondContact O-N 2.83Å; Q526-L528 HydrophobicContact CB-CD1 3.86Å; Q526-L528 HydrophobicContact CB-CG 3.89Å; Q526-L528 PolarHBondContact O-N 2.79Å
529	A	86.7	Confident	91.1	Very high	22 Å²	22	73.3 Å²	73.3	18%	0.182	38%	0.378	C	S	.	.			trans	-80	128.5	177.9	0	0	0	0	0	112.3	E523 C531 C535 Y542	E523-A529 HydrophobicContact CB-CB 4.28Å; E523-A529 PolarHBondContact O-N 3.31Å; A529-C531 VanDerWaalsContact C-N 3.26Å; A529-C531 PolarHBondContact O-N 3.19Å; A529-C535 HydrophobicContact CB-CB 4.25Å; A529-C535 WeakPolarHBondContact CB-SG 3.5Å; A529-Y542 HydrophobicContact CB-CD1 4.19Å; A529-Y542 HydrophobicContact CB-CD2 3.41Å; A529-Y542 VanDerWaalsContact CB-CD2 3.41Å; A529-Y542 HydrophobicContact CB-CE1 4.21Å; A529-Y542 HydrophobicContact CB-CE2 3.43Å; A529-Y542 VanDerWaalsContact CB-CE2 3.43Å; A529-Y542 HydrophobicContact CB-CG 3.8Å
530	S	87.9	Confident	91	Very high	93 Å²	93	71.3 Å²	71.3	65%	0.65	37%	0.374	S	S	*	.			trans	-88.2	36.8	179.9	-59.3	0	0	0	0	113.4	Y542 S557	S530-Y542 PolarHBondContact N-OH 2.73Å; S530-S557 WeakPolarHBondContact O-CB 3.47Å
531	C	90.6	Very high	90.9	Very high	27 Å²	27	71.9 Å²	71.9	18%	0.182	38%	0.382	C	S	.	.			trans	-78.4	139.3	-177.2	-60.4	0	0	0	0	112.6	A529 C535 C544	A529-C531 VanDerWaalsContact C-N 3.26Å; A529-C531 PolarHBondContact O-N 3.19Å; C531-C535 HydrophobicContact CB-CB 4.36Å; C531-C544 WeakPolarHBondContact CA-SG 3.39Å; C531-C544 HydrophobicContact CB-CB 3.64Å; C531-C544 WeakPolarHBondContact CB-SG 3.45Å; C531-C544 WeakPolarHBondContact SG-CA 3.21Å; C531-C544 WeakPolarHBondContact SG-CB 3.37Å; C531-C544 CovalentContact SG-SG 2.03Å; C531-C544 PolarHBondContact SG-SG 3.46Å
532	H	89.9	Confident	90.9	Very high	121 Å²	121	73.3 Å²	73.3	56%	0.56	39%	0.385	S	S	*	.	S	Bend	trans	-68.2	-43.1	177.8	-176.8	-153.5	0	0	0	113.1	S557 C559	H532-S557 WeakPolarHBondContact CB-O 3.47Å; H532-S557 PolarHBondContact N-O 3.14Å; H532-C559 HydrophobicContact CB-CB 4.41Å; H532-C559 PolarHBondContact ND1-N 3.37Å; H532-C559 PolarHBondContact ND1-O 3.16Å
533	Q	89.6	Confident	90.8	Very high	52 Å²	52	77.9 Å²	77.9	24%	0.243	41%	0.406	C	S	.	.	S	Bend	trans	-120.2	-72.7	-173.8	-68.8	175.2	-1.1	0	0	112.2	E547 C559	Q533-E547 HydrophobicContact CB-CG 4.36Å; Q533-C559 HydrophobicContact CG-CB 3.92Å
534	R	91	Very high	90.8	Very high	163 Å²	163	77.6 Å²	77.6	62%	0.615	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	135	-175.1	-177.1	176.9	173.2	167.8	-1.8	111.4	C544 A545	R534-C544 CarbonylContact O-C 3.54Å; R534-C544 WeakPolarHBondContact O-CA 3.42Å; R534-A545 HydrophobicContact CB-CB 4.25Å; R534-A545 WeakPolarHBondContact CB-O 3.39Å; R534-A545 HydrophobicContact CG-CB 4.42Å; R534-A545 PolarHBondContact N-O 2.96Å; R534-A545 PolarHBondContact O-N 2.93Å
535	C	94.1	Very high	90.6	Very high	38 Å²	38	77.8 Å²	77.8	26%	0.257	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	137.7	172.1	-175	0	0	0	0	110.6	C524 A529 C531	C524-C535 WeakPolarHBondContact CA-SG 3.2Å; C524-C535 HydrophobicContact CB-CB 3.75Å; C524-C535 WeakPolarHBondContact CB-SG 3.24Å; C524-C535 WeakPolarHBondContact SG-CB 3.29Å; C524-C535 CovalentContact SG-SG 2.03Å; C524-C535 PolarHBondContact SG-SG 3.29Å; A529-C535 HydrophobicContact CB-CB 4.25Å; A529-C535 WeakPolarHBondContact CB-SG 3.5Å; C531-C535 HydrophobicContact CB-CB 4.36Å
536	V	93.2	Very high	90.3	Very high	62 Å²	62	69.4 Å²	69.4	38%	0.376	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	115.2	173.2	-177.2	0	0	0	0	108.6	C524 Q543 A545	C524-V536 PolarHBondContact SG-N 2.76Å; C524-V536 VanDerWaalsContact SG-N 3.43Å; V536-Q543 PolarHBondContact N-O 3.2Å; V536-Q543 PolarHBondContact O-N 2.98Å; V536-A545 HydrophobicContact CG2-CB 4.24Å
537	N	93.3	Very high	90.1	Very high	50 Å²	50	71.6 Å²	71.6	27%	0.267	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	137.8	-179.9	-168.1	61.1	0	0	0	110.9	D520 D522 E523 C524	D520-N537 PolarHBondContact OD2-ND2 2.91Å; D522-N537 WeakPolarHBondContact CA-OD1 3.39Å; E523-N537 PolarHBondContact N-OD1 2.88Å; E523-N537 PolarHBondContact OE2-OD1 3.49Å; E523-N537 VanDerWaalsContact OE2-OD1 3.1Å; C524-N537 PolarHBondContact SG-N 3.33Å
538	T	91.4	Very high	89.7	Confident	31 Å²	31	76.1 Å²	76.1	19%	0.19	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152	177.5	57.1	0	0	0	0	109.9	G540 S541 Q543	T538-G540 PolarHBondContact O-N 3.26Å; T538-S541 CarbonylContact C-O 3.25Å; T538-S541 VanDerWaalsContact C-O 3.29Å; T538-S541 WeakPolarHBondContact CA-O 3.01Å; T538-S541 PolarHBondContact N-O 2.76Å; T538-S541 CarbonylContact O-C 3.54Å; T538-S541 PolarHBondContact O-N 2.66Å; T538-S541 VanDerWaalsContact O-N 3.1Å; T538-S541 PolarHBondContact OG1-O 2.86Å; T538-Q543 HydrophobicContact CG2-CG 4.07Å
539	P	91.4	Very high	89.3	Confident	112 Å²	112	72.1 Å²	72.1	73%	0.727	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	112.4	178.7	-25.2	35	0	0	0	112.2	Y509	Y509-P539 VanDerWaalsContact OH-C 3.23Å; Y509-P539 WeakPolarHBondContact OH-CB 3.37Å
540	G	88.9	Confident	89.3	Confident	20 Å²	20	73.7 Å²	73.7	21%	0.206	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	3.7	179.9	0	0	0	0	0	116.1	Y509 D520 T538	Y509-G540 PolarHBondContact OH-N 3.31Å; D520-G540 PolarHBondContact OD1-N 3.03Å; T538-G540 PolarHBondContact O-N 3.26Å
541	S	91.7	Very high	89.1	Confident	58 Å²	58	72.9 Å²	72.9	41%	0.406	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	-174.8	-179.9	-165.7	0	0	0	0	111.5	E523 T538	E523-S541 VanDerWaalsContact OE2-C 3.26Å; T538-S541 CarbonylContact C-O 3.25Å; T538-S541 VanDerWaalsContact C-O 3.29Å; T538-S541 WeakPolarHBondContact CA-O 3.01Å; T538-S541 PolarHBondContact N-O 2.76Å; T538-S541 CarbonylContact O-C 3.54Å; T538-S541 PolarHBondContact O-N 2.66Å; T538-S541 VanDerWaalsContact O-N 3.1Å; T538-S541 PolarHBondContact OG1-O 2.86Å
542	Y	92.4	Very high	89.1	Confident	67 Å²	67	75 Å²	75	26%	0.263	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	163.6	166.9	65.7	-80.8	0	0	0	111.1	E523 A529 S530	E523-Y542 HydrophobicContact CB-CD1 3.66Å; E523-Y542 HydrophobicContact CB-CE1 4.32Å; E523-Y542 HydrophobicContact CB-CG 4.15Å; E523-Y542 HydrophobicContact CG-CD1 3.79Å; E523-Y542 HydrophobicContact CG-CE1 4.39Å; A529-Y542 HydrophobicContact CB-CD1 4.19Å; A529-Y542 HydrophobicContact CB-CD2 3.41Å; A529-Y542 VanDerWaalsContact CB-CD2 3.41Å; A529-Y542 HydrophobicContact CB-CE1 4.21Å; A529-Y542 HydrophobicContact CB-CE2 3.43Å; A529-Y542 VanDerWaalsContact CB-CE2 3.43Å; A529-Y542 HydrophobicContact CB-CG 3.8Å; S530-Y542 PolarHBondContact N-OH 2.73Å
543	Q	91.5	Very high	88.8	Confident	129 Å²	129	69.7 Å²	69.7	60%	0.603	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.7	171	-64.7	-178.4	10.8	0	0	109.8	V536 T538	V536-Q543 PolarHBondContact N-O 3.2Å; V536-Q543 PolarHBondContact O-N 2.98Å; T538-Q543 HydrophobicContact CG2-CG 4.07Å
544	C	92.3	Very high	88.6	Confident	14 Å²	14	75 Å²	75	10%	0.095	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	142.7	172.4	-53.3	0	0	0	0	110.5	C531 R534 L552 G556	C531-C544 WeakPolarHBondContact CA-SG 3.39Å; C531-C544 HydrophobicContact CB-CB 3.64Å; C531-C544 WeakPolarHBondContact CB-SG 3.45Å; C531-C544 WeakPolarHBondContact SG-CA 3.21Å; C531-C544 WeakPolarHBondContact SG-CB 3.37Å; C531-C544 CovalentContact SG-SG 2.03Å; C531-C544 PolarHBondContact SG-SG 3.46Å; R534-C544 CarbonylContact O-C 3.54Å; R534-C544 WeakPolarHBondContact O-CA 3.42Å; C544-L552 HydrophobicContact CB-CD1 4Å; C544-G556 VanDerWaalsContact CB-O 3.28Å; C544-G556 WeakPolarHBondContact CB-O 3.49Å
545	A	88.4	Confident	88.4	Confident	33 Å²	33	70.9 Å²	70.9	27%	0.273	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	151.4	175.7	0	0	0	0	0	109.3	R534 V536	R534-A545 HydrophobicContact CB-CB 4.25Å; R534-A545 WeakPolarHBondContact CB-O 3.39Å; R534-A545 HydrophobicContact CG-CB 4.42Å; R534-A545 PolarHBondContact N-O 2.96Å; R534-A545 PolarHBondContact O-N 2.93Å; V536-A545 HydrophobicContact CG2-CB 4.24Å
546	C	87.9	Confident	88	Confident	34 Å²	34	70.6 Å²	70.6	23%	0.23	39%	0.392	C	S	.	.			trans	-105.9	151.9	179.4	-57	0	0	0	0	111.5	C559	C546-C559 WeakPolarHBondContact CA-SG 3.29Å; C546-C559 HydrophobicContact CB-CB 3.76Å; C546-C559 WeakPolarHBondContact CB-SG 3.07Å; C546-C559 WeakPolarHBondContact SG-CA 3.43Å; C546-C559 WeakPolarHBondContact SG-CB 3.15Å; C546-C559 CovalentContact SG-SG 2.04Å; C546-C559 PolarHBondContact SG-SG 2.91Å
547	E	85.2	Confident	87.8	Confident	127 Å²	127	69.1 Å²	69.1	59%	0.593	38%	0.384	S	S	*	.			trans	-65.8	165.5	168.9	-63.6	-173.9	173.5	0	0	110.4	Q533 G549 Y550	Q533-E547 HydrophobicContact CB-CG 4.36Å; E547-G549 PolarHBondContact O-N 3.49Å; E547-Y550 HydrophobicContact CB-CD2 4.29Å; E547-Y550 PolarHBondContact O-N 2.03Å
548	R	77.5	Confident	87.7	Confident	244 Å²	244	69.5 Å²	69.5	92%	0.921	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	139	176.9	-67.9	-178	178	172.7	-0.4	109.6
549	G	79.7	Confident	87.6	Confident	18 Å²	18	68.4 Å²	68.4	19%	0.186	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-1.7	-175.2	0	0	0	0	0	114.1	E547 I562	E547-G549 PolarHBondContact O-N 3.49Å; G549-I562 WeakPolarHBondContact O-CB 3.5Å; G549-I562 WeakPolarHBondContact O-CG1 3.04Å; G549-I562 PolarHBondContact O-N 2.9Å
550	Y	87.3	Confident	87.4	Confident	54 Å²	54	67.6 Å²	67.6	21%	0.212	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	150.2	178.8	-63.4	-93.2	0	0	0	111.6	E547 C559 L560 D561 P584 G585	E547-Y550 HydrophobicContact CB-CD2 4.29Å; E547-Y550 PolarHBondContact O-N 2.03Å; Y550-C559 HydrophobicContact CD1-CB 4.43Å; Y550-C559 HydrophobicContact CG-CB 4.48Å; Y550-L560 CarbonylContact C-O 3.3Å; Y550-L560 WeakPolarHBondContact CA-O 3.33Å; Y550-D561 HydrophobicContact CD1-CB 4.24Å; Y550-D561 HydrophobicContact CE1-CB 4.05Å; Y550-P584 VanDerWaalsContact OH-C 3.25Å; Y550-P584 WeakPolarHBondContact OH-CB 3.33Å; Y550-G585 VanDerWaalsContact CE2-CA 3.49Å; Y550-G585 PolarHBondContact OH-N 3.24Å
551	T	84.7	Confident	87.4	Confident	77 Å²	77	69 Å²	69	47%	0.472	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	148.8	171.8	-170.2	0	0	0	0	110.8	G553 C559 L560 I562	T551-G553 PolarHBondContact O-N 3.14Å; T551-C559 WeakPolarHBondContact O-CA 3.35Å; T551-L560 HydrophobicContact CG2-CB 4.18Å; T551-L560 PolarHBondContact N-O 2.78Å; T551-L560 PolarHBondContact O-N 3.01Å; T551-I562 HydrophobicContact CG2-CG1 4.42Å
552	L	88.7	Confident	86.9	Confident	71 Å²	71	68.8 Å²	68.8	37%	0.372	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	129.1	177	-164.7	68.8	0	0	0	109.4	C544	C544-L552 HydrophobicContact CB-CD1 4Å
553	G	85.2	Confident	86.5	Confident	10 Å²	10	68.9 Å²	68.9	10%	0.103	37%	0.372	C	S	.	.			trans	-67.8	168.1	176.4	0	0	0	0	0	112.4	T551 D555 G556 T558	T551-G553 PolarHBondContact O-N 3.14Å; G553-D555 PolarHBondContact O-N 2.89Å; G553-G556 PolarHBondContact O-N 2.03Å; G553-T558 PolarHBondContact N-O 2.73Å
554	V	85.4	Confident	86	Confident	164 Å²	164	64 Å²	64	99%	0.994	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.1	179.4	-65.5	0	0	0	0	113.6	G556	V554-G556 PolarHBondContact O-N 2.98Å
555	D	86.6	Confident	85.4	Confident	76 Å²	76	64.5 Å²	64.5	41%	0.406	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-12.9	175.2	68.5	-34.3	0	0	0	112.7	G553 S557 T558	G553-D555 PolarHBondContact O-N 2.89Å; D555-S557 PolarHBondContact O-N 2.85Å; D555-S557 PolarHBondContact OD1-N 2.9Å; D555-S557 PolarHBondContact OD2-OG 3.27Å; D555-T558 PolarHBondContact OD1-N 3.37Å; D555-T558 PolarHBondContact OD1-OG1 2.76Å; D555-T558 WeakPolarHBondContact OD2-CB 3.34Å; D555-T558 VanDerWaalsContact OD2-CG2 3.22Å; D555-T558 WeakPolarHBondContact OD2-CG2 3.44Å; D555-T558 PolarHBondContact OD2-N 3.3Å; D555-T558 PolarHBondContact OD2-OG1 3.44Å
556	G	85.8	Confident	85.1	Confident	32 Å²	32	65.1 Å²	65.1	33%	0.33	36%	0.358	S	S	.	.	S	Bend	trans	73.3	8.8	-177.4	0	0	0	0	0	114.2	C544 G553 V554	C544-G556 VanDerWaalsContact CB-O 3.28Å; C544-G556 WeakPolarHBondContact CB-O 3.49Å; G553-G556 PolarHBondContact O-N 2.03Å; V554-G556 PolarHBondContact O-N 2.98Å
557	S	88.8	Confident	84.3	Confident	31 Å²	31	68 Å²	68	22%	0.217	37%	0.371	C	S	.	.	S	Bend	trans	-132.1	-34.3	-177.7	44.7	0	0	0	0	115.1	S530 H532 D555	S530-S557 WeakPolarHBondContact O-CB 3.47Å; H532-S557 WeakPolarHBondContact CB-O 3.47Å; H532-S557 PolarHBondContact N-O 3.14Å; D555-S557 PolarHBondContact O-N 2.85Å; D555-S557 PolarHBondContact OD1-N 2.9Å; D555-S557 PolarHBondContact OD2-OG 3.27Å
558	T	90.1	Very high	83.5	Confident	58 Å²	58	66.5 Å²	66.5	36%	0.356	36%	0.36	S	S	.	.			trans	-77.6	139.4	176.6	55	0	0	0	0	111.2	G553 D555	G553-T558 PolarHBondContact N-O 2.73Å; D555-T558 PolarHBondContact OD1-N 3.37Å; D555-T558 PolarHBondContact OD1-OG1 2.76Å; D555-T558 WeakPolarHBondContact OD2-CB 3.34Å; D555-T558 VanDerWaalsContact OD2-CG2 3.22Å; D555-T558 WeakPolarHBondContact OD2-CG2 3.44Å; D555-T558 PolarHBondContact OD2-N 3.3Å; D555-T558 PolarHBondContact OD2-OG1 3.44Å
559	C	89.7	Confident	82.9	Confident	8 Å²	8	62.8 Å²	62.8	5%	0.054	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	111.7	171.3	-69	0	0	0	0	108.7	H532 Q533 C546 Y550 T551	H532-C559 HydrophobicContact CB-CB 4.41Å; H532-C559 PolarHBondContact ND1-N 3.37Å; H532-C559 PolarHBondContact ND1-O 3.16Å; Q533-C559 HydrophobicContact CG-CB 3.92Å; C546-C559 WeakPolarHBondContact CA-SG 3.29Å; C546-C559 HydrophobicContact CB-CB 3.76Å; C546-C559 WeakPolarHBondContact CB-SG 3.07Å; C546-C559 WeakPolarHBondContact SG-CA 3.43Å; C546-C559 WeakPolarHBondContact SG-CB 3.15Å; C546-C559 CovalentContact SG-SG 2.04Å; C546-C559 PolarHBondContact SG-SG 2.91Å; Y550-C559 HydrophobicContact CD1-CB 4.43Å; Y550-C559 HydrophobicContact CG-CB 4.48Å; T551-C559 WeakPolarHBondContact O-CA 3.35Å
560	L	87.6	Confident	81.7	Confident	94 Å²	94	69.5 Å²	69.5	49%	0.492	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	135.7	-179.7	-59.4	176.8	0	0	0	109.3	Y550 T551	Y550-L560 CarbonylContact C-O 3.3Å; Y550-L560 WeakPolarHBondContact CA-O 3.33Å; T551-L560 HydrophobicContact CG2-CB 4.18Å; T551-L560 PolarHBondContact N-O 2.78Å; T551-L560 PolarHBondContact O-N 3.01Å
561	D	88.5	Confident	79.7	Confident	51 Å²	51	72.1 Å²	72.1	27%	0.273	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	137.4	176.1	-178.4	53	0	0	0	111.3	Y550 D563 N582 G585	Y550-D561 HydrophobicContact CD1-CB 4.24Å; Y550-D561 HydrophobicContact CE1-CB 4.05Å; D561-D563 PolarHBondContact O-N 3.4Å; D561-N582 PolarHBondContact OD2-ND2 2.87Å; D561-G585 PolarHBondContact OD1-N 3.05Å
562	I	81.1	Confident	77.5	Confident	53 Å²	53	72 Å²	72	27%	0.272	40%	0.403	S	S	.	.			trans	-85.3	107	175.1	-63.1	173.8	0	0	0	107.6	G549 T551 E564 L567	G549-I562 WeakPolarHBondContact O-CB 3.5Å; G549-I562 WeakPolarHBondContact O-CG1 3.04Å; G549-I562 PolarHBondContact O-N 2.9Å; T551-I562 HydrophobicContact CG2-CG1 4.42Å; I562-E564 HydrophobicContact CG2-CG 4.39Å; I562-E564 PolarHBondContact O-N 2.83Å; I562-E564 VanDerWaalsContact O-OE2 3.13Å; I562-L567 HydrophobicContact CG2-CD1 3.32Å; I562-L567 HydrophobicContact CG2-CG 4.47Å
563	D	84.1	Confident	75.6	Confident	69 Å²	69	71.6 Å²	71.6	37%	0.369	41%	0.406	S	S	.	.			trans	-72	91.5	175.4	-172.9	-22.3	0	0	0	110.8	D561 C565 A566 L567	D561-D563 PolarHBondContact O-N 3.4Å; D563-C565 PolarHBondContact O-N 2.75Å; D563-C565 WeakPolarHBondContact OD1-CA 3.06Å; D563-C565 WeakPolarHBondContact OD1-CB 3.49Å; D563-C565 PolarHBondContact OD1-N 2.79Å; D563-C565 VanDerWaalsContact OD1-N 3.1Å; D563-A566 HydrophobicContact CB-CB 3.96Å; D563-A566 PolarHBondContact O-N 3.38Å; D563-A566 PolarHBondContact OD1-N 3.43Å; D563-L567 WeakPolarHBondContact O-CG 3.05Å; D563-L567 PolarHBondContact O-N 3.25Å
564	E	81	Confident	74.2	Confident	26 Å²	26	74.1 Å²	74.1	12%	0.121	43%	0.433	C	S	.	.	H	α-helix	trans	-66.1	-28.5	-178.3	-55.7	97.5	155.4	0	0	111.6	I562 L567 Y568 L575 N582 S586 F587	I562-E564 HydrophobicContact CG2-CG 4.39Å; I562-E564 PolarHBondContact O-N 2.83Å; I562-E564 VanDerWaalsContact O-OE2 3.13Å; E564-L567 PolarHBondContact O-N 3.02Å; E564-Y568 HydrophobicContact CB-CD2 4.35Å; E564-Y568 WeakPolarHBondContact O-CD2 3.45Å; E564-Y568 PolarHBondContact O-N 2.7Å; E564-L575 HydrophobicContact CB-CD2 3.65Å; E564-N582 PolarHBondContact OE2-OD1 2.83Å; E564-S586 WeakPolarHBondContact OE1-CA 3.33Å; E564-F587 HydrophobicContact CB-CB 4.36Å; E564-F587 HydrophobicContact CB-CD1 3.8Å; E564-F587 HydrophobicContact CB-CE1 4.49Å; E564-F587 HydrophobicContact CB-CG 4.25Å; E564-F587 HydrophobicContact CG-CD1 3.9Å; E564-F587 WeakPolarHBondContact OE2-CB 3.34Å; E564-F587 PolarHBondContact OE2-N 2.87Å
565	C	80.4	Confident	73.3	Confident	24 Å²	24	67.6 Å²	67.6	16%	0.162	39%	0.392	C	S	.	.	H	α-helix	trans	-65.8	-39.6	176.2	-58.9	0	0	0	0	111.5	D563 K569 C580 V581 N582	D563-C565 PolarHBondContact O-N 2.75Å; D563-C565 WeakPolarHBondContact OD1-CA 3.06Å; D563-C565 WeakPolarHBondContact OD1-CB 3.49Å; D563-C565 PolarHBondContact OD1-N 2.79Å; D563-C565 VanDerWaalsContact OD1-N 3.1Å; C565-K569 WeakPolarHBondContact O-CB 3.44Å; C565-K569 PolarHBondContact O-N 3.49Å; C565-C580 WeakPolarHBondContact CA-SG 3.36Å; C565-C580 HydrophobicContact CB-CB 3.75Å; C565-C580 WeakPolarHBondContact CB-SG 3.26Å; C565-C580 WeakPolarHBondContact SG-CB 3.16Å; C565-C580 CovalentContact SG-SG 2.04Å; C565-C580 PolarHBondContact SG-SG 2.9Å; C565-V581 PolarHBondContact SG-N 2.04Å; C565-V581 VanDerWaalsContact SG-N 3.39Å; C565-N582 HydrophobicContact CB-CB 4.49Å; C565-N582 PolarHBondContact SG-N 2.79Å
566	A	82.2	Confident	72.5	Confident	46 Å²	46	64.4 Å²	64.4	38%	0.38	38%	0.376	S	S	.	.	H	α-helix	trans	-70.6	-40.9	174.8	0	0	0	0	0	112.2	D563	D563-A566 HydrophobicContact CB-CB 3.96Å; D563-A566 PolarHBondContact O-N 3.38Å; D563-A566 PolarHBondContact OD1-N 3.43Å
567	L	70.8	Confident	71.6	Confident	96 Å²	96	63.9 Å²	63.9	50%	0.503	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-46.4	-179.7	-73.4	178.2	0	0	0	112.8	I562 D563 E564	I562-L567 HydrophobicContact CG2-CD1 3.32Å; I562-L567 HydrophobicContact CG2-CG 4.47Å; D563-L567 WeakPolarHBondContact O-CG 3.05Å; D563-L567 PolarHBondContact O-N 3.25Å; E564-L567 PolarHBondContact O-N 3.02Å
568	Y	67.7	Low	70.7	Confident	94 Å²	94	63.4 Å²	63.4	37%	0.369	37%	0.368	S	S	.	.	H	α-helix	trans	-86.8	-11.5	-175.4	-74.1	-75.5	0	0	0	114.3	E564 F570 Q571 L575	E564-Y568 HydrophobicContact CB-CD2 4.35Å; E564-Y568 WeakPolarHBondContact O-CD2 3.45Å; E564-Y568 PolarHBondContact O-N 2.7Å; Y568-F570 PolarHBondContact O-N 2.76Å; Y568-F570 VanDerWaalsContact O-N 3.11Å; Y568-Q571 VanDerWaalsContact CD1-OE1 3.28Å; Y568-Q571 VanDerWaalsContact CE1-OE1 3.24Å; Y568-Q571 PolarHBondContact O-N 2.96Å; Y568-L575 HydrophobicContact CD2-CB 4.23Å; Y568-L575 HydrophobicContact CD2-CD1 3.85Å; Y568-L575 HydrophobicContact CD2-CD2 3.89Å; Y568-L575 HydrophobicContact CD2-CG 4.22Å; Y568-L575 HydrophobicContact CE2-CD1 4.01Å; Y568-L575 HydrophobicContact CG-CB 4.14Å; Y568-L575 HydrophobicContact CG-CD1 4.31Å
569	K	65.8	Low	70.2	Confident	166 Å²	166	66.8 Å²	66.8	72%	0.722	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-30.1	176.9	-169.6	175.7	-179.1	-177.5	0	113.2	C565	C565-K569 WeakPolarHBondContact O-CB 3.44Å; C565-K569 PolarHBondContact O-N 3.49Å
570	F	54.5	Low	69.8	Low	159 Å²	159	68.1 Å²	68.1	70%	0.697	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-8.6	-175.1	-60.1	-77.4	0	0	0	114.6	Y568	Y568-F570 PolarHBondContact O-N 2.76Å; Y568-F570 VanDerWaalsContact O-N 3.11Å
571	Q	45.7	Very low	69.9	Low	110 Å²	110	65.2 Å²	65.2	51%	0.514	38%	0.375	S	S	.	.	S	Bend	trans	-88.9	2.5	-176.1	-70.6	-172.5	-10.7	0	0	114.2	Y568 S573	Y568-Q571 VanDerWaalsContact CD1-OE1 3.28Å; Y568-Q571 VanDerWaalsContact CE1-OE1 3.24Å; Y568-Q571 PolarHBondContact O-N 2.96Å; Q571-S573 PolarHBondContact O-N 3.17Å
572	G	39.1	Very low	69.8	Low	73 Å²	73	65.1 Å²	65.1	75%	0.753	37%	0.374	S	S	*	.	S	Bend	trans	77	-23.6	175.2	0	0	0	0	0	115.1
573	S	48	Very low	70.1	Confident	63 Å²	63	64.5 Å²	64.5	44%	0.441	37%	0.373	S	S	.	.	S	Bend	trans	-93.6	107.1	170.1	60.3	0	0	0	0	110.2	Q571 L575	Q571-S573 PolarHBondContact O-N 3.17Å; S573-L575 PolarHBondContact O-N 2.04Å
574	G	56.3	Low	70.3	Confident	64 Å²	64	66.4 Å²	66.4	66%	0.66	39%	0.389	S	S	*	.			trans	-60	120.3	176.5	0	0	0	0	0	111.2	C576	G574-C576 PolarHBondContact O-N 3.18Å
575	L	66.3	Low	70.2	Confident	27 Å²	27	66.2 Å²	66.2	14%	0.141	39%	0.394	C	S	.	.	S	Bend	trans	-56.7	-38.8	175	-177.3	66.5	0	0	0	111.9	E564 Y568 S573 F587	E564-L575 HydrophobicContact CB-CD2 3.65Å; Y568-L575 HydrophobicContact CD2-CB 4.23Å; Y568-L575 HydrophobicContact CD2-CD1 3.85Å; Y568-L575 HydrophobicContact CD2-CD2 3.89Å; Y568-L575 HydrophobicContact CD2-CG 4.22Å; Y568-L575 HydrophobicContact CE2-CD1 4.01Å; Y568-L575 HydrophobicContact CG-CB 4.14Å; Y568-L575 HydrophobicContact CG-CD1 4.31Å; S573-L575 PolarHBondContact O-N 2.04Å; L575-F587 HydrophobicContact CD1-CE1 4.04Å; L575-F587 HydrophobicContact CD1-CE2 4Å; L575-F587 HydrophobicContact CD1-CZ 3.55Å; L575-F587 HydrophobicContact CD2-CB 4.45Å; L575-F587 HydrophobicContact CD2-CD1 3.67Å; L575-F587 HydrophobicContact CD2-CD2 3.45Å; L575-F587 VanDerWaalsContact CD2-CD2 3.45Å; L575-F587 HydrophobicContact CD2-CE1 3.67Å; L575-F587 HydrophobicContact CD2-CE2 3.45Å; L575-F587 VanDerWaalsContact CD2-CE2 3.45Å; L575-F587 HydrophobicContact CD2-CG 3.57Å; L575-F587 HydrophobicContact CD2-CZ 3.55Å; L575-F587 HydrophobicContact CG-CD2 3.92Å; L575-F587 HydrophobicContact CG-CE1 4.11Å; L575-F587 HydrophobicContact CG-CE2 3.41Å; L575-F587 VanDerWaalsContact CG-CE2 3.41Å; L575-F587 HydrophobicContact CG-CG 4.46Å; L575-F587 HydrophobicContact CG-CZ 3.51Å
576	C	68.7	Low	70.4	Confident	9 Å²	9	67.8 Å²	67.8	6%	0.061	41%	0.405	C	S	.	.	S	Bend	trans	-112	141.9	169.1	-59.7	0	0	0	0	107.9	G574 G578 C580 C589	G574-C576 PolarHBondContact O-N 3.18Å; C576-G578 VanDerWaalsContact C-N 3.28Å; C576-C580 HydrophobicContact CB-CB 4.18Å; C576-C589 VanDerWaalsContact CA-SG 3.51Å; C576-C589 HydrophobicContact CB-CB 3.6Å; C576-C589 WeakPolarHBondContact CB-SG 3.38Å; C576-C589 WeakPolarHBondContact SG-CA 3.04Å; C576-C589 WeakPolarHBondContact SG-CB 3.28Å; C576-C589 CovalentContact SG-SG 2.02Å; C576-C589 PolarHBondContact SG-SG 2.72Å
577	A	66.9	Low	70.4	Confident	21 Å²	21	67.5 Å²	67.5	17%	0.174	40%	0.396	C	S	.	.	S	Bend	trans	-70.9	-33.5	170.2	0	0	0	0	0	110.2	R602 F790	A577-R602 WeakPolarHBondContact CB-O 3.49Å; A577-R602 PolarHBondContact N-O 2.04Å; A577-F790 VanDerWaalsContact C-CD1 3.42Å; A577-F790 HydrophobicContact CB-CB 3.93Å; A577-F790 HydrophobicContact CB-CD1 3.07Å; A577-F790 HydrophobicContact CB-CE1 3.73Å; A577-F790 HydrophobicContact CB-CG 3.82Å; A577-F790 WeakPolarHBondContact O-CD1 3.43Å; A577-F790 WeakPolarHBondContact O-CE1 3.39Å; A577-F790 VanDerWaalsContact O-CZ 3.23Å; A577-F790 WeakPolarHBondContact O-CZ 3.05Å
578	G	71.2	Confident	71.1	Confident	21 Å²	21	66.7 Å²	66.7	22%	0.216	39%	0.389	C	S	.	.	S	Bend	trans	-90	-146.4	170.9	0	0	0	0	0	113.6	C576 R590 F790	C576-G578 VanDerWaalsContact C-N 3.28Å; G578-R590 CarbonylContact C-O 3.54Å; G578-R590 WeakPolarHBondContact CA-O 3.39Å; G578-F790 VanDerWaalsContact N-CE1 3.28Å
579	Q	80	Confident	71.8	Confident	129 Å²	129	62.8 Å²	62.8	60%	0.603	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	127.8	173.5	-178.7	178.1	2.6	0	0	110.5	V581 R590	Q579-V581 HydrophobicContact CG-CG2 4.32Å; Q579-R590 HydrophobicContact CB-CB 4.43Å; Q579-R590 PolarHBondContact N-O 3.42Å; Q579-R590 PolarHBondContact O-N 3Å
580	C	81.1	Confident	72.7	Confident	35 Å²	35	61.2 Å²	61.2	24%	0.236	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	132.4	169	-171.1	0	0	0	0	110.3	C565 C576	C565-C580 WeakPolarHBondContact CA-SG 3.36Å; C565-C580 HydrophobicContact CB-CB 3.75Å; C565-C580 WeakPolarHBondContact CB-SG 3.26Å; C565-C580 WeakPolarHBondContact SG-CB 3.16Å; C565-C580 CovalentContact SG-SG 2.04Å; C565-C580 PolarHBondContact SG-SG 2.9Å; C576-C580 HydrophobicContact CB-CB 4.18Å
581	V	88	Confident	74	Confident	33 Å²	33	55.1 Å²	55.1	20%	0.2	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	117.5	173.5	-179.2	0	0	0	0	108.5	C565 Q579 E588 R590	C565-V581 PolarHBondContact SG-N 2.04Å; C565-V581 VanDerWaalsContact SG-N 3.39Å; Q579-V581 HydrophobicContact CG-CG2 4.32Å; V581-E588 HydrophobicContact CB-CG 3.84Å; V581-E588 HydrophobicContact CG1-CG 4.32Å; V581-E588 PolarHBondContact N-O 3Å; V581-E588 PolarHBondContact O-N 3.36Å; V581-R590 HydrophobicContact CG2-CG 4.07Å
582	N	86.8	Confident	75.6	Confident	49 Å²	49	52 Å²	52	26%	0.262	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	140.8	179.3	-172.4	46.7	0	0	0	110.8	D561 E564 C565 S586	D561-N582 PolarHBondContact OD2-ND2 2.87Å; E564-N582 PolarHBondContact OE2-OD1 2.83Å; C565-N582 HydrophobicContact CB-CB 4.49Å; C565-N582 PolarHBondContact SG-N 2.79Å; N582-S586 PolarHBondContact OD1-O 2.7Å
583	T	87.7	Confident	77.8	Confident	41 Å²	41	56.9 Å²	56.9	25%	0.252	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	152.6	178.2	59.3	0	0	0	0	109.9	G585 S586 E588	T583-G585 PolarHBondContact O-N 3.06Å; T583-S586 CarbonylContact C-O 3.52Å; T583-S586 VanDerWaalsContact C-O 3.26Å; T583-S586 VanDerWaalsContact CA-O 3.29Å; T583-S586 WeakPolarHBondContact CA-O 3.49Å; T583-S586 WeakPolarHBondContact CB-O 3.33Å; T583-S586 PolarHBondContact N-O 2.77Å; T583-S586 CarbonylContact O-C 3.55Å; T583-S586 PolarHBondContact O-N 3.29Å; T583-S586 PolarHBondContact OG1-O 3.25Å; T583-E588 HydrophobicContact CG2-CG 4.14Å
584	P	87.7	Confident	79.5	Confident	108 Å²	108	54 Å²	54	70%	0.701	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	114.2	179	-24.8	35	0	0	0	112.2	Y550	Y550-P584 VanDerWaalsContact OH-C 3.25Å; Y550-P584 WeakPolarHBondContact OH-CB 3.33Å
585	G	80.2	Confident	80.6	Confident	22 Å²	22	51.6 Å²	51.6	23%	0.227	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	0.8	179.7	0	0	0	0	0	115.7	Y550 D561 T583	Y550-G585 VanDerWaalsContact CE2-CA 3.49Å; Y550-G585 PolarHBondContact OH-N 3.24Å; D561-G585 PolarHBondContact OD1-N 3.05Å; T583-G585 PolarHBondContact O-N 3.06Å
586	S	83.6	Confident	81.5	Confident	57 Å²	57	55.2 Å²	55.2	40%	0.399	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168	-177.8	-176.2	-173.5	0	0	0	0	111.8	E564 N582 T583	E564-S586 WeakPolarHBondContact OE1-CA 3.33Å; N582-S586 PolarHBondContact OD1-O 2.7Å; T583-S586 CarbonylContact C-O 3.52Å; T583-S586 VanDerWaalsContact C-O 3.26Å; T583-S586 VanDerWaalsContact CA-O 3.29Å; T583-S586 WeakPolarHBondContact CA-O 3.49Å; T583-S586 WeakPolarHBondContact CB-O 3.33Å; T583-S586 PolarHBondContact N-O 2.77Å; T583-S586 CarbonylContact O-C 3.55Å; T583-S586 PolarHBondContact O-N 3.29Å; T583-S586 PolarHBondContact OG1-O 3.25Å
587	F	83	Confident	81.9	Confident	41 Å²	41	58.3 Å²	58.3	18%	0.18	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	162.4	166.2	64.5	-77.9	0	0	0	111.4	E564 L575	E564-F587 HydrophobicContact CB-CB 4.36Å; E564-F587 HydrophobicContact CB-CD1 3.8Å; E564-F587 HydrophobicContact CB-CE1 4.49Å; E564-F587 HydrophobicContact CB-CG 4.25Å; E564-F587 HydrophobicContact CG-CD1 3.9Å; E564-F587 WeakPolarHBondContact OE2-CB 3.34Å; E564-F587 PolarHBondContact OE2-N 2.87Å; L575-F587 HydrophobicContact CD1-CE1 4.04Å; L575-F587 HydrophobicContact CD1-CE2 4Å; L575-F587 HydrophobicContact CD1-CZ 3.55Å; L575-F587 HydrophobicContact CD2-CB 4.45Å; L575-F587 HydrophobicContact CD2-CD1 3.67Å; L575-F587 HydrophobicContact CD2-CD2 3.45Å; L575-F587 VanDerWaalsContact CD2-CD2 3.45Å; L575-F587 HydrophobicContact CD2-CE1 3.67Å; L575-F587 HydrophobicContact CD2-CE2 3.45Å; L575-F587 VanDerWaalsContact CD2-CE2 3.45Å; L575-F587 HydrophobicContact CD2-CG 3.57Å; L575-F587 HydrophobicContact CD2-CZ 3.55Å; L575-F587 HydrophobicContact CG-CD2 3.92Å; L575-F587 HydrophobicContact CG-CE1 4.11Å; L575-F587 HydrophobicContact CG-CE2 3.41Å; L575-F587 VanDerWaalsContact CG-CE2 3.41Å; L575-F587 HydrophobicContact CG-CG 4.46Å; L575-F587 HydrophobicContact CG-CZ 3.51Å
588	E	85.4	Confident	82.1	Confident	79 Å²	79	57.6 Å²	57.6	37%	0.369	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.2	167.5	69	173	-165.9	0	0	111.4	V581 T583 R590	V581-E588 HydrophobicContact CB-CG 3.84Å; V581-E588 HydrophobicContact CG1-CG 4.32Å; V581-E588 PolarHBondContact N-O 3Å; V581-E588 PolarHBondContact O-N 3.36Å; T583-E588 HydrophobicContact CG2-CG 4.14Å; E588-R590 IonicContact OE1-CZ 3.79Å; E588-R590 IonicContact OE1-NE 2.68Å; E588-R590 PolarHBondContact OE1-NE 2.93Å; E588-R590 IonicContact OE1-NH2 2.7Å; E588-R590 PolarHBondContact OE1-NH2 2.95Å
589	C	81.3	Confident	82.3	Confident	11 Å²	11	67 Å²	67	7%	0.074	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.3	175.9	-60.4	0	0	0	0	110.5	C576 L597 G601	C576-C589 VanDerWaalsContact CA-SG 3.51Å; C576-C589 HydrophobicContact CB-CB 3.6Å; C576-C589 WeakPolarHBondContact CB-SG 3.38Å; C576-C589 WeakPolarHBondContact SG-CA 3.04Å; C576-C589 WeakPolarHBondContact SG-CB 3.28Å; C576-C589 CovalentContact SG-SG 2.02Å; C576-C589 PolarHBondContact SG-SG 2.72Å; C589-L597 HydrophobicContact CB-CD1 3.77Å; C589-G601 WeakPolarHBondContact CB-O 3.45Å; C589-G601 PolarHBondContact SG-O 2.75Å; C589-G601 VanDerWaalsContact SG-O 3.38Å
590	R	86.2	Confident	81.8	Confident	133 Å²	133	64.9 Å²	64.9	50%	0.502	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.2	176.5	-64	-171.2	-177.2	174.8	-0.3	110.9	G578 Q579 V581 E588	G578-R590 CarbonylContact C-O 3.54Å; G578-R590 WeakPolarHBondContact CA-O 3.39Å; Q579-R590 HydrophobicContact CB-CB 4.43Å; Q579-R590 PolarHBondContact N-O 3.42Å; Q579-R590 PolarHBondContact O-N 3Å; V581-R590 HydrophobicContact CG2-CG 4.07Å; E588-R590 IonicContact OE1-CZ 3.79Å; E588-R590 IonicContact OE1-NE 2.68Å; E588-R590 PolarHBondContact OE1-NE 2.93Å; E588-R590 IonicContact OE1-NH2 2.7Å; E588-R590 PolarHBondContact OE1-NH2 2.95Å
591	C	80.8	Confident	81.4	Confident	32 Å²	32	64.6 Å²	64.6	22%	0.216	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-85.9	147.5	178.9	-64.6	0	0	0	0	111.9	F595 Q596 L597 C604	C591-F595 HydrophobicContact CB-CB 3.89Å; C591-Q596 VanDerWaalsContact SG-C 3.59Å; C591-L597 VanDerWaalsContact SG-CA 3.59Å; C591-C604 WeakPolarHBondContact CA-SG 3.43Å; C591-C604 HydrophobicContact CB-CB 3.74Å; C591-C604 WeakPolarHBondContact CB-SG 3.37Å; C591-C604 WeakPolarHBondContact SG-CA 3.49Å; C591-C604 WeakPolarHBondContact SG-CB 3.06Å; C591-C604 CovalentContact SG-SG 2.03Å; C591-C604 PolarHBondContact SG-SG 3.46Å
592	P	79.5	Confident	80.5	Confident	45 Å²	45	69 Å²	69	29%	0.292	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-61.6	159.3	170.1	25.5	-30.3	0	0	0	110.6	G594 F595 F785 F790	P592-G594 PolarHBondContact O-N 3.32Å; P592-F595 HydrophobicContact CB-CD2 4.41Å; P592-F595 HydrophobicContact CG-CD2 3.69Å; P592-F595 HydrophobicContact CG-CE2 4.24Å; P592-F595 HydrophobicContact CG-CG 4.29Å; P592-F595 WeakPolarHBondContact O-CB 3Å; P592-F595 PolarHBondContact O-N 3.21Å; P592-F595 VanDerWaalsContact O-N 3.11Å; P592-F785 HydrophobicContact CB-CE1 4.21Å; P592-F785 HydrophobicContact CG-CE1 4.29Å; P592-F790 HydrophobicContact CG-CZ 4.11Å
593	H	85.6	Confident	79.5	Confident	174 Å²	174	67.7 Å²	67.7	81%	0.806	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	139.1	176.1	-174.8	-78.8	0	0	0	111.3
594	G	83.1	Confident	78.6	Confident	4 Å²	4	66.1 Å²	66.1	4%	0.041	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	91	-4.1	-172.1	0	0	0	0	0	113.8	P592 I607	P592-G594 PolarHBondContact O-N 3.32Å; G594-I607 PolarHBondContact O-N 2.86Å
595	F	80.3	Confident	78	Confident	13 Å²	13	64.2 Å²	64.2	6%	0.057	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	150.9	179.3	-61.5	-95.8	0	0	0	111.7	C591 P592 C604 E605 D606 Y626 G627 F785	C591-F595 HydrophobicContact CB-CB 3.89Å; P592-F595 HydrophobicContact CB-CD2 4.41Å; P592-F595 HydrophobicContact CG-CD2 3.69Å; P592-F595 HydrophobicContact CG-CE2 4.24Å; P592-F595 HydrophobicContact CG-CG 4.29Å; P592-F595 WeakPolarHBondContact O-CB 3Å; P592-F595 PolarHBondContact O-N 3.21Å; P592-F595 VanDerWaalsContact O-N 3.11Å; F595-C604 HydrophobicContact CB-CB 3.96Å; F595-C604 HydrophobicContact CD1-CB 4.42Å; F595-C604 HydrophobicContact CG-CB 4.45Å; F595-E605 CarbonylContact C-O 3.58Å; F595-E605 VanDerWaalsContact CA-O 3.27Å; F595-E605 WeakPolarHBondContact CA-O 3.43Å; F595-D606 HydrophobicContact CD1-CB 4.28Å; F595-D606 HydrophobicContact CE1-CB 4.11Å; F595-Y626 HydrophobicContact CE1-CD1 4.12Å; F595-Y626 HydrophobicContact CE1-CD2 4.04Å; F595-Y626 AromaticContact CE1-CE1 3.71Å; F595-Y626 HydrophobicContact CE1-CE1 3.71Å; F595-Y626 AromaticContact CE1-CE2 3.65Å; F595-Y626 HydrophobicContact CE1-CE2 3.65Å; F595-Y626 HydrophobicContact CE1-CG 4.25Å; F595-Y626 AromaticContact CE1-CZ 3.46Å; F595-Y626 VanDerWaalsContact CE1-CZ 3.46Å; F595-Y626 AromaticContact CZ-CD1 3.8Å; F595-Y626 HydrophobicContact CZ-CD1 3.8Å; F595-Y626 HydrophobicContact CZ-CD2 4.4Å; F595-Y626 AromaticContact CZ-CE1 3.66Å; F595-Y626 HydrophobicContact CZ-CE1 3.66Å; F595-Y626 HydrophobicContact CZ-CE2 4.32Å; F595-Y626 HydrophobicContact CZ-CG 4.16Å; F595-Y626 AromaticContact CZ-CZ 3.94Å; F595-G627 VanDerWaalsContact CZ-CA 3.46Å; F595-F785 AromaticContact CE2-CD1 3.88Å; F595-F785 HydrophobicContact CE2-CD1 3.88Å; F595-F785 AromaticContact CE2-CD2 3.86Å; F595-F785 HydrophobicContact CE2-CD2 3.86Å; F595-F785 AromaticContact CE2-CE1 3.9Å; F595-F785 HydrophobicContact CE2-CE1 3.9Å; F595-F785 AromaticContact CE2-CE2 3.86Å; F595-F785 HydrophobicContact CE2-CE2 3.86Å; F595-F785 AromaticContact CE2-CG 3.86Å; F595-F785 HydrophobicContact CE2-CG 3.86Å; F595-F785 AromaticContact CE2-CZ 3.88Å; F595-F785 HydrophobicContact CE2-CZ 3.88Å; F595-F785 HydrophobicContact CZ-CB 4.24Å; F595-F785 HydrophobicContact CZ-CD1 4.3Å; F595-F785 HydrophobicContact CZ-CD2 4.16Å; F595-F785 AromaticContact CZ-CG 3.99Å; F595-F785 HydrophobicContact CZ-CG 3.99Å
596	Q	84	Confident	77.8	Confident	102 Å²	102	64.5 Å²	64.5	48%	0.477	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	152.2	174.5	63.7	178.5	33	0	0	110.9	C591 G598 C604 E605 I607	C591-Q596 VanDerWaalsContact SG-C 3.59Å; Q596-G598 PolarHBondContact O-N 2.76Å; Q596-C604 CarbonylContact O-C 3.6Å; Q596-C604 WeakPolarHBondContact O-CA 3.43Å; Q596-E605 HydrophobicContact CG-CB 4.31Å; Q596-E605 PolarHBondContact N-O 2.8Å; Q596-E605 PolarHBondContact O-N 2.99Å; Q596-I607 HydrophobicContact CB-CD1 4.24Å; Q596-I607 HydrophobicContact CB-CG1 3.91Å; Q596-I607 HydrophobicContact CG-CG1 4.05Å
597	L	76.7	Confident	77.5	Confident	74 Å²	74	63.9 Å²	63.9	39%	0.387	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	125.8	178.5	-163.3	68.6	0	0	0	109.9	C589 C591	C589-L597 HydrophobicContact CB-CD1 3.77Å; C591-L597 VanDerWaalsContact SG-CA 3.59Å
598	G	71.5	Confident	77.3	Confident	7 Å²	7	63.6 Å²	63.6	7%	0.072	31%	0.312	C	S	.	.			trans	-64.8	171.4	176.6	0	0	0	0	0	112.1	Q596 D600 G601 T603	Q596-G598 PolarHBondContact O-N 2.76Å; G598-D600 PolarHBondContact O-N 3.33Å; G598-D600 VanDerWaalsContact O-N 3.12Å; G598-G601 PolarHBondContact O-N 2.74Å; G598-T603 PolarHBondContact N-O 3.09Å
599	K	75.2	Confident	77.2	Confident	217 Å²	217	60.6 Å²	60.6	94%	0.943	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.2	-177.7	-65.2	-178	-177.2	176	0	114.1
600	D	70.2	Confident	77.1	Confident	85 Å²	85	60.1 Å²	60.1	46%	0.455	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-7.5	176.9	65.5	-9.3	0	0	0	113.3	G598 R602 T603	G598-D600 PolarHBondContact O-N 3.33Å; G598-D600 VanDerWaalsContact O-N 3.12Å; D600-R602 PolarHBondContact O-N 2.6Å; D600-R602 PolarHBondContact OD1-N 3.42Å; D600-T603 PolarHBondContact OD1-N 3.03Å; D600-T603 PolarHBondContact OD1-OG1 3.31Å; D600-T603 WeakPolarHBondContact OD2-CB 3.12Å; D600-T603 WeakPolarHBondContact OD2-CG2 3.48Å; D600-T603 PolarHBondContact OD2-N 3.19Å; D600-T603 PolarHBondContact OD2-OG1 3.33Å; D600-T603 VanDerWaalsContact OD2-OG1 3.05Å
601	G	72.9	Confident	76.8	Confident	30 Å²	30	56.4 Å²	56.4	31%	0.309	29%	0.292	S	S	.	.	S	Bend	trans	69.6	12.1	-177	0	0	0	0	0	113.9	C589 G598	C589-G601 WeakPolarHBondContact CB-O 3.45Å; C589-G601 PolarHBondContact SG-O 2.75Å; C589-G601 VanDerWaalsContact SG-O 3.38Å; G598-G601 PolarHBondContact O-N 2.74Å
602	R	68	Low	76.8	Confident	125 Å²	125	60 Å²	60	47%	0.472	31%	0.309	S	S	.	.	S	Bend	trans	-134.6	-35.7	-172.6	-65	-178.6	-175.7	177.9	-1.2	113.8	A577 D600	A577-R602 WeakPolarHBondContact CB-O 3.49Å; A577-R602 PolarHBondContact N-O 2.04Å; D600-R602 PolarHBondContact O-N 2.6Å; D600-R602 PolarHBondContact OD1-N 3.42Å
603	T	66.1	Low	76.8	Confident	22 Å²	22	60.5 Å²	60.5	14%	0.135	32%	0.323	C	S	.	.			trans	-83.2	151.2	176.4	54.2	0	0	0	0	110.9	G598 D600	G598-T603 PolarHBondContact N-O 3.09Å; D600-T603 PolarHBondContact OD1-N 3.03Å; D600-T603 PolarHBondContact OD1-OG1 3.31Å; D600-T603 WeakPolarHBondContact OD2-CB 3.12Å; D600-T603 WeakPolarHBondContact OD2-CG2 3.48Å; D600-T603 PolarHBondContact OD2-N 3.19Å; D600-T603 PolarHBondContact OD2-OG1 3.33Å; D600-T603 VanDerWaalsContact OD2-OG1 3.05Å
604	C	70.2	Confident	76.7	Confident	8 Å²	8	56.8 Å²	56.8	5%	0.054	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	124.2	171.2	-62.2	0	0	0	0	108.9	C591 F595 Q596 F790	C591-C604 WeakPolarHBondContact CA-SG 3.43Å; C591-C604 HydrophobicContact CB-CB 3.74Å; C591-C604 WeakPolarHBondContact CB-SG 3.37Å; C591-C604 WeakPolarHBondContact SG-CA 3.49Å; C591-C604 WeakPolarHBondContact SG-CB 3.06Å; C591-C604 CovalentContact SG-SG 2.03Å; C591-C604 PolarHBondContact SG-SG 3.46Å; F595-C604 HydrophobicContact CB-CB 3.96Å; F595-C604 HydrophobicContact CD1-CB 4.42Å; F595-C604 HydrophobicContact CG-CB 4.45Å; Q596-C604 CarbonylContact O-C 3.6Å; Q596-C604 WeakPolarHBondContact O-CA 3.43Å; C604-F790 HydrophobicContact CB-CD1 3.45Å; C604-F790 VanDerWaalsContact CB-CD1 3.45Å; C604-F790 HydrophobicContact CB-CE1 3.3Å; C604-F790 HydrophobicContact CB-CZ 4.24Å; C604-F790 WeakPolarHBondContact SG-CE1 3.3Å
605	E	74.1	Confident	76.6	Confident	67 Å²	67	57.8 Å²	57.8	31%	0.313	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	137.2	179.2	-62.5	179.3	166.7	0	0	108.2	F595 Q596	F595-E605 CarbonylContact C-O 3.58Å; F595-E605 VanDerWaalsContact CA-O 3.27Å; F595-E605 WeakPolarHBondContact CA-O 3.43Å; Q596-E605 HydrophobicContact CG-CB 4.31Å; Q596-E605 PolarHBondContact N-O 2.8Å; Q596-E605 PolarHBondContact O-N 2.99Å
606	D	75.2	Confident	76.5	Confident	28 Å²	28	62.9 Å²	62.9	15%	0.15	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	135.4	176.1	-177.1	58.9	0	0	0	110.5	F595 D608 N624 Y626 G627	F595-D606 HydrophobicContact CD1-CB 4.28Å; F595-D606 HydrophobicContact CE1-CB 4.11Å; D606-D608 PolarHBondContact O-N 2.7Å; D606-N624 PolarHBondContact OD2-ND2 3.11Å; D606-Y626 HydrophobicContact CB-CD2 4.01Å; D606-Y626 HydrophobicContact CB-CE2 4.2Å; D606-G627 WeakPolarHBondContact OD1-CA 3.3Å; D606-G627 PolarHBondContact OD1-N 2.91Å
607	I	78.7	Confident	76.1	Confident	44 Å²	44	59.3 Å²	59.3	23%	0.226	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-82.1	118	175.4	-62	172.3	0	0	0	107.3	G594 Q596 E609 N624	G594-I607 PolarHBondContact O-N 2.86Å; Q596-I607 HydrophobicContact CB-CD1 4.24Å; Q596-I607 HydrophobicContact CB-CG1 3.91Å; Q596-I607 HydrophobicContact CG-CG1 4.05Å; I607-E609 VanDerWaalsContact C-N 3.27Å; I607-E609 HydrophobicContact CB-CG 4.49Å; I607-E609 HydrophobicContact CG2-CG 4.05Å; I607-E609 PolarHBondContact O-N 2.72Å; I607-E609 VanDerWaalsContact O-OE2 3.06Å; I607-N624 PolarHBondContact O-OD1 3.49Å
608	D	78.8	Confident	75.8	Confident	36 Å²	36	62.8 Å²	62.8	19%	0.193	35%	0.354	C	S	.	.			trans	-71.1	84.6	170.1	-176.9	-11.7	0	0	0	109.5	D606 C610 A611 N624 R841	D606-D608 PolarHBondContact O-N 2.7Å; D608-C610 PolarHBondContact O-N 3.34Å; D608-C610 WeakPolarHBondContact OD1-CA 3.3Å; D608-C610 VanDerWaalsContact OD1-CB 3.29Å; D608-C610 WeakPolarHBondContact OD1-CB 3.08Å; D608-C610 PolarHBondContact OD1-N 3.22Å; D608-A611 HydrophobicContact CB-CB 4.05Å; D608-A611 WeakPolarHBondContact O-CB 3.35Å; D608-A611 PolarHBondContact O-N 3.1Å; D608-A611 VanDerWaalsContact O-N 3.11Å; D608-A611 PolarHBondContact OD1-N 3.37Å; D608-N624 WeakPolarHBondContact CA-OD1 3.43Å; D608-R841 IonicContact OD2-CZ 2.73Å; D608-R841 IonicContact OD2-NH1 3.32Å; D608-R841 PolarHBondContact OD2-NH1 2.73Å; D608-R841 IonicContact OD2-NH2 3.5Å; D608-R841 PolarHBondContact OD2-NH2 3.05Å
609	E	83.6	Confident	75.9	Confident	15 Å²	15	66 Å²	66	7%	0.07	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-22	-178.8	-63.3	104.7	163.9	0	0	112	I607 N612 G613 M614 N624 G628 Y629	I607-E609 VanDerWaalsContact C-N 3.27Å; I607-E609 HydrophobicContact CB-CG 4.49Å; I607-E609 HydrophobicContact CG2-CG 4.05Å; I607-E609 PolarHBondContact O-N 2.72Å; I607-E609 VanDerWaalsContact O-OE2 3.06Å; E609-N612 PolarHBondContact O-N 2.95Å; E609-G613 PolarHBondContact O-N 2.03Å; E609-M614 HydrophobicContact CB-CB 4.35Å; E609-M614 HydrophobicContact CB-CG 3.9Å; E609-M614 WeakPolarHBondContact O-CG 3.08Å; E609-M614 PolarHBondContact O-N 3.1Å; E609-N624 PolarHBondContact N-OD1 3.41Å; E609-N624 PolarHBondContact OE2-OD1 3.18Å; E609-G628 WeakPolarHBondContact OE1-CA 3.46Å; E609-G628 WeakPolarHBondContact OE2-CA 3.29Å; E609-Y629 HydrophobicContact CB-CD1 3.32Å; E609-Y629 HydrophobicContact CB-CE1 3.98Å; E609-Y629 HydrophobicContact CB-CG 3.68Å; E609-Y629 HydrophobicContact CG-CD1 3.55Å; E609-Y629 HydrophobicContact CG-CE1 4.1Å; E609-Y629 HydrophobicContact CG-CG 4.36Å; E609-Y629 WeakPolarHBondContact OE2-CB 3.49Å; E609-Y629 PolarHBondContact OE2-N 2.87Å
610	C	78.7	Confident	76.1	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.007	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-38.1	172.9	-68.4	0	0	0	0	111.8	D608 N612 G613 C622 I623 N624 Y843	D608-C610 PolarHBondContact O-N 3.34Å; D608-C610 WeakPolarHBondContact OD1-CA 3.3Å; D608-C610 VanDerWaalsContact OD1-CB 3.29Å; D608-C610 WeakPolarHBondContact OD1-CB 3.08Å; D608-C610 PolarHBondContact OD1-N 3.22Å; C610-N612 PolarHBondContact O-N 2.72Å; C610-G613 PolarHBondContact O-N 3.2Å; C610-C622 WeakPolarHBondContact CA-SG 3.49Å; C610-C622 HydrophobicContact CB-CB 3.77Å; C610-C622 WeakPolarHBondContact CB-SG 3.13Å; C610-C622 WeakPolarHBondContact SG-CB 3.23Å; C610-C622 CovalentContact SG-SG 2.03Å; C610-C622 PolarHBondContact SG-SG 3.32Å; C610-I623 PolarHBondContact SG-N 2.03Å; C610-N624 HydrophobicContact CB-CB 4.49Å; C610-N624 PolarHBondContact SG-N 3.27Å; C610-Y843 VanDerWaalsContact C-OH 3.23Å; C610-Y843 HydrophobicContact CB-CE2 4Å; C610-Y843 VanDerWaalsContact O-CE2 3.24Å; C610-Y843 WeakPolarHBondContact O-CE2 3.29Å; C610-Y843 PolarHBondContact O-OH 3.22Å
611	A	80	Confident	76.5	Confident	56 Å²	56	54.6 Å²	54.6	46%	0.463	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-28	173.1	0	0	0	0	0	112.8	D608 G613 Y843	D608-A611 HydrophobicContact CB-CB 4.05Å; D608-A611 WeakPolarHBondContact O-CB 3.35Å; D608-A611 PolarHBondContact O-N 3.1Å; D608-A611 VanDerWaalsContact O-N 3.11Å; D608-A611 PolarHBondContact OD1-N 3.37Å; A611-G613 VanDerWaalsContact C-N 3.32Å; A611-Y843 WeakPolarHBondContact CA-OH 3.39Å; A611-Y843 PolarHBondContact N-OH 3.07Å
612	N	80.2	Confident	76.9	Confident	107 Å²	107	53.4 Å²	53.4	57%	0.572	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-2.5	178	-67.7	-30.3	0	0	0	113.9	E609 C610 M614	E609-N612 PolarHBondContact O-N 2.95Å; C610-N612 PolarHBondContact O-N 2.72Å; N612-M614 HydrophobicContact CB-CE 4.44Å
613	G	79.5	Confident	77.4	Confident	56 Å²	56	47.5 Å²	47.5	58%	0.577	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	34.3	176.5	0	0	0	0	0	114.4	E609 C610 A611 C615	E609-G613 PolarHBondContact O-N 2.03Å; C610-G613 PolarHBondContact O-N 3.2Å; A611-G613 VanDerWaalsContact C-N 3.32Å; G613-C615 VanDerWaalsContact C-N 3.27Å; G613-C615 PolarHBondContact O-N 3.01Å
614	M	83.1	Confident	77.9	Confident	95 Å²	95	46.7 Å²	46.7	47%	0.468	28%	0.277	S	S	.	.			trans	-67.4	-19.1	-176.7	-71.6	-64.4	179.8	0	0	115.1	E609 N612 S616 Y629	E609-M614 HydrophobicContact CB-CB 4.35Å; E609-M614 HydrophobicContact CB-CG 3.9Å; E609-M614 WeakPolarHBondContact O-CG 3.08Å; E609-M614 PolarHBondContact O-N 3.1Å; N612-M614 HydrophobicContact CB-CE 4.44Å; M614-S616 PolarHBondContact O-N 3.48Å; M614-Y629 HydrophobicContact CB-CD2 4.15Å; M614-Y629 HydrophobicContact CB-CE1 4.08Å; M614-Y629 HydrophobicContact CB-CE2 3.57Å; M614-Y629 HydrophobicContact CG-CE1 4.31Å
615	C	82.5	Confident	78.1	Confident	26 Å²	26	47.6 Å²	47.6	18%	0.176	28%	0.281	C	S	.	.			trans	-80.6	111.2	174.4	-62.3	0	0	0	0	111.4	G613 G617 Q620 C622 C631	G613-C615 VanDerWaalsContact C-N 3.27Å; G613-C615 PolarHBondContact O-N 3.01Å; C615-G617 VanDerWaalsContact C-N 3.33Å; C615-G617 PolarHBondContact O-N 3.34Å; C615-Q620 HydrophobicContact CB-CB 4.35Å; C615-C622 HydrophobicContact CB-CB 4.43Å; C615-C622 WeakPolarHBondContact SG-CB 3Å; C615-C622 PolarHBondContact SG-SG 3.23Å; C615-C631 WeakPolarHBondContact CA-SG 3.48Å; C615-C631 HydrophobicContact CB-CB 3.96Å; C615-C631 WeakPolarHBondContact CB-SG 3.09Å; C615-C631 WeakPolarHBondContact SG-CB 3.43Å; C615-C631 CovalentContact SG-SG 2.03Å; C615-C631 PolarHBondContact SG-SG 3.41Å
616	S	77.6	Confident	78.1	Confident	120 Å²	120	45.4 Å²	45.4	84%	0.839	27%	0.27	S	S	*	.			trans	-74.7	-19	-179.8	-55.6	0	0	0	0	114.2	M614 H618	M614-S616 PolarHBondContact O-N 3.48Å; S616-H618 PolarHBondContact O-N 3.29Å
617	G	75	Confident	78.1	Confident	26 Å²	26	44.9 Å²	44.9	27%	0.268	27%	0.271	S	S	.	.			trans	-79	118.5	-176.9	0	0	0	0	0	112.2	C615 D619 Q620	C615-G617 VanDerWaalsContact C-N 3.33Å; C615-G617 PolarHBondContact O-N 3.34Å; G617-D619 PolarHBondContact O-N 2.61Å; G617-D619 VanDerWaalsContact O-N 3.09Å; G617-Q620 WeakPolarHBondContact O-CB 3.25Å; G617-Q620 PolarHBondContact O-N 3.31Å
618	H	70.3	Confident	78.2	Confident	147 Å²	147	43.6 Å²	43.6	68%	0.681	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.5	-41.6	172.6	-90.8	-71.6	0	0	0	113.5	S616 K647 E845	S616-H618 PolarHBondContact O-N 3.29Å; H618-K647 PolarHBondContact O-NZ 3.12Å; H618-K647 VanDerWaalsContact O-NZ 3.15Å; H618-E845 VanDerWaalsContact C-CD 3.44Å; H618-E845 HydrophobicContact CB-CG 4.31Å; H618-E845 WeakPolarHBondContact CB-OE1 3.29Å; H618-E845 IonicContact CG-OE1 3.52Å; H618-E845 IonicContact ND1-OE1 3.84Å; H618-E845 WeakPolarHBondContact O-CG 3.27Å
619	D	74.2	Confident	78.4	Confident	74 Å²	74	46.8 Å²	46.8	40%	0.396	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	5	-177.4	-98	-44.2	0	0	0	115.7	G617 K642	G617-D619 PolarHBondContact O-N 2.61Å; G617-D619 VanDerWaalsContact O-N 3.09Å; D619-K642 PolarHBondContact O-NZ 2.9Å; D619-K642 IonicContact OD1-NZ 3.62Å; D619-K642 PolarHBondContact OD1-NZ 3.35Å
620	Q	79.5	Confident	78.5	Confident	61 Å²	61	48.3 Å²	48.3	29%	0.285	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-82.8	146.3	-177.7	-68.6	174.3	-9.8	0	0	111.7	C615 G617 C631 Q633	C615-Q620 HydrophobicContact CB-CB 4.35Å; G617-Q620 WeakPolarHBondContact O-CB 3.25Å; G617-Q620 PolarHBondContact O-N 3.31Å; Q620-C631 HydrophobicContact CB-CB 4.34Å; Q620-Q633 HydrophobicContact CG-CB 4.29Å
621	I	77.5	Confident	78.9	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	125.4	169.1	-60.5	175.5	0	0	0	106.4	I623 C631 E632 I634 K647 N648 F675 I842	I621-I623 HydrophobicContact CG2-CD1 4.23Å; I621-I623 HydrophobicContact CG2-CG1 4.43Å; I621-I623 WeakPolarHBondContact O-CD1 3.32Å; I621-C631 CarbonylContact O-C 3.48Å; I621-C631 WeakPolarHBondContact O-CA 3.09Å; I621-E632 PolarHBondContact N-O 2.89Å; I621-E632 PolarHBondContact O-N 3.04Å; I621-I634 HydrophobicContact CD1-CD1 3.45Å; I621-I634 VanDerWaalsContact CD1-CD1 3.45Å; I621-I634 HydrophobicContact CD1-CG1 4.2Å; I621-K647 HydrophobicContact CD1-CB 4.29Å; I621-K647 HydrophobicContact CG1-CB 4.44Å; I621-N648 HydrophobicContact CD1-CB 4.08Å; I621-F675 HydrophobicContact CD1-CE2 3.88Å; I621-F675 HydrophobicContact CD1-CZ 4.48Å; I621-F675 HydrophobicContact CG2-CD2 4.41Å; I621-F675 HydrophobicContact CG2-CE2 4.33Å; I621-I842 HydrophobicContact CD1-CG1 4.37Å; I621-I842 HydrophobicContact CG1-CG1 4.37Å; I621-I842 HydrophobicContact CG2-CG1 4.21Å
622	C	82.5	Confident	79	Confident	6 Å²	6	49.5 Å²	49.5	4%	0.041	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	133.1	173.7	-165.8	0	0	0	0	109.6	C610 C615 K630 R841 Y843	C610-C622 WeakPolarHBondContact CA-SG 3.49Å; C610-C622 HydrophobicContact CB-CB 3.77Å; C610-C622 WeakPolarHBondContact CB-SG 3.13Å; C610-C622 WeakPolarHBondContact SG-CB 3.23Å; C610-C622 CovalentContact SG-SG 2.03Å; C610-C622 PolarHBondContact SG-SG 3.32Å; C615-C622 HydrophobicContact CB-CB 4.43Å; C615-C622 WeakPolarHBondContact SG-CB 3Å; C615-C622 PolarHBondContact SG-SG 3.23Å; C622-K630 CarbonylContact C-O 3.49Å; C622-R841 PolarHBondContact O-N 2.69Å; C622-Y843 HydrophobicContact CB-CE2 4.47Å
623	I	78.5	Confident	79.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	115.7	174.6	-55.4	98.8	0	0	0	107.6	C610 I621 Y629 K630 E632 F675 F781	C610-I623 PolarHBondContact SG-N 2.03Å; I621-I623 HydrophobicContact CG2-CD1 4.23Å; I621-I623 HydrophobicContact CG2-CG1 4.43Å; I621-I623 WeakPolarHBondContact O-CD1 3.32Å; I623-Y629 CarbonylContact O-C 3.59Å; I623-Y629 WeakPolarHBondContact O-CA 3.26Å; I623-K630 PolarHBondContact N-O 2.91Å; I623-K630 PolarHBondContact O-N 2.64Å; I623-E632 HydrophobicContact CD1-CB 3.76Å; I623-E632 HydrophobicContact CD1-CG 3.59Å; I623-F675 HydrophobicContact CD1-CB 4.34Å; I623-F675 HydrophobicContact CD1-CD1 3.98Å; I623-F675 HydrophobicContact CD1-CD2 4.47Å; I623-F675 HydrophobicContact CD1-CE1 4.43Å; I623-F675 HydrophobicContact CD1-CG 4.01Å; I623-F675 HydrophobicContact CG1-CB 3.7Å; I623-F675 HydrophobicContact CG1-CD1 4.29Å; I623-F675 HydrophobicContact CG1-CD2 4.41Å; I623-F675 HydrophobicContact CG1-CG 3.9Å; I623-F675 HydrophobicContact CG2-CB 4.37Å; I623-F781 HydrophobicContact CB-CE2 4.47Å; I623-F781 HydrophobicContact CD1-CE2 4.16Å; I623-F781 HydrophobicContact CG1-CE2 4.33Å; I623-F781 HydrophobicContact CG2-CD2 4.09Å; I623-F781 HydrophobicContact CG2-CE2 4.4Å
624	N	75.7	Confident	79.4	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.027	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	136.6	173.6	-162.1	57.8	0	0	0	109.5	D606 I607 D608 E609 C610 S677 E838	D606-N624 PolarHBondContact OD2-ND2 3.11Å; I607-N624 PolarHBondContact O-OD1 3.49Å; D608-N624 WeakPolarHBondContact CA-OD1 3.43Å; E609-N624 PolarHBondContact N-OD1 3.41Å; E609-N624 PolarHBondContact OE2-OD1 3.18Å; C610-N624 HydrophobicContact CB-CB 4.49Å; C610-N624 PolarHBondContact SG-N 3.27Å; N624-S677 VanDerWaalsContact O-CB 3.28Å; N624-S677 WeakPolarHBondContact O-CB 3.34Å; N624-S677 PolarHBondContact O-OG 3.12Å; N624-E838 HydrophobicContact CB-CB 4.46Å; N624-E838 HydrophobicContact CB-CG 4.26Å; N624-E838 WeakPolarHBondContact CB-OE2 3.48Å
625	M	75.5	Confident	79.7	Confident	27 Å²	27	48.6 Å²	48.6	13%	0.133	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	152.5	179.7	-60.1	177.8	52.9	0	0	108.6	G627 G628 K630 F781	M625-G627 PolarHBondContact O-N 2.04Å; M625-G628 CarbonylContact C-O 3.58Å; M625-G628 VanDerWaalsContact C-O 3.28Å; M625-G628 VanDerWaalsContact CA-O 3.23Å; M625-G628 WeakPolarHBondContact CA-O 3.49Å; M625-G628 VanDerWaalsContact CB-O 3.29Å; M625-G628 WeakPolarHBondContact CB-O 3.45Å; M625-G628 PolarHBondContact N-O 2.97Å; M625-G628 CarbonylContact O-C 3.51Å; M625-G628 PolarHBondContact O-N 2.77Å; M625-K630 HydrophobicContact SD-CB 3.98Å; M625-F781 HydrophobicContact CE-CB 3.55Å; M625-F781 HydrophobicContact CG-CB 4.35Å; M625-F781 HydrophobicContact SD-CB 3.7Å; M625-F781 HydrophobicContact SD-CD2 4.42Å; M625-F781 HydrophobicContact SD-CG 4.23Å
626	Y	74	Confident	80	Confident	22 Å²	22	48.7 Å²	48.7	9%	0.086	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	107.4	178.3	-163.9	-111.4	0	0	0	110.8	F595 D606 P679 S783 F785	F595-Y626 HydrophobicContact CE1-CD1 4.12Å; F595-Y626 HydrophobicContact CE1-CD2 4.04Å; F595-Y626 AromaticContact CE1-CE1 3.71Å; F595-Y626 HydrophobicContact CE1-CE1 3.71Å; F595-Y626 AromaticContact CE1-CE2 3.65Å; F595-Y626 HydrophobicContact CE1-CE2 3.65Å; F595-Y626 HydrophobicContact CE1-CG 4.25Å; F595-Y626 AromaticContact CE1-CZ 3.46Å; F595-Y626 VanDerWaalsContact CE1-CZ 3.46Å; F595-Y626 AromaticContact CZ-CD1 3.8Å; F595-Y626 HydrophobicContact CZ-CD1 3.8Å; F595-Y626 HydrophobicContact CZ-CD2 4.4Å; F595-Y626 AromaticContact CZ-CE1 3.66Å; F595-Y626 HydrophobicContact CZ-CE1 3.66Å; F595-Y626 HydrophobicContact CZ-CE2 4.32Å; F595-Y626 HydrophobicContact CZ-CG 4.16Å; F595-Y626 AromaticContact CZ-CZ 3.94Å; D606-Y626 HydrophobicContact CB-CD2 4.01Å; D606-Y626 HydrophobicContact CB-CE2 4.2Å; Y626-P679 HydrophobicContact CD1-CB 4.29Å; Y626-S783 WeakPolarHBondContact O-CB 3.39Å; Y626-S783 PolarHBondContact O-OG 2.85Å; Y626-F785 HydrophobicContact CD1-CB 3.6Å; Y626-F785 HydrophobicContact CE1-CB 3.96Å; Y626-F785 WeakPolarHBondContact O-CD2 3.22Å
627	G	74.9	Confident	80.6	Confident	16 Å²	16	45.1 Å²	45.1	17%	0.165	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	18.3	-175.1	0	0	0	0	0	115.7	F595 D606 M625	F595-G627 VanDerWaalsContact CZ-CA 3.46Å; D606-G627 WeakPolarHBondContact OD1-CA 3.3Å; D606-G627 PolarHBondContact OD1-N 2.91Å; M625-G627 PolarHBondContact O-N 2.04Å
628	G	80.3	Confident	81.3	Confident	17 Å²	17	49.4 Å²	49.4	18%	0.175	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168	-169.5	174.8	0	0	0	0	0	114.4	E609 M625	E609-G628 WeakPolarHBondContact OE1-CA 3.46Å; E609-G628 WeakPolarHBondContact OE2-CA 3.29Å; M625-G628 CarbonylContact C-O 3.58Å; M625-G628 VanDerWaalsContact C-O 3.28Å; M625-G628 VanDerWaalsContact CA-O 3.23Å; M625-G628 WeakPolarHBondContact CA-O 3.49Å; M625-G628 VanDerWaalsContact CB-O 3.29Å; M625-G628 WeakPolarHBondContact CB-O 3.45Å; M625-G628 PolarHBondContact N-O 2.97Å; M625-G628 CarbonylContact O-C 3.51Å; M625-G628 PolarHBondContact O-N 2.77Å
629	Y	83.9	Confident	82.2	Confident	103 Å²	103	47.5 Å²	47.5	40%	0.404	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	162.8	-178.5	66.2	-74.9	0	0	0	112.2	E609 M614 I623	E609-Y629 HydrophobicContact CB-CD1 3.32Å; E609-Y629 HydrophobicContact CB-CE1 3.98Å; E609-Y629 HydrophobicContact CB-CG 3.68Å; E609-Y629 HydrophobicContact CG-CD1 3.55Å; E609-Y629 HydrophobicContact CG-CE1 4.1Å; E609-Y629 HydrophobicContact CG-CG 4.36Å; E609-Y629 WeakPolarHBondContact OE2-CB 3.49Å; E609-Y629 PolarHBondContact OE2-N 2.87Å; M614-Y629 HydrophobicContact CB-CD2 4.15Å; M614-Y629 HydrophobicContact CB-CE1 4.08Å; M614-Y629 HydrophobicContact CB-CE2 3.57Å; M614-Y629 HydrophobicContact CG-CE1 4.31Å; I623-Y629 CarbonylContact O-C 3.59Å; I623-Y629 WeakPolarHBondContact O-CA 3.26Å
630	K	84.6	Confident	82.9	Confident	47 Å²	47	45.3 Å²	45.3	20%	0.204	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	134.1	174.6	-155.3	177.6	-167.2	-167.7	0	111.4	C622 I623 M625 E632 D755 F781	C622-K630 CarbonylContact C-O 3.49Å; I623-K630 PolarHBondContact N-O 2.91Å; I623-K630 PolarHBondContact O-N 2.64Å; M625-K630 HydrophobicContact SD-CB 3.98Å; K630-E632 HydrophobicContact CD-CG 4.35Å; K630-E632 VanDerWaalsContact CD-OE1 3.31Å; K630-E632 WeakPolarHBondContact CD-OE1 3.44Å; K630-E632 WeakPolarHBondContact CE-OE1 3.06Å; K630-E632 HydrophobicContact CG-CG 4.44Å; K630-E632 IonicContact NZ-OE1 3.87Å; K630-E632 PolarHBondContact NZ-OE1 3.46Å; K630-D755 VanDerWaalsContact NZ-CG 3.3Å; K630-D755 IonicContact NZ-OD1 3.55Å; K630-D755 IonicContact NZ-OD2 2.85Å; K630-D755 PolarHBondContact NZ-OD2 3.28Å; K630-F781 HydrophobicContact CD-CD1 4.03Å; K630-F781 HydrophobicContact CD-CD2 4.16Å; K630-F781 HydrophobicContact CD-CE1 3.78Å; K630-F781 HydrophobicContact CD-CE2 3.89Å; K630-F781 HydrophobicContact CD-CG 4.22Å; K630-F781 HydrophobicContact CD-CZ 3.69Å
631	C	87.4	Confident	83.5	Confident	41 Å²	41	45.7 Å²	45.7	28%	0.277	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	111.7	173.7	-54.7	0	0	0	0	109	C615 Q620 I621	C615-C631 WeakPolarHBondContact CA-SG 3.48Å; C615-C631 HydrophobicContact CB-CB 3.96Å; C615-C631 WeakPolarHBondContact CB-SG 3.09Å; C615-C631 WeakPolarHBondContact SG-CB 3.43Å; C615-C631 CovalentContact SG-SG 2.03Å; C615-C631 PolarHBondContact SG-SG 3.41Å; Q620-C631 HydrophobicContact CB-CB 4.34Å; I621-C631 CarbonylContact O-C 3.48Å; I621-C631 WeakPolarHBondContact O-CA 3.09Å
632	E	82.7	Confident	83.8	Confident	42 Å²	42	48.5 Å²	48.5	20%	0.196	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.1	179.6	-72.2	-69.9	171.9	0	0	110.6	I621 I623 K630 F675 F781	I621-E632 PolarHBondContact N-O 2.89Å; I621-E632 PolarHBondContact O-N 3.04Å; I623-E632 HydrophobicContact CD1-CB 3.76Å; I623-E632 HydrophobicContact CD1-CG 3.59Å; K630-E632 HydrophobicContact CD-CG 4.35Å; K630-E632 VanDerWaalsContact CD-OE1 3.31Å; K630-E632 WeakPolarHBondContact CD-OE1 3.44Å; K630-E632 WeakPolarHBondContact CE-OE1 3.06Å; K630-E632 HydrophobicContact CG-CG 4.44Å; K630-E632 IonicContact NZ-OE1 3.87Å; K630-E632 PolarHBondContact NZ-OE1 3.46Å; E632-F675 HydrophobicContact CB-CD1 4.48Å; E632-F675 HydrophobicContact CB-CE1 3.74Å; E632-F675 HydrophobicContact CB-CZ 3.99Å; E632-F675 HydrophobicContact CG-CD1 4.18Å; E632-F675 HydrophobicContact CG-CE1 3.75Å; E632-F781 HydrophobicContact CG-CE2 4.22Å; E632-F781 HydrophobicContact CG-CZ 3.9Å; E632-F781 WeakPolarHBondContact OE1-CZ 3.42Å
633	Q	84.3	Confident	83.7	Confident	114 Å²	114	48.8 Å²	48.8	53%	0.533	27%	0.267	S	S	.	.			trans	-105.8	117.2	172.2	-175.7	179.2	-13.2	0	0	109.3	Q620 V635	Q620-Q633 HydrophobicContact CG-CB 4.29Å; Q633-V635 PolarHBondContact O-N 2.79Å
634	I	83	Confident	83.6	Confident	14 Å²	14	55.8 Å²	55.8	7%	0.072	31%	0.31	C	S	.	.			trans	-78.4	115.5	177.6	-67	170.4	0	0	0	109.7	I621 K647 N648 Y673 F675	I621-I634 HydrophobicContact CD1-CD1 3.45Å; I621-I634 VanDerWaalsContact CD1-CD1 3.45Å; I621-I634 HydrophobicContact CD1-CG1 4.2Å; I634-K647 WeakPolarHBondContact CD1-O 3.46Å; I634-N648 VanDerWaalsContact CD1-CA 3.46Å; I634-N648 HydrophobicContact CD1-CB 4.1Å; I634-Y673 HydrophobicContact CD1-CD1 4.15Å; I634-Y673 HydrophobicContact CD1-CD2 4.08Å; I634-Y673 HydrophobicContact CD1-CG 3.69Å; I634-Y673 HydrophobicContact CG1-CD1 4.03Å; I634-Y673 HydrophobicContact CG1-CE1 4.5Å; I634-Y673 HydrophobicContact CG1-CG 4.07Å; I634-Y673 HydrophobicContact CG2-CD1 4.23Å; I634-Y673 HydrophobicContact CG2-CD2 3.91Å; I634-Y673 HydrophobicContact CG2-CE1 4.01Å; I634-Y673 HydrophobicContact CG2-CE2 3.69Å; I634-Y673 HydrophobicContact CG2-CG 4.2Å; I634-F675 HydrophobicContact CD1-CE2 4.01Å; I634-F675 HydrophobicContact CD1-CZ 3.94Å; I634-F675 HydrophobicContact CG1-CZ 4.03Å
635	V	89	Confident	83.5	Confident	111 Å²	111	64.9 Å²	64.9	67%	0.673	34%	0.344	S	S	*	.			trans	-98.8	113.7	168.3	-175.9	0	0	0	0	108	Q633	Q633-V635 PolarHBondContact O-N 2.79Å
636	C	89.5	Confident	83.2	Confident	27 Å²	27	67.9 Å²	67.9	18%	0.182	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-68.6	137.7	176.7	-62.4	0	0	0	0	110.4	K642 C650	C636-K642 VanDerWaalsContact SG-CA 3.53Å; C636-K642 PolarHBondContact SG-N 3.49Å; C636-K642 VanDerWaalsContact SG-N 3.36Å; C636-C650 WeakPolarHBondContact CA-SG 3.07Å; C636-C650 HydrophobicContact CB-CB 3.75Å; C636-C650 WeakPolarHBondContact CB-SG 3.42Å; C636-C650 WeakPolarHBondContact SG-CB 3.26Å; C636-C650 CovalentContact SG-SG 2.04Å; C636-C650 PolarHBondContact SG-SG 2.95Å
637	P	90.2	Very high	83.1	Confident	45 Å²	45	68.2 Å²	68.2	29%	0.292	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-65.5	165.4	176.8	25.6	-31.6	0	0	0	111.8	N639 Y640 L671	P637-N639 PolarHBondContact O-N 2.94Å; P637-Y640 HydrophobicContact CG-CD2 3.78Å; P637-Y640 HydrophobicContact CG-CE2 4.31Å; P637-Y640 HydrophobicContact CG-CG 4.15Å; P637-Y640 WeakPolarHBondContact O-CB 3.44Å; P637-Y640 PolarHBondContact O-N 2.83Å; P637-L671 HydrophobicContact CG-CD1 3.35Å
638	P	90	Very high	83.1	Confident	117 Å²	117	69 Å²	69	76%	0.76	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	141.2	176.3	-25.6	34	0	0	0	112	Y640	P638-Y640 VanDerWaalsContact C-N 3.27Å; P638-Y640 WeakPolarHBondContact O-CD2 3.06Å; P638-Y640 PolarHBondContact O-N 2.89Å
639	N	88.3	Confident	83	Confident	107 Å²	107	70.4 Å²	70.4	57%	0.572	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	9.8	-173.8	-52.7	-42.5	0	0	0	116.3	P637 R652 L653	P637-N639 PolarHBondContact O-N 2.94Å; N639-R652 WeakPolarHBondContact O-CA 3.31Å; N639-L653 PolarHBondContact O-N 3.38Å
640	Y	90.5	Very high	83.1	Confident	28 Å²	28	65.5 Å²	65.5	11%	0.11	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	151.3	171.2	-66.9	-107.9	0	0	0	111.4	P637 P638 C650 N651 R652 P668 L671	P637-Y640 HydrophobicContact CG-CD2 3.78Å; P637-Y640 HydrophobicContact CG-CE2 4.31Å; P637-Y640 HydrophobicContact CG-CG 4.15Å; P637-Y640 WeakPolarHBondContact O-CB 3.44Å; P637-Y640 PolarHBondContact O-N 2.83Å; P638-Y640 VanDerWaalsContact C-N 3.27Å; P638-Y640 WeakPolarHBondContact O-CD2 3.06Å; P638-Y640 PolarHBondContact O-N 2.89Å; Y640-C650 HydrophobicContact CD1-CB 4.3Å; Y640-N651 CarbonylContact C-O 3.46Å; Y640-N651 WeakPolarHBondContact CA-O 3.41Å; Y640-N651 VanDerWaalsContact CD1-C 3.45Å; Y640-R652 HydrophobicContact CD1-CB 4.13Å; Y640-R652 VanDerWaalsContact CD1-N 3.34Å; Y640-R652 HydrophobicContact CE1-CB 3.84Å; Y640-R652 HydrophobicContact CE1-CG 4.41Å; Y640-P668 WeakPolarHBondContact CE1-O 3.03Å; Y640-P668 WeakPolarHBondContact OH-CD 3.27Å; Y640-P668 WeakPolarHBondContact OH-CG 3.28Å; Y640-P668 PolarHBondContact OH-O 3.49Å; Y640-L671 HydrophobicContact CD1-CD1 3.94Å; Y640-L671 HydrophobicContact CD1-CG 4.1Å; Y640-L671 HydrophobicContact CD2-CD1 4.4Å; Y640-L671 HydrophobicContact CE1-CD1 3.87Å; Y640-L671 HydrophobicContact CE1-CG 3.74Å; Y640-L671 HydrophobicContact CE2-CD1 4.34Å; Y640-L671 HydrophobicContact CG-CD1 4.23Å
641	V	90.7	Very high	83.1	Confident	69 Å²	69	64.8 Å²	64.8	42%	0.418	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.9	174.4	-70.4	0	0	0	0	110.1	D643 C650 N651 L653	V641-D643 PolarHBondContact O-N 3.37Å; V641-C650 CarbonylContact O-C 3.27Å; V641-C650 WeakPolarHBondContact O-CA 3.38Å; V641-N651 PolarHBondContact N-O 3.39Å; V641-N651 PolarHBondContact O-N 3.29Å; V641-L653 HydrophobicContact CB-CD2 4.31Å; V641-L653 HydrophobicContact CG1-CD2 3.29Å; V641-L653 HydrophobicContact CG1-CG 4.02Å; V641-L653 HydrophobicContact CG2-CD2 4.08Å
642	K	84.6	Confident	83	Confident	60 Å²	60	63.6 Å²	63.6	26%	0.261	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	134.4	177.9	-165.9	174.6	-178.8	178.1	0	109.4	D619 C636 K647	D619-K642 PolarHBondContact O-NZ 2.9Å; D619-K642 IonicContact OD1-NZ 3.62Å; D619-K642 PolarHBondContact OD1-NZ 3.35Å; C636-K642 VanDerWaalsContact SG-CA 3.53Å; C636-K642 PolarHBondContact SG-N 3.49Å; C636-K642 VanDerWaalsContact SG-N 3.36Å; K642-K647 WeakPolarHBondContact CE-O 3.11Å
643	D	79.6	Confident	83.1	Confident	12 Å²	12	67 Å²	67	6%	0.064	35%	0.346	C	S	.	.			trans	-67.5	133.5	175.6	-171.2	-65.4	0	0	0	109.3	V641 R645 F646 R649 N651	V641-D643 PolarHBondContact O-N 3.37Å; D643-R645 VanDerWaalsContact C-N 3.26Å; D643-R645 PolarHBondContact O-N 2.84Å; D643-R645 WeakPolarHBondContact OD1-CA 3.43Å; D643-R645 WeakPolarHBondContact OD1-CB 3.45Å; D643-R645 PolarHBondContact OD1-N 2.95Å; D643-F646 HydrophobicContact CB-CB 4.29Å; D643-F646 PolarHBondContact OD1-N 3.36Å; D643-R649 HydrophobicContact CB-CB 3.83Å; D643-R649 HydrophobicContact CB-CG 4.1Å; D643-R649 WeakPolarHBondContact CB-O 3.35Å; D643-R649 PolarHBondContact N-O 3.35Å; D643-R649 WeakPolarHBondContact OD2-CD 3.32Å; D643-N651 WeakPolarHBondContact CB-ND2 3.36Å; D643-N651 PolarHBondContact OD2-ND2 3.21Å
644	T	78	Confident	83	Confident	147 Å²	147	64.3 Å²	64.3	90%	0.902	34%	0.34	S	S	*	.	S	Bend	trans	-72.8	-20	-177.1	53.9	0	0	0	0	113.2
645	R	71.9	Confident	82.5	Confident	197 Å²	197	69.2 Å²	69.2	74%	0.743	36%	0.363	S	S	*	.	S	Bend	trans	-99.8	-31.9	178.9	-61.8	-176.6	-69.6	-177.6	-3.5	112.3	D643	D643-R645 VanDerWaalsContact C-N 3.26Å; D643-R645 PolarHBondContact O-N 2.84Å; D643-R645 WeakPolarHBondContact OD1-CA 3.43Å; D643-R645 WeakPolarHBondContact OD1-CB 3.45Å; D643-R645 PolarHBondContact OD1-N 2.95Å
646	F	69.4	Low	82	Confident	89 Å²	89	69.3 Å²	69.3	39%	0.39	36%	0.364	S	S	.	.			trans	-123.4	99.9	-173.8	-57.5	-73.5	0	0	0	111.1	D643 N648 R649	D643-F646 HydrophobicContact CB-CB 4.29Å; D643-F646 PolarHBondContact OD1-N 3.36Å; F646-N648 PolarHBondContact O-N 3.4Å; F646-R649 HydrophobicContact CB-CB 3.9Å; F646-R649 PolarHBondContact O-N 3.15Å
647	K	72.4	Confident	81.5	Confident	30 Å²	30	69.6 Å²	69.6	13%	0.13	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.2	-178.4	-62.7	-159.4	-170.3	-166.9	0	113.4	H618 I621 I634 K642 R649 I842 E845	H618-K647 PolarHBondContact O-NZ 3.12Å; H618-K647 VanDerWaalsContact O-NZ 3.15Å; I621-K647 HydrophobicContact CD1-CB 4.29Å; I621-K647 HydrophobicContact CG1-CB 4.44Å; I634-K647 WeakPolarHBondContact CD1-O 3.46Å; K642-K647 WeakPolarHBondContact CE-O 3.11Å; K647-R649 VanDerWaalsContact C-N 3.35Å; K647-I842 HydrophobicContact CB-CD1 4.27Å; K647-I842 HydrophobicContact CB-CG2 3.76Å; K647-I842 HydrophobicContact CD-CG2 3.69Å; K647-I842 HydrophobicContact CG-CG2 3.63Å; K647-E845 IonicContact NZ-OE2 2.92Å; K647-E845 PolarHBondContact NZ-OE2 3.38Å
648	N	75.6	Confident	81.1	Confident	31 Å²	31	70.3 Å²	70.3	17%	0.166	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	13.9	178.4	74.3	-36.4	0	0	0	115.2	I621 I634 F646 Y673 I842	I621-N648 HydrophobicContact CD1-CB 4.08Å; I634-N648 VanDerWaalsContact CD1-CA 3.46Å; I634-N648 HydrophobicContact CD1-CB 4.1Å; F646-N648 PolarHBondContact O-N 3.4Å; N648-Y673 WeakPolarHBondContact CB-O 3.08Å; N648-Y673 PolarHBondContact ND2-O 3.3Å; N648-Y673 WeakPolarHBondContact O-CD2 3.08Å; N648-Y673 PolarHBondContact O-N 2.9Å; N648-I842 HydrophobicContact CB-CD1 3.97Å
649	R	77.7	Confident	80.5	Confident	47 Å²	47	69.7 Å²	69.7	18%	0.177	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	138.5	-177.8	-175.3	-174.5	-64.2	-156	-0.8	111	D643 F646 K647 N651 L671 L672	D643-R649 HydrophobicContact CB-CB 3.83Å; D643-R649 HydrophobicContact CB-CG 4.1Å; D643-R649 WeakPolarHBondContact CB-O 3.35Å; D643-R649 PolarHBondContact N-O 3.35Å; D643-R649 WeakPolarHBondContact OD2-CD 3.32Å; F646-R649 HydrophobicContact CB-CB 3.9Å; F646-R649 PolarHBondContact O-N 3.15Å; K647-R649 VanDerWaalsContact C-N 3.35Å; R649-N651 WeakPolarHBondContact CD-OD1 3.39Å; R649-L671 WeakPolarHBondContact CA-O 3.38Å; R649-L672 HydrophobicContact CB-CD1 4.26Å
650	C	86.5	Confident	80.3	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	127.4	168.1	-64.2	0	0	0	0	108.9	C636 Y640 V641 S670 L671 Y673	C636-C650 WeakPolarHBondContact CA-SG 3.07Å; C636-C650 HydrophobicContact CB-CB 3.75Å; C636-C650 WeakPolarHBondContact CB-SG 3.42Å; C636-C650 WeakPolarHBondContact SG-CB 3.26Å; C636-C650 CovalentContact SG-SG 2.04Å; C636-C650 PolarHBondContact SG-SG 2.95Å; Y640-C650 HydrophobicContact CD1-CB 4.3Å; V641-C650 CarbonylContact O-C 3.27Å; V641-C650 WeakPolarHBondContact O-CA 3.38Å; C650-S670 CarbonylContact O-C 3.59Å; C650-S670 VanDerWaalsContact O-CA 3.25Å; C650-S670 WeakPolarHBondContact O-CA 3.05Å; C650-L671 HydrophobicContact CB-CB 4.29Å; C650-L671 PolarHBondContact N-O 2.03Å; C650-L671 PolarHBondContact O-N 3.06Å; C650-Y673 HydrophobicContact CB-CE2 4.35Å
651	N	83.6	Confident	80	Confident	32 Å²	32	75.2 Å²	75.2	17%	0.171	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	142.1	177.2	-63.2	-39.6	0	0	0	110	Y640 V641 D643 R649 S670	Y640-N651 CarbonylContact C-O 3.46Å; Y640-N651 WeakPolarHBondContact CA-O 3.41Å; Y640-N651 VanDerWaalsContact CD1-C 3.45Å; V641-N651 PolarHBondContact N-O 3.39Å; V641-N651 PolarHBondContact O-N 3.29Å; D643-N651 WeakPolarHBondContact CB-ND2 3.36Å; D643-N651 PolarHBondContact OD2-ND2 3.21Å; R649-N651 WeakPolarHBondContact CD-OD1 3.39Å; N651-S670 WeakPolarHBondContact OD1-CB 3.05Å
652	R	86.1	Confident	79.6	Confident	17 Å²	17	78 Å²	78	6%	0.064	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	137.6	173.3	-164.4	176.3	66.8	-164.7	0.7	109.4	N639 Y640 S654 Q655 C657 C664 S667 V669	N639-R652 WeakPolarHBondContact O-CA 3.31Å; Y640-R652 HydrophobicContact CD1-CB 4.13Å; Y640-R652 VanDerWaalsContact CD1-N 3.34Å; Y640-R652 HydrophobicContact CE1-CB 3.84Å; Y640-R652 HydrophobicContact CE1-CG 4.41Å; R652-S654 VanDerWaalsContact C-N 3.28Å; R652-S654 VanDerWaalsContact CZ-O 3.3Å; R652-S654 PolarHBondContact NE-O 3.39Å; R652-S654 PolarHBondContact NH2-O 3.2Å; R652-S654 PolarHBondContact O-N 2.88Å; R652-Q655 PolarHBondContact NH2-O 3.27Å; R652-Q655 PolarHBondContact O-NE2 2.95Å; R652-C657 PolarHBondContact NH1-SG 3.41Å; R652-C657 PolarHBondContact NH2-SG 3.37Å; R652-C664 VanDerWaalsContact CZ-SG 3.57Å; R652-C664 PolarHBondContact NH1-O 3.43Å; R652-S667 PolarHBondContact NH1-O 2.7Å; R652-V669 WeakPolarHBondContact CB-O 3.31Å; R652-V669 PolarHBondContact N-O 3.23Å
653	L	85.2	Confident	79.5	Confident	113 Å²	113	82.1 Å²	82.1	59%	0.592	42%	0.419	S	S	*	.	S	Bend	trans	-56.2	-42.8	179.4	-80.9	174	0	0	0	112.1	N639 V641	N639-L653 PolarHBondContact O-N 3.38Å; V641-L653 HydrophobicContact CB-CD2 4.31Å; V641-L653 HydrophobicContact CG1-CD2 3.29Å; V641-L653 HydrophobicContact CG1-CG 4.02Å; V641-L653 HydrophobicContact CG2-CD2 4.08Å
654	S	80.7	Confident	79.7	Confident	58 Å²	58	82.3 Å²	82.3	41%	0.406	42%	0.421	S	S	.	.			trans	-98.1	115.3	177	-162.6	0	0	0	0	110.9	R652 T656	R652-S654 VanDerWaalsContact C-N 3.28Å; R652-S654 VanDerWaalsContact CZ-O 3.3Å; R652-S654 PolarHBondContact NE-O 3.39Å; R652-S654 PolarHBondContact NH2-O 3.2Å; R652-S654 PolarHBondContact O-N 2.88Å; S654-T656 VanDerWaalsContact C-N 3.27Å; S654-T656 WeakPolarHBondContact CB-O 3.39Å; S654-T656 PolarHBondContact O-N 2.87Å; S654-T656 PolarHBondContact OG-O 3.36Å
655	Q	73.1	Confident	79.5	Confident	117 Å²	117	78.8 Å²	78.8	55%	0.547	40%	0.396	S	S	.	.	S	Bend	trans	-71.5	-25.8	175.8	-66.6	-64	-34.4	0	0	112	R652	R652-Q655 PolarHBondContact NH2-O 3.27Å; R652-Q655 PolarHBondContact O-NE2 2.95Å
656	T	78.4	Confident	79.8	Confident	112 Å²	112	73.6 Å²	73.6	69%	0.687	38%	0.381	S	S	*	.	S	Bend	trans	-111.1	144.8	176.7	52.6	0	0	0	0	110.8	S654	S654-T656 VanDerWaalsContact C-N 3.27Å; S654-T656 WeakPolarHBondContact CB-O 3.39Å; S654-T656 PolarHBondContact O-N 2.87Å; S654-T656 PolarHBondContact OG-O 3.36Å
657	C	78.4	Confident	80.3	Confident	34 Å²	34	70.7 Å²	70.7	23%	0.23	37%	0.371	C	S	.	.			trans	-108.8	146.2	174.1	-62.4	0	0	0	0	110.8	R652 C664 L665	R652-C657 PolarHBondContact NH1-SG 3.41Å; R652-C657 PolarHBondContact NH2-SG 3.37Å; C657-C664 WeakPolarHBondContact CA-SG 3.42Å; C657-C664 HydrophobicContact CB-CB 3.7Å; C657-C664 WeakPolarHBondContact CB-SG 3.43Å; C657-C664 WeakPolarHBondContact SG-CB 3.02Å; C657-C664 PolarHBondContact SG-O 3.22Å; C657-C664 CovalentContact SG-SG 2.05Å; C657-C664 PolarHBondContact SG-SG 3.16Å; C657-L665 HydrophobicContact CB-CD2 3.69Å; C657-L665 HydrophobicContact CB-CG 3.89Å; C657-L665 PolarHBondContact SG-N 2.93Å
658	S	82.2	Confident	80.5	Confident	60 Å²	60	69.5 Å²	69.5	42%	0.42	37%	0.367	S	S	.	.			trans	-65.2	141.7	165.5	174.3	0	0	0	0	109.6	F660 D661	S658-F660 PolarHBondContact O-N 3.01Å; S658-F660 VanDerWaalsContact O-N 3.08Å; S658-F660 PolarHBondContact OG-N 3.34Å; S658-D661 PolarHBondContact O-N 2.96Å
659	P	78.7	Confident	80.4	Confident	103 Å²	103	71.3 Å²	71.3	67%	0.669	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-24.3	174.4	-25.6	34.4	0	0	0	114.2
660	F	83.4	Confident	80.3	Confident	181 Å²	181	70.5 Å²	70.5	79%	0.794	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-10.6	179	-55.7	-72.9	0	0	0	113.6	S658 H662	S658-F660 PolarHBondContact O-N 3.01Å; S658-F660 VanDerWaalsContact O-N 3.08Å; S658-F660 PolarHBondContact OG-N 3.34Å; F660-H662 PolarHBondContact O-N 3.19Å; F660-H662 VanDerWaalsContact O-N 3.14Å
661	D	83.3	Confident	79.9	Confident	70 Å²	70	71 Å²	71	37%	0.374	38%	0.383	S	S	.	.			trans	-88.8	78.3	178.3	-172.6	-10.9	0	0	0	109.6	S658 Q663 C664 L665	S658-D661 PolarHBondContact O-N 2.96Å; D661-Q663 PolarHBondContact O-N 3.14Å; D661-Q663 PolarHBondContact OD1-N 3.08Å; D661-C664 HydrophobicContact CB-CB 4Å; D661-C664 PolarHBondContact O-N 2.03Å; D661-C664 PolarHBondContact OD1-N 3.33Å; D661-C664 WeakPolarHBondContact OD2-CB 3.25Å; D661-L665 WeakPolarHBondContact O-CG 3.43Å; D661-L665 PolarHBondContact O-N 2.91Å
662	H	81.9	Confident	79.6	Confident	128 Å²	128	70.1 Å²	70.1	59%	0.593	38%	0.378	S	S	*	.	H	α-helix	trans	-55.1	-36	177	-72.2	-77.5	0	0	0	111.7	F660 L665 H666	F660-H662 PolarHBondContact O-N 3.19Å; F660-H662 VanDerWaalsContact O-N 3.14Å; H662-L665 PolarHBondContact O-N 2.04Å; H662-H666 WeakPolarHBondContact O-CB 3.48Å; H662-H666 PolarHBondContact O-CD2 3.07Å; H662-H666 PolarHBondContact O-N 3.47Å
663	Q	83.8	Confident	79.3	Confident	147 Å²	147	70.1 Å²	70.1	69%	0.687	38%	0.378	S	S	*	.	H	α-helix	trans	-66.6	-43.2	-179.5	-170.6	175.8	12.3	0	0	111.5	D661 S667	D661-Q663 PolarHBondContact O-N 3.14Å; D661-Q663 PolarHBondContact OD1-N 3.08Å; Q663-S667 VanDerWaalsContact O-CB 3.31Å; Q663-S667 WeakPolarHBondContact O-CB 3.28Å; Q663-S667 PolarHBondContact O-N 3.47Å; Q663-S667 PolarHBondContact O-OG 2.82Å
664	C	82.5	Confident	78.9	Confident	15 Å²	15	65 Å²	65	10%	0.101	35%	0.351	C	S	.	.	H	α-helix	trans	-65.3	-47.1	173.5	-177	0	0	0	0	111.3	R652 C657 D661 H666 S667	R652-C664 VanDerWaalsContact CZ-SG 3.57Å; R652-C664 PolarHBondContact NH1-O 3.43Å; C657-C664 WeakPolarHBondContact CA-SG 3.42Å; C657-C664 HydrophobicContact CB-CB 3.7Å; C657-C664 WeakPolarHBondContact CB-SG 3.43Å; C657-C664 WeakPolarHBondContact SG-CB 3.02Å; C657-C664 PolarHBondContact SG-O 3.22Å; C657-C664 CovalentContact SG-SG 2.05Å; C657-C664 PolarHBondContact SG-SG 3.16Å; D661-C664 HydrophobicContact CB-CB 4Å; D661-C664 PolarHBondContact O-N 2.03Å; D661-C664 PolarHBondContact OD1-N 3.33Å; D661-C664 WeakPolarHBondContact OD2-CB 3.25Å; C664-H666 PolarHBondContact O-N 2.77Å; C664-S667 WeakPolarHBondContact O-CB 3.03Å; C664-S667 PolarHBondContact O-N 3.48Å
665	L	75.3	Confident	78.8	Confident	73 Å²	73	62.6 Å²	62.6	38%	0.382	33%	0.333	S	S	.	.	H	α-helix	trans	-59.4	-36.7	-178.6	-73.6	168.5	0	0	0	112.4	C657 D661 H662	C657-L665 HydrophobicContact CB-CD2 3.69Å; C657-L665 HydrophobicContact CB-CG 3.89Å; C657-L665 PolarHBondContact SG-N 2.93Å; D661-L665 WeakPolarHBondContact O-CG 3.43Å; D661-L665 PolarHBondContact O-N 2.91Å; H662-L665 PolarHBondContact O-N 2.04Å
666	H	77.2	Confident	79	Confident	89 Å²	89	57.1 Å²	57.1	41%	0.412	31%	0.308	S	S	.	.	H	α-helix	trans	-83.4	-12.2	173	-69	-66.9	0	0	0	113	H662 C664 F770 R773	H662-H666 WeakPolarHBondContact O-CB 3.48Å; H662-H666 PolarHBondContact O-CD2 3.07Å; H662-H666 PolarHBondContact O-N 3.47Å; C664-H666 PolarHBondContact O-N 2.77Å; H666-F770 AromaticContact ND1-CE1 3.72Å; H666-R773 WeakPolarHBondContact O-CD 3.34Å; H666-R773 WeakPolarHBondContact O-CG 3.11Å; H666-R773 PolarHBondContact O-NE 2.85Å; H666-R773 PolarHBondContact O-NH2 3.43Å
667	S	79.5	Confident	78.9	Confident	27 Å²	27	52.2 Å²	52.2	19%	0.189	28%	0.278	C	S	.	.	S	Bend	trans	-82.4	135.7	179.3	-70.3	0	0	0	0	111.8	R652 Q663 C664	R652-S667 PolarHBondContact NH1-O 2.7Å; Q663-S667 VanDerWaalsContact O-CB 3.31Å; Q663-S667 WeakPolarHBondContact O-CB 3.28Å; Q663-S667 PolarHBondContact O-N 3.47Å; Q663-S667 PolarHBondContact O-OG 2.82Å; C664-S667 WeakPolarHBondContact O-CB 3.03Å; C664-S667 PolarHBondContact O-N 3.48Å
668	P	77.5	Confident	78.9	Confident	6 Å²	6	50.9 Å²	50.9	4%	0.039	27%	0.269	C	S	.	.			trans	-61.7	147.8	178.8	25.3	-33.4	0	0	0	112.1	Y640 S670 L671 R773	Y640-P668 WeakPolarHBondContact CE1-O 3.03Å; Y640-P668 WeakPolarHBondContact OH-CD 3.27Å; Y640-P668 WeakPolarHBondContact OH-CG 3.28Å; Y640-P668 PolarHBondContact OH-O 3.49Å; P668-S670 VanDerWaalsContact C-N 3.27Å; P668-S670 PolarHBondContact O-N 2.72Å; P668-L671 HydrophobicContact CB-CD2 4.38Å; P668-L671 HydrophobicContact CG-CD2 3.43Å; P668-L671 VanDerWaalsContact CG-CD2 3.43Å; P668-L671 HydrophobicContact CG-CG 4.21Å; P668-R773 WeakPolarHBondContact CA-O 3.21Å
669	V	74.3	Confident	78.7	Confident	68 Å²	68	48.6 Å²	48.6	41%	0.412	25%	0.252	S	S	.	.	S	Bend	trans	-66.3	-34.8	177.5	177.8	0	0	0	0	111	R652	R652-V669 WeakPolarHBondContact CB-O 3.31Å; R652-V669 PolarHBondContact N-O 3.23Å
670	S	75.7	Confident	78.9	Confident	31 Å²	31	44 Å²	44	22%	0.217	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	145.3	175.3	63.3	0	0	0	0	111.2	C650 N651 P668	C650-S670 CarbonylContact O-C 3.59Å; C650-S670 VanDerWaalsContact O-CA 3.25Å; C650-S670 WeakPolarHBondContact O-CA 3.05Å; N651-S670 WeakPolarHBondContact OD1-CB 3.05Å; P668-S670 VanDerWaalsContact C-N 3.27Å; P668-S670 PolarHBondContact O-N 2.72Å
671	L	78.1	Confident	78.9	Confident	11 Å²	11	37.8 Å²	37.8	6%	0.058	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.8	168.9	-61.9	169.8	0	0	0	108.5	P637 Y640 R649 C650 P668 Y673 T775	P637-L671 HydrophobicContact CG-CD1 3.35Å; Y640-L671 HydrophobicContact CD1-CD1 3.94Å; Y640-L671 HydrophobicContact CD1-CG 4.1Å; Y640-L671 HydrophobicContact CD2-CD1 4.4Å; Y640-L671 HydrophobicContact CE1-CD1 3.87Å; Y640-L671 HydrophobicContact CE1-CG 3.74Å; Y640-L671 HydrophobicContact CE2-CD1 4.34Å; Y640-L671 HydrophobicContact CG-CD1 4.23Å; R649-L671 WeakPolarHBondContact CA-O 3.38Å; C650-L671 HydrophobicContact CB-CB 4.29Å; C650-L671 PolarHBondContact N-O 2.03Å; C650-L671 PolarHBondContact O-N 3.06Å; P668-L671 HydrophobicContact CB-CD2 4.38Å; P668-L671 HydrophobicContact CG-CD2 3.43Å; P668-L671 VanDerWaalsContact CG-CD2 3.43Å; P668-L671 HydrophobicContact CG-CG 4.21Å; L671-Y673 HydrophobicContact CB-CE2 4.1Å; L671-T775 HydrophobicContact CD2-CG2 4.46Å
672	L	76.1	Confident	78.2	Confident	12 Å²	12	35 Å²	35	6%	0.063	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.9	173.5	-171.4	73.3	0	0	0	110	R649 N674 K777 Y822	R649-L672 HydrophobicContact CB-CD1 4.26Å; L672-N674 WeakPolarHBondContact CD2-OD1 3.27Å; L672-K777 PolarHBondContact O-N 3.24Å; L672-Y822 HydrophobicContact CB-CE2 4.44Å; L672-Y822 HydrophobicContact CD2-CD1 4.34Å; L672-Y822 HydrophobicContact CD2-CD2 3.29Å; L672-Y822 HydrophobicContact CD2-CE1 4.15Å; L672-Y822 HydrophobicContact CD2-CE2 3.11Å; L672-Y822 HydrophobicContact CD2-CG 3.94Å; L672-Y822 HydrophobicContact CG-CE2 4.34Å
673	Y	79.1	Confident	77.7	Confident	18 Å²	18	31.4 Å²	31.4	7%	0.071	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.3	175.4	-64.4	-110.3	0	0	0	108.5	I634 N648 C650 L671 K777 F779	I634-Y673 HydrophobicContact CD1-CD1 4.15Å; I634-Y673 HydrophobicContact CD1-CD2 4.08Å; I634-Y673 HydrophobicContact CD1-CG 3.69Å; I634-Y673 HydrophobicContact CG1-CD1 4.03Å; I634-Y673 HydrophobicContact CG1-CE1 4.5Å; I634-Y673 HydrophobicContact CG1-CG 4.07Å; I634-Y673 HydrophobicContact CG2-CD1 4.23Å; I634-Y673 HydrophobicContact CG2-CD2 3.91Å; I634-Y673 HydrophobicContact CG2-CE1 4.01Å; I634-Y673 HydrophobicContact CG2-CE2 3.69Å; I634-Y673 HydrophobicContact CG2-CG 4.2Å; N648-Y673 WeakPolarHBondContact CB-O 3.08Å; N648-Y673 PolarHBondContact ND2-O 3.3Å; N648-Y673 WeakPolarHBondContact O-CD2 3.08Å; N648-Y673 PolarHBondContact O-N 2.9Å; C650-Y673 HydrophobicContact CB-CE2 4.35Å; L671-Y673 HydrophobicContact CB-CE2 4.1Å; Y673-K777 HydrophobicContact CD1-CB 4.35Å; Y673-K777 HydrophobicContact CD1-CD 4.41Å; Y673-K777 HydrophobicContact CE1-CD 3.88Å; Y673-F779 HydrophobicContact CD1-CD2 4.49Å; Y673-F779 AromaticContact CD1-CE2 3.6Å; Y673-F779 HydrophobicContact CD1-CE2 3.6Å; Y673-F779 HydrophobicContact CD1-CZ 4.2Å; Y673-F779 HydrophobicContact CE1-CE2 4.2Å; Y673-F779 HydrophobicContact CE1-CZ 4.45Å
674	N	78.6	Confident	77	Confident	4 Å²	4	25.3 Å²	25.3	2%	0.021	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.5	177.9	-57.2	-85.3	0	0	0	107.9	L672 I695 K777 I778 F779	L672-N674 WeakPolarHBondContact CD2-OD1 3.27Å; N674-I695 HydrophobicContact CB-CD1 3.78Å; N674-K777 PolarHBondContact N-O 2.04Å; N674-K777 PolarHBondContact ND2-O 2.88Å; N674-I778 HydrophobicContact CB-CG1 4.48Å; N674-I778 CarbonylContact O-C 3.55Å; N674-I778 WeakPolarHBondContact O-CA 3.47Å; N674-F779 PolarHBondContact O-N 2.81Å
675	F	77.3	Confident	76.3	Confident	8 Å²	8	32.1 Å²	32.1	4%	0.035	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	130.5	176.9	-53.5	-86.4	0	0	0	108.4	I621 I623 E632 I634 F779 F781	I621-F675 HydrophobicContact CD1-CE2 3.88Å; I621-F675 HydrophobicContact CD1-CZ 4.48Å; I621-F675 HydrophobicContact CG2-CD2 4.41Å; I621-F675 HydrophobicContact CG2-CE2 4.33Å; I623-F675 HydrophobicContact CD1-CB 4.34Å; I623-F675 HydrophobicContact CD1-CD1 3.98Å; I623-F675 HydrophobicContact CD1-CD2 4.47Å; I623-F675 HydrophobicContact CD1-CE1 4.43Å; I623-F675 HydrophobicContact CD1-CG 4.01Å; I623-F675 HydrophobicContact CG1-CB 3.7Å; I623-F675 HydrophobicContact CG1-CD1 4.29Å; I623-F675 HydrophobicContact CG1-CD2 4.41Å; I623-F675 HydrophobicContact CG1-CG 3.9Å; I623-F675 HydrophobicContact CG2-CB 4.37Å; E632-F675 HydrophobicContact CB-CD1 4.48Å; E632-F675 HydrophobicContact CB-CE1 3.74Å; E632-F675 HydrophobicContact CB-CZ 3.99Å; E632-F675 HydrophobicContact CG-CD1 4.18Å; E632-F675 HydrophobicContact CG-CE1 3.75Å; I634-F675 HydrophobicContact CD1-CE2 4.01Å; I634-F675 HydrophobicContact CD1-CZ 3.94Å; I634-F675 HydrophobicContact CG1-CZ 4.03Å; F675-F779 CarbonylContact C-O 3.43Å; F675-F779 WeakPolarHBondContact CA-O 3.43Å; F675-F779 HydrophobicContact CD1-CB 3.59Å; F675-F779 HydrophobicContact CD1-CD2 4.2Å; F675-F779 AromaticContact CD1-CG 3.92Å; F675-F779 HydrophobicContact CD1-CG 3.92Å; F675-F779 HydrophobicContact CE1-CB 4.08Å; F675-F779 HydrophobicContact CE1-CD1 4.41Å; F675-F779 AromaticContact CE1-CD2 3.93Å; F675-F779 HydrophobicContact CE1-CD2 3.93Å; F675-F779 AromaticContact CE1-CG 3.88Å; F675-F779 HydrophobicContact CE1-CG 3.88Å; F675-F779 HydrophobicContact CG-CB 4.47Å; F675-F781 HydrophobicContact CB-CE2 4.31Å; F675-F781 AromaticContact CD1-CE2 3.75Å; F675-F781 HydrophobicContact CD1-CE2 3.75Å; F675-F781 AromaticContact CD1-CZ 3.95Å; F675-F781 HydrophobicContact CD1-CZ 3.95Å; F675-F781 HydrophobicContact CG-CE2 4.47Å
676	I	78.2	Confident	75.4	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.01	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	126.4	179.2	-59.1	176.6	0	0	0	106.8	L678 L694 I695 I778 F779 L780 F781 L837	I676-L678 HydrophobicContact CG2-CD2 4.29Å; I676-L678 HydrophobicContact CG2-CG 4.24Å; I676-L694 HydrophobicContact CD1-CB 4.01Å; I676-I695 HydrophobicContact CD1-CD1 3.97Å; I676-I695 HydrophobicContact CD1-CG1 3.8Å; I676-I778 HydrophobicContact CD1-CG2 4.02Å; I676-F779 PolarHBondContact N-O 2.81Å; I676-L780 HydrophobicContact CB-CD1 3.66Å; I676-L780 HydrophobicContact CG2-CD1 3.48Å; I676-L780 VanDerWaalsContact CG2-CD1 3.48Å; I676-L780 CarbonylContact O-C 3.59Å; I676-L780 WeakPolarHBondContact O-CA 3.27Å; I676-F781 PolarHBondContact O-N 2.88Å; I676-L837 HydrophobicContact CG2-CD2 3.78Å
677	S	75.8	Confident	74.4	Confident	10 Å²	10	29 Å²	29	7%	0.07	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	139.9	168.7	56.5	0	0	0	0	110.3	N624 F781	N624-S677 VanDerWaalsContact O-CB 3.28Å; N624-S677 WeakPolarHBondContact O-CB 3.34Å; N624-S677 PolarHBondContact O-OG 3.12Å; S677-F781 CarbonylContact C-O 3.48Å; S677-F781 VanDerWaalsContact CA-O 3.3Å; S677-F781 WeakPolarHBondContact CA-O 3.23Å
678	L	77.7	Confident	73.6	Confident	6 Å²	6	31.1 Å²	31.1	3%	0.031	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	146.7	175.3	-65.8	-179	0	0	0	110.4	I676 V682 L692 L694 L746 L780 F781 V782 S783 L837	I676-L678 HydrophobicContact CG2-CD2 4.29Å; I676-L678 HydrophobicContact CG2-CG 4.24Å; L678-V682 HydrophobicContact CB-CG2 4.3Å; L678-L692 HydrophobicContact CD1-CD2 4.14Å; L678-L692 HydrophobicContact CD2-CD2 3.91Å; L678-L694 HydrophobicContact CD1-CD2 4.31Å; L678-L746 HydrophobicContact CD1-CD2 3.96Å; L678-L780 HydrophobicContact CD1-CD1 3.65Å; L678-L780 HydrophobicContact CD1-CD2 4.35Å; L678-L780 HydrophobicContact CD1-CG 4.4Å; L678-L780 HydrophobicContact CG-CD1 3.8Å; L678-F781 PolarHBondContact N-O 2.88Å; L678-V782 CarbonylContact O-C 3.34Å; L678-V782 WeakPolarHBondContact O-CA 3.39Å; L678-S783 PolarHBondContact O-N 3.33Å; L678-L837 HydrophobicContact CD2-CD1 3.93Å; L678-L837 HydrophobicContact CD2-CG 4.26Å
679	P	78.2	Confident	73	Confident	11 Å²	11	33.1 Å²	33.1	7%	0.071	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	160.9	165.9	14.6	-11.5	0	0	0	111.7	Y626 V682 E787	Y626-P679 HydrophobicContact CD1-CB 4.29Å; P679-V682 HydrophobicContact CB-CG2 4.49Å; P679-V682 HydrophobicContact CG-CG2 3.86Å; P679-V682 VanDerWaalsContact O-CG2 3.24Å; P679-V682 WeakPolarHBondContact O-CG2 3.26Å; P679-E787 HydrophobicContact CB-CB 4.33Å; P679-E787 HydrophobicContact CG-CB 4.24Å
680	S	83.9	Confident	73.1	Confident	7 Å²	7	35.5 Å²	35.5	5%	0.049	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	136.6	171.4	-167.3	0	0	0	0	110.3	V682 G752 S783 F785 K786	S680-V682 PolarHBondContact O-N 2.06Å; S680-G752 PolarHBondContact OG-N 3.15Å; S680-S783 VanDerWaalsContact CB-O 3.3Å; S680-S783 WeakPolarHBondContact CB-O 3.47Å; S680-F785 WeakPolarHBondContact CB-O 3.41Å; S680-F785 PolarHBondContact N-O 3.09Å; S680-K786 WeakPolarHBondContact O-CA 3.37Å
681	N	82.1	Confident	73.2	Confident	50 Å²	50	34.8 Å²	34.8	27%	0.267	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	43.9	173.5	-67.4	-27.4	0	0	0	115.9	N683 S749 L750 Q751 K786	N681-N683 PolarHBondContact O-N 3.49Å; N681-N683 VanDerWaalsContact O-N 3.11Å; N681-S749 WeakPolarHBondContact CA-OG 3.12Å; N681-L750 PolarHBondContact N-O 2.83Å; N681-Q751 WeakPolarHBondContact OD1-CG 3.35Å; N681-K786 HydrophobicContact CB-CD 4.38Å; N681-K786 HydrophobicContact CB-CG 4.45Å; N681-K786 VanDerWaalsContact ND2-CE 3.32Å; N681-K786 WeakPolarHBondContact ND2-CE 3.33Å
682	V	70	Confident	73	Confident	11 Å²	11	34.5 Å²	34.5	7%	0.067	21%	0.206	C	C	.	.			trans	-54.7	116.9	175.9	-171.1	0	0	0	0	110.6	L678 P679 S680 F684 F687 S749	L678-V682 HydrophobicContact CB-CG2 4.3Å; P679-V682 HydrophobicContact CB-CG2 4.49Å; P679-V682 HydrophobicContact CG-CG2 3.86Å; P679-V682 VanDerWaalsContact O-CG2 3.24Å; P679-V682 WeakPolarHBondContact O-CG2 3.26Å; S680-V682 PolarHBondContact O-N 2.06Å; V682-F684 HydrophobicContact CB-CE1 4.33Å; V682-F684 HydrophobicContact CG1-CD1 4.39Å; V682-F684 WeakPolarHBondContact O-CD1 3.46Å; V682-F684 WeakPolarHBondContact O-CE1 3.12Å; V682-F684 PolarHBondContact O-N 2.64Å; V682-F687 HydrophobicContact CG1-CE2 3.81Å; V682-S749 PolarHBondContact N-OG 2.73Å; V682-S749 WeakPolarHBondContact O-CB 3.39Å; V682-S749 PolarHBondContact O-OG 3.13Å
683	N	70.1	Confident	73	Confident	54 Å²	54	35.7 Å²	35.7	29%	0.289	22%	0.215	S	C	.	.			trans	-85.2	108.8	177.7	-179.1	10.4	0	0	0	110.3	N681 Q685 D686 F687	N681-N683 PolarHBondContact O-N 3.49Å; N681-N683 VanDerWaalsContact O-N 3.11Å; N683-Q685 PolarHBondContact O-N 2.91Å; N683-Q685 WeakPolarHBondContact OD1-CB 3.05Å; N683-Q685 PolarHBondContact OD1-N 3.11Å; N683-Q685 VanDerWaalsContact OD1-N 3.13Å; N683-D686 VanDerWaalsContact CB-OD2 3.3Å; N683-D686 WeakPolarHBondContact CB-OD2 3.25Å; N683-D686 PolarHBondContact ND2-OD1 3.38Å; N683-D686 PolarHBondContact ND2-OD2 3Å; N683-D686 PolarHBondContact O-N 3.2Å; N683-F687 VanDerWaalsContact O-CD2 3.27Å; N683-F687 WeakPolarHBondContact O-CD2 3.48Å; N683-F687 WeakPolarHBondContact O-CE2 3.05Å
684	F	70.6	Confident	72.7	Confident	18 Å²	18	35.5 Å²	35.5	8%	0.079	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-64	-25.7	-178.3	-48	-30.7	0	0	0	112.9	V682 D686 F687 G688 L689 L692 L746 E748	V682-F684 HydrophobicContact CB-CE1 4.33Å; V682-F684 HydrophobicContact CG1-CD1 4.39Å; V682-F684 WeakPolarHBondContact O-CD1 3.46Å; V682-F684 WeakPolarHBondContact O-CE1 3.12Å; V682-F684 PolarHBondContact O-N 2.64Å; F684-D686 VanDerWaalsContact C-N 3.3Å; F684-D686 PolarHBondContact O-N 3.11Å; F684-F687 PolarHBondContact O-N 3.23Å; F684-F687 VanDerWaalsContact O-N 3.16Å; F684-G688 PolarHBondContact O-N 3.32Å; F684-L689 CarbonylContact C-O 3.45Å; F684-L689 HydrophobicContact CB-CB 4.39Å; F684-L689 WeakPolarHBondContact CB-O 3.49Å; F684-L689 PolarHBondContact O-N 2.95Å; F684-L692 HydrophobicContact CD1-CB 3.84Å; F684-L692 HydrophobicContact CE1-CB 3.71Å; F684-L692 HydrophobicContact CE1-CD2 4.39Å; F684-L692 HydrophobicContact CZ-CB 4.31Å; F684-L746 HydrophobicContact CE1-CD2 4.02Å; F684-L746 HydrophobicContact CZ-CD2 3.79Å; F684-L746 HydrophobicContact CZ-CG 3.91Å; F684-E748 VanDerWaalsContact CZ-C 3.42Å
685	Q	68.4	Low	72.2	Confident	159 Å²	159	35.4 Å²	35.4	74%	0.743	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-69.1	-29.7	-179.2	-61.2	-175.8	-2.3	0	0	112.4	N683 F687 G688	N683-Q685 PolarHBondContact O-N 2.91Å; N683-Q685 WeakPolarHBondContact OD1-CB 3.05Å; N683-Q685 PolarHBondContact OD1-N 3.11Å; N683-Q685 VanDerWaalsContact OD1-N 3.13Å; Q685-F687 PolarHBondContact O-N 3.03Å; Q685-F687 VanDerWaalsContact O-N 3.12Å; Q685-G688 PolarHBondContact O-N 3.01Å
686	D	54.8	Low	71.9	Confident	72 Å²	72	35.3 Å²	35.3	39%	0.385	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-63.2	-20.1	176.2	-62.4	-14.9	0	0	0	111.1	N683 F684	N683-D686 VanDerWaalsContact CB-OD2 3.3Å; N683-D686 WeakPolarHBondContact CB-OD2 3.25Å; N683-D686 PolarHBondContact ND2-OD1 3.38Å; N683-D686 PolarHBondContact ND2-OD2 3Å; N683-D686 PolarHBondContact O-N 3.2Å; F684-D686 VanDerWaalsContact C-N 3.3Å; F684-D686 PolarHBondContact O-N 3.11Å
687	F	57	Low	71.4	Confident	24 Å²	24	35.3 Å²	35.3	11%	0.105	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-104.3	3.3	175.3	-50.1	-77	0	0	0	113.5	V682 N683 F684 Q685 L689 V830 L832 I833	V682-F687 HydrophobicContact CG1-CE2 3.81Å; N683-F687 VanDerWaalsContact O-CD2 3.27Å; N683-F687 WeakPolarHBondContact O-CD2 3.48Å; N683-F687 WeakPolarHBondContact O-CE2 3.05Å; F684-F687 PolarHBondContact O-N 3.23Å; F684-F687 VanDerWaalsContact O-N 3.16Å; Q685-F687 PolarHBondContact O-N 3.03Å; Q685-F687 VanDerWaalsContact O-N 3.12Å; F687-L689 VanDerWaalsContact C-N 3.26Å; F687-L689 HydrophobicContact CB-CD1 4.03Å; F687-L689 HydrophobicContact CB-CG 4.09Å; F687-L689 PolarHBondContact O-N 2.9Å; F687-V830 HydrophobicContact CB-CG2 4.31Å; F687-V830 HydrophobicContact CD1-CB 3.81Å; F687-V830 HydrophobicContact CD1-CG1 3.75Å; F687-V830 HydrophobicContact CD1-CG2 3.88Å; F687-V830 HydrophobicContact CE1-CB 4.37Å; F687-V830 HydrophobicContact CE1-CG1 4.2Å; F687-L832 HydrophobicContact CE1-CB 4Å; F687-I833 HydrophobicContact CE1-CD1 3.77Å; F687-I833 HydrophobicContact CE1-CG1 3.47Å; F687-I833 VanDerWaalsContact CE1-CG1 3.47Å; F687-I833 HydrophobicContact CZ-CD1 3.86Å; F687-I833 HydrophobicContact CZ-CG1 3.71Å
688	G	61.7	Low	71	Confident	72 Å²	72	38.8 Å²	38.8	74%	0.742	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.4	24.4	-174.6	0	0	0	0	0	114.2	F684 Q685	F684-G688 PolarHBondContact O-N 3.32Å; Q685-G688 PolarHBondContact O-N 3.01Å
689	L	66.5	Low	70.5	Confident	47 Å²	47	39 Å²	39	25%	0.246	23%	0.232	C	C	.	.			trans	-109.4	144	-176.6	-62.6	176	0	0	0	111.6	F684 F687 L827	F684-L689 CarbonylContact C-O 3.45Å; F684-L689 HydrophobicContact CB-CB 4.39Å; F684-L689 WeakPolarHBondContact CB-O 3.49Å; F684-L689 PolarHBondContact O-N 2.95Å; F687-L689 VanDerWaalsContact C-N 3.26Å; F687-L689 HydrophobicContact CB-CD1 4.03Å; F687-L689 HydrophobicContact CB-CG 4.09Å; F687-L689 PolarHBondContact O-N 2.9Å; L689-L827 HydrophobicContact CD1-CD2 3.52Å
690	S	75.9	Confident	70.1	Confident	118 Å²	118	40.6 Å²	40.6	83%	0.825	24%	0.242	S	C	*	.	S	Bend	trans	-86.1	-18.1	170.3	61.6	0	0	0	0	113
691	A	76.5	Confident	69.5	Low	17 Å²	17	44.4 Å²	44.4	14%	0.14	27%	0.265	C	S	.	.	S	Bend	trans	-155	147.5	177.7	0	0	0	0	0	108.6	P693 N745 L746 V747	A691-P693 WeakPolarHBondContact O-CD 3.47Å; A691-N745 HydrophobicContact CB-CB 4.07Å; A691-L746 CarbonylContact C-O 3.29Å; A691-L746 WeakPolarHBondContact CA-O 3.39Å; A691-L746 WeakPolarHBondContact CB-O 3.43Å; A691-V747 HydrophobicContact CB-CG1 4.12Å
692	L	75.5	Confident	69.2	Low	4 Å²	4	47 Å²	47	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	113.6	-179.8	-178.4	72.1	0	0	0	110.1	L678 F684 L694 N745 L746 L827	L678-L692 HydrophobicContact CD1-CD2 4.14Å; L678-L692 HydrophobicContact CD2-CD2 3.91Å; F684-L692 HydrophobicContact CD1-CB 3.84Å; F684-L692 HydrophobicContact CE1-CB 3.71Å; F684-L692 HydrophobicContact CE1-CD2 4.39Å; F684-L692 HydrophobicContact CZ-CB 4.31Å; L692-L694 HydrophobicContact CD2-CD2 4.11Å; L692-L694 HydrophobicContact CG-CD2 4.34Å; L692-L694 PolarHBondContact O-N 3.48Å; L692-N745 CarbonylContact O-C 3.56Å; L692-N745 WeakPolarHBondContact O-CA 3.42Å; L692-L746 HydrophobicContact CB-CB 4.23Å; L692-L746 HydrophobicContact CD2-CD2 4.34Å; L692-L746 PolarHBondContact N-O 3.32Å; L692-L746 PolarHBondContact O-N 2.91Å; L692-L827 HydrophobicContact CD1-CD1 4.14Å; L692-L827 HydrophobicContact CD1-CD2 3.83Å
693	P	75.2	Confident	69	Low	38 Å²	38	54.9 Å²	54.9	25%	0.247	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	118.3	176.3	28.9	-33.5	0	0	0	110.2	A691 V743 N745 L827	A691-P693 WeakPolarHBondContact O-CD 3.47Å; P693-V743 HydrophobicContact CB-CG1 3.72Å; P693-N745 WeakPolarHBondContact CA-OD1 3.31Å; P693-L827 HydrophobicContact CG-CD2 4.1Å
694	L	73.2	Confident	69.4	Low	13 Å²	13	57 Å²	57	7%	0.068	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-54.4	-177.9	-61.3	-177.1	0	0	0	112.2	I676 L678 L692 F731 L744 L746	I676-L694 HydrophobicContact CD1-CB 4.01Å; L678-L694 HydrophobicContact CD1-CD2 4.31Å; L692-L694 HydrophobicContact CD2-CD2 4.11Å; L692-L694 HydrophobicContact CG-CD2 4.34Å; L692-L694 PolarHBondContact O-N 3.48Å; L694-F731 HydrophobicContact CD1-CD1 4.09Å; L694-F731 HydrophobicContact CD1-CE1 3.99Å; L694-L744 HydrophobicContact CB-CD2 4.46Å; L694-L744 HydrophobicContact CB-CG 4.45Å; L694-L744 WeakPolarHBondContact CB-O 3.42Å; L694-L744 HydrophobicContact CD1-CD2 4.23Å; L694-L744 HydrophobicContact CD1-CG 4.37Å; L694-L744 PolarHBondContact N-O 2.62Å; L694-L746 HydrophobicContact CD1-CB 4.09Å; L694-L746 HydrophobicContact CD2-CB 4.15Å; L694-L746 HydrophobicContact CG-CB 4.08Å
695	I	68.5	Low	69.6	Low	3 Å²	3	57.6 Å²	57.6	2%	0.015	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	134.8	-176.5	-59.9	-174.6	0	0	0	109.8	N674 I676 L697 V743 L744 I778 Y822	N674-I695 HydrophobicContact CB-CD1 3.78Å; I676-I695 HydrophobicContact CD1-CD1 3.97Å; I676-I695 HydrophobicContact CD1-CG1 3.8Å; I695-L697 HydrophobicContact CG2-CD2 4.34Å; I695-V743 WeakPolarHBondContact O-CA 3.28Å; I695-L744 PolarHBondContact N-O 3Å; I695-L744 PolarHBondContact O-N 3.4Å; I695-I778 HydrophobicContact CD1-CD1 3.79Å; I695-I778 HydrophobicContact CD1-CG1 3.82Å; I695-I778 HydrophobicContact CD1-CG2 4.12Å; I695-Y822 HydrophobicContact CG2-CD1 4.05Å
696	T	71.2	Confident	70.2	Confident	5 Å²	5	52.9 Å²	52.9	3%	0.031	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	126.9	169.1	-58.4	0	0	0	0	110.6	M736 V743 I825	T696-M736 HydrophobicContact CG2-SD 3.67Å; T696-V743 HydrophobicContact CG2-CG2 4.17Å; T696-I825 HydrophobicContact CG2-CD1 4.33Å; T696-I825 WeakPolarHBondContact OG1-CD1 3.04Å
697	L	66.5	Low	71.3	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	138.9	173.9	-61.3	-179.5	0	0	0	110.9	I695 Y709 S741 A742 L760 M762 Y822	I695-L697 HydrophobicContact CG2-CD2 4.34Å; L697-Y709 HydrophobicContact CB-CE1 4.39Å; L697-Y709 HydrophobicContact CD1-CD1 3.84Å; L697-Y709 HydrophobicContact CD1-CE1 3.94Å; L697-S741 CarbonylContact O-C 3.56Å; L697-S741 VanDerWaalsContact O-CA 3.27Å; L697-S741 WeakPolarHBondContact O-CA 3.19Å; L697-A742 PolarHBondContact N-O 2.89Å; L697-A742 PolarHBondContact O-N 2.04Å; L697-L760 HydrophobicContact CD1-CD1 4.3Å; L697-L760 HydrophobicContact CD1-CD2 3.26Å; L697-L760 HydrophobicContact CD1-CG 3.64Å; L697-L760 HydrophobicContact CD2-CD2 4.15Å; L697-L760 HydrophobicContact CG-CD2 3.85Å; L697-M762 HydrophobicContact CB-SD 4.23Å; L697-M762 HydrophobicContact CD1-CG 4.08Å; L697-M762 HydrophobicContact CD1-SD 3.93Å; L697-Y822 HydrophobicContact CD2-CD1 3.77Å; L697-Y822 HydrophobicContact CD2-CE1 3.33Å
698	K	68.6	Low	72.7	Confident	84 Å²	84	54.7 Å²	54.7	37%	0.365	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	119.5	169.1	-67.1	-176.2	172.5	-179.7	0	109.2
699	G	66	Low	73.9	Confident	10 Å²	10	53.3 Å²	53.3	10%	0.103	30%	0.301	C	S	.	.			trans	-87.9	-179.7	173.3	0	0	0	0	0	112.4	N740	G699-N740 WeakPolarHBondContact CA-O 3.33Å; G699-N740 PolarHBondContact N-O 3.02Å
700	P	69	Low	75	Confident	45 Å²	45	54.5 Å²	54.5	29%	0.292	31%	0.305	S	S	.	.			trans	-55.7	147.6	173.1	-21.9	32.4	0	0	0	111.7	N740 F764	P700-N740 WeakPolarHBondContact O-CB 3.37Å; P700-N740 PolarHBondContact O-ND2 3.24Å; P700-F764 HydrophobicContact CG-CD1 4Å; P700-F764 HydrophobicContact CG-CE1 4.07Å
701	T	72.5	Confident	75.7	Confident	86 Å²	86	49.4 Å²	49.4	53%	0.528	27%	0.269	S	S	.	.			trans	-109.7	9.7	-177.1	59	0	0	0	0	113.4	P739	T701-P739 HydrophobicContact CG2-CG 3.95Å
702	D	74.7	Confident	76.6	Confident	104 Å²	104	52.1 Å²	52.1	56%	0.556	28%	0.279	S	S	*	.			trans	-66.1	145.2	-178.4	-59.4	-40.7	0	0	0	111.7	D704 T705	D702-D704 PolarHBondContact O-N 3.41Å; D702-T705 HydrophobicContact CB-CG2 3.83Å; D702-T705 PolarHBondContact N-OG1 3.17Å; D702-T705 PolarHBondContact O-N 3.31Å; D702-T705 PolarHBondContact O-OG1 3.18Å
703	L	66.8	Low	77.5	Confident	177 Å²	177	54.5 Å²	54.5	93%	0.927	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-10.4	-167.7	-78.1	162.1	0	0	0	115.9
704	D	78.9	Confident	78.4	Confident	100 Å²	100	56.7 Å²	56.7	54%	0.535	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	12.1	177.2	-68.4	-55.3	0	0	0	113.4	D702 H766 S767	D702-D704 PolarHBondContact O-N 3.41Å; D704-H766 WeakPolarHBondContact O-CA 3.44Å; D704-S767 PolarHBondContact O-N 3.13Å
705	T	73.5	Confident	79.4	Confident	29 Å²	29	59.8 Å²	59.8	18%	0.178	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129	-177	61.3	0	0	0	0	112.1	D702 N740 H765	D702-T705 HydrophobicContact CB-CG2 3.83Å; D702-T705 PolarHBondContact N-OG1 3.17Å; D702-T705 PolarHBondContact O-N 3.31Å; D702-T705 PolarHBondContact O-OG1 3.18Å; T705-N740 PolarHBondContact O-ND2 3.06Å; T705-N740 PolarHBondContact OG1-ND2 3.18Å; T705-H765 CarbonylContact C-O 3.57Å; T705-H765 VanDerWaalsContact CA-O 3.29Å; T705-H765 WeakPolarHBondContact CA-O 3.32Å
706	S	82.4	Confident	80.7	Confident	61 Å²	61	61.5 Å²	61.5	43%	0.427	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.1	169.8	68.5	0	0	0	0	110.8	H765	S706-H765 PolarHBondContact N-O 3.12Å; S706-H765 PolarHBondContact O-N 2.93Å; S706-H765 WeakPolarHBondContact OG-CB 3.24Å
707	V	77.3	Confident	81.9	Confident	14 Å²	14	68.3 Å²	68.3	9%	0.085	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.3	179.8	-178.8	0	0	0	0	110.5	Y709 N740 M762 H763 F764	V707-Y709 HydrophobicContact CB-CE2 4.47Å; V707-Y709 HydrophobicContact CG1-CD1 4.18Å; V707-Y709 HydrophobicContact CG1-CE1 3.67Å; V707-Y709 HydrophobicContact CG1-CE2 4.14Å; V707-N740 HydrophobicContact CB-CB 4.05Å; V707-N740 HydrophobicContact CG2-CB 3.64Å; V707-N740 PolarHBondContact N-OD1 2.74Å; V707-N740 VanDerWaalsContact N-OD1 3.15Å; V707-M762 HydrophobicContact CG1-CB 3.89Å; V707-M762 HydrophobicContact CG1-CG 4.14Å; V707-M762 HydrophobicContact CG1-SD 4.48Å; V707-H763 WeakPolarHBondContact CA-O 3.33Å; V707-F764 HydrophobicContact CG2-CD1 3.74Å; V707-F764 HydrophobicContact CG2-CE1 4.11Å
708	Q	86	Confident	83.1	Confident	120 Å²	120	71.1 Å²	71.1	56%	0.561	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	133.8	167.6	177.8	178	-8.6	0	0	109.5	M762 H763	Q708-M762 WeakPolarHBondContact O-CA 3.01Å; Q708-H763 HydrophobicContact CB-CB 4.29Å; Q708-H763 PolarHBondContact N-O 3.43Å; Q708-H763 PolarHBondContact O-N 3.29Å
709	Y	86.3	Confident	84	Confident	43 Å²	43	70.2 Å²	70.2	17%	0.169	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	136	-179.8	-53.4	-86.7	0	0	0	110.6	L697 V707 V733 N740 S741 A742 I761 M762	L697-Y709 HydrophobicContact CB-CE1 4.39Å; L697-Y709 HydrophobicContact CD1-CD1 3.84Å; L697-Y709 HydrophobicContact CD1-CE1 3.94Å; V707-Y709 HydrophobicContact CB-CE2 4.47Å; V707-Y709 HydrophobicContact CG1-CD1 4.18Å; V707-Y709 HydrophobicContact CG1-CE1 3.67Å; V707-Y709 HydrophobicContact CG1-CE2 4.14Å; Y709-V733 HydrophobicContact CG-CG1 4.26Å; Y709-N740 PolarHBondContact OH-O 3.44Å; Y709-S741 PolarHBondContact OH-N 3.45Å; Y709-A742 HydrophobicContact CD1-CB 3.97Å; Y709-A742 HydrophobicContact CD2-CB 3.99Å; Y709-A742 HydrophobicContact CE1-CB 3.67Å; Y709-A742 HydrophobicContact CE2-CB 3.7Å; Y709-A742 HydrophobicContact CG-CB 4.13Å; Y709-I761 CarbonylContact C-O 3.6Å; Y709-I761 WeakPolarHBondContact CA-O 3.09Å; Y709-M762 HydrophobicContact CD1-CG 3.77Å; Y709-M762 HydrophobicContact CD1-SD 4.44Å; Y709-M762 HydrophobicContact CE1-CG 3.84Å; Y709-M762 HydrophobicContact CE1-SD 3.95Å
710	E	90.2	Very high	85	Confident	71 Å²	71	78.5 Å²	78.5	33%	0.332	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	129.5	174.9	175.4	-173.5	178.9	0	0	108.5	Q712 I761 H763	E710-Q712 HydrophobicContact CG-CG 4.33Å; E710-Q712 PolarHBondContact OE1-NE2 2.74Å; E710-I761 HydrophobicContact CB-CB 4.22Å; E710-I761 PolarHBondContact N-O 2.9Å; E710-I761 PolarHBondContact O-N 3.18Å; E710-H763 IonicContact OE2-CD2 3.89Å; E710-H763 IonicContact OE2-CE1 3.6Å; E710-H763 IonicContact OE2-NE2 2.8Å; E710-H763 PolarHBondContact OE2-NE2 2.82Å
711	L	92.1	Very high	85.7	Confident	12 Å²	12	85.7 Å²	85.7	6%	0.063	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.3	177.7	172.3	70.5	0	0	0	109.3	R728 F731 V733 L744 L758 D759 L760	L711-R728 PolarHBondContact O-NE 2.92Å; L711-R728 PolarHBondContact O-NH2 2.9Å; L711-F731 HydrophobicContact CD2-CB 3.68Å; L711-V733 HydrophobicContact CB-CG2 3.8Å; L711-V733 HydrophobicContact CD2-CG2 3.93Å; L711-V733 HydrophobicContact CG-CG2 4.41Å; L711-L744 HydrophobicContact CD1-CD1 4.1Å; L711-L744 HydrophobicContact CD2-CD1 3.53Å; L711-L744 HydrophobicContact CG-CD1 4.47Å; L711-L758 HydrophobicContact CD1-CB 4.08Å; L711-L758 HydrophobicContact CD1-CD1 4.46Å; L711-L758 HydrophobicContact CD1-CD2 4.44Å; L711-D759 WeakPolarHBondContact CA-O 3.28Å; L711-L760 HydrophobicContact CB-CD1 4.06Å; L711-L760 HydrophobicContact CD1-CB 4.32Å; L711-L760 HydrophobicContact CD1-CD1 4.25Å
712	Q	93.7	Very high	86.3	Confident	74 Å²	74	85.3 Å²	85.3	35%	0.346	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	134.3	178.1	-61.3	-175.5	-9.5	0	0	109.9	E710 L714 L758 D759 I761	E710-Q712 HydrophobicContact CG-CG 4.33Å; E710-Q712 PolarHBondContact OE1-NE2 2.74Å; Q712-L714 HydrophobicContact CB-CD2 4.38Å; Q712-L758 CarbonylContact O-C 3.51Å; Q712-L758 WeakPolarHBondContact O-CA 3.08Å; Q712-D759 HydrophobicContact CB-CB 4.31Å; Q712-D759 PolarHBondContact N-O 3.43Å; Q712-D759 PolarHBondContact O-N 2.04Å; Q712-I761 HydrophobicContact CG-CD1 4.41Å
713	L	94.9	Very high	87	Confident	54 Å²	54	81.3 Å²	81.3	28%	0.283	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	115.3	167.1	175.3	67.4	0	0	0	107.7	R728 V756 L758	L713-R728 HydrophobicContact CB-CB 4.29Å; L713-V756 HydrophobicContact CD1-CG1 3.5Å; L713-L758 HydrophobicContact CB-CD2 4.12Å; L713-L758 HydrophobicContact CD1-CD2 3.51Å; L713-L758 HydrophobicContact CG-CD2 4.44Å
714	L	93.7	Very high	88.3	Confident	83 Å²	83	79.5 Å²	79.5	44%	0.435	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-45.7	-177	-63.2	-172.9	0	0	0	111.9	Q712 V757 D759	Q712-L714 HydrophobicContact CB-CD2 4.38Å; L714-V757 HydrophobicContact CB-CB 4.37Å; L714-V757 HydrophobicContact CB-CG1 4.25Å; L714-V757 HydrophobicContact CD1-CG1 4.17Å; L714-V757 PolarHBondContact N-O 2.63Å; L714-D759 HydrophobicContact CD1-CB 4.2Å; L714-D759 VanDerWaalsContact CD1-CG 3.42Å; L714-D759 VanDerWaalsContact CD1-OD1 3.28Å; L714-D759 WeakPolarHBondContact CD1-OD1 3.46Å; L714-D759 HydrophobicContact CD2-CB 4.45Å; L714-D759 HydrophobicContact CG-CB 4.27Å
715	E	95.2	Very high	89.1	Confident	78 Å²	78	77.9 Å²	77.9	36%	0.364	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	148.3	-172.9	-169.4	170.7	-160.7	0	0	111.2	R717 V757	E715-R717 VanDerWaalsContact CD-NH2 3.27Å; E715-R717 HydrophobicContact CG-CG 4.09Å; E715-R717 IonicContact OE1-CZ 2.68Å; E715-R717 IonicContact OE1-NE 2.97Å; E715-R717 PolarHBondContact OE1-NE 2.89Å; E715-R717 IonicContact OE1-NH2 3.27Å; E715-R717 PolarHBondContact OE1-NH2 2.91Å; E715-R717 IonicContact OE2-CZ 3.5Å; E715-R717 IonicContact OE2-NE 3.6Å; E715-R717 IonicContact OE2-NH2 3.15Å; E715-R717 PolarHBondContact OE2-NH2 2.04Å; E715-V757 HydrophobicContact CB-CB 4.16Å; E715-V757 HydrophobicContact CB-CG2 4.24Å; E715-V757 PolarHBondContact N-O 2.73Å; E715-V757 PolarHBondContact O-N 3.39Å
716	T	95.2	Very high	90.1	Very high	39 Å²	39	76.7 Å²	76.7	24%	0.239	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	117.9	168.6	-60.9	0	0	0	0	108.4	V718 P725 A726 Q754 D755 V756	T716-V718 HydrophobicContact CG2-CG2 4.45Å; T716-P725 HydrophobicContact CG2-CB 3.9Å; T716-A726 HydrophobicContact CG2-CB 4.29Å; T716-A726 PolarHBondContact OG1-O 2.62Å; T716-Q754 VanDerWaalsContact CG2-OE1 3.3Å; T716-D755 CarbonylContact C-O 3.58Å; T716-D755 VanDerWaalsContact CA-O 3.32Å; T716-D755 WeakPolarHBondContact CA-O 3.46Å; T716-V756 HydrophobicContact CG2-CG2 4.3Å
717	R	95.6	Very high	90.7	Very high	149 Å²	149	76.4 Å²	76.4	56%	0.562	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	122	177.7	-61.7	-176.6	-178.1	162.8	11.6	109.3	E715 Q754 D755	E715-R717 VanDerWaalsContact CD-NH2 3.27Å; E715-R717 HydrophobicContact CG-CG 4.09Å; E715-R717 IonicContact OE1-CZ 2.68Å; E715-R717 IonicContact OE1-NE 2.97Å; E715-R717 PolarHBondContact OE1-NE 2.89Å; E715-R717 IonicContact OE1-NH2 3.27Å; E715-R717 PolarHBondContact OE1-NH2 2.91Å; E715-R717 IonicContact OE2-CZ 3.5Å; E715-R717 IonicContact OE2-NE 3.6Å; E715-R717 IonicContact OE2-NH2 3.15Å; E715-R717 PolarHBondContact OE2-NH2 2.04Å; R717-Q754 CarbonylContact O-C 3.54Å; R717-Q754 WeakPolarHBondContact O-CA 3.5Å; R717-Q754 WeakPolarHBondContact O-CB 3.26Å; R717-D755 HydrophobicContact CB-CB 4.33Å; R717-D755 PolarHBondContact N-O 3.13Å; R717-D755 PolarHBondContact O-N 3.22Å
718	V	93.1	Very high	91.5	Very high	61 Å²	61	80.8 Å²	80.8	37%	0.37	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.8	-179.4	178.5	0	0	0	0	109.4	T716 R720 V723 P725 Q754	T716-V718 HydrophobicContact CG2-CG2 4.45Å; V718-R720 VanDerWaalsContact CG1-O 3.24Å; V718-R720 WeakPolarHBondContact CG1-O 3.42Å; V718-V723 HydrophobicContact CG1-CB 3.53Å; V718-V723 HydrophobicContact CG1-CG1 3.81Å; V718-V723 HydrophobicContact CG1-CG2 4.39Å; V718-P725 HydrophobicContact CG2-CB 3.87Å; V718-Q754 HydrophobicContact CG2-CB 4.37Å
719	G	87	Confident	91.9	Very high	64 Å²	64	78.7 Å²	78.7	66%	0.66	42%	0.415	S	S	*	.	S	Bend	trans	-86.8	-11.7	-176.2	0	0	0	0	0	115.1	P753	G719-P753 PolarHBondContact N-O 3.43Å
720	R	87.9	Confident	92.3	Very high	184 Å²	184	76.7 Å²	76.7	69%	0.694	41%	0.407	S	S	*	.	S	Bend	trans	-146.6	141.1	-177.5	-168	177.8	-179.4	178.5	1.2	112.2	V718 G722 V723 P753	V718-R720 VanDerWaalsContact CG1-O 3.24Å; V718-R720 WeakPolarHBondContact CG1-O 3.42Å; R720-G722 PolarHBondContact O-N 3.38Å; R720-V723 HydrophobicContact CB-CG2 4.16Å; R720-V723 PolarHBondContact O-N 2.81Å; R720-P753 HydrophobicContact CB-CG 4.01Å
721	H	82.2	Confident	92.5	Very high	197 Å²	197	73.5 Å²	73.5	91%	0.912	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	136.9	172.2	-71.7	-72.8	0	0	0	111.5
722	G	86	Confident	92.4	Very high	78 Å²	78	74.7 Å²	74.7	80%	0.804	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	-11.2	179.5	0	0	0	0	0	115.4	R720	R720-G722 PolarHBondContact O-N 3.38Å
723	V	90.3	Very high	92.2	Very high	20 Å²	20	73.4 Å²	73.4	12%	0.121	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-76.6	126.8	175.5	170.9	0	0	0	0	110.2	V718 R720 P725 Q751 G752	V718-V723 HydrophobicContact CG1-CB 3.53Å; V718-V723 HydrophobicContact CG1-CG1 3.81Å; V718-V723 HydrophobicContact CG1-CG2 4.39Å; R720-V723 HydrophobicContact CB-CG2 4.16Å; R720-V723 PolarHBondContact O-N 2.81Å; V723-P725 WeakPolarHBondContact O-CD 3.47Å; V723-Q751 HydrophobicContact CG1-CB 3.9Å; V723-Q751 WeakPolarHBondContact CG1-O 3.32Å; V723-G752 VanDerWaalsContact CG2-O 3.29Å; V723-G752 WeakPolarHBondContact CG2-O 3.48Å
724	R	93.8	Very high	91.8	Very high	139 Å²	139	76.5 Å²	76.5	53%	0.525	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-69.6	118.2	176	-174.4	177.2	177.2	-138.6	-6.7	110.2	E748 Q751 Q754	R724-E748 IonicContact CZ-OE2 2.86Å; R724-E748 IonicContact NH1-OE2 3.19Å; R724-E748 PolarHBondContact NH1-OE2 3.4Å; R724-E748 IonicContact NH2-OE2 3.18Å; R724-Q751 VanDerWaalsContact N-OE1 3.16Å; R724-Q754 PolarHBondContact O-NE2 2.7Å
725	P	94.5	Very high	91.3	Very high	65 Å²	65	79.4 Å²	79.4	42%	0.422	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-66.3	140.1	178.9	26.5	-33	0	0	0	110.7	T716 V718 V723	T716-P725 HydrophobicContact CG2-CB 3.9Å; V718-P725 HydrophobicContact CG2-CB 3.87Å; V723-P725 WeakPolarHBondContact O-CD 3.47Å
726	A	94.5	Very high	90.5	Very high	5 Å²	5	79.3 Å²	79.3	4%	0.041	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-59.3	144.5	170.1	0	0	0	0	0	110.6	T716 F731 L750 V756	T716-A726 HydrophobicContact CG2-CB 4.29Å; T716-A726 PolarHBondContact OG1-O 2.62Å; A726-F731 HydrophobicContact CB-CE2 4.25Å; A726-F731 HydrophobicContact CB-CZ 4.48Å; A726-L750 HydrophobicContact CB-CD1 4.14Å; A726-L750 HydrophobicContact CB-CD2 3.77Å; A726-V756 HydrophobicContact CB-CG1 4.17Å; A726-V756 HydrophobicContact CB-CG2 3.57Å
727	T	96	Very high	89.5	Confident	55 Å²	55	83.9 Å²	83.9	34%	0.337	46%	0.457	S	S	.	.			trans	-124.3	169.8	178.3	69.7	0	0	0	0	109.9	A729 S730 F731	T727-A729 PolarHBondContact O-N 2.87Å; T727-A729 VanDerWaalsContact O-N 3.14Å; T727-A729 PolarHBondContact OG1-N 2.78Å; T727-S730 PolarHBondContact N-OG 3.02Å; T727-S730 VanDerWaalsContact O-CB 3.25Å; T727-S730 WeakPolarHBondContact O-CB 3.08Å; T727-S730 PolarHBondContact O-N 2.78Å; T727-S730 PolarHBondContact O-OG 3.15Å; T727-S730 VanDerWaalsContact O-OG 3.07Å; T727-S730 PolarHBondContact OG1-OG 2.89Å; T727-F731 WeakPolarHBondContact O-CD2 3.28Å
728	R	94.5	Very high	88.3	Confident	105 Å²	105	78 Å²	78	40%	0.396	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-58.8	-27.9	175.6	179	57.7	-174.9	75.8	6	112.3	L711 L713 S730 F731	L711-R728 PolarHBondContact O-NE 2.92Å; L711-R728 PolarHBondContact O-NH2 2.9Å; L713-R728 HydrophobicContact CB-CB 4.29Å; R728-S730 VanDerWaalsContact C-N 3.27Å; R728-S730 PolarHBondContact O-N 3.32Å; R728-F731 PolarHBondContact NH1-O 2.71Å; R728-F731 PolarHBondContact O-N 2.85Å
729	A	94	Very high	87.2	Confident	77 Å²	77	79.1 Å²	79.1	64%	0.636	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-71.8	-19.2	177.3	0	0	0	0	0	113.3	T727 F731 V747	T727-A729 PolarHBondContact O-N 2.87Å; T727-A729 VanDerWaalsContact O-N 3.14Å; T727-A729 PolarHBondContact OG1-N 2.78Å; A729-F731 PolarHBondContact O-N 3.27Å; A729-V747 VanDerWaalsContact O-CG2 3.22Å; A729-V747 WeakPolarHBondContact O-CG2 3.21Å
730	S	94.3	Very high	86.6	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-68.1	-13.5	176.3	-43.7	0	0	0	0	112.9	T727 R728 L746 V747 E748	T727-S730 PolarHBondContact N-OG 3.02Å; T727-S730 VanDerWaalsContact O-CB 3.25Å; T727-S730 WeakPolarHBondContact O-CB 3.08Å; T727-S730 PolarHBondContact O-N 2.78Å; T727-S730 PolarHBondContact O-OG 3.15Å; T727-S730 VanDerWaalsContact O-OG 3.07Å; T727-S730 PolarHBondContact OG1-OG 2.89Å; R728-S730 VanDerWaalsContact C-N 3.27Å; R728-S730 PolarHBondContact O-N 3.32Å; S730-L746 WeakPolarHBondContact O-CD1 3.47Å; S730-V747 WeakPolarHBondContact O-CG2 2.86Å; S730-V747 PolarHBondContact O-N 3.25Å; S730-E748 VanDerWaalsContact CB-OE1 3.27Å; S730-E748 WeakPolarHBondContact CB-OE1 3.42Å; S730-E748 PolarHBondContact OG-OE1 2.96Å
731	F	93.5	Very high	86	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.018	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	139	-174.4	-54.2	-82.2	0	0	0	112.3	L694 L711 A726 T727 R728 A729 L744 N745 L746 L750 V756 L758 L780	L694-F731 HydrophobicContact CD1-CD1 4.09Å; L694-F731 HydrophobicContact CD1-CE1 3.99Å; L711-F731 HydrophobicContact CD2-CB 3.68Å; A726-F731 HydrophobicContact CB-CE2 4.25Å; A726-F731 HydrophobicContact CB-CZ 4.48Å; T727-F731 WeakPolarHBondContact O-CD2 3.28Å; R728-F731 PolarHBondContact NH1-O 2.71Å; R728-F731 PolarHBondContact O-N 2.85Å; A729-F731 PolarHBondContact O-N 3.27Å; F731-L744 HydrophobicContact CB-CD1 4.15Å; F731-N745 CarbonylContact C-O 3.57Å; F731-N745 WeakPolarHBondContact CA-O 3.35Å; F731-L746 HydrophobicContact CD1-CD1 3.9Å; F731-L746 HydrophobicContact CE1-CD1 3.52Å; F731-L746 HydrophobicContact CZ-CD1 4.09Å; F731-L750 HydrophobicContact CZ-CD1 4.13Å; F731-V756 HydrophobicContact CE2-CG1 3.99Å; F731-V756 HydrophobicContact CZ-CG1 3.91Å; F731-L758 HydrophobicContact CD1-CD1 3.77Å; F731-L758 HydrophobicContact CD2-CD1 4.2Å; F731-L758 HydrophobicContact CD2-CD2 3.89Å; F731-L758 HydrophobicContact CE1-CD1 3.73Å; F731-L758 HydrophobicContact CE2-CD1 4.17Å; F731-L758 HydrophobicContact CE2-CD2 3.89Å; F731-L758 HydrophobicContact CG-CD1 4.01Å; F731-L758 HydrophobicContact CG-CD2 4.41Å; F731-L758 HydrophobicContact CZ-CD1 3.94Å; F731-L758 HydrophobicContact CZ-CD2 4.41Å; F731-L780 HydrophobicContact CE1-CD2 3.78Å; F731-L780 HydrophobicContact CZ-CD2 3.91Å
732	A	91.7	Very high	85.6	Confident	37 Å²	37	59.1 Å²	59.1	31%	0.306	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	138.7	176.2	0	0	0	0	0	111.3	N745 V747	A732-N745 PolarHBondContact N-O 2.97Å; A732-N745 PolarHBondContact O-N 2.89Å; A732-V747 HydrophobicContact CB-CG1 3.55Å
733	V	88.6	Confident	85.3	Confident	47 Å²	47	56.1 Å²	56.1	29%	0.285	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120.2	171.5	-177.8	0	0	0	0	108.3	Y709 L711 A742 V743 L744 L760	Y709-V733 HydrophobicContact CG-CG1 4.26Å; L711-V733 HydrophobicContact CB-CG2 3.8Å; L711-V733 HydrophobicContact CD2-CG2 3.93Å; L711-V733 HydrophobicContact CG-CG2 4.41Å; V733-A742 HydrophobicContact CG1-CB 3.94Å; V733-V743 CarbonylContact C-O 3.43Å; V733-V743 WeakPolarHBondContact CA-O 3.43Å; V733-L744 HydrophobicContact CG2-CD1 4.08Å; V733-L760 HydrophobicContact CG2-CD1 3.78Å
734	Q	86.3	Confident	84.8	Confident	120 Å²	120	55.1 Å²	55.1	56%	0.561	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.4	180	-175.3	178.7	2.7	0	0	110.2	A742 V743 N745	Q734-A742 CarbonylContact O-C 3.49Å; Q734-A742 WeakPolarHBondContact O-CA 3.32Å; Q734-V743 PolarHBondContact N-O 2.75Å; Q734-V743 PolarHBondContact O-N 3.27Å; Q734-N745 PolarHBondContact OE1-ND2 3.09Å; Q734-N745 VanDerWaalsContact OE1-ND2 3.09Å
735	K	83.9	Confident	84.3	Confident	143 Å²	143	49.2 Å²	49.2	62%	0.622	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	132	173.9	-167.6	176.9	-178.9	177.3	0	110
736	M	78	Confident	83.9	Confident	77 Å²	77	46.1 Å²	46.1	38%	0.379	27%	0.269	S	S	.	.			trans	-86.9	169	176.3	-60.4	-172.2	82.4	0	0	111.4	T696 G738 S741 V743	T696-M736 HydrophobicContact CG2-SD 3.67Å; M736-G738 VanDerWaalsContact C-N 3.27Å; M736-G738 PolarHBondContact O-N 2.7Å; M736-S741 PolarHBondContact N-O 3.34Å; M736-V743 HydrophobicContact CE-CG2 4.15Å; M736-V743 HydrophobicContact CG-CG2 3.63Å; M736-V743 HydrophobicContact SD-CG2 3.42Å; M736-V743 WeakPolarHBondContact SD-CG2 3.48Å
737	S	74.9	Confident	83.7	Confident	134 Å²	134	48.9 Å²	48.9	94%	0.937	29%	0.285	S	S	*	.	S	Bend	trans	-66.6	-23.5	176.8	52.5	0	0	0	0	114.1
738	G	69	Low	83.4	Confident	26 Å²	26	48.7 Å²	48.7	27%	0.268	28%	0.281	S	S	.	.	S	Bend	trans	-72.5	152.2	176.3	0	0	0	0	0	113.1	M736 N740 S741	M736-G738 VanDerWaalsContact C-N 3.27Å; M736-G738 PolarHBondContact O-N 2.7Å; G738-N740 PolarHBondContact O-N 3.44Å; G738-S741 PolarHBondContact O-N 3.42Å
739	P	70	Confident	83.1	Confident	84 Å²	84	45.8 Å²	45.8	55%	0.545	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	133.3	177.1	24.4	-32.8	0	0	0	110.2	T701 S741	T701-P739 HydrophobicContact CG2-CG 3.95Å; P739-S741 PolarHBondContact O-N 2.7Å; P739-S741 PolarHBondContact O-OG 3.08Å
740	N	75.1	Confident	82.9	Confident	14 Å²	14	42.6 Å²	42.6	8%	0.075	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.4	39.8	176.8	-61.8	-34.9	0	0	0	114	G699 P700 T705 V707 Y709 G738	G699-N740 WeakPolarHBondContact CA-O 3.33Å; G699-N740 PolarHBondContact N-O 3.02Å; P700-N740 WeakPolarHBondContact O-CB 3.37Å; P700-N740 PolarHBondContact O-ND2 3.24Å; T705-N740 PolarHBondContact O-ND2 3.06Å; T705-N740 PolarHBondContact OG1-ND2 3.18Å; V707-N740 HydrophobicContact CB-CB 4.05Å; V707-N740 HydrophobicContact CG2-CB 3.64Å; V707-N740 PolarHBondContact N-OD1 2.74Å; V707-N740 VanDerWaalsContact N-OD1 3.15Å; Y709-N740 PolarHBondContact OH-O 3.44Å; G738-N740 PolarHBondContact O-N 3.44Å
741	S	74.4	Confident	82.7	Confident	12 Å²	12	46 Å²	46	8%	0.084	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.5	178.6	-60.2	0	0	0	0	111.4	L697 Y709 M736 G738 P739	L697-S741 CarbonylContact O-C 3.56Å; L697-S741 VanDerWaalsContact O-CA 3.27Å; L697-S741 WeakPolarHBondContact O-CA 3.19Å; Y709-S741 PolarHBondContact OH-N 3.45Å; M736-S741 PolarHBondContact N-O 3.34Å; G738-S741 PolarHBondContact O-N 3.42Å; P739-S741 PolarHBondContact O-N 2.7Å; P739-S741 PolarHBondContact O-OG 3.08Å
742	A	73.4	Confident	82.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	155.2	177.6	0	0	0	0	0	111.9	L697 Y709 V733 Q734	L697-A742 PolarHBondContact N-O 2.89Å; L697-A742 PolarHBondContact O-N 2.04Å; Y709-A742 HydrophobicContact CD1-CB 3.97Å; Y709-A742 HydrophobicContact CD2-CB 3.99Å; Y709-A742 HydrophobicContact CE1-CB 3.67Å; Y709-A742 HydrophobicContact CE2-CB 3.7Å; Y709-A742 HydrophobicContact CG-CB 4.13Å; V733-A742 HydrophobicContact CG1-CB 3.94Å; Q734-A742 CarbonylContact O-C 3.49Å; Q734-A742 WeakPolarHBondContact O-CA 3.32Å
743	V	80	Confident	82.5	Confident	14 Å²	14	46.1 Å²	46.1	9%	0.085	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	134.2	174.9	-175.5	0	0	0	0	109.2	P693 I695 T696 V733 Q734 M736 N745	P693-V743 HydrophobicContact CB-CG1 3.72Å; I695-V743 WeakPolarHBondContact O-CA 3.28Å; T696-V743 HydrophobicContact CG2-CG2 4.17Å; V733-V743 CarbonylContact C-O 3.43Å; V733-V743 WeakPolarHBondContact CA-O 3.43Å; Q734-V743 PolarHBondContact N-O 2.75Å; Q734-V743 PolarHBondContact O-N 3.27Å; M736-V743 HydrophobicContact CE-CG2 4.15Å; M736-V743 HydrophobicContact CG-CG2 3.63Å; M736-V743 HydrophobicContact SD-CG2 3.42Å; M736-V743 WeakPolarHBondContact SD-CG2 3.48Å; V743-N745 VanDerWaalsContact CG1-OD1 3.26Å; V743-N745 WeakPolarHBondContact CG1-OD1 3.11Å
744	L	80.2	Confident	82.7	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	117.7	164.7	177.3	66.5	0	0	0	108.6	L694 I695 L711 F731 V733 L758 L760 I778	L694-L744 HydrophobicContact CB-CD2 4.46Å; L694-L744 HydrophobicContact CB-CG 4.45Å; L694-L744 WeakPolarHBondContact CB-O 3.42Å; L694-L744 HydrophobicContact CD1-CD2 4.23Å; L694-L744 HydrophobicContact CD1-CG 4.37Å; L694-L744 PolarHBondContact N-O 2.62Å; I695-L744 PolarHBondContact N-O 3Å; I695-L744 PolarHBondContact O-N 3.4Å; L711-L744 HydrophobicContact CD1-CD1 4.1Å; L711-L744 HydrophobicContact CD2-CD1 3.53Å; L711-L744 HydrophobicContact CG-CD1 4.47Å; F731-L744 HydrophobicContact CB-CD1 4.15Å; V733-L744 HydrophobicContact CG2-CD1 4.08Å; L744-L758 HydrophobicContact CD2-CD1 4.1Å; L744-L760 HydrophobicContact CB-CD2 4.24Å; L744-I778 HydrophobicContact CD2-CD1 3.37Å
745	N	84.5	Confident	83.1	Confident	14 Å²	14	40.3 Å²	40.3	8%	0.075	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	140.5	178.2	-64.5	-38	0	0	0	110.5	A691 L692 P693 F731 A732 Q734 V743 V747	A691-N745 HydrophobicContact CB-CB 4.07Å; L692-N745 CarbonylContact O-C 3.56Å; L692-N745 WeakPolarHBondContact O-CA 3.42Å; P693-N745 WeakPolarHBondContact CA-OD1 3.31Å; F731-N745 CarbonylContact C-O 3.57Å; F731-N745 WeakPolarHBondContact CA-O 3.35Å; A732-N745 PolarHBondContact N-O 2.97Å; A732-N745 PolarHBondContact O-N 2.89Å; Q734-N745 PolarHBondContact OE1-ND2 3.09Å; Q734-N745 VanDerWaalsContact OE1-ND2 3.09Å; V743-N745 VanDerWaalsContact CG1-OD1 3.26Å; V743-N745 WeakPolarHBondContact CG1-OD1 3.11Å; N745-V747 HydrophobicContact CB-CG1 4.38Å
746	L	85.9	Confident	83.6	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	115.5	161.2	-179.2	73.1	0	0	0	108	L678 F684 A691 L692 L694 S730 F731 E748 L750	L678-L746 HydrophobicContact CD1-CD2 3.96Å; F684-L746 HydrophobicContact CE1-CD2 4.02Å; F684-L746 HydrophobicContact CZ-CD2 3.79Å; F684-L746 HydrophobicContact CZ-CG 3.91Å; A691-L746 CarbonylContact C-O 3.29Å; A691-L746 WeakPolarHBondContact CA-O 3.39Å; A691-L746 WeakPolarHBondContact CB-O 3.43Å; L692-L746 HydrophobicContact CB-CB 4.23Å; L692-L746 HydrophobicContact CD2-CD2 4.34Å; L692-L746 PolarHBondContact N-O 3.32Å; L692-L746 PolarHBondContact O-N 2.91Å; L694-L746 HydrophobicContact CD1-CB 4.09Å; L694-L746 HydrophobicContact CD2-CB 4.15Å; L694-L746 HydrophobicContact CG-CB 4.08Å; S730-L746 WeakPolarHBondContact O-CD1 3.47Å; F731-L746 HydrophobicContact CD1-CD1 3.9Å; F731-L746 HydrophobicContact CE1-CD1 3.52Å; F731-L746 HydrophobicContact CZ-CD1 4.09Å; L746-E748 WeakPolarHBondContact CD1-O 3.09Å; L746-E748 WeakPolarHBondContact CG-O 3.07Å; L746-L750 HydrophobicContact CD1-CD1 3.79Å; L746-L750 HydrophobicContact CD1-CD2 4.14Å; L746-L750 HydrophobicContact CD1-CG 3.76Å; L746-L750 HydrophobicContact CD2-CG 4.27Å
747	V	90.5	Very high	84.4	Confident	62 Å²	62	30.9 Å²	30.9	38%	0.376	19%	0.194	S	C	.	.			trans	-98.4	-14.2	-172.1	-64.5	0	0	0	0	113.7	A691 A729 S730 A732 N745	A691-V747 HydrophobicContact CB-CG1 4.12Å; A729-V747 VanDerWaalsContact O-CG2 3.22Å; A729-V747 WeakPolarHBondContact O-CG2 3.21Å; S730-V747 WeakPolarHBondContact O-CG2 2.86Å; S730-V747 PolarHBondContact O-N 3.25Å; A732-V747 HydrophobicContact CB-CG1 3.55Å; N745-V747 HydrophobicContact CB-CG1 4.38Å
748	E	89.6	Confident	85.2	Confident	51 Å²	51	24.5 Å²	24.5	24%	0.238	15%	0.149	C	C	.	.	S	Bend	trans	-132.4	147.7	170	76.5	-176.6	155.4	0	0	110	F684 R724 S730 L746	F684-E748 VanDerWaalsContact CZ-C 3.42Å; R724-E748 IonicContact CZ-OE2 2.86Å; R724-E748 IonicContact NH1-OE2 3.19Å; R724-E748 PolarHBondContact NH1-OE2 3.4Å; R724-E748 IonicContact NH2-OE2 3.18Å; S730-E748 VanDerWaalsContact CB-OE1 3.27Å; S730-E748 WeakPolarHBondContact CB-OE1 3.42Å; S730-E748 PolarHBondContact OG-OE1 2.96Å; L746-E748 WeakPolarHBondContact CD1-O 3.09Å; L746-E748 WeakPolarHBondContact CG-O 3.07Å
749	S	86.8	Confident	86.3	Confident	44 Å²	44	24.1 Å²	24.1	31%	0.308	14%	0.141	S	C	.	.	P	Polyproline II helix	trans	-66.6	137.6	176.6	170.7	0	0	0	0	111.2	N681 V682	N681-S749 WeakPolarHBondContact CA-OG 3.12Å; V682-S749 PolarHBondContact N-OG 2.73Å; V682-S749 WeakPolarHBondContact O-CB 3.39Å; V682-S749 PolarHBondContact O-OG 3.13Å
750	L	90.4	Very high	87	Confident	10 Å²	10	20.1 Å²	20.1	5%	0.052	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-99.4	138.3	179.6	-59.2	-177.6	0	0	0	111.6	N681 A726 F731 L746 V756 L780 V782	N681-L750 PolarHBondContact N-O 2.83Å; A726-L750 HydrophobicContact CB-CD1 4.14Å; A726-L750 HydrophobicContact CB-CD2 3.77Å; F731-L750 HydrophobicContact CZ-CD1 4.13Å; L746-L750 HydrophobicContact CD1-CD1 3.79Å; L746-L750 HydrophobicContact CD1-CD2 4.14Å; L746-L750 HydrophobicContact CD1-CG 3.76Å; L746-L750 HydrophobicContact CD2-CG 4.27Å; L750-V756 HydrophobicContact CD1-CG2 4.48Å; L750-L780 HydrophobicContact CD1-CD2 3.6Å; L750-V782 HydrophobicContact CB-CG1 4.4Å; L750-V782 HydrophobicContact CB-CG2 4Å; L750-V782 HydrophobicContact CD1-CG2 3.97Å
751	Q	90.8	Very high	87.4	Confident	72 Å²	72	19.7 Å²	19.7	34%	0.336	11%	0.113	S	C	.	.	P	Polyproline II helix	trans	-85.8	132.1	172	-69.3	173.8	19.6	0	0	109.6	N681 V723 R724 Q754	N681-Q751 WeakPolarHBondContact OD1-CG 3.35Å; V723-Q751 HydrophobicContact CG1-CB 3.9Å; V723-Q751 WeakPolarHBondContact CG1-O 3.32Å; R724-Q751 VanDerWaalsContact N-OE1 3.16Å; Q751-Q754 WeakPolarHBondContact O-CG 3.44Å; Q751-Q754 PolarHBondContact O-NE2 3.42Å
752	G	87	Confident	87.5	Confident	9 Å²	9	19.2 Å²	19.2	9%	0.093	11%	0.109	C	C	.	.	S	Bend	trans	-103.4	173.6	170.2	0	0	0	0	0	113.6	S680 V723 S783	S680-G752 PolarHBondContact OG-N 3.15Å; V723-G752 VanDerWaalsContact CG2-O 3.29Å; V723-G752 WeakPolarHBondContact CG2-O 3.48Å; G752-S783 VanDerWaalsContact CA-O 3.24Å; G752-S783 WeakPolarHBondContact CA-O 3.15Å
753	P	92.4	Very high	87.9	Confident	35 Å²	35	20.6 Å²	20.6	23%	0.227	12%	0.116	C	C	.	.	S	Bend	cis	-79.7	130.5	1.4	30	-33.5	0	0	0	112.6	G719 R720 V782 A784	G719-P753 PolarHBondContact N-O 3.43Å; R720-P753 HydrophobicContact CB-CG 4.01Å; P753-V782 VanDerWaalsContact CA-O 3.29Å; P753-V782 WeakPolarHBondContact CA-O 3.02Å; P753-A784 HydrophobicContact CB-CB 4.17Å; P753-A784 HydrophobicContact CG-CB 4.15Å
754	Q	94.5	Very high	87.6	Confident	3 Å²	3	21.7 Å²	21.7	1%	0.014	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	148.4	170.8	67.1	176.8	-56.8	0	0	113.1	T716 R717 V718 R724 Q751 V756 V782	T716-Q754 VanDerWaalsContact CG2-OE1 3.3Å; R717-Q754 CarbonylContact O-C 3.54Å; R717-Q754 WeakPolarHBondContact O-CA 3.5Å; R717-Q754 WeakPolarHBondContact O-CB 3.26Å; V718-Q754 HydrophobicContact CG2-CB 4.37Å; R724-Q754 PolarHBondContact O-NE2 2.7Å; Q751-Q754 WeakPolarHBondContact O-CG 3.44Å; Q751-Q754 PolarHBondContact O-NE2 3.42Å; Q754-V756 HydrophobicContact CG-CG2 4.3Å; Q754-V782 HydrophobicContact CG-CB 3.94Å; Q754-V782 HydrophobicContact CG-CG2 3.91Å; Q754-V782 PolarHBondContact N-O 2.87Å; Q754-V782 VanDerWaalsContact N-O 3.11Å; Q754-V782 PolarHBondContact O-N 3.16Å
755	D	94	Very high	87.6	Confident	42 Å²	42	23.7 Å²	23.7	23%	0.225	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.4	172.6	-61.7	-18.7	0	0	0	109.4	K630 T716 R717 L780 F781	K630-D755 VanDerWaalsContact NZ-CG 3.3Å; K630-D755 IonicContact NZ-OD1 3.55Å; K630-D755 IonicContact NZ-OD2 2.85Å; K630-D755 PolarHBondContact NZ-OD2 3.28Å; T716-D755 CarbonylContact C-O 3.58Å; T716-D755 VanDerWaalsContact CA-O 3.32Å; T716-D755 WeakPolarHBondContact CA-O 3.46Å; R717-D755 HydrophobicContact CB-CB 4.33Å; R717-D755 PolarHBondContact N-O 3.13Å; R717-D755 PolarHBondContact O-N 3.22Å; D755-L780 CarbonylContact C-O 3.53Å; D755-F781 HydrophobicContact CB-CD1 4.07Å; D755-F781 HydrophobicContact CB-CE1 4.33Å; D755-F781 VanDerWaalsContact OD1-CD1 3.26Å; D755-F781 WeakPolarHBondContact OD1-CD1 3.29Å
756	V	94.3	Very high	87.4	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130	-179.7	-171.6	0	0	0	0	109.6	L713 T716 A726 F731 L750 Q754 L758 L780	L713-V756 HydrophobicContact CD1-CG1 3.5Å; T716-V756 HydrophobicContact CG2-CG2 4.3Å; A726-V756 HydrophobicContact CB-CG1 4.17Å; A726-V756 HydrophobicContact CB-CG2 3.57Å; F731-V756 HydrophobicContact CE2-CG1 3.99Å; F731-V756 HydrophobicContact CZ-CG1 3.91Å; L750-V756 HydrophobicContact CD1-CG2 4.48Å; Q754-V756 HydrophobicContact CG-CG2 4.3Å; V756-L758 HydrophobicContact CG1-CD2 4.23Å; V756-L758 HydrophobicContact CG1-CG 4.32Å; V756-L780 HydrophobicContact CB-CB 4.17Å; V756-L780 PolarHBondContact N-O 3.3Å; V756-L780 PolarHBondContact O-N 3.41Å
757	V	94.3	Very high	87.1	Confident	20 Å²	20	31.3 Å²	31.3	12%	0.121	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.9	179.1	-172.4	0	0	0	0	109.7	L714 E715 I778 F779	L714-V757 HydrophobicContact CB-CB 4.37Å; L714-V757 HydrophobicContact CB-CG1 4.25Å; L714-V757 HydrophobicContact CD1-CG1 4.17Å; L714-V757 PolarHBondContact N-O 2.63Å; E715-V757 HydrophobicContact CB-CB 4.16Å; E715-V757 HydrophobicContact CB-CG2 4.24Å; E715-V757 PolarHBondContact N-O 2.73Å; E715-V757 PolarHBondContact O-N 3.39Å; V757-I778 WeakPolarHBondContact CA-O 2.99Å; V757-F779 HydrophobicContact CG1-CE1 4.21Å; V757-F779 HydrophobicContact CG1-CZ 4.23Å; V757-F779 HydrophobicContact CG2-CD1 3.93Å; V757-F779 HydrophobicContact CG2-CE1 3.93Å
758	L	92.9	Very high	86.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.1	179.3	-53.8	166.7	0	0	0	110.7	L711 Q712 L713 F731 L744 V756 I778	L711-L758 HydrophobicContact CD1-CB 4.08Å; L711-L758 HydrophobicContact CD1-CD1 4.46Å; L711-L758 HydrophobicContact CD1-CD2 4.44Å; Q712-L758 CarbonylContact O-C 3.51Å; Q712-L758 WeakPolarHBondContact O-CA 3.08Å; L713-L758 HydrophobicContact CB-CD2 4.12Å; L713-L758 HydrophobicContact CD1-CD2 3.51Å; L713-L758 HydrophobicContact CG-CD2 4.44Å; F731-L758 HydrophobicContact CD1-CD1 3.77Å; F731-L758 HydrophobicContact CD2-CD1 4.2Å; F731-L758 HydrophobicContact CD2-CD2 3.89Å; F731-L758 HydrophobicContact CE1-CD1 3.73Å; F731-L758 HydrophobicContact CE2-CD1 4.17Å; F731-L758 HydrophobicContact CE2-CD2 3.89Å; F731-L758 HydrophobicContact CG-CD1 4.01Å; F731-L758 HydrophobicContact CG-CD2 4.41Å; F731-L758 HydrophobicContact CZ-CD1 3.94Å; F731-L758 HydrophobicContact CZ-CD2 4.41Å; L744-L758 HydrophobicContact CD2-CD1 4.1Å; V756-L758 HydrophobicContact CG1-CD2 4.23Å; V756-L758 HydrophobicContact CG1-CG 4.32Å; L758-I778 HydrophobicContact CB-CB 4.23Å; L758-I778 PolarHBondContact N-O 3.36Å; L758-I778 PolarHBondContact O-N 3.39Å
759	D	90.6	Very high	86	Confident	18 Å²	18	33.5 Å²	33.5	10%	0.096	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	122.1	164.1	-88.4	12.1	0	0	0	109.2	L711 Q712 L714 I761 T775 K777	L711-D759 WeakPolarHBondContact CA-O 3.28Å; Q712-D759 HydrophobicContact CB-CB 4.31Å; Q712-D759 PolarHBondContact N-O 3.43Å; Q712-D759 PolarHBondContact O-N 2.04Å; L714-D759 HydrophobicContact CD1-CB 4.2Å; L714-D759 VanDerWaalsContact CD1-CG 3.42Å; L714-D759 VanDerWaalsContact CD1-OD1 3.28Å; L714-D759 WeakPolarHBondContact CD1-OD1 3.46Å; L714-D759 HydrophobicContact CD2-CB 4.45Å; L714-D759 HydrophobicContact CG-CB 4.27Å; D759-I761 HydrophobicContact CB-CG1 4.48Å; D759-T775 HydrophobicContact CB-CG2 4.21Å; D759-K777 WeakPolarHBondContact OD1-CG 3.06Å; D759-K777 IonicContact OD1-NZ 2.81Å; D759-K777 PolarHBondContact OD1-NZ 3.06Å; D759-K777 IonicContact OD2-NZ 3.17Å; D759-K777 PolarHBondContact OD2-NZ 3.3Å
760	L	84.7	Confident	85.4	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	108.3	172.6	-176.3	57.5	0	0	0	108.9	L697 L711 V733 L744 T775 A776 I778	L697-L760 HydrophobicContact CD1-CD1 4.3Å; L697-L760 HydrophobicContact CD1-CD2 3.26Å; L697-L760 HydrophobicContact CD1-CG 3.64Å; L697-L760 HydrophobicContact CD2-CD2 4.15Å; L697-L760 HydrophobicContact CG-CD2 3.85Å; L711-L760 HydrophobicContact CB-CD1 4.06Å; L711-L760 HydrophobicContact CD1-CB 4.32Å; L711-L760 HydrophobicContact CD1-CD1 4.25Å; V733-L760 HydrophobicContact CG2-CD1 3.78Å; L744-L760 HydrophobicContact CB-CD2 4.24Å; L760-T775 WeakPolarHBondContact O-CA 3.28Å; L760-A776 HydrophobicContact CB-CB 4.47Å; L760-A776 PolarHBondContact N-O 2.04Å; L760-A776 PolarHBondContact O-N 3.03Å; L760-I778 HydrophobicContact CB-CD1 4.16Å; L760-I778 HydrophobicContact CD2-CD1 4.29Å
761	I	83.6	Confident	84.2	Confident	5 Å²	5	37.4 Å²	37.4	3%	0.026	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.3	-172.1	-51.6	170.3	0	0	0	108.8	Y709 E710 Q712 D759 R773 S774 T775	Y709-I761 CarbonylContact C-O 3.6Å; Y709-I761 WeakPolarHBondContact CA-O 3.09Å; E710-I761 HydrophobicContact CB-CB 4.22Å; E710-I761 PolarHBondContact N-O 2.9Å; E710-I761 PolarHBondContact O-N 3.18Å; Q712-I761 HydrophobicContact CG-CD1 4.41Å; D759-I761 HydrophobicContact CB-CG1 4.48Å; I761-R773 HydrophobicContact CG2-CB 4.23Å; I761-S774 CarbonylContact C-O 3.33Å; I761-S774 WeakPolarHBondContact CA-O 3.23Å; I761-T775 HydrophobicContact CG1-CG2 4.1Å
762	M	77.6	Confident	83.2	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	119.6	171.7	-66.5	-175.4	-69.4	0	0	108.8	L697 V707 Q708 Y709 F764 R773 S774 I820	L697-M762 HydrophobicContact CB-SD 4.23Å; L697-M762 HydrophobicContact CD1-CG 4.08Å; L697-M762 HydrophobicContact CD1-SD 3.93Å; V707-M762 HydrophobicContact CG1-CB 3.89Å; V707-M762 HydrophobicContact CG1-CG 4.14Å; V707-M762 HydrophobicContact CG1-SD 4.48Å; Q708-M762 WeakPolarHBondContact O-CA 3.01Å; Y709-M762 HydrophobicContact CD1-CG 3.77Å; Y709-M762 HydrophobicContact CD1-SD 4.44Å; Y709-M762 HydrophobicContact CE1-CG 3.84Å; Y709-M762 HydrophobicContact CE1-SD 3.95Å; M762-F764 HydrophobicContact CB-CE1 4.21Å; M762-F764 HydrophobicContact CB-CZ 4.08Å; M762-F764 HydrophobicContact CE-CZ 4.34Å; M762-R773 CarbonylContact O-C 3.49Å; M762-R773 WeakPolarHBondContact O-CA 3.4Å; M762-R773 WeakPolarHBondContact O-CB 3.37Å; M762-S774 PolarHBondContact N-O 2.76Å; M762-S774 PolarHBondContact O-N 3.46Å; M762-I820 HydrophobicContact CE-CD1 3.88Å; M762-I820 HydrophobicContact CE-CG2 4.11Å
763	H	81.1	Confident	82.6	Confident	30 Å²	30	38.3 Å²	38.3	14%	0.139	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	117.4	172.7	-60.3	-89.8	0	0	0	108.5	V707 Q708 E710 F770	V707-H763 WeakPolarHBondContact CA-O 3.33Å; Q708-H763 HydrophobicContact CB-CB 4.29Å; Q708-H763 PolarHBondContact N-O 3.43Å; Q708-H763 PolarHBondContact O-N 3.29Å; E710-H763 IonicContact OE2-CD2 3.89Å; E710-H763 IonicContact OE2-CE1 3.6Å; E710-H763 IonicContact OE2-NE2 2.8Å; E710-H763 PolarHBondContact OE2-NE2 2.82Å; H763-F770 HydrophobicContact CB-CD2 4.49Å; H763-F770 HydrophobicContact CB-CE2 4.02Å; H763-F770 AromaticContact ND1-CE2 3.61Å
764	F	75.2	Confident	81.6	Confident	36 Å²	36	37 Å²	37	16%	0.158	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	132.8	178.8	-51.7	-71.7	0	0	0	109.3	P700 V707 M762 G771 G772 I820	P700-F764 HydrophobicContact CG-CD1 4Å; P700-F764 HydrophobicContact CG-CE1 4.07Å; V707-F764 HydrophobicContact CG2-CD1 3.74Å; V707-F764 HydrophobicContact CG2-CE1 4.11Å; M762-F764 HydrophobicContact CB-CE1 4.21Å; M762-F764 HydrophobicContact CB-CZ 4.08Å; M762-F764 HydrophobicContact CE-CZ 4.34Å; F764-G771 PolarHBondContact O-N 3.25Å; F764-G772 WeakPolarHBondContact CD2-O 2.99Å; F764-G772 PolarHBondContact N-O 3.22Å; F764-I820 HydrophobicContact CZ-CD1 3.85Å
765	H	80.1	Confident	80.9	Confident	43 Å²	43	37.2 Å²	37.2	20%	0.199	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133	170.3	-67.2	-105.8	0	0	0	109.3	T705 S706 G768 T769	T705-H765 CarbonylContact C-O 3.57Å; T705-H765 VanDerWaalsContact CA-O 3.29Å; T705-H765 WeakPolarHBondContact CA-O 3.32Å; S706-H765 PolarHBondContact N-O 3.12Å; S706-H765 PolarHBondContact O-N 2.93Å; S706-H765 WeakPolarHBondContact OG-CB 3.24Å; H765-G768 PolarHBondContact ND1-O 3.4Å; H765-T769 CarbonylContact C-O 3.47Å; H765-T769 WeakPolarHBondContact CA-O 3.48Å
766	H	78.4	Confident	80.1	Confident	95 Å²	95	35.3 Å²	35.3	44%	0.44	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	120.7	173.7	-175.6	67.1	0	0	0	108.5	D704 G768 T769	D704-H766 WeakPolarHBondContact O-CA 3.44Å; H766-G768 PolarHBondContact O-N 2.86Å; H766-G768 VanDerWaalsContact O-N 3.12Å; H766-T769 PolarHBondContact N-O 2.78Å; H766-T769 PolarHBondContact O-N 2.72Å; H766-T769 PolarHBondContact O-OG1 2.97Å
767	S	81.1	Confident	79.6	Confident	80 Å²	80	37.1 Å²	37.1	56%	0.559	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	37.3	-174.9	-50.3	0	0	0	0	113.1	D704 T769	D704-S767 PolarHBondContact O-N 3.13Å; S767-T769 VanDerWaalsContact C-N 3.28Å; S767-T769 PolarHBondContact O-N 3.23Å
768	G	77.7	Confident	79.2	Confident	65 Å²	65	36.2 Å²	36.2	67%	0.67	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.9	-13.1	-178	0	0	0	0	0	115.6	H765 H766	H765-G768 PolarHBondContact ND1-O 3.4Å; H766-G768 PolarHBondContact O-N 2.86Å; H766-G768 VanDerWaalsContact O-N 3.12Å
769	T	79.4	Confident	78.9	Confident	93 Å²	93	38 Å²	38	57%	0.571	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	141.1	177.8	65	0	0	0	0	111.4	H765 H766 S767 G771	H765-T769 CarbonylContact C-O 3.47Å; H765-T769 WeakPolarHBondContact CA-O 3.48Å; H766-T769 PolarHBondContact N-O 2.78Å; H766-T769 PolarHBondContact O-N 2.72Å; H766-T769 PolarHBondContact O-OG1 2.97Å; S767-T769 VanDerWaalsContact C-N 3.28Å; S767-T769 PolarHBondContact O-N 3.23Å; T769-G771 PolarHBondContact O-N 2.04Å
770	F	73.3	Confident	78.7	Confident	79 Å²	79	37.1 Å²	37.1	35%	0.346	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	116.9	178.1	178.1	-100	0	0	0	110.4	H666 H763 G772 R773	H666-F770 AromaticContact ND1-CE1 3.72Å; H763-F770 HydrophobicContact CB-CD2 4.49Å; H763-F770 HydrophobicContact CB-CE2 4.02Å; H763-F770 AromaticContact ND1-CE2 3.61Å; F770-G772 WeakPolarHBondContact CE2-O 3.13Å; F770-G772 WeakPolarHBondContact CZ-O 3.35Å; F770-R773 HydrophobicContact CZ-CB 4.19Å
771	G	65.1	Low	78.8	Confident	58 Å²	58	37.1 Å²	37.1	60%	0.598	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	-5.2	-177.9	0	0	0	0	0	114.4	F764 T769	F764-G771 PolarHBondContact O-N 3.25Å; T769-G771 PolarHBondContact O-N 2.04Å
772	G	70.2	Confident	79	Confident	13 Å²	13	37 Å²	37	13%	0.134	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139.3	-177.5	176.9	0	0	0	0	0	113.1	F764 F770	F764-G772 WeakPolarHBondContact CD2-O 2.99Å; F764-G772 PolarHBondContact N-O 3.22Å; F770-G772 WeakPolarHBondContact CE2-O 3.13Å; F770-G772 WeakPolarHBondContact CZ-O 3.35Å
773	R	74	Confident	79.2	Confident	86 Å²	86	37.2 Å²	37.2	33%	0.325	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	155.1	172.8	71.5	173	-177.5	-162.7	-15.6	113.1	H666 P668 I761 M762 F770	H666-R773 WeakPolarHBondContact O-CD 3.34Å; H666-R773 WeakPolarHBondContact O-CG 3.11Å; H666-R773 PolarHBondContact O-NE 2.85Å; H666-R773 PolarHBondContact O-NH2 3.43Å; P668-R773 WeakPolarHBondContact CA-O 3.21Å; I761-R773 HydrophobicContact CG2-CB 4.23Å; M762-R773 CarbonylContact O-C 3.49Å; M762-R773 WeakPolarHBondContact O-CA 3.4Å; M762-R773 WeakPolarHBondContact O-CB 3.37Å; F770-R773 HydrophobicContact CZ-CB 4.19Å
774	S	72.1	Confident	79.4	Confident	8 Å²	8	38.5 Å²	38.5	6%	0.056	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.2	169.9	175.2	0	0	0	0	109.3	I761 M762	I761-S774 CarbonylContact C-O 3.33Å; I761-S774 WeakPolarHBondContact CA-O 3.23Å; M762-S774 PolarHBondContact N-O 2.76Å; M762-S774 PolarHBondContact O-N 3.46Å
775	T	78.6	Confident	79.2	Confident	7 Å²	7	39.9 Å²	39.9	4%	0.043	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.4	-178.8	-56.2	0	0	0	0	110.2	L671 D759 L760 I761	L671-T775 HydrophobicContact CD2-CG2 4.46Å; D759-T775 HydrophobicContact CB-CG2 4.21Å; L760-T775 WeakPolarHBondContact O-CA 3.28Å; I761-T775 HydrophobicContact CG1-CG2 4.1Å
776	A	77.1	Confident	78.6	Confident	2 Å²	2	43 Å²	43	2%	0.017	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	119.1	167.4	0	0	0	0	0	109	L760 Y822	L760-A776 HydrophobicContact CB-CB 4.47Å; L760-A776 PolarHBondContact N-O 2.04Å; L760-A776 PolarHBondContact O-N 3.03Å; A776-Y822 HydrophobicContact CB-CE1 4.04Å
777	K	85	Confident	77.7	Confident	39 Å²	39	39.4 Å²	39.4	17%	0.17	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	129	169.5	-59.6	-157.7	160.7	-73.2	0	108.4	L672 Y673 N674 D759 F779	L672-K777 PolarHBondContact O-N 3.24Å; Y673-K777 HydrophobicContact CD1-CB 4.35Å; Y673-K777 HydrophobicContact CD1-CD 4.41Å; Y673-K777 HydrophobicContact CE1-CD 3.88Å; N674-K777 PolarHBondContact N-O 2.04Å; N674-K777 PolarHBondContact ND2-O 2.88Å; D759-K777 WeakPolarHBondContact OD1-CG 3.06Å; D759-K777 IonicContact OD1-NZ 2.81Å; D759-K777 PolarHBondContact OD1-NZ 3.06Å; D759-K777 IonicContact OD2-NZ 3.17Å; D759-K777 PolarHBondContact OD2-NZ 3.3Å; K777-F779 HydrophobicContact CB-CE2 4.07Å
778	I	85.5	Confident	76.2	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	119.7	-177	-52.7	168.7	0	0	0	107.8	N674 I676 I695 L744 V757 L758 L760	N674-I778 HydrophobicContact CB-CG1 4.48Å; N674-I778 CarbonylContact O-C 3.55Å; N674-I778 WeakPolarHBondContact O-CA 3.47Å; I676-I778 HydrophobicContact CD1-CG2 4.02Å; I695-I778 HydrophobicContact CD1-CD1 3.79Å; I695-I778 HydrophobicContact CD1-CG1 3.82Å; I695-I778 HydrophobicContact CD1-CG2 4.12Å; L744-I778 HydrophobicContact CD2-CD1 3.37Å; V757-I778 WeakPolarHBondContact CA-O 2.99Å; L758-I778 HydrophobicContact CB-CB 4.23Å; L758-I778 PolarHBondContact N-O 3.36Å; L758-I778 PolarHBondContact O-N 3.39Å; L760-I778 HydrophobicContact CB-CD1 4.16Å; L760-I778 HydrophobicContact CD2-CD1 4.29Å
779	F	86.7	Confident	74.5	Confident	37 Å²	37	43 Å²	43	16%	0.162	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.8	174.3	-69.1	-101.8	0	0	0	107	Y673 N674 F675 I676 V757 K777 F781	Y673-F779 HydrophobicContact CD1-CD2 4.49Å; Y673-F779 AromaticContact CD1-CE2 3.6Å; Y673-F779 HydrophobicContact CD1-CE2 3.6Å; Y673-F779 HydrophobicContact CD1-CZ 4.2Å; Y673-F779 HydrophobicContact CE1-CE2 4.2Å; Y673-F779 HydrophobicContact CE1-CZ 4.45Å; N674-F779 PolarHBondContact O-N 2.81Å; F675-F779 CarbonylContact C-O 3.43Å; F675-F779 WeakPolarHBondContact CA-O 3.43Å; F675-F779 HydrophobicContact CD1-CB 3.59Å; F675-F779 HydrophobicContact CD1-CD2 4.2Å; F675-F779 AromaticContact CD1-CG 3.92Å; F675-F779 HydrophobicContact CD1-CG 3.92Å; F675-F779 HydrophobicContact CE1-CB 4.08Å; F675-F779 HydrophobicContact CE1-CD1 4.41Å; F675-F779 AromaticContact CE1-CD2 3.93Å; F675-F779 HydrophobicContact CE1-CD2 3.93Å; F675-F779 AromaticContact CE1-CG 3.88Å; F675-F779 HydrophobicContact CE1-CG 3.88Å; F675-F779 HydrophobicContact CG-CB 4.47Å; I676-F779 PolarHBondContact N-O 2.81Å; V757-F779 HydrophobicContact CG1-CE1 4.21Å; V757-F779 HydrophobicContact CG1-CZ 4.23Å; V757-F779 HydrophobicContact CG2-CD1 3.93Å; V757-F779 HydrophobicContact CG2-CE1 3.93Å; K777-F779 HydrophobicContact CB-CE2 4.07Å; F779-F781 HydrophobicContact CB-CE1 4.11Å; F779-F781 HydrophobicContact CB-CE2 4.28Å; F779-F781 HydrophobicContact CB-CZ 3.77Å; F779-F781 HydrophobicContact CD1-CE1 4.39Å; F779-F781 HydrophobicContact CD1-CZ 4.26Å; F779-F781 HydrophobicContact CG-CZ 4.4Å
780	L	86.3	Confident	72.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116	178.1	-178.6	69.8	0	0	0	108.4	I676 L678 F731 L750 D755 V756 V782	I676-L780 HydrophobicContact CB-CD1 3.66Å; I676-L780 HydrophobicContact CG2-CD1 3.48Å; I676-L780 VanDerWaalsContact CG2-CD1 3.48Å; I676-L780 CarbonylContact O-C 3.59Å; I676-L780 WeakPolarHBondContact O-CA 3.27Å; L678-L780 HydrophobicContact CD1-CD1 3.65Å; L678-L780 HydrophobicContact CD1-CD2 4.35Å; L678-L780 HydrophobicContact CD1-CG 4.4Å; L678-L780 HydrophobicContact CG-CD1 3.8Å; F731-L780 HydrophobicContact CE1-CD2 3.78Å; F731-L780 HydrophobicContact CZ-CD2 3.91Å; L750-L780 HydrophobicContact CD1-CD2 3.6Å; D755-L780 CarbonylContact C-O 3.53Å; V756-L780 HydrophobicContact CB-CB 4.17Å; V756-L780 PolarHBondContact N-O 3.3Å; V756-L780 PolarHBondContact O-N 3.41Å; L780-V782 HydrophobicContact CG-CG2 4.45Å
781	F	86.6	Confident	70.9	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.009	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	113	179.3	-53.4	-50.2	0	0	0	109.5	I623 M625 K630 E632 F675 I676 S677 L678 D755 F779	I623-F781 HydrophobicContact CB-CE2 4.47Å; I623-F781 HydrophobicContact CD1-CE2 4.16Å; I623-F781 HydrophobicContact CG1-CE2 4.33Å; I623-F781 HydrophobicContact CG2-CD2 4.09Å; I623-F781 HydrophobicContact CG2-CE2 4.4Å; M625-F781 HydrophobicContact CE-CB 3.55Å; M625-F781 HydrophobicContact CG-CB 4.35Å; M625-F781 HydrophobicContact SD-CB 3.7Å; M625-F781 HydrophobicContact SD-CD2 4.42Å; M625-F781 HydrophobicContact SD-CG 4.23Å; K630-F781 HydrophobicContact CD-CD1 4.03Å; K630-F781 HydrophobicContact CD-CD2 4.16Å; K630-F781 HydrophobicContact CD-CE1 3.78Å; K630-F781 HydrophobicContact CD-CE2 3.89Å; K630-F781 HydrophobicContact CD-CG 4.22Å; K630-F781 HydrophobicContact CD-CZ 3.69Å; E632-F781 HydrophobicContact CG-CE2 4.22Å; E632-F781 HydrophobicContact CG-CZ 3.9Å; E632-F781 WeakPolarHBondContact OE1-CZ 3.42Å; F675-F781 HydrophobicContact CB-CE2 4.31Å; F675-F781 AromaticContact CD1-CE2 3.75Å; F675-F781 HydrophobicContact CD1-CE2 3.75Å; F675-F781 AromaticContact CD1-CZ 3.95Å; F675-F781 HydrophobicContact CD1-CZ 3.95Å; F675-F781 HydrophobicContact CG-CE2 4.47Å; I676-F781 PolarHBondContact O-N 2.88Å; S677-F781 CarbonylContact C-O 3.48Å; S677-F781 VanDerWaalsContact CA-O 3.3Å; S677-F781 WeakPolarHBondContact CA-O 3.23Å; L678-F781 PolarHBondContact N-O 2.88Å; D755-F781 HydrophobicContact CB-CD1 4.07Å; D755-F781 HydrophobicContact CB-CE1 4.33Å; D755-F781 VanDerWaalsContact OD1-CD1 3.26Å; D755-F781 WeakPolarHBondContact OD1-CD1 3.29Å; F779-F781 HydrophobicContact CB-CE1 4.11Å; F779-F781 HydrophobicContact CB-CE2 4.28Å; F779-F781 HydrophobicContact CB-CZ 3.77Å; F779-F781 HydrophobicContact CD1-CE1 4.39Å; F779-F781 HydrophobicContact CD1-CZ 4.26Å; F779-F781 HydrophobicContact CG-CZ 4.4Å
782	V	87.1	Confident	69.1	Low	2 Å²	2	45.2 Å²	45.2	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	119.7	178.3	-170.3	0	0	0	0	108.2	L678 L750 P753 Q754 L780	L678-V782 CarbonylContact O-C 3.34Å; L678-V782 WeakPolarHBondContact O-CA 3.39Å; L750-V782 HydrophobicContact CB-CG1 4.4Å; L750-V782 HydrophobicContact CB-CG2 4Å; L750-V782 HydrophobicContact CD1-CG2 3.97Å; P753-V782 VanDerWaalsContact CA-O 3.29Å; P753-V782 WeakPolarHBondContact CA-O 3.02Å; Q754-V782 HydrophobicContact CG-CB 3.94Å; Q754-V782 HydrophobicContact CG-CG2 3.91Å; Q754-V782 PolarHBondContact N-O 2.87Å; Q754-V782 VanDerWaalsContact N-O 3.11Å; Q754-V782 PolarHBondContact O-N 3.16Å; L780-V782 HydrophobicContact CG-CG2 4.45Å
783	S	83.1	Confident	67.1	Low	5 Å²	5	52.3 Å²	52.3	4%	0.035	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	165.7	-179.2	85.7	0	0	0	0	112.3	Y626 L678 S680 G752 F785	Y626-S783 WeakPolarHBondContact O-CB 3.39Å; Y626-S783 PolarHBondContact O-OG 2.85Å; L678-S783 PolarHBondContact O-N 3.33Å; S680-S783 VanDerWaalsContact CB-O 3.3Å; S680-S783 WeakPolarHBondContact CB-O 3.47Å; G752-S783 VanDerWaalsContact CA-O 3.24Å; G752-S783 WeakPolarHBondContact CA-O 3.15Å; S783-F785 VanDerWaalsContact C-N 3.28Å; S783-F785 PolarHBondContact OG-N 3.29Å; S783-F785 PolarHBondContact OG-O 2.82Å
784	A	84.7	Confident	64.8	Low	57 Å²	57	56.3 Å²	56.3	47%	0.471	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	-19.1	175.2	0	0	0	0	0	113.5	P753	P753-A784 HydrophobicContact CB-CB 4.17Å; P753-A784 HydrophobicContact CG-CB 4.15Å
785	F	71.7	Confident	62.7	Low	66 Å²	66	61.9 Å²	61.9	29%	0.289	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	139	-172.5	-65.2	-82.2	0	0	0	111.1	P592 F595 Y626 S680 S783	P592-F785 HydrophobicContact CB-CE1 4.21Å; P592-F785 HydrophobicContact CG-CE1 4.29Å; F595-F785 AromaticContact CE2-CD1 3.88Å; F595-F785 HydrophobicContact CE2-CD1 3.88Å; F595-F785 AromaticContact CE2-CD2 3.86Å; F595-F785 HydrophobicContact CE2-CD2 3.86Å; F595-F785 AromaticContact CE2-CE1 3.9Å; F595-F785 HydrophobicContact CE2-CE1 3.9Å; F595-F785 AromaticContact CE2-CE2 3.86Å; F595-F785 HydrophobicContact CE2-CE2 3.86Å; F595-F785 AromaticContact CE2-CG 3.86Å; F595-F785 HydrophobicContact CE2-CG 3.86Å; F595-F785 AromaticContact CE2-CZ 3.88Å; F595-F785 HydrophobicContact CE2-CZ 3.88Å; F595-F785 HydrophobicContact CZ-CB 4.24Å; F595-F785 HydrophobicContact CZ-CD1 4.3Å; F595-F785 HydrophobicContact CZ-CD2 4.16Å; F595-F785 AromaticContact CZ-CG 3.99Å; F595-F785 HydrophobicContact CZ-CG 3.99Å; Y626-F785 HydrophobicContact CD1-CB 3.6Å; Y626-F785 HydrophobicContact CE1-CB 3.96Å; Y626-F785 WeakPolarHBondContact O-CD2 3.22Å; S680-F785 WeakPolarHBondContact CB-O 3.41Å; S680-F785 PolarHBondContact N-O 3.09Å; S783-F785 VanDerWaalsContact C-N 3.28Å; S783-F785 PolarHBondContact OG-N 3.29Å; S783-F785 PolarHBondContact OG-O 2.82Å
786	K	66.5	Low	60.1	Low	107 Å²	107	72.1 Å²	72.1	47%	0.465	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	146.3	171.4	-57.7	-176.9	-172.3	-179.6	0	109.3	S680 N681 N788	S680-K786 WeakPolarHBondContact O-CA 3.37Å; N681-K786 HydrophobicContact CB-CD 4.38Å; N681-K786 HydrophobicContact CB-CG 4.45Å; N681-K786 VanDerWaalsContact ND2-CE 3.32Å; N681-K786 WeakPolarHBondContact ND2-CE 3.33Å; K786-N788 PolarHBondContact O-N 2.94Å
787	E	59.7	Low	57.8	Low	20 Å²	20	78.5 Å²	78.5	9%	0.093	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-65.8	-28.1	174.5	-155.7	159.4	-157.7	0	0	111.3	P679 N789 F790 I833	P679-E787 HydrophobicContact CB-CB 4.33Å; P679-E787 HydrophobicContact CG-CB 4.24Å; E787-N789 PolarHBondContact O-N 2.79Å; E787-F790 PolarHBondContact O-N 3Å; E787-I833 WeakPolarHBondContact OE1-CA 3.37Å; E787-I833 VanDerWaalsContact OE1-CG2 3.23Å; E787-I833 WeakPolarHBondContact OE1-CG2 3.31Å
788	N	50.5	Low	55.1	Low	102 Å²	102	79 Å²	79	55%	0.545	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-80.4	19.4	-172.4	-62.7	18.3	0	0	0	115.7	K786	K786-N788 PolarHBondContact O-N 2.94Å
789	N	41.1	Very low	52.3	Low	119 Å²	119	88.3 Å²	88.3	64%	0.636	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-98	-5.6	167.8	-92.7	19	0	0	0	113.2	E787	E787-N789 PolarHBondContact O-N 2.79Å
790	F	42.7	Very low	49.5	Very low	20 Å²	20	91.8 Å²	91.8	9%	0.088	47%	0.47	C	S	.	.	S	Bend	trans	-131.4	-0.8	-164.7	-65.8	-96.2	0	0	0	118.2	A577 G578 P592 C604 E787	A577-F790 VanDerWaalsContact C-CD1 3.42Å; A577-F790 HydrophobicContact CB-CB 3.93Å; A577-F790 HydrophobicContact CB-CD1 3.07Å; A577-F790 HydrophobicContact CB-CE1 3.73Å; A577-F790 HydrophobicContact CB-CG 3.82Å; A577-F790 WeakPolarHBondContact O-CD1 3.43Å; A577-F790 WeakPolarHBondContact O-CE1 3.39Å; A577-F790 VanDerWaalsContact O-CZ 3.23Å; A577-F790 WeakPolarHBondContact O-CZ 3.05Å; G578-F790 VanDerWaalsContact N-CE1 3.28Å; P592-F790 HydrophobicContact CG-CZ 4.11Å; C604-F790 HydrophobicContact CB-CD1 3.45Å; C604-F790 VanDerWaalsContact CB-CD1 3.45Å; C604-F790 HydrophobicContact CB-CE1 3.3Å; C604-F790 HydrophobicContact CB-CZ 4.24Å; C604-F790 WeakPolarHBondContact SG-CE1 3.3Å; E787-F790 PolarHBondContact O-N 3Å
791	T	33.8	Very low	46.5	Very low	79 Å²	79	98.6 Å²	98.6	49%	0.485	52%	0.515	S	S	.	.			trans	-149.1	102.5	-178.3	46.9	0	0	0	0	112.9
792	E	27.9	Very low	43.7	Very low	178 Å²	178	110 Å²	110	83%	0.832	56%	0.558	S	S	*	*			trans	-127.2	65.8	162.1	-144.2	-177.6	-146	0	0	108.7
793	I	28.9	Very low	40.9	Very low	161 Å²	161	119.2 Å²	119.2	83%	0.826	60%	0.598	S	S	*	*			trans	-141.8	112.6	160.3	-57.2	-177.9	0	0	0	108.3
794	L	25.4	Very low	38.5	Very low	171 Å²	171	124.1 Å²	124.1	90%	0.895	63%	0.633	S	S	*	*			trans	-62.7	132.1	175.2	-83.3	131.5	0	0	0	113
795	V	27	Very low	36.5	Very low	124 Å²	124	123.1 Å²	123.1	75%	0.752	62%	0.622	S	S	*	*			trans	-141.9	138.4	152.9	-174	0	0	0	0	109.4
796	R	25.4	Very low	34.8	Very low	222 Å²	222	128.7 Å²	128.7	84%	0.838	64%	0.642	S	S	*	*			trans	-86.5	138.6	174.6	-60.7	173.7	168.2	-166.2	-3	109.1
797	E	28.9	Very low	33.4	Very low	137 Å²	137	128.9 Å²	128.9	64%	0.64	65%	0.654	S	S	*	*				173.7	128	81.8	-81.6	-169.4	164.7	0	0	113.5	E831	E797-E831 PolarHBondContact N-OE2 3.12Å; E797-E831 VanDerWaalsContact N-OE2 3.08Å
798	G	27.4	Very low	32.5	Very low	49 Å²	49	135.3 Å²	135.3	51%	0.505	69%	0.689	S	S	.	*			trans	23.9	116.1	136.6	0	0	0	0	0	126.9
799	Y	27	Very low	32.4	Very low	197 Å²	197	133.9 Å²	133.9	77%	0.773	68%	0.681	S	S	*	*			trans	-151.3	142.1	151.1	-64.6	-78.5	0	0	0	115.1	S829	Y799-S829 PolarHBondContact N-OG 3.2Å; Y799-S829 WeakPolarHBondContact O-CB 3.45Å; Y799-S829 PolarHBondContact O-OG 3.16Å
800	T	27.1	Very low	32.5	Very low	110 Å²	110	134.5 Å²	134.5	68%	0.675	68%	0.683	S	S	*	*			trans	-133.7	145.4	173.6	48.8	0	0	0	0	112.6	P828 S829	T800-P828 HydrophobicContact CG2-CB 3.68Å; T800-S829 VanDerWaalsContact CG2-OG 3.29Å; T800-S829 WeakPolarHBondContact CG2-OG 3.32Å
801	C	24.9	Very low	32.6	Very low	142 Å²	142	137.7 Å²	137.7	96%	0.959	71%	0.708	S	S	*	*			trans	-116.8	138.7	-179	-77.1	0	0	0	0	113.4
802	R	27.4	Very low	33.3	Very low	242 Å²	242	135.9 Å²	135.9	91%	0.913	70%	0.698	S	S	*	*			trans	-132.3	133.7	175.4	-170.8	-179.5	-175.8	-174.8	1.7	111.3
803	K	28.7	Very low	33.9	Very low	195 Å²	195	131.3 Å²	131.3	85%	0.848	68%	0.679	S	S	*	*			trans	-101	136	170.2	-107.8	-178.7	178	178.3	0	110.7
804	S	33.1	Very low	34.3	Very low	109 Å²	109	126.2 Å²	126.2	76%	0.762	66%	0.661	S	S	*	*			trans	-134.3	128.3	175.8	40.2	0	0	0	0	110.8
805	C	41.6	Very low	35.1	Very low	35 Å²	35	124.9 Å²	124.9	24%	0.236	65%	0.654	C	S	.	*			trans	-77.6	152.3	169.5	-78.9	0	0	0	0	110.9	C812 M816	C805-C812 HydrophobicContact CB-CB 4.04Å; C805-C812 WeakPolarHBondContact CB-SG 3.46Å; C805-C812 WeakPolarHBondContact SG-CB 3.02Å; C805-C812 CovalentContact SG-SG 2.06Å; C805-C812 PolarHBondContact SG-SG 3.09Å; C805-M816 WeakPolarHBondContact SG-CE 3.4Å
806	Y	36.1	Very low	35.6	Very low	183 Å²	183	124.7 Å²	124.7	72%	0.718	65%	0.647	S	S	*	*			trans	-70	140	169.9	-121.5	-96.9	0	0	0	110.8	L808 D809	Y806-L808 PolarHBondContact O-N 3.27Å; Y806-D809 PolarHBondContact O-N 3.03Å
807	P	36.9	Very low	35.9	Very low	111 Å²	111	118.8 Å²	118.8	72%	0.721	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-13.9	-175.1	-22.6	32.3	0	0	0	116.1
808	L	40.4	Very low	35.9	Very low	156 Å²	156	115.5 Å²	115.5	82%	0.817	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-1.5	-177	-69.5	167	0	0	0	113.2	Y806 I810	Y806-L808 PolarHBondContact O-N 3.27Å; L808-I810 PolarHBondContact O-N 3.3Å; L808-I810 VanDerWaalsContact O-N 3.1Å
809	D	48.8	Very low	36	Very low	71 Å²	71	117.1 Å²	117.1	38%	0.38	64%	0.635	S	S	.	*			trans	-85.9	83.1	177.3	-169.3	-16.6	0	0	0	109.6	Y806 S811 C812 L813	Y806-D809 PolarHBondContact O-N 3.03Å; D809-S811 PolarHBondContact O-N 3.19Å; D809-S811 WeakPolarHBondContact OD1-CB 3.37Å; D809-S811 PolarHBondContact OD1-N 3.03Å; D809-S811 VanDerWaalsContact OD1-N 3.13Å; D809-C812 HydrophobicContact CB-CB 3.73Å; D809-C812 PolarHBondContact O-N 3.01Å; D809-C812 VanDerWaalsContact O-N 3.13Å; D809-C812 PolarHBondContact OD1-N 3.28Å; D809-C812 WeakPolarHBondContact OD2-CB 3.04Å; D809-L813 WeakPolarHBondContact O-CB 3.44Å; D809-L813 WeakPolarHBondContact O-CG 3.47Å; D809-L813 PolarHBondContact O-N 3.26Å
810	I	44.2	Very low	36	Very low	133 Å²	133	110.1 Å²	110.1	68%	0.682	61%	0.611	S	S	*	*	H	α-helix	trans	-58.8	-26.6	177.9	-62.5	174.7	0	0	0	110.6	L808 A814	L808-I810 PolarHBondContact O-N 3.3Å; L808-I810 VanDerWaalsContact O-N 3.1Å; I810-A814 WeakPolarHBondContact O-CB 3.43Å; I810-A814 PolarHBondContact O-N 3.03Å
811	S	44.8	Very low	36	Very low	87 Å²	87	107.9 Å²	107.9	61%	0.608	60%	0.6	S	S	*	*	H	α-helix	trans	-76.3	-38.9	176.1	-54	0	0	0	0	112.6	D809 N815	D809-S811 PolarHBondContact O-N 3.19Å; D809-S811 WeakPolarHBondContact OD1-CB 3.37Å; D809-S811 PolarHBondContact OD1-N 3.03Å; D809-S811 VanDerWaalsContact OD1-N 3.13Å; S811-N815 WeakPolarHBondContact O-CB 3.02Å; S811-N815 PolarHBondContact O-N 3.31Å
812	C	47.4	Very low	36.2	Very low	41 Å²	41	103 Å²	103	28%	0.277	56%	0.562	S	S	.	*	H	α-helix	trans	-65.4	-42.8	170.8	-165.9	0	0	0	0	111.3	C805 D809 M816	C805-C812 HydrophobicContact CB-CB 4.04Å; C805-C812 WeakPolarHBondContact CB-SG 3.46Å; C805-C812 WeakPolarHBondContact SG-CB 3.02Å; C805-C812 CovalentContact SG-SG 2.06Å; C805-C812 PolarHBondContact SG-SG 3.09Å; D809-C812 HydrophobicContact CB-CB 3.73Å; D809-C812 PolarHBondContact O-N 3.01Å; D809-C812 VanDerWaalsContact O-N 3.13Å; D809-C812 PolarHBondContact OD1-N 3.28Å; D809-C812 WeakPolarHBondContact OD2-CB 3.04Å; C812-M816 WeakPolarHBondContact O-CG 3.15Å; C812-M816 PolarHBondContact O-N 3.33Å
813	L	40.6	Very low	36.2	Very low	82 Å²	82	96.2 Å²	96.2	43%	0.429	54%	0.54	S	S	.	.	H	α-helix	trans	-67.2	-42.3	176.9	-72.7	162.4	0	0	0	112	D809 M816	D809-L813 WeakPolarHBondContact O-CB 3.44Å; D809-L813 WeakPolarHBondContact O-CG 3.47Å; D809-L813 PolarHBondContact O-N 3.26Å; L813-M816 PolarHBondContact O-N 2.79Å
814	A	38.3	Very low	36.1	Very low	54 Å²	54	91.2 Å²	91.2	45%	0.446	52%	0.518	S	S	.	.	H	α-helix	trans	-75.1	-27.2	-179.7	0	0	0	0	0	114	I810 M816 T817	I810-A814 WeakPolarHBondContact O-CB 3.43Å; I810-A814 PolarHBondContact O-N 3.03Å; A814-M816 VanDerWaalsContact C-N 3.28Å; A814-T817 PolarHBondContact O-OG1 2.02Å
815	N	41.1	Very low	35.9	Very low	142 Å²	142	90.2 Å²	90.2	76%	0.759	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-9.8	171.8	-94.1	-15.8	0	0	0	113.6	S811	S811-N815 WeakPolarHBondContact O-CB 3.02Å; S811-N815 PolarHBondContact O-N 3.31Å
816	M	38.3	Very low	35.2	Very low	120 Å²	120	93.4 Å²	93.4	59%	0.591	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-8.9	173	-75.3	-173	175	0	0	113.6	C805 C812 L813 A814	C805-M816 WeakPolarHBondContact SG-CE 3.4Å; C812-M816 WeakPolarHBondContact O-CG 3.15Å; C812-M816 PolarHBondContact O-N 3.33Å; L813-M816 PolarHBondContact O-N 2.79Å; A814-M816 VanDerWaalsContact C-N 3.28Å
817	T	31.4	Very low	34.8	Very low	99 Å²	99	86.1 Å²	86.1	61%	0.607	50%	0.5	S	S	*	.	S	Bend	trans	-105.4	10	-173.7	40.6	0	0	0	0	114.6	A814	A814-T817 PolarHBondContact O-OG1 2.02Å
818	A	28.4	Very low	34.4	Very low	68 Å²	68	84.2 Å²	84.2	56%	0.562	49%	0.487	S	S	*	.	S	Bend	trans	-120.2	114.5	176.2	0	0	0	0	0	111.3
819	S	30.1	Very low	33.8	Very low	83 Å²	83	79 Å²	79	58%	0.58	46%	0.464	S	S	*	.	S	Bend	trans	83.7	128.1	179.9	85.7	0	0	0	0	116	S821	S819-S821 PolarHBondContact O-N 3.22Å; S819-S821 PolarHBondContact O-OG 3.11Å
820	I	26.8	Very low	32.9	Very low	49 Å²	49	77.8 Å²	77.8	25%	0.251	46%	0.459	S	S	.	.			trans	-50.9	103.2	169.5	-65.9	162.7	0	0	0	107.4	M762 F764 Y822	M762-I820 HydrophobicContact CE-CD1 3.88Å; M762-I820 HydrophobicContact CE-CG2 4.11Å; F764-I820 HydrophobicContact CZ-CD1 3.85Å; I820-Y822 HydrophobicContact CB-CE2 4.5Å; I820-Y822 HydrophobicContact CG2-CD2 4.23Å; I820-Y822 HydrophobicContact CG2-CE2 3.66Å
821	S	27	Very low	32.3	Very low	64 Å²	64	78 Å²	78	45%	0.448	46%	0.457	S	S	.	.			trans	-95.3	105.5	-178.8	-61.4	0	0	0	0	107.3	S819 Q823	S819-S821 PolarHBondContact O-N 3.22Å; S819-S821 PolarHBondContact O-OG 3.11Å; S821-Q823 PolarHBondContact O-N 3.38Å
822	Y	29.4	Very low	31.8	Very low	40 Å²	40	78.1 Å²	78.1	16%	0.157	45%	0.45	C	S	.	.			trans	-70	109.1	170.5	-60.1	-97.9	0	0	0	106.9	L672 I695 L697 A776 I820	L672-Y822 HydrophobicContact CB-CE2 4.44Å; L672-Y822 HydrophobicContact CD2-CD1 4.34Å; L672-Y822 HydrophobicContact CD2-CD2 3.29Å; L672-Y822 HydrophobicContact CD2-CE1 4.15Å; L672-Y822 HydrophobicContact CD2-CE2 3.11Å; L672-Y822 HydrophobicContact CD2-CG 3.94Å; L672-Y822 HydrophobicContact CG-CE2 4.34Å; I695-Y822 HydrophobicContact CG2-CD1 4.05Å; L697-Y822 HydrophobicContact CD2-CD1 3.77Å; L697-Y822 HydrophobicContact CD2-CE1 3.33Å; A776-Y822 HydrophobicContact CB-CE1 4.04Å; I820-Y822 HydrophobicContact CB-CE2 4.5Å; I820-Y822 HydrophobicContact CG2-CD2 4.23Å; I820-Y822 HydrophobicContact CG2-CE2 3.66Å
823	Q	25.9	Very low	31	Very low	98 Å²	98	78.2 Å²	78.2	46%	0.458	45%	0.448	S	S	.	.	B	Isolated β-bridge	trans	-85.4	112.5	165.5	-91.7	-178.3	-32.6	0	0	107.3	S821 I825	S821-Q823 PolarHBondContact O-N 3.38Å; Q823-I825 PolarHBondContact O-N 2.78Å; Q823-I825 VanDerWaalsContact O-N 3.11Å
824	F	28.4	Very low	30.5	Very low	90 Å²	90	81.1 Å²	81.1	40%	0.395	46%	0.457	S	S	.	.			trans	-65.6	107.3	160.4	-63.4	-74.4	0	0	0	107	S826 I839	F824-S826 PolarHBondContact O-N 3.43Å; F824-I839 HydrophobicContact CB-CD1 3.84Å; F824-I839 HydrophobicContact CD1-CD1 3.1Å; F824-I839 HydrophobicContact CD1-CG1 3.64Å; F824-I839 HydrophobicContact CD2-CD1 3.75Å; F824-I839 HydrophobicContact CE1-CB 4.27Å; F824-I839 HydrophobicContact CE1-CD1 3.45Å; F824-I839 VanDerWaalsContact CE1-CD1 3.45Å; F824-I839 HydrophobicContact CE1-CG1 3.44Å; F824-I839 VanDerWaalsContact CE1-CG1 3.44Å; F824-I839 HydrophobicContact CE1-CG2 3.88Å; F824-I839 HydrophobicContact CE2-CD1 4.06Å; F824-I839 HydrophobicContact CE2-CG1 4.42Å; F824-I839 HydrophobicContact CE2-CG2 3.92Å; F824-I839 HydrophobicContact CG-CD1 3.26Å; F824-I839 HydrophobicContact CG-CG1 4.21Å; F824-I839 HydrophobicContact CZ-CB 4.21Å; F824-I839 HydrophobicContact CZ-CD1 3.93Å; F824-I839 HydrophobicContact CZ-CG1 3.88Å; F824-I839 HydrophobicContact CZ-CG2 3.42Å; F824-I839 VanDerWaalsContact CZ-CG2 3.42Å
825	I	27.2	Very low	30.2	Very low	88 Å²	88	79.3 Å²	79.3	45%	0.451	44%	0.441	S	S	.	.			trans	-78.4	99.8	163.8	-63.1	-179.1	0	0	0	104.4	T696 Q823 L827	T696-I825 HydrophobicContact CG2-CD1 4.33Å; T696-I825 WeakPolarHBondContact OG1-CD1 3.04Å; Q823-I825 PolarHBondContact O-N 2.78Å; Q823-I825 VanDerWaalsContact O-N 3.11Å; I825-L827 PolarHBondContact O-N 2.8Å
826	S	27.9	Very low	29.5	Very low	102 Å²	102	76.2 Å²	76.2	71%	0.713	43%	0.428	S	S	*	.			trans	-53	128.5	156.1	58	0	0	0	0	106.7	F824	F824-S826 PolarHBondContact O-N 3.43Å
827	L	28.5	Very low	29.1	Very low	31 Å²	31	73.3 Å²	73.3	16%	0.162	42%	0.415	C	S	.	.			trans	-37.8	137.3	172.9	-68.8	158.5	0	0	0	110.7	L689 L692 P693 I825 S829 I833 L837	L689-L827 HydrophobicContact CD1-CD2 3.52Å; L692-L827 HydrophobicContact CD1-CD1 4.14Å; L692-L827 HydrophobicContact CD1-CD2 3.83Å; P693-L827 HydrophobicContact CG-CD2 4.1Å; I825-L827 PolarHBondContact O-N 2.8Å; L827-S829 PolarHBondContact O-N 3.47Å; L827-I833 HydrophobicContact CD1-CD1 3.72Å; L827-L837 HydrophobicContact CD1-CD1 4.5Å
828	P	28.4	Very low	29.1	Very low	70 Å²	70	69 Å²	69	46%	0.455	39%	0.388	S	S	.	.	S	Bend	trans	-62.3	112.3	171.3	27.2	-30.6	0	0	0	107.9	T800 V830	T800-P828 HydrophobicContact CG2-CB 3.68Å; P828-V830 WeakPolarHBondContact O-CG2 3.02Å; P828-V830 PolarHBondContact O-N 2.04Å
829	S	27.2	Very low	29.3	Very low	47 Å²	47	68.9 Å²	68.9	33%	0.329	38%	0.377	S	S	.	.	S	Bend	trans	60.7	57.1	147.4	-39.8	0	0	0	0	117.2	Y799 T800 L827	Y799-S829 PolarHBondContact N-OG 3.2Å; Y799-S829 WeakPolarHBondContact O-CB 3.45Å; Y799-S829 PolarHBondContact O-OG 3.16Å; T800-S829 VanDerWaalsContact CG2-OG 3.29Å; T800-S829 WeakPolarHBondContact CG2-OG 3.32Å; L827-S829 PolarHBondContact O-N 3.47Å
830	V	29.3	Very low	29.3	Very low	46 Å²	46	65.5 Å²	65.5	28%	0.279	36%	0.355	S	S	.	.			trans	-132.7	107	168.4	-155.7	0	0	0	0	110.6	F687 P828 L832	F687-V830 HydrophobicContact CB-CG2 4.31Å; F687-V830 HydrophobicContact CD1-CB 3.81Å; F687-V830 HydrophobicContact CD1-CG1 3.75Å; F687-V830 HydrophobicContact CD1-CG2 3.88Å; F687-V830 HydrophobicContact CE1-CB 4.37Å; F687-V830 HydrophobicContact CE1-CG1 4.2Å; P828-V830 WeakPolarHBondContact O-CG2 3.02Å; P828-V830 PolarHBondContact O-N 2.04Å; V830-L832 HydrophobicContact CG1-CB 3.59Å; V830-L832 HydrophobicContact CG1-CD1 3.22Å; V830-L832 HydrophobicContact CG1-CG 3.92Å; V830-L832 PolarHBondContact O-N 3.17Å
831	E	31.7	Very low	29.5	Very low	136 Å²	136	68 Å²	68	64%	0.636	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	22.7	167.6	-69.3	-179.7	126.5	0	0	113.4	E797	E797-E831 PolarHBondContact N-OE2 3.12Å; E797-E831 VanDerWaalsContact N-OE2 3.08Å
832	L	33.9	Very low	29.8	Very low	90 Å²	90	68.2 Å²	68.2	47%	0.471	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-7.5	-174.6	-83.1	130.4	0	0	0	114.8	F687 V830	F687-L832 HydrophobicContact CE1-CB 4Å; V830-L832 HydrophobicContact CG1-CB 3.59Å; V830-L832 HydrophobicContact CG1-CD1 3.22Å; V830-L832 HydrophobicContact CG1-CG 3.92Å; V830-L832 PolarHBondContact O-N 3.17Å
833	I	31.4	Very low	30	Very low	44 Å²	44	70.7 Å²	70.7	23%	0.226	37%	0.367	C	S	.	.			trans	-108.9	96.2	174.1	-39.5	-176.7	0	0	0	109.4	F687 E787 L827 S835	F687-I833 HydrophobicContact CE1-CD1 3.77Å; F687-I833 HydrophobicContact CE1-CG1 3.47Å; F687-I833 VanDerWaalsContact CE1-CG1 3.47Å; F687-I833 HydrophobicContact CZ-CD1 3.86Å; F687-I833 HydrophobicContact CZ-CG1 3.71Å; E787-I833 WeakPolarHBondContact OE1-CA 3.37Å; E787-I833 VanDerWaalsContact OE1-CG2 3.23Å; E787-I833 WeakPolarHBondContact OE1-CG2 3.31Å; L827-I833 HydrophobicContact CD1-CD1 3.72Å; I833-S835 WeakPolarHBondContact CG2-O 3.21Å; I833-S835 PolarHBondContact O-N 2.96Å
834	K	30.1	Very low	30.3	Very low	143 Å²	143	69 Å²	69	62%	0.622	36%	0.364	S	S	*	.	S	Bend	trans	-73.4	-11.2	177.9	-85.8	-169.9	176.6	-173.6	0	113.7
835	S	30.9	Very low	30.6	Very low	15 Å²	15	68.8 Å²	68.8	11%	0.105	36%	0.364	C	S	.	.	S	Bend	trans	-103	122.9	164.4	49.8	0	0	0	0	108.3	I833 L837	I833-S835 WeakPolarHBondContact CG2-O 3.21Å; I833-S835 PolarHBondContact O-N 2.96Å; S835-L837 PolarHBondContact O-N 3.06Å
836	P	28.2	Very low	30.9	Very low	77 Å²	77	68.5 Å²	68.5	50%	0.5	37%	0.371	S	S	.	.			trans	-52.7	141.3	172.5	5.7	-2.6	0	0	0	108.1	E838	P836-E838 HydrophobicContact CB-CG 4.01Å; P836-E838 HydrophobicContact CG-CG 3.78Å; P836-E838 WeakPolarHBondContact O-CG 3.36Å; P836-E838 PolarHBondContact O-N 2.69Å
837	L	29.1	Very low	31.4	Very low	59 Å²	59	76 Å²	76	31%	0.309	38%	0.383	S	S	.	.			trans	-57.5	89.3	159.1	-137.1	122.9	0	0	0	105.1	I676 L678 L827 S835 I839	I676-L837 HydrophobicContact CG2-CD2 3.78Å; L678-L837 HydrophobicContact CD2-CD1 3.93Å; L678-L837 HydrophobicContact CD2-CG 4.26Å; L827-L837 HydrophobicContact CD1-CD1 4.5Å; S835-L837 PolarHBondContact O-N 3.06Å; L837-I839 PolarHBondContact O-N 3.01Å
838	E	32.2	Very low	31.7	Very low	10 Å²	10	79 Å²	79	5%	0.047	40%	0.403	C	S	.	.			trans	-79.6	97.9	-168.2	-80.3	-132.3	151.1	0	0	107.7	N624 P836 G840 R841	N624-E838 HydrophobicContact CB-CB 4.46Å; N624-E838 HydrophobicContact CB-CG 4.26Å; N624-E838 WeakPolarHBondContact CB-OE2 3.48Å; P836-E838 HydrophobicContact CB-CG 4.01Å; P836-E838 HydrophobicContact CG-CG 3.78Å; P836-E838 WeakPolarHBondContact O-CG 3.36Å; P836-E838 PolarHBondContact O-N 2.69Å; E838-G840 PolarHBondContact O-N 3.19Å; E838-G840 VanDerWaalsContact O-N 3.15Å; E838-R841 IonicContact OE1-CZ 2.86Å; E838-R841 VanDerWaalsContact OE1-CZ 3.27Å; E838-R841 IonicContact OE1-NE 2.68Å; E838-R841 PolarHBondContact OE1-NE 2.73Å; E838-R841 IonicContact OE1-NH2 3.57Å; E838-R841 PolarHBondContact OE1-NH2 3.14Å
839	I	32.7	Very low	31.8	Very low	64 Å²	64	81.6 Å²	81.6	33%	0.328	42%	0.42	S	S	.	.			trans	-68.9	109.6	160.1	-60.1	132.8	0	0	0	105.5	F824 L837 R841	F824-I839 HydrophobicContact CB-CD1 3.84Å; F824-I839 HydrophobicContact CD1-CD1 3.1Å; F824-I839 HydrophobicContact CD1-CG1 3.64Å; F824-I839 HydrophobicContact CD2-CD1 3.75Å; F824-I839 HydrophobicContact CE1-CB 4.27Å; F824-I839 HydrophobicContact CE1-CD1 3.45Å; F824-I839 VanDerWaalsContact CE1-CD1 3.45Å; F824-I839 HydrophobicContact CE1-CG1 3.44Å; F824-I839 VanDerWaalsContact CE1-CG1 3.44Å; F824-I839 HydrophobicContact CE1-CG2 3.88Å; F824-I839 HydrophobicContact CE2-CD1 4.06Å; F824-I839 HydrophobicContact CE2-CG1 4.42Å; F824-I839 HydrophobicContact CE2-CG2 3.92Å; F824-I839 HydrophobicContact CG-CD1 3.26Å; F824-I839 HydrophobicContact CG-CG1 4.21Å; F824-I839 HydrophobicContact CZ-CB 4.21Å; F824-I839 HydrophobicContact CZ-CD1 3.93Å; F824-I839 HydrophobicContact CZ-CG1 3.88Å; F824-I839 HydrophobicContact CZ-CG2 3.42Å; F824-I839 VanDerWaalsContact CZ-CG2 3.42Å; L837-I839 PolarHBondContact O-N 3.01Å; I839-R841 PolarHBondContact O-N 2.8Å
840	G	29.1	Very low	31.8	Very low	12 Å²	12	89.4 Å²	89.4	12%	0.124	44%	0.442	C	S	.	.			trans	-32.9	122.2	-167.3	0	0	0	0	0	114.7	E838 I842	E838-G840 PolarHBondContact O-N 3.19Å; E838-G840 VanDerWaalsContact O-N 3.15Å; G840-I842 PolarHBondContact O-N 2.9Å
841	R	31.6	Very low	31.9	Very low	103 Å²	103	91.4 Å²	91.4	39%	0.389	46%	0.456	S	S	.	.			trans	-68	116.1	175.1	-69.3	-174.8	-169.7	159.5	15.7	109.3	D608 C622 E838 I839 Y843	D608-R841 IonicContact OD2-CZ 2.73Å; D608-R841 IonicContact OD2-NH1 3.32Å; D608-R841 PolarHBondContact OD2-NH1 2.73Å; D608-R841 IonicContact OD2-NH2 3.5Å; D608-R841 PolarHBondContact OD2-NH2 3.05Å; C622-R841 PolarHBondContact O-N 2.69Å; E838-R841 IonicContact OE1-CZ 2.86Å; E838-R841 VanDerWaalsContact OE1-CZ 3.27Å; E838-R841 IonicContact OE1-NE 2.68Å; E838-R841 PolarHBondContact OE1-NE 2.73Å; E838-R841 IonicContact OE1-NH2 3.57Å; E838-R841 PolarHBondContact OE1-NH2 3.14Å; I839-R841 PolarHBondContact O-N 2.8Å; R841-Y843 HydrophobicContact CB-CD2 4.45Å; R841-Y843 HydrophobicContact CB-CE2 3.86Å; R841-Y843 WeakPolarHBondContact CD-OH 3.3Å; R841-Y843 PolarHBondContact O-N 3.29Å
842	I	32	Very low	31.7	Very low	68 Å²	68	93.3 Å²	93.3	35%	0.349	46%	0.459	S	S	.	.			trans	-85.2	100.7	171.3	-58.9	171.3	0	0	0	107.9	I621 K647 N648 G840	I621-I842 HydrophobicContact CD1-CG1 4.37Å; I621-I842 HydrophobicContact CG1-CG1 4.37Å; I621-I842 HydrophobicContact CG2-CG1 4.21Å; K647-I842 HydrophobicContact CB-CD1 4.27Å; K647-I842 HydrophobicContact CB-CG2 3.76Å; K647-I842 HydrophobicContact CD-CG2 3.69Å; K647-I842 HydrophobicContact CG-CG2 3.63Å; N648-I842 HydrophobicContact CB-CD1 3.97Å; G840-I842 PolarHBondContact O-N 2.9Å
843	Y	34.2	Very low	31.3	Very low	92 Å²	92	97.3 Å²	97.3	36%	0.361	47%	0.472	S	S	.	.			trans	-73.7	133.3	171.7	-64.6	-83.2	0	0	0	110.4	C610 A611 C622 R841	C610-Y843 VanDerWaalsContact C-OH 3.23Å; C610-Y843 HydrophobicContact CB-CE2 4Å; C610-Y843 VanDerWaalsContact O-CE2 3.24Å; C610-Y843 WeakPolarHBondContact O-CE2 3.29Å; C610-Y843 PolarHBondContact O-OH 3.22Å; A611-Y843 WeakPolarHBondContact CA-OH 3.39Å; A611-Y843 PolarHBondContact N-OH 3.07Å; C622-Y843 HydrophobicContact CB-CE2 4.47Å; R841-Y843 HydrophobicContact CB-CD2 4.45Å; R841-Y843 HydrophobicContact CB-CE2 3.86Å; R841-Y843 WeakPolarHBondContact CD-OH 3.3Å; R841-Y843 PolarHBondContact O-N 3.29Å
844	P	32.8	Very low	31.1	Very low	62 Å²	62	100.3 Å²	100.3	40%	0.403	49%	0.493	S	S	.	.			trans	-68.3	135.8	174	29.5	-35.6	0	0	0	111.1	S846 Y852	P844-S846 PolarHBondContact O-N 3.48Å; P844-Y852 HydrophobicContact CB-CE2 3.96Å; P844-Y852 VanDerWaalsContact CB-OH 3.31Å; P844-Y852 WeakPolarHBondContact CB-OH 3.5Å; P844-Y852 HydrophobicContact CG-CE2 3.65Å
845	E	33.6	Very low	30.9	Very low	85 Å²	85	100.7 Å²	100.7	40%	0.397	49%	0.494	S	S	.	.	S	Bend	trans	-71.6	95.1	164.8	-84.7	160.9	106.3	0	0	109	H618 K647	H618-E845 VanDerWaalsContact C-CD 3.44Å; H618-E845 HydrophobicContact CB-CG 4.31Å; H618-E845 WeakPolarHBondContact CB-OE1 3.29Å; H618-E845 IonicContact CG-OE1 3.52Å; H618-E845 IonicContact ND1-OE1 3.84Å; H618-E845 WeakPolarHBondContact O-CG 3.27Å; K647-E845 IonicContact NZ-OE2 2.92Å; K647-E845 PolarHBondContact NZ-OE2 3.38Å
846	S	34.6	Very low	30.7	Very low	83 Å²	83	109.6 Å²	109.6	58%	0.58	53%	0.527	S	S	*	.	S	Bend	trans	176.7	141.2	143.1	39.5	0	0	0	0	109.9	P844 T848	P844-S846 PolarHBondContact O-N 3.48Å; S846-T848 PolarHBondContact O-N 3.42Å
847	R	37.7	Very low	30.7	Very low	258 Å²	258	113.2 Å²	113.2	97%	0.974	54%	0.537	S	S	*	.	S	Bend	trans	-66.4	43.1	175.6	-64.6	180	-178.3	-179.1	0	113.3
848	T	34.7	Very low	30.6	Very low	95 Å²	95	116.4 Å²	116.4	58%	0.583	55%	0.553	S	S	*	*	S	Bend	trans	-126.5	113.8	172	47.8	0	0	0	0	108.2	S846 R850	S846-T848 PolarHBondContact O-N 3.42Å; T848-R850 PolarHBondContact O-N 3.1Å
849	P	30.2	Very low	30.5	Very low	125 Å²	125	123.5 Å²	123.5	81%	0.812	59%	0.591	S	S	*	*			trans	-72.4	94.8	180	30.6	-30.9	0	0	0	107.9
850	R	28.7	Very low	30.3	Very low	211 Å²	211	128.3 Å²	128.3	80%	0.796	61%	0.607	S	S	*	*			trans	-120.8	98.4	151.6	-70	-163.3	-171.8	-151.5	4.2	106.6	T848 Y852	T848-R850 PolarHBondContact O-N 3.1Å; R850-Y852 PolarHBondContact O-N 3.47Å
851	P	30.5	Very low	30.2	Very low	87 Å²	87	134 Å²	134	57%	0.565	64%	0.642	S	S	*	*			trans	-63	124.5	170	-4.3	19	0	0	0	106.9	F853	P851-F853 HydrophobicContact CB-CD2 4.06Å; P851-F853 HydrophobicContact CB-CE1 4.4Å; P851-F853 HydrophobicContact CB-CE2 3.61Å; P851-F853 HydrophobicContact CB-CZ 3.8Å; P851-F853 HydrophobicContact CG-CE2 3.63Å; P851-F853 HydrophobicContact CG-CZ 3.77Å; P851-F853 WeakPolarHBondContact O-CD2 3Å; P851-F853 PolarHBondContact O-N 2.7Å
852	Y	27.3	Very low	30.4	Very low	177 Å²	177	133.5 Å²	133.5	69%	0.694	65%	0.654	S	S	*	*			trans	-73.5	108.7	160.6	-33.7	-75.9	0	0	0	105.9	P844 R850	P844-Y852 HydrophobicContact CB-CE2 3.96Å; P844-Y852 VanDerWaalsContact CB-OH 3.31Å; P844-Y852 WeakPolarHBondContact CB-OH 3.5Å; P844-Y852 HydrophobicContact CG-CE2 3.65Å; R850-Y852 PolarHBondContact O-N 3.47Å
853	F	25.9	Very low	30.3	Very low	173 Å²	173	141.6 Å²	141.6	76%	0.759	68%	0.68	S	S	*	*			trans	-82.8	120.5	171.6	-66.9	-87.4	0	0	0	108.7	P851 K855	P851-F853 HydrophobicContact CB-CD2 4.06Å; P851-F853 HydrophobicContact CB-CE1 4.4Å; P851-F853 HydrophobicContact CB-CE2 3.61Å; P851-F853 HydrophobicContact CB-CZ 3.8Å; P851-F853 HydrophobicContact CG-CE2 3.63Å; P851-F853 HydrophobicContact CG-CZ 3.77Å; P851-F853 WeakPolarHBondContact O-CD2 3Å; P851-F853 PolarHBondContact O-N 2.7Å; F853-K855 PolarHBondContact O-N 2.99Å
854	V	26.6	Very low	30.2	Very low	107 Å²	107	141.9 Å²	141.9	65%	0.648	70%	0.696	S	S	*	*			trans	-82.6	99.2	158	-179	0	0	0	0	106.3	Y856	V854-Y856 HydrophobicContact CB-CE2 4.19Å; V854-Y856 HydrophobicContact CG1-CD2 4.29Å; V854-Y856 HydrophobicContact CG1-CE1 4.12Å; V854-Y856 HydrophobicContact CG1-CE2 3.7Å; V854-Y856 PolarHBondContact O-N 2.92Å
855	K	26.4	Very low	30	Very low	151 Å²	151	149.1 Å²	149.1	66%	0.657	72%	0.716	S	S	*	*			trans	-73.4	113.2	174.8	-168.2	-177.1	177.4	-155.9	0	108.5	F853 E857	F853-K855 PolarHBondContact O-N 2.99Å; K855-E857 WeakPolarHBondContact CE-OE1 3.34Å; K855-E857 IonicContact NZ-OE1 3.53Å; K855-E857 PolarHBondContact NZ-OE1 2.77Å; K855-E857 IonicContact NZ-OE2 2.67Å; K855-E857 PolarHBondContact NZ-OE2 3.35Å
856	Y	27.4	Very low	29.7	Very low	202 Å²	202	155.5 Å²	155.5	79%	0.792	74%	0.743	S	S	*	*			trans	-92	112.8	163.8	-61.4	-83.1	0	0	0	107.2	V854	V854-Y856 HydrophobicContact CB-CE2 4.19Å; V854-Y856 HydrophobicContact CG1-CD2 4.29Å; V854-Y856 HydrophobicContact CG1-CE1 4.12Å; V854-Y856 HydrophobicContact CG1-CE2 3.7Å; V854-Y856 PolarHBondContact O-N 2.92Å
857	E	27.9	Very low	29.3	Very low	153 Å²	153	155.7 Å²	155.7	72%	0.715	75%	0.75	S	S	*	*			trans	-103.4	118.9	178.1	-155.1	157	-148.3	0	0	107.6	K855	K855-E857 WeakPolarHBondContact CE-OE1 3.34Å; K855-E857 IonicContact NZ-OE1 3.53Å; K855-E857 PolarHBondContact NZ-OE1 2.77Å; K855-E857 IonicContact NZ-OE2 2.67Å; K855-E857 PolarHBondContact NZ-OE2 3.35Å
858	I	27	Very low	28.8	Very low	126 Å²	126	151.7 Å²	151.7	65%	0.646	75%	0.747	S	S	*	*			trans	-95.4	111.6	-178.7	-59.4	171.9	0	0	0	106.9	Y860	I858-Y860 HydrophobicContact CG2-CD2 4.41Å; I858-Y860 HydrophobicContact CG2-CE2 4.16Å
859	D	28.4	Very low	28.4	Very low	159 Å²	159	155.1 Å²	155.1	85%	0.85	76%	0.756	S	S	*	*			trans	-96.5	115.7	174.2	-154.7	3.2	0	0	0	109	P861	D859-P861 WeakPolarHBondContact O-CD 3.39Å
860	Y	28.9	Very low	28.3	Very low	165 Å²	165	158.5 Å²	158.5	65%	0.647	76%	0.761	S	S	*	*			trans	-84.7	122	-176.5	-68.8	-94.5	0	0	0	110.4	I858 S862	I858-Y860 HydrophobicContact CG2-CD2 4.41Å; I858-Y860 HydrophobicContact CG2-CE2 4.16Å; Y860-S862 PolarHBondContact O-N 3.46Å
861	P	28.6	Very low	28.3	Very low	132 Å²	132	156.9 Å²	156.9	86%	0.857	76%	0.76	S	S	*	*	S	Bend	trans	-84.3	51.5	162.4	34.9	-31.6	0	0	0	110.7	D859	D859-P861 WeakPolarHBondContact O-CD 3.39Å
862	S	33.9	Very low	28.3	Very low	92 Å²	92	161.3 Å²	161.3	64%	0.643	77%	0.773	S	S	*	*	S	Bend	trans	-177.3	90.2	161.5	53.5	0	0	0	0	111	Y860	Y860-S862 PolarHBondContact O-N 3.46Å
863	R	30.2	Very low	28.2	Very low	239 Å²	239	160.1 Å²	160.1	90%	0.902	78%	0.779	S	S	*	*			trans	40.9	112.6	153.8	-68.7	-172.5	175.3	-159	-1.3	119.9
864	S	31.8	Very low	28.4	Very low	98 Å²	98	158.7 Å²	158.7	69%	0.685	78%	0.784	S	S	*	*			trans	74.5	97.7	132.2	56.1	0	0	0	0	120.7
865	Y	29.2	Very low	28.3	Very low	213 Å²	213	156.3 Å²	156.3	84%	0.835	78%	0.781	S	S	*	*			trans	44.5	115	135	-67.7	-84.6	0	0	0	119.5
866	F	28.1	Very low	28.4	Very low	219 Å²	219	156 Å²	156	96%	0.961	79%	0.792	S	S	*	*				-146.6	120.6	110.1	-82.4	-76.9	0	0	0	109
867	A	26.1	Very low	28.4	Very low	87 Å²	87	151.2 Å²	151.2	72%	0.719	79%	0.788	S	S	*	*			trans	-84.7	135.3	174.2	0	0	0	0	0	109.8
868	L	26.4	Very low	28.4	Very low	175 Å²	175	148.7 Å²	148.7	92%	0.916	79%	0.787	S	S	*	*			trans	-116.7	98.6	162.5	-92.7	158.4	0	0	0	108.1
869	E	26.5	Very low	28.6	Very low	166 Å²	166	148.7 Å²	148.7	78%	0.776	79%	0.793	S	S	*	*			trans	-65.4	133.5	156.4	-73.1	-178.2	147.5	0	0	108.1
870	Q	27.6	Very low	28.5	Very low	197 Å²	197	146.4 Å²	146.4	92%	0.921	79%	0.788	S	S	*	*			trans	-132.4	111	153.8	-139.8	175.6	-0.1	0	0	110.3
871	K	29.3	Very low	28.6	Very low	176 Å²	176	145.5 Å²	145.5	77%	0.765	79%	0.793	S	S	*	*			trans	-67.7	148	174.4	-81.8	172.8	171.9	170.8	0	111.3
872	E	30.6	Very low	28.6	Very low	180 Å²	180	146.9 Å²	146.9	84%	0.841	79%	0.793	S	S	*	*			trans	6.6	132.2	153.1	-64.3	178	153.8	0	0	119.5
873	N	24.8	Very low	28.5	Very low	153 Å²	153	146.8 Å²	146.8	82%	0.818	80%	0.797	S	S	*	*			trans	17	121.6	140.3	-70.9	-20.1	0	0	0	117.5
874	V	30.3	Very low	28.5	Very low	143 Å²	143	141.1 Å²	141.1	87%	0.867	79%	0.793	S	S	*	*				173.1	127.5	112.6	165.7	0	0	0	0	108.5
875	G	25	Very low	28.4	Very low	57 Å²	57	144.2 Å²	144.2	59%	0.588	80%	0.801	S	S	*	*			trans	54.6	121.5	135.6	0	0	0	0	0	120.9
876	T	28.3	Very low	28.5	Very low	143 Å²	143	142.1 Å²	142.1	88%	0.877	80%	0.804	S	S	*	*			trans	84.5	119.8	141.4	66	0	0	0	0	120.2
877	S	28.4	Very low	28.6	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	79%	0.789	S	S	*	*			trans	74.7	101	134.2	-155.7	0	0	0	0	120.4
878	S	27.3	Very low	28.9	Very low	99 Å²	99	135.9 Å²	135.9	69%	0.692	79%	0.792	S	S	*	*				62.3	143.4	123	75.1	0	0	0	0	123.1
879	V	30.8	Very low	29.2	Very low	127 Å²	127	132.6 Å²	132.6	77%	0.77	78%	0.783	S	S	*	*			trans	91	93	154.1	-160.3	0	0	0	0	118.9
880	C	27.4	Very low	29.5	Very low	110 Å²	110	130 Å²	130	74%	0.743	78%	0.784	S	S	*	*				43.8	143.1	115.2	-107.7	0	0	0	0	123.4
881	L	29.9	Very low	29.9	Very low	146 Å²	146	125.7 Å²	125.7	76%	0.764	78%	0.775	S	S	*	*			trans	101.2	108	145.2	-83.2	144.7	0	0	0	120.4
882	L	28.8	Very low	30.1	Very low	162 Å²	162	128.4 Å²	128.4	85%	0.848	78%	0.781	S	S	*	*			trans	4.7	134	144.1	-77.8	89.9	0	0	0	118.4
883	A	30.9	Very low	30.2	Very low	89 Å²	89	126.3 Å²	126.3	74%	0.736	78%	0.775	S	S	*	*				179.1	134.7	115.7	0	0	0	0	0	113.5
884	C	30.8	Very low	30.7	Very low	121 Å²	121	128 Å²	128	82%	0.818	79%	0.794	S	S	*	*			trans	62.6	105.7	139	-62.4	0	0	0	0	121
885	L	29.4	Very low	30.7	Very low	162 Å²	162	127.3 Å²	127.3	85%	0.848	79%	0.791	S	S	*	*				17.8	131.5	117.4	-73.1	170.3	0	0	0	118.4
886	L	31.9	Very low	31	Very low	170 Å²	170	131 Å²	131	89%	0.89	80%	0.801	S	S	*	*			trans	92.8	115.7	158.1	-57	169.4	0	0	0	117
887	G	30.3	Very low	31.2	Very low	63 Å²	63	130.3 Å²	130.3	65%	0.649	80%	0.797	S	S	*	*			trans	99.6	90.4	130.9	0	0	0	0	0	115.6
888	S	31.9	Very low	31.4	Very low	111 Å²	111	131.9 Å²	131.9	78%	0.776	80%	0.802	S	S	*	*				51.5	126.7	125.8	51.5	0	0	0	0	120
889	S	33.8	Very low	31.6	Very low	106 Å²	106	134 Å²	134	74%	0.741	81%	0.808	S	S	*	*			trans	100.5	104	140.1	73.7	0	0	0	0	118.6
890	S	32	Very low	31.7	Very low	113 Å²	113	134.5 Å²	134.5	79%	0.79	81%	0.811	S	S	*	*				75.4	144.9	123.4	-79.7	0	0	0	0	121.7
891	S	35.8	Very low	32	Very low	106 Å²	106	136.2 Å²	136.2	74%	0.741	82%	0.816	S	S	*	*			trans	78.8	104.2	160.2	37.3	0	0	0	0	116.8
892	R	34.3	Very low	32.1	Very low	233 Å²	233	135.5 Å²	135.5	88%	0.879	82%	0.82	S	S	*	*				66.2	132.4	83.4	-77.7	-174.8	-168.9	-165.6	4.8	110.7
893	L	32.5	Very low	32.4	Very low	136 Å²	136	133.3 Å²	133.3	71%	0.712	82%	0.817	S	S	*	*			cis	-175.5	166.8	13.8	-104.9	151.4	0	0	0	104.3
894	P	35.4	Very low	32.6	Very low	189 Å²	189	137.3 Å²	137.3	100%	1.227	83%	0.825	S	S	*	*			cis	-102.1	0	22.4	9	13.3	0	0	0	115.2

Retrieved 894 of 894 residues in 204.8 ms (Link to these results)

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