A0A093H7W6_STRCA Loading...

Tudor domain-containing protein

AlphaFold DB , UniProt , Accession A0A093H7W6, Species STRCA (Struthio camelus australis), Gene n/a, Length 887 aa.

						>A0A093H7W6_STRCA|A0A093H7W6
MALRFRTFFPYALPGVLALLGWWWFFSRKKEHGNNHDRRAIAITEEQQVELPVNGSSPRTEAHAPQGLPLSSEEEHPEKETSTSVLSAGSMTPSLMHQTHERLDFSQDLPAPAITTIQSSTLEDDSEKLERIGSQDESSVPACVSLPLVSKSAKCHISAVISPKQDSSSSATEGQWPSASVTLTQESSGVVEEVSNAEQSSDFSFKSPKESQMPETVLSDTGSVTALHLGLEKEASTPLAFLNSEVEEAVSGHRDSVVGMLSDSCMKSACLEQSKEEERSESIDSTVPVCQEEDAQPKGDELERERIGGVSLDKEEVEKIEQVAIQIISKVILAATEEVLSGSVSDVSSRICQAAASRAETPLERASIAASDQMLAVEPRGGDEHVAAKSGAVVSTSLQAEEHDQCVTYSSCLTHGRLSSPVQGDPKERQVKNCVHSESPGVGRTPIANHGGSLGESHVVMEDSGCSTCASEDGTSVEDPLQNTMLSVTSGQHSDSLSTSATQDTSAEQSSVPSEKPHTPKLPEDSKVPYSNGMLKEDSPDLRHDSNWTTETDGDHSGGSDVNSMDSVDSGCALGKTETHPNSKAGGESSKSELTIWEIEVPKHLVGRLIGKQGRYVSFLKQTSGAKIYISTLPYTQDFQICHIEGSQHHVDKALSLIGKKFKELSLTNIYAPPPPSLTLHSLPMTSWLMLPDGVTVEVIVVNQVNAGHMFVQQHTHPTFHVLRSLDQQMYVCYSQPGIPTLPTPVEVGVICAAPGLDGAWWRAQVVGYFKESSEVEIRYVDYGGYERVKIDTLRQIRSDFVTLPFQGAEVLLDNVVPLPDEDHFSSEADAAVSEMTRGTALLAQVTNYDSATGLPLIQLWSMMGDEVVSINRALVERGFAQWIDSY
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.2	Very low	43.6	Very low	246 Å²	246	172.9 Å²	172.9	100%	1.212	82%	0.815	S	S	*	*				0	104	0	-72.9	-177.3	-86.1	0	0	108.8
2	A	37	Very low	44.5	Very low	99 Å²	99	163.2 Å²	163.2	82%	0.818	79%	0.785	S	S	*	*			trans	-161.2	85.8	175	0	0	0	0	0	110
3	L	38.3	Very low	45.5	Very low	169 Å²	169	158.5 Å²	158.5	89%	0.885	77%	0.766	S	S	*	*			trans	-175.6	57.3	166.7	-107.3	170.7	0	0	0	111.4
4	R	43.5	Very low	47	Very low	225 Å²	225	152.8 Å²	152.8	85%	0.849	75%	0.748	S	S	*	*			trans	-135.2	7.9	170.2	-80.1	-161.4	173.5	-164.6	-1.8	115.3
5	F	37.4	Very low	48.9	Very low	218 Å²	218	145 Å²	145	96%	0.956	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	38	-178.5	-97.1	-78	0	0	0	114.2
6	R	43.8	Very low	51	Low	229 Å²	229	141.1 Å²	141.1	86%	0.864	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.8	2.2	175.1	-97.9	-169.7	173.6	-166.3	-3.3	115.7
7	T	47.4	Very low	52.5	Low	90 Å²	90	139.5 Å²	139.5	55%	0.552	70%	0.702	S	S	*	*	S	Bend	trans	-95.8	-16.1	-171.4	38.2	0	0	0	0	115.7	P10	T7-P10 WeakPolarHBondContact O-CD 3.31Å
8	F	46.3	Very low	54.1	Low	178 Å²	178	135.3 Å²	135.3	78%	0.781	69%	0.692	S	S	*	*	S	Bend	trans	-92.1	-18.7	-172.8	-85.1	-80.1	0	0	0	116.1	P10	F8-P10 VanDerWaalsContact C-CD 3.48Å
9	F	44.4	Very low	55.5	Low	175 Å²	175	134.7 Å²	134.7	77%	0.768	69%	0.69	S	S	*	*	H	α-helix	trans	-74.8	-25.7	-176.1	-118.9	-91	0	0	0	117.7
10	P	46	Very low	56.9	Low	80 Å²	80	132.3 Å²	132.3	52%	0.519	68%	0.678	S	S	.	*	H	α-helix	trans	-80.5	-18.7	-178.1	30.7	-32.6	0	0	0	114	T7 F8 P14	T7-P10 WeakPolarHBondContact O-CD 3.31Å; F8-P10 VanDerWaalsContact C-CD 3.48Å; P10-P14 WeakPolarHBondContact O-CD 3.26Å
11	Y	51.8	Low	58.1	Low	193 Å²	193	127.8 Å²	127.8	76%	0.757	66%	0.664	S	S	*	*	H	α-helix	trans	-93.8	-21	-174.3	-65.9	-74	0	0	0	114.4
12	A	54.7	Low	59.9	Low	56 Å²	56	124.5 Å²	124.5	46%	0.463	64%	0.638	S	S	.	*	H	α-helix	trans	-72.5	-41.3	179.3	0	0	0	0	0	113.1	G15 V16	A12-G15 PolarHBondContact O-N 2.76Å; A12-V16 WeakPolarHBondContact O-CG2 3.34Å; A12-V16 PolarHBondContact O-N 3.43Å; A12-V16 VanDerWaalsContact O-N 3.08Å
13	L	56.9	Low	61.9	Low	103 Å²	103	128.2 Å²	128.2	54%	0.539	63%	0.632	S	S	.	*	H	α-helix	trans	-61.8	-47.6	-177.4	-96	82.9	0	0	0	113.6	G15 V16 L17	L13-G15 VanDerWaalsContact C-N 3.32Å; L13-G15 PolarHBondContact O-N 3.35Å; L13-V16 PolarHBondContact O-N 2.99Å; L13-L17 WeakPolarHBondContact O-CB 3.41Å; L13-L17 WeakPolarHBondContact O-CG 3.41Å; L13-L17 PolarHBondContact O-N 2.96Å
14	P	67.6	Low	63.9	Low	78 Å²	78	127.5 Å²	127.5	51%	0.506	62%	0.617	S	S	.	*	H	α-helix	trans	-58	-42	178	-26.9	35.8	0	0	0	113.1	P10 L17 A18	P10-P14 WeakPolarHBondContact O-CD 3.26Å; P14-L17 PolarHBondContact O-N 3.48Å; P14-A18 WeakPolarHBondContact O-CB 3.22Å; P14-A18 PolarHBondContact O-N 2.91Å
15	G	74.8	Confident	65.7	Low	36 Å²	36	122.5 Å²	122.5	37%	0.371	60%	0.602	S	S	.	*	H	α-helix	trans	-64.6	-44.3	177.2	0	0	0	0	0	113	A12 L13 A18 L19	A12-G15 PolarHBondContact O-N 2.76Å; L13-G15 VanDerWaalsContact C-N 3.32Å; L13-G15 PolarHBondContact O-N 3.35Å; G15-A18 PolarHBondContact O-N 2.88Å; G15-L19 WeakPolarHBondContact O-CG 3.47Å; G15-L19 PolarHBondContact O-N 3.36Å
16	V	82.3	Confident	67.4	Low	83 Å²	83	117.4 Å²	117.4	50%	0.503	58%	0.579	S	S	.	*	H	α-helix	trans	-65.1	-39.8	176.8	172.6	0	0	0	0	111.5	A12 L13 L19 L20	A12-V16 WeakPolarHBondContact O-CG2 3.34Å; A12-V16 PolarHBondContact O-N 3.43Å; A12-V16 VanDerWaalsContact O-N 3.08Å; L13-V16 PolarHBondContact O-N 2.99Å; V16-L19 PolarHBondContact O-N 2.9Å; V16-L20 HydrophobicContact CG1-CD1 4Å; V16-L20 WeakPolarHBondContact O-CB 3.28Å; V16-L20 VanDerWaalsContact O-CG 3.32Å; V16-L20 WeakPolarHBondContact O-CG 3.49Å; V16-L20 PolarHBondContact O-N 2.97Å
17	L	77.4	Confident	68.3	Low	114 Å²	114	109.4 Å²	109.4	60%	0.597	56%	0.558	S	S	*	*	H	α-helix	trans	-67.3	-38.4	175.9	-70.6	171.5	0	0	0	112.2	L13 P14 L20 G21	L13-L17 WeakPolarHBondContact O-CB 3.41Å; L13-L17 WeakPolarHBondContact O-CG 3.41Å; L13-L17 PolarHBondContact O-N 2.96Å; P14-L17 PolarHBondContact O-N 3.48Å; L17-L20 PolarHBondContact O-N 3.06Å; L17-G21 PolarHBondContact O-N 2.91Å
18	A	80.3	Confident	68.8	Low	63 Å²	63	111.9 Å²	111.9	52%	0.521	56%	0.558	S	S	.	*	H	α-helix	trans	-62.4	-45.5	173.4	0	0	0	0	0	111.6	P14 G15 L20 G21 W22	P14-A18 WeakPolarHBondContact O-CB 3.22Å; P14-A18 PolarHBondContact O-N 2.91Å; G15-A18 PolarHBondContact O-N 2.88Å; A18-L20 PolarHBondContact O-N 3.29Å; A18-G21 PolarHBondContact O-N 3.24Å; A18-W22 WeakPolarHBondContact O-CB 3.39Å; A18-W22 PolarHBondContact O-N 3.3Å
19	L	81.1	Confident	69.1	Low	124 Å²	124	110.3 Å²	110.3	65%	0.649	55%	0.551	S	S	*	*	H	α-helix	trans	-64.1	-39.3	176.7	-71.1	170.9	0	0	0	112.6	G15 V16 W22 W23	G15-L19 WeakPolarHBondContact O-CG 3.47Å; G15-L19 PolarHBondContact O-N 3.36Å; V16-L19 PolarHBondContact O-N 2.9Å; L19-W22 PolarHBondContact O-N 2.99Å; L19-W23 WeakPolarHBondContact O-CB 3.2Å; L19-W23 PolarHBondContact O-N 3.16Å
20	L	84.5	Confident	69.2	Low	87 Å²	87	110.3 Å²	110.3	46%	0.455	55%	0.55	S	S	.	*	H	α-helix	trans	-66.3	-41.1	174.5	-74	169	0	0	0	112.2	V16 L17 A18 W23 W24	V16-L20 HydrophobicContact CG1-CD1 4Å; V16-L20 WeakPolarHBondContact O-CB 3.28Å; V16-L20 VanDerWaalsContact O-CG 3.32Å; V16-L20 WeakPolarHBondContact O-CG 3.49Å; V16-L20 PolarHBondContact O-N 2.97Å; L17-L20 PolarHBondContact O-N 3.06Å; A18-L20 PolarHBondContact O-N 3.29Å; L20-W23 HydrophobicContact CD2-CE3 4.24Å; L20-W24 VanDerWaalsContact O-CB 3.31Å; L20-W24 WeakPolarHBondContact O-CB 3.42Å; L20-W24 PolarHBondContact O-N 2.96Å
21	G	82.3	Confident	69.2	Low	37 Å²	37	112.8 Å²	112.8	38%	0.381	56%	0.555	S	S	.	*	H	α-helix	trans	-63.9	-42.6	174.2	0	0	0	0	0	112.6	L17 A18 W24 F25	L17-G21 PolarHBondContact O-N 2.91Å; A18-G21 PolarHBondContact O-N 3.24Å; G21-W24 PolarHBondContact O-N 3.33Å; G21-F25 WeakPolarHBondContact O-CB 3.35Å; G21-F25 PolarHBondContact O-N 3.07Å
22	W	79.8	Confident	68.8	Low	177 Å²	177	111.3 Å²	111.3	67%	0.67	55%	0.554	S	S	*	*	H	α-helix	trans	-62.7	-47.2	176	-162	-61.9	0	0	0	111.3	A18 L19 F25 F26	A18-W22 WeakPolarHBondContact O-CB 3.39Å; A18-W22 PolarHBondContact O-N 3.3Å; L19-W22 PolarHBondContact O-N 2.99Å; W22-F25 PolarHBondContact O-N 3.08Å; W22-F26 AromaticContact CD1-CD2 3.47Å; W22-F26 VanDerWaalsContact CD1-CD2 3.47Å; W22-F26 AromaticContact CD1-CE2 3.65Å; W22-F26 AromaticContact CE2-CE2 3.95Å; W22-F26 HydrophobicContact CG-CD2 4.43Å; W22-F26 AromaticContact NE1-CD2 3.54Å; W22-F26 AromaticContact NE1-CE2 3.21Å; W22-F26 AromaticContact NE1-CZ 3.98Å; W22-F26 WeakPolarHBondContact O-CD2 3.29Å; W22-F26 PolarHBondContact O-N 3.2Å
23	W	80.3	Confident	68.2	Low	178 Å²	178	111.5 Å²	111.5	67%	0.674	56%	0.562	S	S	*	*	H	α-helix	trans	-60.7	-46.8	176	-177.2	13	0	0	0	111.4	L19 L20 F25 F26 S27	L19-W23 WeakPolarHBondContact O-CB 3.2Å; L19-W23 PolarHBondContact O-N 3.16Å; L20-W23 HydrophobicContact CD2-CE3 4.24Å; W23-F25 PolarHBondContact O-N 3.28Å; W23-F26 PolarHBondContact O-N 3.27Å; W23-S27 PolarHBondContact NE1-OG 2.96Å; W23-S27 WeakPolarHBondContact O-CB 3.41Å; W23-S27 PolarHBondContact O-N 3.17Å; W23-S27 PolarHBondContact O-OG 2.98Å
24	W	80.1	Confident	67.4	Low	153 Å²	153	111.6 Å²	111.6	58%	0.58	56%	0.563	S	S	*	*	H	α-helix	trans	-59.4	-43.3	177.8	-176.9	88.1	0	0	0	112.8	L20 G21 R28	L20-W24 VanDerWaalsContact O-CB 3.31Å; L20-W24 WeakPolarHBondContact O-CB 3.42Å; L20-W24 PolarHBondContact O-N 2.96Å; G21-W24 PolarHBondContact O-N 3.33Å; W24-R28 VanDerWaalsContact CZ2-NH1 3.3Å; W24-R28 PolarHBondContact O-N 2.85Å; W24-R28 VanDerWaalsContact O-N 3.09Å
25	F	80.5	Confident	66	Low	120 Å²	120	113.6 Å²	113.6	53%	0.526	57%	0.57	S	S	.	*	H	α-helix	trans	-62.1	-49.1	177.1	-178.2	-101.2	0	0	0	112	G21 W22 W23 R28 K29	G21-F25 WeakPolarHBondContact O-CB 3.35Å; G21-F25 PolarHBondContact O-N 3.07Å; W22-F25 PolarHBondContact O-N 3.08Å; W23-F25 PolarHBondContact O-N 3.28Å; F25-R28 PolarHBondContact O-N 3Å; F25-K29 PolarHBondContact O-N 2.77Å
26	F	72.9	Confident	64.2	Low	111 Å²	111	120.1 Å²	120.1	49%	0.487	59%	0.59	S	S	.	*	H	α-helix	trans	-69.1	-35.1	179.2	-86.1	-98.3	0	0	0	113	W22 W23 K29 K30	W22-F26 AromaticContact CD1-CD2 3.47Å; W22-F26 VanDerWaalsContact CD1-CD2 3.47Å; W22-F26 AromaticContact CD1-CE2 3.65Å; W22-F26 AromaticContact CE2-CE2 3.95Å; W22-F26 HydrophobicContact CG-CD2 4.43Å; W22-F26 AromaticContact NE1-CD2 3.54Å; W22-F26 AromaticContact NE1-CE2 3.21Å; W22-F26 AromaticContact NE1-CZ 3.98Å; W22-F26 WeakPolarHBondContact O-CD2 3.29Å; W22-F26 PolarHBondContact O-N 3.2Å; W23-F26 PolarHBondContact O-N 3.27Å; F26-K29 PolarHBondContact O-N 3.42Å; F26-K30 PolarHBondContact O-N 3.08Å; F26-K30 VanDerWaalsContact O-N 3.07Å
27	S	63.2	Low	62.2	Low	61 Å²	61	122 Å²	122	43%	0.427	60%	0.597	S	S	.	*	H	α-helix	trans	-60.6	-47.3	173.2	-75.7	0	0	0	0	112.1	W23 K29 K30 E31	W23-S27 PolarHBondContact NE1-OG 2.96Å; W23-S27 WeakPolarHBondContact O-CB 3.41Å; W23-S27 PolarHBondContact O-N 3.17Å; W23-S27 PolarHBondContact O-OG 2.98Å; S27-K29 PolarHBondContact O-N 2.79Å; S27-K30 PolarHBondContact O-N 2.82Å; S27-E31 PolarHBondContact O-N 3.2Å
28	R	57.2	Low	60.3	Low	142 Å²	142	126.3 Å²	126.3	54%	0.536	61%	0.606	S	S	.	*	H	α-helix	trans	-66.6	-34.5	176.7	-82.6	-173	155.1	-162.6	-7.5	113.5	W24 F25 K30 E31 H32	W24-R28 VanDerWaalsContact CZ2-NH1 3.3Å; W24-R28 PolarHBondContact O-N 2.85Å; W24-R28 VanDerWaalsContact O-N 3.09Å; F25-R28 PolarHBondContact O-N 3Å; R28-K30 VanDerWaalsContact C-N 3.3Å; R28-K30 PolarHBondContact O-N 3.26Å; R28-E31 PolarHBondContact O-N 3.29Å; R28-H32 PolarHBondContact O-ND1 2.86Å
29	K	53.3	Low	58.1	Low	146 Å²	146	134.1 Å²	134.1	64%	0.635	62%	0.622	S	S	*	*	H	α-helix	trans	-65.5	-33.1	175.3	-164.9	172.6	-177	179.6	0	112.1	F25 F26 S27	F25-K29 PolarHBondContact O-N 2.77Å; F26-K29 PolarHBondContact O-N 3.42Å; S27-K29 PolarHBondContact O-N 2.79Å
30	K	47	Very low	55.8	Low	174 Å²	174	132.3 Å²	132.3	76%	0.757	62%	0.624	S	S	*	*	H	α-helix	trans	-72.8	-26	176.7	-163.2	167.1	-174.2	171.5	0	113.5	F26 S27 R28	F26-K30 PolarHBondContact O-N 3.08Å; F26-K30 VanDerWaalsContact O-N 3.07Å; S27-K30 PolarHBondContact O-N 2.82Å; R28-K30 VanDerWaalsContact C-N 3.3Å; R28-K30 PolarHBondContact O-N 3.26Å
31	E	45.6	Very low	53.4	Low	132 Å²	132	135.9 Å²	135.9	62%	0.617	64%	0.642	S	S	*	*	H	α-helix	trans	-75.3	-28.1	-178.4	-161.8	164.5	-136.2	0	0	113.3	S27 R28	S27-E31 PolarHBondContact O-N 3.2Å; R28-E31 PolarHBondContact O-N 3.29Å
32	H	43.7	Very low	51	Low	162 Å²	162	137.9 Å²	137.9	75%	0.75	66%	0.656	S	S	*	*	S	Bend	trans	-85.3	-13.5	177.4	-72.1	72.2	0	0	0	113.9	R28	R28-H32 PolarHBondContact O-ND1 2.86Å
33	G	41.3	Very low	48.6	Very low	61 Å²	61	137.2 Å²	137.2	63%	0.629	66%	0.663	S	S	*	*	S	Bend	trans	-89.5	-8.4	-178.4	0	0	0	0	0	115.8
34	N	41.3	Very low	46.1	Very low	104 Å²	104	135.2 Å²	135.2	56%	0.556	67%	0.671	S	S	*	*	S	Bend	trans	-125.5	27.3	-166	-159.9	10.1	0	0	0	114.3
35	N	36.5	Very low	43.6	Very low	120 Å²	120	136.8 Å²	136.8	64%	0.642	69%	0.685	S	S	*	*	S	Bend	trans	-114.7	-1.6	179.4	-100.1	-43.9	0	0	0	114.5
36	H	38.6	Very low	41.1	Very low	174 Å²	174	139.8 Å²	139.8	81%	0.806	70%	0.7	S	S	*	*	S	Bend	trans	-95.1	-47.7	174.9	-94.5	-82.3	0	0	0	113.2	R38 R39	H36-R38 PolarHBondContact O-N 2.82Å; H36-R39 PolarHBondContact O-N 3.2Å
37	D	38.9	Very low	38.9	Very low	122 Å²	122	141.4 Å²	141.4	65%	0.652	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-65.8	-26.6	-179.6	-64.2	-39.4	0	0	0	113.4	R39 A40	D37-R39 PolarHBondContact O-N 2.98Å; D37-A40 PolarHBondContact O-N 2.91Å; D37-A40 VanDerWaalsContact O-N 3.13Å
38	R	37.8	Very low	37.1	Very low	204 Å²	204	146 Å²	146	77%	0.77	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-74.8	7.8	-178.7	-135.5	175.2	-171.2	-179.2	2.5	115	H36	H36-R38 PolarHBondContact O-N 2.82Å
39	R	33.7	Very low	35.8	Very low	228 Å²	228	145 Å²	145	86%	0.86	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-108	-9.1	168.7	-92.9	-177.3	169.1	176.1	-2.7	114.6	H36 D37	H36-R39 PolarHBondContact O-N 3.2Å; D37-R39 PolarHBondContact O-N 2.98Å
40	A	33.3	Very low	34.5	Very low	85 Å²	85	146.7 Å²	146.7	70%	0.702	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-28.6	178.4	0	0	0	0	0	113.2	D37	D37-A40 PolarHBondContact O-N 2.91Å; D37-A40 VanDerWaalsContact O-N 3.13Å
41	I	35.2	Very low	33.4	Very low	162 Å²	162	145.9 Å²	145.9	83%	0.831	75%	0.747	S	S	*	*	S	Bend	trans	-111.8	67.2	-174.4	-45.9	179.5	0	0	0	110
42	A	31.7	Very low	33.4	Very low	80 Å²	80	144.6 Å²	144.6	66%	0.661	75%	0.75	S	S	*	*	S	Bend	trans	-149.2	8	178.1	0	0	0	0	0	114.8
43	I	28.8	Very low	32.7	Very low	162 Å²	162	142.5 Å²	142.5	83%	0.831	75%	0.748	S	S	*	*	S	Bend	trans	-141.2	91.4	172	-51	178.1	0	0	0	109.3
44	T	27	Very low	32	Very low	137 Å²	137	147 Å²	147	84%	0.84	76%	0.758	S	S	*	*			trans	171.8	83.7	138.2	-69	0	0	0	0	108.3
45	E	28.4	Very low	31.3	Very low	186 Å²	186	145.6 Å²	145.6	87%	0.869	77%	0.768	S	S	*	*	S	Bend	trans	-165.5	132	141	-114.1	171.1	-171.8	0	0	109.5
46	E	28.2	Very low	31	Very low	182 Å²	182	145.1 Å²	145.1	85%	0.85	77%	0.774	S	S	*	*			trans	55.1	157.8	173.9	-59.1	-168.1	157.5	0	0	120.4
47	Q	25.9	Very low	30.5	Very low	145 Å²	145	142 Å²	142	68%	0.678	77%	0.772	S	S	*	*			cis	-157.2	125.5	-48.2	-170.4	159.1	-4.2	0	0	109.7
48	Q	26.3	Very low	31.3	Very low	159 Å²	159	141.4 Å²	141.4	74%	0.743	78%	0.775	S	S	*	*			trans	39.3	147.1	141.1	-138.8	176.4	3.7	0	0	122.4
49	V	28.9	Very low	30.8	Very low	119 Å²	119	142.8 Å²	142.8	72%	0.721	78%	0.78	S	S	*	*			trans	78.3	132.2	164.2	-174.6	0	0	0	0	114.9
50	E	26.5	Very low	30.6	Very low	182 Å²	182	136.6 Å²	136.6	85%	0.85	77%	0.768	S	S	*	*			cis	-150.7	-178.8	-1.6	-133.8	166.6	175	0	0	113.2
51	L	23.4	Very low	30.6	Very low	157 Å²	157	141 Å²	141	82%	0.822	77%	0.774	S	S	*	*			trans	-107.8	-173	173.2	-88.3	169.5	0	0	0	110.1
52	P	45.9	Very low	30.3	Very low	105 Å²	105	138.1 Å²	138.1	68%	0.682	77%	0.774	S	S	*	*			cis	-136.5	-163.5	-18.9	21.2	5.9	0	0	0	114.6
53	V	29	Very low	30.2	Very low	119 Å²	119	143.5 Å²	143.5	72%	0.721	79%	0.785	S	S	*	*			trans	107.4	110.6	144.1	-171.3	0	0	0	0	121.8
54	N	27	Very low	30.3	Very low	155 Å²	155	140 Å²	140	83%	0.829	78%	0.781	S	S	*	*			trans	32.1	118.5	141.4	-54.9	-13.8	0	0	0	125.3
55	G	27.4	Very low	31.9	Very low	75 Å²	75	138.9 Å²	138.9	77%	0.773	78%	0.776	S	S	*	*				74.3	168.1	108.5	0	0	0	0	0	122.3
56	S	29.4	Very low	31.9	Very low	109 Å²	109	139.4 Å²	139.4	76%	0.762	78%	0.778	S	S	*	*			cis	-174.5	143.1	-18.2	45.8	0	0	0	0	114.7
57	S	28.8	Very low	31.7	Very low	108 Å²	108	134.4 Å²	134.4	76%	0.755	78%	0.776	S	S	*	*			trans	67.5	-175.8	150.1	83.2	0	0	0	0	119
58	P	54.6	Low	31.6	Very low	110 Å²	110	135.6 Å²	135.6	71%	0.714	79%	0.786	S	S	*	*			cis	-138.7	178.3	-8.3	34.1	-13	0	0	0	118.2
59	R	26.9	Very low	32.2	Very low	233 Å²	233	132.6 Å²	132.6	88%	0.879	78%	0.78	S	S	*	*			trans	109.4	140.8	154.8	-65.4	-161.7	148.2	154.6	-3.7	118.7
60	T	30.7	Very low	32.1	Very low	99 Å²	99	134.2 Å²	134.2	61%	0.607	78%	0.784	S	S	*	*			cis	-161.5	133	-13.4	-94.1	0	0	0	0	112.4
61	E	32.9	Very low	31.9	Very low	177 Å²	177	129.9 Å²	129.9	83%	0.827	77%	0.774	S	S	*	*			trans	26.3	136.2	148.3	-56.9	161.8	176.9	0	0	125
62	A	29.3	Very low	32	Very low	102 Å²	102	127.3 Å²	127.3	84%	0.843	77%	0.769	S	S	*	*				-170.7	167.5	120.6	0	0	0	0	0	113.2
63	H	28.6	Very low	31.1	Very low	192 Å²	192	130 Å²	130	89%	0.889	77%	0.772	S	S	*	*			trans	-94.5	149.5	-158	-68.3	-96.7	0	0	0	119.9
64	A	32	Very low	30.8	Very low	89 Å²	89	132.4 Å²	132.4	74%	0.736	78%	0.776	S	S	*	*			trans	-31.1	-175.3	151	0	0	0	0	0	120.4
65	P	59.8	Low	30.7	Very low	113 Å²	113	133.2 Å²	133.2	73%	0.734	78%	0.775	S	S	*	*			cis	-143.8	-174.1	-3.7	41.2	-21.2	0	0	0	118.5
66	Q	29	Very low	30.6	Very low	197 Å²	197	137.5 Å²	137.5	92%	0.921	77%	0.774	S	S	*	*			trans	97.7	126.7	152.1	-75	-175.5	-21.9	0	0	122
67	G	23.1	Very low	31	Very low	78 Å²	78	137.5 Å²	137.5	80%	0.804	77%	0.772	S	S	*	*			trans	146.8	112.8	164.8	0	0	0	0	0	116
68	L	23.9	Very low	30.9	Very low	169 Å²	169	139.8 Å²	139.8	89%	0.885	77%	0.77	S	S	*	*			trans	-151.8	170.3	175	-97.8	173.8	0	0	0	107
69	P	39.7	Very low	29.4	Very low	97 Å²	97	142.6 Å²	142.6	63%	0.63	77%	0.771	S	S	*	*			cis	-140.9	-167.8	-10.8	36.8	-14.1	0	0	0	115.6
70	L	25.3	Very low	29.4	Very low	152 Å²	152	138.7 Å²	138.7	80%	0.796	76%	0.763	S	S	*	*			trans	68.9	128	136.9	-83.5	162.5	0	0	0	126.1
71	S	24.2	Very low	29	Very low	92 Å²	92	139.7 Å²	139.7	64%	0.643	77%	0.769	S	S	*	*			trans	30.3	137.9	132.4	65.8	0	0	0	0	126.2
72	S	25.4	Very low	28.7	Very low	103 Å²	103	136.2 Å²	136.2	72%	0.72	77%	0.765	S	S	*	*				-164.6	154	120.8	69.2	0	0	0	0	108.2
73	E	25.3	Very low	28.4	Very low	160 Å²	160	137.9 Å²	137.9	75%	0.748	76%	0.764	S	S	*	*			cis	65.3	135.9	42.9	-72.7	166.9	136.8	0	0	112.9
74	E	24.6	Very low	28.1	Very low	170 Å²	170	134.2 Å²	134.2	79%	0.794	76%	0.76	S	S	*	*			cis	-162.1	-159.8	-14.9	-146.9	-169.8	165.4	0	0	109.7
75	E	23.2	Very low	27.9	Very low	173 Å²	173	136.7 Å²	136.7	81%	0.808	77%	0.766	S	S	*	*			trans	67	137.3	159.2	-80.9	-170.4	107.3	0	0	123.3
76	H	26.7	Very low	26.3	Very low	164 Å²	164	139 Å²	139	76%	0.759	77%	0.771	S	S	*	*			trans	-106.3	149.6	156.6	-160	-35.9	0	0	0	106.7
77	P	37.3	Very low	26.1	Very low	110 Å²	110	134.4 Å²	134.4	71%	0.714	76%	0.761	S	S	*	*			trans	-141	-172.3	133.7	34.8	-19.6	0	0	0	113.5
78	E	27.4	Very low	26.2	Very low	155 Å²	155	135.6 Å²	135.6	72%	0.724	76%	0.763	S	S	*	*			trans	-105.9	-173.6	-163.5	-49.2	177.1	129.5	0	0	114.5
79	K	23.1	Very low	26.3	Very low	170 Å²	170	131.4 Å²	131.4	74%	0.739	76%	0.761	S	S	*	*			trans	77.6	156.7	153.3	-71.6	-178.9	-179.1	171.8	0	119.7
80	E	25.2	Very low	25.5	Very low	151 Å²	151	132.9 Å²	132.9	71%	0.706	77%	0.774	S	S	*	*			cis	-174.5	149.4	-39	-118.2	-175.8	144.6	0	0	108.1
81	T	23.1	Very low	25.5	Very low	120 Å²	120	133.7 Å²	133.7	74%	0.736	78%	0.776	S	S	*	*			trans	48.9	125	159.1	51.1	0	0	0	0	122
82	S	25.8	Very low	25.6	Very low	104 Å²	104	135.4 Å²	135.4	73%	0.727	78%	0.782	S	S	*	*				159.9	123.5	110.9	-75.3	0	0	0	0	116.3
83	T	23.3	Very low	26.1	Very low	136 Å²	136	136.6 Å²	136.6	83%	0.834	79%	0.788	S	S	*	*				35.7	153.2	129.5	13.4	0	0	0	0	123.3
84	S	24	Very low	26.1	Very low	115 Å²	115	133.8 Å²	133.8	80%	0.804	79%	0.785	S	S	*	*			cis	-154.9	163.8	10.5	63.2	0	0	0	0	117
85	V	26.1	Very low	26.2	Very low	142 Å²	142	133 Å²	133	86%	0.861	79%	0.786	S	S	*	*			trans	-76	142.1	-164.9	175.5	0	0	0	0	117.1
86	L	26.4	Very low	26.2	Very low	160 Å²	160	132 Å²	132	84%	0.838	78%	0.783	S	S	*	*			trans	-156.8	155.3	162.8	-92.8	172.2	0	0	0	109
87	S	24.5	Very low	26.1	Very low	102 Å²	102	131 Å²	131	71%	0.713	78%	0.779	S	S	*	*			cis	-160.4	165.8	-6.3	-160.1	0	0	0	0	113.5
88	A	26.8	Very low	25.5	Very low	102 Å²	102	133 Å²	133	84%	0.843	78%	0.778	S	S	*	*			trans	11.4	141.8	158.4	0	0	0	0	0	125.3
89	G	25.8	Very low	25.3	Very low	82 Å²	82	132.1 Å²	132.1	85%	0.845	78%	0.784	S	S	*	*			trans	169.3	95.3	156.2	0	0	0	0	0	116.4
90	S	23.3	Very low	25.5	Very low	128 Å²	128	131.7 Å²	131.7	90%	0.895	78%	0.784	S	S	*	*			trans	-71	158.6	-171.3	-171.6	0	0	0	0	117.3
91	M	24.8	Very low	25.5	Very low	169 Å²	169	133.9 Å²	133.9	83%	0.833	79%	0.794	S	S	*	*			trans	-88.6	166.5	170.7	-59	-174.9	78	0	0	114.6
92	T	26.4	Very low	25.6	Very low	128 Å²	128	137.6 Å²	137.6	79%	0.785	79%	0.794	S	S	*	*			trans	-165.5	151.3	151.8	-0.7	0	0	0	0	108.4
93	P	35.2	Very low	25.5	Very low	128 Å²	128	140.2 Å²	140.2	83%	0.831	80%	0.8	S	S	*	*				-148.8	-172.8	84.7	39.9	-21	0	0	0	114.8
94	S	24.6	Very low	25.6	Very low	100 Å²	100	138.5 Å²	138.5	70%	0.699	79%	0.785	S	S	*	*			trans	-153.8	150.7	-175.3	-52.7	0	0	0	0	114.9
95	L	26.6	Very low	25.6	Very low	153 Å²	153	142.3 Å²	142.3	80%	0.801	79%	0.788	S	S	*	*			trans	68.2	112.3	154	-89.5	78.8	0	0	0	123.4
96	M	23.9	Very low	25.8	Very low	152 Å²	152	139.6 Å²	139.6	75%	0.749	78%	0.775	S	S	*	*				92.1	152.5	112.1	-75.5	-73.5	-173	0	0	126
97	H	24.7	Very low	26	Very low	145 Å²	145	139.7 Å²	139.7	67%	0.671	77%	0.771	S	S	*	*			trans	72.4	109	166.8	-62.4	-66.1	0	0	0	118.8
98	Q	24.8	Very low	26.1	Very low	152 Å²	152	140.7 Å²	140.7	71%	0.71	77%	0.768	S	S	*	*				84.6	137	78.9	-82.9	-179.5	-37.3	0	0	114.2
99	T	22.9	Very low	26.1	Very low	136 Å²	136	143 Å²	143	83%	0.834	77%	0.766	S	S	*	*				-160.8	174.1	65.1	-52.4	0	0	0	0	113
100	H	27.2	Very low	26.6	Very low	160 Å²	160	145 Å²	145	74%	0.741	76%	0.764	S	S	*	*			trans	-74.1	159.9	-172.2	-64.2	-112.8	0	0	0	117.5
101	E	25	Very low	27	Very low	197 Å²	197	143.2 Å²	143.2	92%	0.921	76%	0.757	S	S	*	*				-155.4	-174.5	113.4	-121.6	-177.5	171.2	0	0	113.7
102	R	24.6	Very low	27.8	Very low	198 Å²	198	141.4 Å²	141.4	75%	0.747	76%	0.758	S	S	*	*			trans	-153.8	157.9	-133.2	-179.3	-173	-178.1	-179.8	3.5	114.8	D104	R102-D104 IonicContact CZ-OD2 3.22Å; R102-D104 IonicContact NE-OD2 2.86Å; R102-D104 PolarHBondContact NE-OD2 2.59Å; R102-D104 IonicContact NH2-OD2 3.37Å; R102-D104 PolarHBondContact NH2-OD2 3.38Å
103	L	24.1	Very low	27.8	Very low	160 Å²	160	139.2 Å²	139.2	84%	0.838	75%	0.753	S	S	*	*			trans	-164.9	141	138.5	-109.3	167.1	0	0	0	113.4
104	D	26.6	Very low	27.3	Very low	99 Å²	99	140.4 Å²	140.4	53%	0.529	75%	0.751	S	S	.	*			trans	-135.4	165.1	-175.5	-56.1	-67.1	0	0	0	112.6	R102	R102-D104 IonicContact CZ-OD2 3.22Å; R102-D104 IonicContact NE-OD2 2.86Å; R102-D104 PolarHBondContact NE-OD2 2.59Å; R102-D104 IonicContact NH2-OD2 3.37Å; R102-D104 PolarHBondContact NH2-OD2 3.38Å
105	F	23.9	Very low	27.4	Very low	196 Å²	196	141.3 Å²	141.3	86%	0.86	75%	0.752	S	S	*	*			trans	-159.8	164.5	153.7	-73.7	-74.1	0	0	0	107.5
106	S	29.9	Very low	27.3	Very low	85 Å²	85	139.5 Å²	139.5	59%	0.594	75%	0.747	S	S	*	*			cis	175.4	151.3	-33.2	-89	0	0	0	0	106
107	Q	30.6	Very low	27.4	Very low	161 Å²	161	138.8 Å²	138.8	75%	0.752	75%	0.745	S	S	*	*			cis	-166.5	172.7	-6.4	-108.2	164.2	-98.2	0	0	105.7
108	D	26.1	Very low	27.4	Very low	123 Å²	123	140 Å²	140	66%	0.658	75%	0.751	S	S	*	*			cis	-150.8	-151.1	12	-147.1	-76.3	0	0	0	110.7
109	L	26.5	Very low	27.3	Very low	152 Å²	152	137.1 Å²	137.1	80%	0.796	75%	0.748	S	S	*	*			trans	-107.1	177.9	178.7	-79.3	168.8	0	0	0	112.4
110	P	36.6	Very low	27.5	Very low	123 Å²	123	135.7 Å²	135.7	80%	0.799	74%	0.743	S	S	*	*			cis	-139.5	179.3	14.7	43.6	-25.3	0	0	0	118.3
111	A	31.2	Very low	27.5	Very low	90 Å²	90	133.5 Å²	133.5	74%	0.744	74%	0.741	S	S	*	*			trans	-138.6	164	167.1	0	0	0	0	0	112.1
112	P	41.6	Very low	27.8	Very low	132 Å²	132	131.1 Å²	131.1	86%	0.857	73%	0.734	S	S	*	*			trans	-140.3	-164.3	134.2	40.1	-23.2	0	0	0	110.6
113	A	27	Very low	28.2	Very low	82 Å²	82	128.8 Å²	128.8	68%	0.678	73%	0.732	S	S	*	*			cis	-159.8	173	9	0	0	0	0	0	113.7
114	I	25.8	Very low	28.5	Very low	153 Å²	153	127.6 Å²	127.6	79%	0.785	73%	0.726	S	S	*	*			trans	4.7	137.5	131.3	-72.6	166.3	0	0	0	116.8
115	T	26.1	Very low	28.9	Very low	118 Å²	118	129 Å²	129	72%	0.724	73%	0.734	S	S	*	*			cis	-169.9	-176.7	-1.2	30.1	0	0	0	0	108.4
116	T	24.8	Very low	29.3	Very low	115 Å²	115	124 Å²	124	71%	0.706	72%	0.723	S	S	*	*			cis	158.1	157.5	-32.1	-58.7	0	0	0	0	107.2
117	I	26.2	Very low	29.6	Very low	138 Å²	138	127.1 Å²	127.1	71%	0.708	73%	0.728	S	S	*	*			trans	78.9	110.4	169.1	-76.4	154.4	0	0	0	114.3
118	Q	23.6	Very low	29.9	Very low	171 Å²	171	126.4 Å²	126.4	80%	0.799	72%	0.723	S	S	*	*				69.2	146.3	89	-77.6	-178.2	-21.5	0	0	114.4
119	S	23.2	Very low	30.4	Very low	91 Å²	91	127 Å²	127	64%	0.636	73%	0.725	S	S	*	*			cis	-175	-178.2	-8.6	52.6	0	0	0	0	110.1
120	S	26.1	Very low	30.6	Very low	105 Å²	105	126.6 Å²	126.6	73%	0.734	72%	0.719	S	S	*	*			trans	69.9	158.3	154.2	59	0	0	0	0	121.1
121	T	28.1	Very low	30.6	Very low	114 Å²	114	129.8 Å²	129.8	70%	0.699	72%	0.715	S	S	*	*			cis	-173.7	143.6	-34.5	-61.4	0	0	0	0	108.2
122	L	31.5	Very low	30.6	Very low	147 Å²	147	132.9 Å²	132.9	77%	0.77	72%	0.718	S	S	*	*			trans	64.6	162.4	161.6	-101.7	54	0	0	0	117
123	E	32.3	Very low	30.1	Very low	150 Å²	150	129.4 Å²	129.4	70%	0.701	71%	0.706	S	S	*	*			cis	-147.3	150.4	4.4	-107.4	-55.6	42.8	0	0	111.5
124	D	30.5	Very low	30.5	Very low	134 Å²	134	130.6 Å²	130.6	72%	0.717	71%	0.709	S	S	*	*			trans	64.1	142.7	132	-142.9	19.7	0	0	0	128.9
125	D	34.6	Very low	30.9	Very low	129 Å²	129	131.1 Å²	131.1	69%	0.69	71%	0.708	S	S	*	*			trans	81.7	145.1	141.5	-136.2	16.3	0	0	0	129.9
126	S	34	Very low	31.4	Very low	92 Å²	92	131.7 Å²	131.7	64%	0.643	71%	0.707	S	S	*	*			trans	93.2	95.5	139.9	-89.2	0	0	0	0	125.5
127	E	35.3	Very low	31.9	Very low	149 Å²	149	133.6 Å²	133.6	70%	0.696	71%	0.708	S	S	*	*				43.6	109.1	129.7	-68.4	-135.3	133.4	0	0	126
128	K	38	Very low	32.2	Very low	147 Å²	147	131 Å²	131	64%	0.639	70%	0.702	S	S	*	*				82.6	146.2	96.7	-176.8	180	166.2	-165.4	0	126.1
129	L	36.2	Very low	32.4	Very low	134 Å²	134	127.5 Å²	127.5	70%	0.702	70%	0.697	S	S	*	*			trans	100.8	137.6	148.2	-95.2	163.5	0	0	0	125.1
130	E	30.8	Very low	33.1	Very low	144 Å²	144	130 Å²	130	67%	0.673	71%	0.708	S	S	*	*			trans	74.9	160	156.4	-60.9	-133.6	117.7	0	0	123.8
131	R	36.3	Very low	34.8	Very low	190 Å²	190	130.6 Å²	130.6	72%	0.717	71%	0.709	S	S	*	*			cis	-175.3	164.4	-48.8	-144	-168	-153	128.2	-2	113.6
132	I	31.2	Very low	35.1	Very low	155 Å²	155	129.3 Å²	129.3	80%	0.795	71%	0.71	S	S	*	*			trans	78.4	143.5	159.6	-56	154.9	0	0	0	117.1
133	G	30	Very low	34.8	Very low	59 Å²	59	128.3 Å²	128.3	61%	0.608	71%	0.714	S	S	*	*			cis	154.6	154.3	-13.2	0	0	0	0	0	116.4
134	S	36.6	Very low	34.6	Very low	108 Å²	108	127 Å²	127	76%	0.755	72%	0.716	S	S	*	*			trans	65.6	157.9	162.6	62.2	0	0	0	0	120.3
135	Q	34.3	Very low	34.4	Very low	163 Å²	163	126 Å²	126	76%	0.762	72%	0.72	S	S	*	*			cis	-169	-177.3	-14.7	-103.7	166.5	-107.9	0	0	106.6
136	D	35	Very low	34.1	Very low	131 Å²	131	127.5 Å²	127.5	70%	0.701	73%	0.726	S	S	*	*			cis	-172.2	175.1	-0.3	-108.9	-9.6	0	0	0	106.5
137	E	35.9	Very low	34.8	Very low	154 Å²	154	129.3 Å²	129.3	72%	0.72	74%	0.736	S	S	*	*			cis	-167.5	173.5	-16.6	-161.4	-80.1	115.9	0	0	107.8
138	S	32.3	Very low	34.5	Very low	84 Å²	84	129 Å²	129	59%	0.587	74%	0.738	S	S	*	*			trans	86.7	144.1	154	-112.8	0	0	0	0	121.9
139	S	28.6	Very low	34	Very low	98 Å²	98	128.6 Å²	128.6	69%	0.685	75%	0.748	S	S	*	*			cis	-142.8	136.8	-0.3	-48	0	0	0	0	112.1
140	V	38	Very low	33.6	Very low	144 Å²	144	125.9 Å²	125.9	87%	0.873	74%	0.74	S	S	*	*			trans	-140.6	119.2	174.2	-175.2	0	0	0	0	112.7
141	P	62.3	Low	33.4	Very low	116 Å²	116	128 Å²	128	75%	0.753	75%	0.748	S	S	*	*			trans	-97.1	163.7	166.9	36.7	-31.7	0	0	0	112.1
142	A	32.5	Very low	33	Very low	87 Å²	87	124 Å²	124	72%	0.719	75%	0.748	S	S	*	*			cis	-171.8	-157.7	-17.5	0	0	0	0	0	107.9
143	C	26.7	Very low	33	Very low	126 Å²	126	121 Å²	121	85%	0.851	75%	0.746	S	S	*	*			trans	72.2	153.9	165.2	-72.4	0	0	0	0	117.6
144	V	28.7	Very low	32.8	Very low	123 Å²	123	127.1 Å²	127.1	75%	0.745	76%	0.756	S	S	*	*			cis	-160.5	153.9	-20.5	60.3	0	0	0	0	111
145	S	24.9	Very low	32.1	Very low	114 Å²	114	127 Å²	127	80%	0.797	75%	0.754	S	S	*	*			trans	69.6	156	169.6	-74.3	0	0	0	0	119.1
146	L	27.6	Very low	31.6	Very low	159 Å²	159	127.2 Å²	127.2	83%	0.832	76%	0.755	S	S	*	*			trans	-148.8	167.1	-148	-90.9	172.6	0	0	0	110.4
147	P	50	Low	31.1	Very low	130 Å²	130	129.2 Å²	129.2	84%	0.844	76%	0.764	S	S	*	*				-144	-163.6	50.2	41.9	-20.2	0	0	0	116.7
148	L	29.6	Very low	30.6	Very low	142 Å²	142	127.1 Å²	127.1	74%	0.743	77%	0.766	S	S	*	*			trans	-150.7	128.5	-168.3	-169.1	168.1	0	0	0	113.7
149	V	26	Very low	30.3	Very low	140 Å²	140	127 Å²	127	85%	0.848	77%	0.77	S	S	*	*			trans	-133.9	104.6	168.5	171.9	0	0	0	0	107.5
150	S	29	Very low	30.1	Very low	77 Å²	77	128.5 Å²	128.5	54%	0.538	78%	0.775	S	S	.	*				73.6	137.1	77.9	-71.8	0	0	0	0	114.2
151	K	26.3	Very low	29.6	Very low	189 Å²	189	129.5 Å²	129.5	82%	0.822	77%	0.774	S	S	*	*			cis	-162.3	171.2	5.2	-120.6	167.9	-171.5	173.6	0	113.7
152	S	27.3	Very low	27.9	Very low	105 Å²	105	128.8 Å²	128.8	73%	0.734	77%	0.771	S	S	*	*			trans	-55.1	170.9	171.5	56.2	0	0	0	0	117.5
153	A	30.4	Very low	28	Very low	91 Å²	91	131 Å²	131	75%	0.752	78%	0.779	S	S	*	*			cis	174.7	171	-23.9	0	0	0	0	0	111.2
154	K	26.9	Very low	28	Very low	188 Å²	188	133.7 Å²	133.7	82%	0.817	78%	0.776	S	S	*	*			trans	90.7	152.2	145.9	-143.9	171.2	-173.2	171.5	0	120.2
155	C	21.1	Very low	28.1	Very low	105 Å²	105	135.1 Å²	135.1	71%	0.709	77%	0.774	S	S	*	*			trans	75.5	147.2	170.6	-58.4	0	0	0	0	117.7
156	H	24.8	Very low	28.1	Very low	169 Å²	169	135.6 Å²	135.6	78%	0.782	77%	0.768	S	S	*	*			cis	-173.1	-175.6	-31.4	-114.7	-49.7	0	0	0	109.6
157	I	24.4	Very low	28.1	Very low	173 Å²	173	133.1 Å²	133.1	89%	0.887	76%	0.764	S	S	*	*			trans	103.3	158.2	169.3	-57.2	168.4	0	0	0	114.9
158	S	25.9	Very low	27.1	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	76%	0.76	S	S	*	*			trans	-148.8	166.6	-147.7	-169.9	0	0	0	0	114.2
159	A	25.5	Very low	27.2	Very low	81 Å²	81	130.4 Å²	130.4	67%	0.669	76%	0.76	S	S	*	*			trans	72.9	114.3	152.5	0	0	0	0	0	122.2
160	V	25.2	Very low	27.4	Very low	130 Å²	130	129.2 Å²	129.2	79%	0.788	76%	0.758	S	S	*	*				37.3	128.2	116.8	-170.6	0	0	0	0	119.9
161	I	25.7	Very low	27.7	Very low	164 Å²	164	129.8 Å²	129.8	84%	0.841	77%	0.767	S	S	*	*				-175.2	146.5	123.9	-96	159.6	0	0	0	111.2
162	S	26.5	Very low	27.8	Very low	101 Å²	101	126.6 Å²	126.6	71%	0.706	76%	0.764	S	S	*	*			trans	-80.5	173.6	178.3	-44.8	0	0	0	0	113.3
163	P	36.3	Very low	28.1	Very low	135 Å²	135	129.9 Å²	129.9	88%	0.877	77%	0.768	S	S	*	*				-142.8	-177.2	101.5	39.6	-25.5	0	0	0	116.3
164	K	25.8	Very low	27.8	Very low	182 Å²	182	128.9 Å²	128.9	79%	0.791	77%	0.766	S	S	*	*			trans	-107.9	174.6	-157.9	-164.6	-172.2	-175.6	-175.7	0	111.5
165	Q	30	Very low	27.8	Very low	152 Å²	152	127.6 Å²	127.6	71%	0.71	76%	0.763	S	S	*	*			trans	78.4	154.2	159.1	-57.6	-163.3	-92.4	0	0	119.2
166	D	25.8	Very low	28.1	Very low	125 Å²	125	133.5 Å²	133.5	67%	0.668	77%	0.77	S	S	*	*			cis	-171.6	171	-27.5	-98	-14.7	0	0	0	111
167	S	28.4	Very low	29.5	Very low	106 Å²	106	130 Å²	130	74%	0.741	76%	0.763	S	S	*	*			trans	107.4	119.6	154.9	-44.9	0	0	0	0	115.7
168	S	28.3	Very low	29.7	Very low	110 Å²	110	127.4 Å²	127.4	77%	0.769	76%	0.759	S	S	*	*			cis	84.4	143.8	39.4	88	0	0	0	0	113.3
169	S	31.7	Very low	29.7	Very low	106 Å²	106	126.3 Å²	126.3	74%	0.741	76%	0.757	S	S	*	*			cis	-169.4	-173.9	-8.6	44.9	0	0	0	0	112.5
170	S	29.5	Very low	29.7	Very low	115 Å²	115	127.6 Å²	127.6	80%	0.804	76%	0.761	S	S	*	*			trans	90.2	126.9	171.6	72.2	0	0	0	0	117.1
171	A	35.8	Very low	29.7	Very low	88 Å²	88	128 Å²	128	73%	0.727	76%	0.764	S	S	*	*			cis	106.7	149	22.3	0	0	0	0	0	112.1
172	T	29.5	Very low	29.7	Very low	122 Å²	122	126.9 Å²	126.9	75%	0.748	77%	0.765	S	S	*	*			cis	-158.9	170.4	7	-7.1	0	0	0	0	107.5
173	E	31.6	Very low	29.6	Very low	175 Å²	175	129.9 Å²	129.9	82%	0.818	77%	0.772	S	S	*	*			cis	-159.2	176.3	1	-165.6	137.4	-115.3	0	0	109.5
174	G	24.9	Very low	29	Very low	69 Å²	69	128.8 Å²	128.8	71%	0.711	76%	0.763	S	S	*	*			trans	130.8	138.9	162.9	0	0	0	0	0	116.8
175	Q	26.6	Very low	29.3	Very low	161 Å²	161	128.5 Å²	128.5	75%	0.752	77%	0.765	S	S	*	*				-157.9	116.5	-74.7	171.9	164.4	27.3	0	0	113.3
176	W	28.7	Very low	29	Very low	230 Å²	230	129.6 Å²	129.6	87%	0.871	77%	0.77	S	S	*	*			trans	72.9	164.3	149.7	-91.6	23.7	0	0	0	121
177	P	54.1	Low	29	Very low	96 Å²	96	127.6 Å²	127.6	62%	0.623	77%	0.766	S	S	*	*				-143.4	-164.7	-81.2	38.7	-15.1	0	0	0	115.9
178	S	27.3	Very low	28.9	Very low	117 Å²	117	128.2 Å²	128.2	82%	0.818	77%	0.77	S	S	*	*			trans	87.4	149.6	165.6	-22.4	0	0	0	0	116.2
179	A	26.6	Very low	28.7	Very low	88 Å²	88	126.5 Å²	126.5	73%	0.727	77%	0.769	S	S	*	*			cis	-147.4	149.9	-0.3	0	0	0	0	0	113.4
180	S	25.8	Very low	28.4	Very low	108 Å²	108	128 Å²	128	76%	0.755	77%	0.774	S	S	*	*			trans	22.9	131.3	135.1	-43.6	0	0	0	0	120.8
181	V	25.8	Very low	28.2	Very low	138 Å²	138	128 Å²	128	84%	0.836	77%	0.769	S	S	*	*			cis	76.1	118.3	41	-176.8	0	0	0	0	114.6
182	T	24.1	Very low	27.6	Very low	141 Å²	141	132.6 Å²	132.6	87%	0.865	78%	0.775	S	S	*	*			trans	-143.3	-156.4	166.3	43.6	0	0	0	0	109.7
183	L	25.6	Very low	27.3	Very low	163 Å²	163	134.4 Å²	134.4	85%	0.853	78%	0.775	S	S	*	*			trans	-153.4	-174.1	-151.7	-111.6	170.6	0	0	0	116.2
184	T	22.4	Very low	27	Very low	113 Å²	113	131.7 Å²	131.7	69%	0.693	77%	0.77	S	S	*	*			trans	-78.2	164.3	177.1	51.9	0	0	0	0	115.1
185	Q	33.9	Very low	27	Very low	176 Å²	176	132.5 Å²	132.5	82%	0.822	77%	0.765	S	S	*	*			trans	7.6	127.7	138.8	-174.2	-177.2	11.5	0	0	119.3
186	E	22.2	Very low	26.9	Very low	174 Å²	174	131.7 Å²	131.7	81%	0.813	77%	0.766	S	S	*	*			trans	-116	149.5	142.2	-65.3	-168.9	83.6	0	0	107.6
187	S	26.4	Very low	26.8	Very low	84 Å²	84	125.2 Å²	125.2	59%	0.587	76%	0.761	S	S	*	*			cis	78.2	143.9	28	114.4	0	0	0	0	114
188	S	25.4	Very low	25.6	Very low	119 Å²	119	128.5 Å²	128.5	83%	0.832	77%	0.768	S	S	*	*			cis	-169.2	153.3	-13.6	-109.9	0	0	0	0	111.4
189	G	24.8	Very low	25.7	Very low	73 Å²	73	130.6 Å²	130.6	75%	0.753	77%	0.765	S	S	*	*			trans	83.1	171.5	161.6	0	0	0	0	0	118.2
190	V	26.2	Very low	25.7	Very low	138 Å²	138	131.1 Å²	131.1	84%	0.836	76%	0.764	S	S	*	*			cis	-159.6	149.4	-6.7	114.9	0	0	0	0	112.6
191	V	24.2	Very low	25.8	Very low	115 Å²	115	130.6 Å²	130.6	70%	0.697	76%	0.76	S	S	*	*			trans	4	129.9	159.5	-174.1	0	0	0	0	121.9
192	E	24	Very low	25.9	Very low	184 Å²	184	129.5 Å²	129.5	86%	0.86	75%	0.749	S	S	*	*				-172.4	125.4	113.9	-94.1	-173.2	161.8	0	0	107.4
193	E	23	Very low	26.1	Very low	160 Å²	160	131 Å²	131	75%	0.748	74%	0.744	S	S	*	*				69.9	113.8	64.1	-81.1	-123	100.4	0	0	116.6
194	V	25.1	Very low	26	Very low	118 Å²	118	127.8 Å²	127.8	72%	0.715	74%	0.735	S	S	*	*			trans	60.8	115.1	136.1	175.1	0	0	0	0	117.8
195	S	24.2	Very low	26.1	Very low	87 Å²	87	130.1 Å²	130.1	61%	0.608	74%	0.736	S	S	*	*				-178.1	169.9	74.9	34.8	0	0	0	0	113.8
196	N	24.9	Very low	25.6	Very low	143 Å²	143	130.5 Å²	130.5	77%	0.765	74%	0.735	S	S	*	*			trans	71.5	97.5	169.3	-40.2	-58.5	0	0	0	113.6
197	A	27.5	Very low	25.9	Very low	94 Å²	94	127.1 Å²	127.1	78%	0.777	73%	0.731	S	S	*	*			cis	60.6	106.3	26.9	0	0	0	0	0	114.8
198	E	27.5	Very low	26.4	Very low	165 Å²	165	128.2 Å²	128.2	77%	0.771	74%	0.736	S	S	*	*				-147.4	131.1	128.7	-97.4	-167.3	133.9	0	0	109.5
199	Q	29.2	Very low	26.5	Very low	161 Å²	161	130.6 Å²	130.6	75%	0.752	73%	0.731	S	S	*	*			trans	52	136	136.5	-66.1	164	45.2	0	0	120.8
200	S	28.5	Very low	26.6	Very low	100 Å²	100	134.1 Å²	134.1	70%	0.699	73%	0.728	S	S	*	*			cis	-162.3	157.5	0.1	55.6	0	0	0	0	113.5
201	S	27.2	Very low	26.5	Very low	96 Å²	96	132.7 Å²	132.7	67%	0.671	72%	0.724	S	S	*	*			trans	-8.7	156.3	143.8	67.7	0	0	0	0	118.6
202	D	27.8	Very low	26.5	Very low	115 Å²	115	136.5 Å²	136.5	62%	0.615	73%	0.734	S	S	*	*			cis	-170.1	-178.7	23.3	-144.7	-30.4	0	0	0	112.9
203	F	27.6	Very low	26.6	Very low	172 Å²	172	135.9 Å²	135.9	75%	0.754	73%	0.734	S	S	*	*			trans	55.6	112.2	164.5	-54.4	-61.8	0	0	0	117.6
204	S	25.1	Very low	27.5	Very low	96 Å²	96	134 Å²	134	67%	0.671	74%	0.736	S	S	*	*			cis	84.4	145.2	34.9	-159.3	0	0	0	0	116.4
205	F	23.7	Very low	27.6	Very low	162 Å²	162	137.1 Å²	137.1	71%	0.711	74%	0.742	S	S	*	*			trans	78.1	98.2	170.6	-71.2	-63.9	0	0	0	122.5
206	K	23.7	Very low	27.7	Very low	184 Å²	184	139.9 Å²	139.9	80%	0.8	76%	0.755	S	S	*	*				80.9	139.8	123.6	-85	171.6	-173.4	168.5	0	122.4
207	S	27.9	Very low	27.8	Very low	104 Å²	104	139.3 Å²	139.3	73%	0.727	76%	0.757	S	S	*	*			trans	-70.8	172.3	162.1	63.5	0	0	0	0	111.8
208	P	37.9	Very low	27.7	Very low	107 Å²	107	142.1 Å²	142.1	70%	0.695	76%	0.758	S	S	*	*				-157.2	171.9	68.8	43.3	-22.2	0	0	0	119.5
209	K	25.9	Very low	27.9	Very low	168 Å²	168	138.3 Å²	138.3	73%	0.73	75%	0.75	S	S	*	*			trans	62	112.3	139.1	-81.5	174.3	167.3	-82.9	0	123.3
210	E	26.5	Very low	27.6	Very low	148 Å²	148	136.8 Å²	136.8	69%	0.692	75%	0.747	S	S	*	*				55.7	113.2	99.8	-173.4	-174.8	-152.9	0	0	120
211	S	24.8	Very low	27.7	Very low	107 Å²	107	138.5 Å²	138.5	75%	0.748	75%	0.753	S	S	*	*				159.2	145.8	118.5	53.1	0	0	0	0	117.1
212	Q	24.7	Very low	27.6	Very low	195 Å²	195	137.9 Å²	137.9	91%	0.911	76%	0.762	S	S	*	*			trans	63.8	140.6	148.9	-73.5	-178.9	-14	0	0	125.2
213	M	25.6	Very low	27.5	Very low	171 Å²	171	137.8 Å²	137.8	84%	0.842	77%	0.77	S	S	*	*			trans	-78.8	163.1	164.7	-90.1	-82.7	-166.9	0	0	112.1
214	P	42.1	Very low	27.4	Very low	122 Å²	122	135 Å²	135	79%	0.792	77%	0.767	S	S	*	*				-148.2	170.7	102.3	39.2	-23.3	0	0	0	116.6
215	E	27.6	Very low	27.5	Very low	182 Å²	182	136.8 Å²	136.8	85%	0.85	77%	0.774	S	S	*	*			trans	-75.9	166.5	176.1	-64.3	175	94.6	0	0	115.4
216	T	25.6	Very low	27.7	Very low	145 Å²	145	133.1 Å²	133.1	89%	0.89	77%	0.774	S	S	*	*			trans	-150.3	172.5	149.2	-26.6	0	0	0	0	110.2
217	V	26.4	Very low	27.8	Very low	131 Å²	131	133 Å²	133	79%	0.794	78%	0.781	S	S	*	*			trans	-146.9	-179.9	-155.1	71.6	0	0	0	0	113.8
218	L	27.1	Very low	27.7	Very low	154 Å²	154	136.6 Å²	136.6	81%	0.806	79%	0.786	S	S	*	*			trans	101.5	150.3	175.8	-57.1	-179.4	0	0	0	116
219	S	30.3	Very low	27.2	Very low	85 Å²	85	140 Å²	140	59%	0.594	80%	0.798	S	S	*	*			cis	-169.6	173.2	-31.8	61.4	0	0	0	0	110.8
220	D	24.3	Very low	27.2	Very low	129 Å²	129	134.9 Å²	134.9	69%	0.69	79%	0.792	S	S	*	*			trans	70.6	129.7	165.1	-61.6	-56	0	0	0	118.4
221	T	29.3	Very low	27.2	Very low	135 Å²	135	135 Å²	135	83%	0.828	80%	0.796	S	S	*	*			cis	87.1	126.6	37.9	80.6	0	0	0	0	115.2
222	G	25.3	Very low	27.3	Very low	83 Å²	83	137.6 Å²	137.6	86%	0.856	80%	0.797	S	S	*	*			trans	156.7	100.3	176.5	0	0	0	0	0	115.6
223	S	25.4	Very low	27.6	Very low	113 Å²	113	136.9 Å²	136.9	79%	0.79	79%	0.791	S	S	*	*			trans	-86.3	167.1	176.5	179.2	0	0	0	0	112.9
224	V	26.4	Very low	27.5	Very low	114 Å²	114	138 Å²	138	69%	0.691	79%	0.794	S	S	*	*			trans	147.8	104.2	131.1	165.9	0	0	0	0	115.1
225	T	27.4	Very low	26.9	Very low	134 Å²	134	136.8 Å²	136.8	82%	0.822	80%	0.795	S	S	*	*			trans	54.9	173.8	148.4	63.8	0	0	0	0	121.5
226	A	28.4	Very low	26.8	Very low	85 Å²	85	134.1 Å²	134.1	70%	0.702	80%	0.796	S	S	*	*			cis	-177.1	147.2	-48.3	0	0	0	0	0	107.9
227	L	25.5	Very low	26.9	Very low	181 Å²	181	133.9 Å²	133.9	95%	0.948	79%	0.794	S	S	*	*			trans	-139.8	152.3	155.9	-97.8	180	0	0	0	110.6
228	H	25.8	Very low	28.1	Very low	180 Å²	180	133.3 Å²	133.3	83%	0.833	79%	0.793	S	S	*	*			trans	-140.9	137.4	-163.1	-146.5	75.1	0	0	0	108.8
229	L	27.5	Very low	27.9	Very low	179 Å²	179	133.8 Å²	133.8	94%	0.937	80%	0.796	S	S	*	*			trans	-149.6	135.7	156.2	-101.8	179.7	0	0	0	108.7
230	G	24.4	Very low	27.7	Very low	60 Å²	60	133.5 Å²	133.5	62%	0.619	80%	0.799	S	S	*	*			trans	-172.3	155.8	177	0	0	0	0	0	110.9
231	L	26.7	Very low	27.8	Very low	149 Å²	149	136 Å²	136	78%	0.78	80%	0.804	S	S	*	*			trans	-145.5	107.6	162.2	-96.7	116	0	0	0	105.4
232	E	27.1	Very low	27.7	Very low	162 Å²	162	136.3 Å²	136.3	76%	0.757	80%	0.8	S	S	*	*				79.1	114.1	101.2	-72.5	-169.1	159.4	0	0	112.4
233	K	30.4	Very low	27.9	Very low	181 Å²	181	138.6 Å²	138.6	79%	0.787	79%	0.793	S	S	*	*			cis	96.6	106.2	38.4	176.7	-159.4	173.7	-166.5	0	111.5
234	E	24.6	Very low	28.1	Very low	193 Å²	193	136.5 Å²	136.5	90%	0.902	78%	0.778	S	S	*	*			trans	-158	163.2	131.4	-122.3	174	-156.2	0	0	111.1
235	A	28.8	Very low	28.2	Very low	98 Å²	98	139.4 Å²	139.4	81%	0.81	78%	0.784	S	S	*	*			trans	-158.5	135.2	-175.5	0	0	0	0	0	112.1
236	S	26.1	Very low	28.4	Very low	125 Å²	125	139.7 Å²	139.7	87%	0.874	79%	0.785	S	S	*	*			trans	-165.8	159.5	160	51.6	0	0	0	0	111.7
237	T	27.6	Very low	28.4	Very low	140 Å²	140	144.3 Å²	144.3	86%	0.859	79%	0.792	S	S	*	*			trans	-95.2	-175.7	-165.2	7.4	0	0	0	0	113.6
238	P	51.8	Low	28.6	Very low	119 Å²	119	144.5 Å²	144.5	77%	0.773	79%	0.788	S	S	*	*			trans	-100.1	174.1	-142	41.9	-39.9	0	0	0	115.8
239	L	23.5	Very low	28.7	Very low	164 Å²	164	140.1 Å²	140.1	86%	0.859	78%	0.783	S	S	*	*			trans	-151.9	164.4	157.2	-113.7	169.1	0	0	0	111.7	F241	L239-F241 HydrophobicContact CD2-CE2 4.48Å
240	A	26.2	Very low	28.8	Very low	80 Å²	80	137.8 Å²	137.8	66%	0.661	78%	0.776	S	S	*	*			trans	-110.6	-154.8	-173.2	0	0	0	0	0	112.5
241	F	24.8	Very low	29.1	Very low	180 Å²	180	140.6 Å²	140.6	79%	0.789	79%	0.786	S	S	*	*			trans	83.1	142.8	176.4	-60.8	-59.9	0	0	0	116.1	L239	L239-F241 HydrophobicContact CD2-CE2 4.48Å
242	L	29	Very low	29.2	Very low	143 Å²	143	136.8 Å²	136.8	75%	0.749	78%	0.782	S	S	*	*			cis	-150	168.7	-0.6	-109.7	165.7	0	0	0	107.4
243	N	28	Very low	29.3	Very low	131 Å²	131	137.3 Å²	137.3	70%	0.701	78%	0.784	S	S	*	*			cis	-157.1	178.9	33.5	-120.2	52.6	0	0	0	107.1
244	S	29.2	Very low	29.5	Very low	68 Å²	68	137.7 Å²	137.7	48%	0.476	78%	0.781	S	S	.	*			cis	-168.5	158.3	-31.1	55.9	0	0	0	0	110.3
245	E	29.9	Very low	29.7	Very low	176 Å²	176	134 Å²	134	82%	0.822	77%	0.768	S	S	*	*			trans	66.9	145	153	-66.3	151.4	142.9	0	0	119.2
246	V	30.2	Very low	29.7	Very low	139 Å²	139	134.2 Å²	134.2	84%	0.842	76%	0.763	S	S	*	*			cis	-125.5	175.1	21.4	176.7	0	0	0	0	112.5
247	E	30.3	Very low	29.8	Very low	182 Å²	182	134.2 Å²	134.2	85%	0.85	76%	0.757	S	S	*	*			trans	-84.2	154.2	-166	-46.7	178.8	110.8	0	0	117.8
248	E	28.1	Very low	29.9	Very low	186 Å²	186	134 Å²	134	87%	0.869	76%	0.756	S	S	*	*				-172.7	124.9	113.3	-95.8	-166.6	135	0	0	108.5
249	A	28.9	Very low	28.7	Very low	88 Å²	88	131.3 Å²	131.3	73%	0.727	75%	0.749	S	S	*	*				67.7	131.2	83.2	0	0	0	0	0	115.1
250	V	29.6	Very low	29	Very low	129 Å²	129	131.8 Å²	131.8	78%	0.782	75%	0.749	S	S	*	*			cis	-162	147.4	-5.3	107	0	0	0	0	112.3
251	S	30.1	Very low	29	Very low	120 Å²	120	134.3 Å²	134.3	84%	0.839	75%	0.751	S	S	*	*			trans	62.9	157.3	165.2	72.7	0	0	0	0	120.1
252	G	28.7	Very low	29.2	Very low	68 Å²	68	130 Å²	130	70%	0.701	74%	0.743	S	S	*	*			cis	163.3	152.5	-10.4	0	0	0	0	0	114.7
253	H	29	Very low	29.1	Very low	173 Å²	173	129.7 Å²	129.7	80%	0.801	74%	0.742	S	S	*	*			trans	69.8	133	-175	-88.8	54.7	0	0	0	115.7
254	R	34.2	Very low	29.1	Very low	189 Å²	189	129 Å²	129	71%	0.713	75%	0.748	S	S	*	*			cis	74.9	137.4	46.9	-73.3	-178.3	170.6	-90.3	3.5	112.9
255	D	29.2	Very low	28.8	Very low	117 Å²	117	132.1 Å²	132.1	63%	0.626	77%	0.768	S	S	*	*			cis	-143.7	144.8	4.4	-91.6	-41.9	0	0	0	106.5
256	S	29.5	Very low	28.7	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	77%	0.766	S	S	*	*				105	140.4	60.9	-160	0	0	0	0	113.3
257	V	28.9	Very low	28.7	Very low	125 Å²	125	134 Å²	134	76%	0.758	77%	0.766	S	S	*	*			trans	78	113	163.7	175.2	0	0	0	0	121.2
258	V	28.2	Very low	28.5	Very low	136 Å²	136	131.3 Å²	131.3	82%	0.824	77%	0.768	S	S	*	*			trans	32.7	135.2	132.3	-167.4	0	0	0	0	120.2
259	G	27.5	Very low	28.4	Very low	62 Å²	62	126.5 Å²	126.5	64%	0.639	76%	0.759	S	S	*	*			cis	139.7	165.3	-0.9	0	0	0	0	0	113.7
260	M	29.1	Very low	28.1	Very low	175 Å²	175	127.9 Å²	127.9	86%	0.862	76%	0.762	S	S	*	*			trans	66.6	148	177.5	-66.3	-159.8	136.4	0	0	116.5
261	L	27.7	Very low	28	Very low	133 Å²	133	127.9 Å²	127.9	70%	0.696	76%	0.758	S	S	*	*			cis	-156.6	153.2	-3.8	-119	168.9	0	0	0	110.2
262	S	28.5	Very low	27.8	Very low	88 Å²	88	130.8 Å²	130.8	62%	0.615	76%	0.758	S	S	*	*			trans	48.3	132.5	148.5	-86.6	0	0	0	0	125.1
263	D	26.1	Very low	27.7	Very low	138 Å²	138	135.3 Å²	135.3	74%	0.738	76%	0.761	S	S	*	*			trans	76.4	95.4	131	-54.8	-28.2	0	0	0	123.6
264	S	27.6	Very low	27.6	Very low	117 Å²	117	132.5 Å²	132.5	82%	0.818	76%	0.76	S	S	*	*				97.1	159	113.3	82.5	0	0	0	0	122.2
265	C	23.6	Very low	27.2	Very low	132 Å²	132	131.4 Å²	131.4	89%	0.892	76%	0.761	S	S	*	*			trans	85.3	158.4	158.5	-143.1	0	0	0	0	120.1
266	M	26.7	Very low	27.3	Very low	159 Å²	159	132.4 Å²	132.4	78%	0.783	76%	0.762	S	S	*	*			trans	-101.1	150.9	-154	-82.3	-82.5	156.1	0	0	115.7
267	K	31.1	Very low	27.3	Very low	196 Å²	196	136.1 Å²	136.1	85%	0.852	77%	0.768	S	S	*	*			trans	35.1	118.3	146	-70.3	-178	175	178.5	0	120.9
268	S	26	Very low	27.4	Very low	126 Å²	126	138.3 Å²	138.3	88%	0.881	77%	0.77	S	S	*	*			trans	-151.8	161.3	134.9	66.5	0	0	0	0	107.5
269	A	26.1	Very low	27.4	Very low	84 Å²	84	141.9 Å²	141.9	69%	0.694	77%	0.769	S	S	*	*			cis	-141.9	159	0.7	0	0	0	0	0	107.2
270	C	23.3	Very low	27.5	Very low	117 Å²	117	142.3 Å²	142.3	79%	0.791	76%	0.762	S	S	*	*				42.8	137.4	74.2	-57	0	0	0	0	114.1
271	L	27.8	Very low	27.5	Very low	130 Å²	130	142 Å²	142	68%	0.681	76%	0.758	S	S	*	*			cis	-159.4	166.2	7.2	-157.2	85.4	0	0	0	109.7	Q273	L271-Q273 HydrophobicContact CD2-CG 4.34Å
272	E	25.4	Very low	27.5	Very low	180 Å²	180	139.8 Å²	139.8	84%	0.841	75%	0.754	S	S	*	*			trans	-173	160.5	137.3	-100.3	-66	88.2	0	0	109
273	Q	26.7	Very low	27.6	Very low	164 Å²	164	143 Å²	143	77%	0.766	76%	0.763	S	S	*	*			trans	-138.6	145.6	-167.4	-59.1	179.9	-88.6	0	0	115.3	L271	L271-Q273 HydrophobicContact CD2-CG 4.34Å
274	S	27	Very low	27.5	Very low	113 Å²	113	143.7 Å²	143.7	79%	0.79	77%	0.766	S	S	*	*			trans	-165.9	125.8	146.6	56.4	0	0	0	0	113.8
275	K	26.2	Very low	27.5	Very low	166 Å²	166	142.1 Å²	142.1	72%	0.722	76%	0.755	S	S	*	*				25.2	146.1	127.8	-77.6	-171	171.6	-73	0	120.6
276	E	30	Very low	27.5	Very low	138 Å²	138	142.5 Å²	142.5	65%	0.645	75%	0.754	S	S	*	*			cis	-173.9	166.9	-10.5	-137.1	155.8	-139.9	0	0	110.6
277	E	29.9	Very low	27.6	Very low	179 Å²	179	140.3 Å²	140.3	84%	0.836	75%	0.749	S	S	*	*			trans	66	-174.2	160.6	-76.7	-178.5	158	0	0	121.4
278	E	31.3	Very low	27.9	Very low	172 Å²	172	136.8 Å²	136.8	80%	0.804	75%	0.746	S	S	*	*			trans	-122.5	149.7	-137.1	-75	-167.4	77.9	0	0	118.1
279	R	28.3	Very low	27.9	Very low	211 Å²	211	137.1 Å²	137.1	80%	0.796	74%	0.742	S	S	*	*			trans	69.4	133.2	130	-176.2	172.8	179.6	172.9	0.7	124.6
280	S	29.7	Very low	27.8	Very low	71 Å²	71	137.9 Å²	137.9	50%	0.497	74%	0.742	S	S	.	*			trans	73.9	129.2	151.7	-80.9	0	0	0	0	123
281	E	28.2	Very low	27.9	Very low	168 Å²	168	140.9 Å²	140.9	79%	0.785	74%	0.744	S	S	*	*			trans	62.6	157.5	137.8	-71.1	146.7	-120	0	0	120.8
282	S	28	Very low	28	Very low	86 Å²	86	143.7 Å²	143.7	60%	0.601	75%	0.754	S	S	*	*			cis	-171.7	148.6	-23.8	57.2	0	0	0	0	111.4
283	I	30.2	Very low	28.1	Very low	156 Å²	156	144.9 Å²	144.9	80%	0.8	76%	0.759	S	S	*	*			trans	65.3	147.5	156.3	-56.7	152.9	0	0	0	115.2
284	D	24.8	Very low	28.2	Very low	152 Å²	152	144.9 Å²	144.9	81%	0.813	77%	0.765	S	S	*	*			cis	-154.1	-175.2	23	-149.1	-8	0	0	0	115.4
285	S	27.2	Very low	28.3	Very low	84 Å²	84	144.4 Å²	144.4	59%	0.587	77%	0.767	S	S	*	*			trans	-52.7	167.6	174.4	-174.1	0	0	0	0	119.9
286	T	24.8	Very low	28.4	Very low	140 Å²	140	145.3 Å²	145.3	86%	0.859	77%	0.774	S	S	*	*			trans	-150.2	135.2	155.7	-73.1	0	0	0	0	110.8
287	V	28.3	Very low	29.2	Very low	113 Å²	113	143.5 Å²	143.5	69%	0.685	78%	0.775	S	S	*	*			trans	-138.3	141.1	-179.8	174.2	0	0	0	0	110.3
288	P	37.3	Very low	29	Very low	123 Å²	123	145.1 Å²	145.1	80%	0.799	78%	0.779	S	S	*	*			trans	-104.9	164.3	163.6	36.5	-28.9	0	0	0	113.4
289	V	24.9	Very low	28.9	Very low	132 Å²	132	140.4 Å²	140.4	80%	0.8	78%	0.777	S	S	*	*			trans	-126.4	155.6	-161.5	172.4	0	0	0	0	112.3
290	C	23.7	Very low	29	Very low	101 Å²	101	138.2 Å²	138.2	68%	0.682	78%	0.781	S	S	*	*			trans	151.5	150.2	149.6	-85.4	0	0	0	0	110.7
291	Q	27.1	Very low	29.1	Very low	180 Å²	180	143.8 Å²	143.8	84%	0.841	80%	0.799	S	S	*	*			cis	-159.3	173.8	-7.5	-122	167	-7.8	0	0	110.1
292	E	29.1	Very low	29.5	Very low	188 Å²	188	143.8 Å²	143.8	88%	0.879	80%	0.803	S	S	*	*			trans	-91.8	153.8	-176.7	-57.4	164.1	117.9	0	0	114.1
293	E	28.3	Very low	29.6	Very low	205 Å²	205	148.8 Å²	148.8	96%	0.958	82%	0.817	S	S	*	*			trans	-164.5	160.3	138.6	-119.6	177.7	-174	0	0	112.8
294	D	28.8	Very low	29.9	Very low	165 Å²	165	152.6 Å²	152.6	88%	0.882	82%	0.822	S	S	*	*			trans	-86.5	141.5	-166.8	-100.5	-52.3	0	0	0	116.1
295	A	29	Very low	30.3	Very low	102 Å²	102	153.7 Å²	153.7	84%	0.843	82%	0.822	S	S	*	*			trans	176.9	129.2	134.7	0	0	0	0	0	114.5
296	Q	26.8	Very low	30.9	Very low	185 Å²	185	159.5 Å²	159.5	86%	0.864	83%	0.831	S	S	*	*			trans	-96.4	171.6	165.1	-106.6	-170.2	-67.8	0	0	111.5
297	P	46.7	Very low	31.4	Very low	101 Å²	101	161 Å²	161	66%	0.656	83%	0.832	S	S	*	*			cis	-135.1	166.3	-20.6	38.2	-23.5	0	0	0	114.2
298	K	27.1	Very low	31.6	Very low	212 Å²	212	159.6 Å²	159.6	92%	0.922	84%	0.84	S	S	*	*			trans	177.4	145.8	141.6	-107.8	169.6	-178	-178.2	0	114.1
299	G	27.8	Very low	31.4	Very low	74 Å²	74	156.5 Å²	156.5	76%	0.763	83%	0.83	S	S	*	*			trans	96.7	139.4	149.5	0	0	0	0	0	116.8
300	D	31.8	Very low	32.3	Very low	165 Å²	165	157 Å²	157	88%	0.882	83%	0.834	S	S	*	*			trans	-69.4	156.2	168	-48.4	-87	0	0	0	111.8
301	E	30.6	Very low	33.3	Very low	187 Å²	187	156.9 Å²	156.9	87%	0.874	83%	0.834	S	S	*	*				-173.8	164.6	98.7	-166.8	149.1	-152.8	0	0	110.3
302	L	37.3	Very low	34.9	Very low	168 Å²	168	153.7 Å²	153.7	88%	0.88	82%	0.822	S	S	*	*			trans	-87.6	128	173.1	-90.5	77.7	0	0	0	110.7
303	E	30.7	Very low	36.8	Very low	192 Å²	192	150.2 Å²	150.2	90%	0.897	81%	0.81	S	S	*	*			trans	-117.9	143.9	155.1	-77.2	-126	127.7	0	0	111.5
304	R	35.2	Very low	39	Very low	235 Å²	235	148.5 Å²	148.5	89%	0.887	80%	0.799	S	S	*	*			trans	-142	112.4	169.1	170.4	-174.5	-81.2	-161.5	-3.8	107.6	R306	R304-R306 PolarHBondContact O-N 3.34Å
305	E	33.8	Very low	41.4	Very low	176 Å²	176	146.5 Å²	146.5	82%	0.822	78%	0.784	S	S	*	*			trans	-59.9	131.4	166.6	-64.6	-176.6	103.5	0	0	109.3
306	R	39.7	Very low	43.7	Very low	206 Å²	206	146 Å²	146	78%	0.777	77%	0.765	S	S	*	*			cis	80.5	109.2	39.2	-163	-178	-163	-164.2	4.2	112.6	R304	R304-R306 PolarHBondContact O-N 3.34Å
307	I	34.9	Very low	46.2	Very low	171 Å²	171	141 Å²	141	88%	0.877	75%	0.746	S	S	*	*			trans	-123	123.2	163.5	-65.5	180	0	0	0	108.5
308	G	33.1	Very low	48	Very low	83 Å²	83	141.5 Å²	141.5	86%	0.856	74%	0.74	S	S	*	*			trans	36.1	83.8	152.3	0	0	0	0	0	119.7
309	G	32.9	Very low	50.8	Low	58 Å²	58	136.7 Å²	136.7	60%	0.598	72%	0.719	S	S	*	*			trans	-118	126.4	150.5	0	0	0	0	0	109	S311	G309-S311 PolarHBondContact O-N 2.93Å; G309-S311 VanDerWaalsContact O-N 3.13Å
310	V	43	Very low	53.5	Low	144 Å²	144	138.5 Å²	138.5	87%	0.873	71%	0.71	S	S	*	*			trans	-74.7	102.3	177.6	179.7	0	0	0	0	108.9	L312	V310-L312 PolarHBondContact O-N 3.38Å
311	S	44.6	Very low	56	Low	97 Å²	97	136.5 Å²	136.5	68%	0.678	70%	0.695	S	S	*	*			trans	-78.1	107.9	168.1	52.5	0	0	0	0	109.3	G309	G309-S311 PolarHBondContact O-N 2.93Å; G309-S311 VanDerWaalsContact O-N 3.13Å
312	L	62.5	Low	58.7	Low	114 Å²	114	133 Å²	133	60%	0.597	68%	0.679	S	S	*	*			trans	-58.2	142.7	159.9	-68.5	172.8	0	0	0	108.8	V310	V310-L312 PolarHBondContact O-N 3.38Å
313	D	69.2	Low	61	Low	115 Å²	115	129 Å²	129	62%	0.615	66%	0.662	S	S	*	*			trans	-70.5	146.3	-171.4	-126.9	-35.4	0	0	0	110.6	E315 E316 V317	D313-E315 PolarHBondContact O-N 3.49Å; D313-E315 VanDerWaalsContact O-N 3.11Å; D313-E316 HydrophobicContact CB-CG 4.11Å; D313-E316 PolarHBondContact N-OE2 3.42Å; D313-E316 WeakPolarHBondContact O-CB 3.38Å; D313-E316 PolarHBondContact O-N 2.84Å; D313-V317 PolarHBondContact O-N 2.84Å
314	K	74.5	Confident	63.3	Low	168 Å²	168	122 Å²	122	73%	0.73	64%	0.636	S	S	*	*	H	α-helix	trans	-58.4	-34	-174.8	-173.6	-178.6	174.4	-171.6	0	111.8	E316 V317 E318	K314-E316 VanDerWaalsContact C-N 3.31Å; K314-E316 PolarHBondContact O-N 3.42Å; K314-V317 PolarHBondContact O-N 2.85Å; K314-E318 WeakPolarHBondContact O-CB 3.31Å; K314-E318 PolarHBondContact O-N 3.02Å; K314-E318 VanDerWaalsContact O-N 3.11Å
315	E	77.6	Confident	65.8	Low	124 Å²	124	115.1 Å²	115.1	58%	0.579	62%	0.616	S	S	*	*	H	α-helix	trans	-68.2	-26.5	176.5	-154.4	-169.7	120.8	0	0	113	D313 K319	D313-E315 PolarHBondContact O-N 3.49Å; D313-E315 VanDerWaalsContact O-N 3.11Å; E315-K319 WeakPolarHBondContact O-CB 3.25Å; E315-K319 VanDerWaalsContact O-CD 3.26Å; E315-K319 WeakPolarHBondContact O-CD 3.46Å; E315-K319 WeakPolarHBondContact O-CG 3.28Å; E315-K319 PolarHBondContact O-N 3.42Å; E315-K319 VanDerWaalsContact O-N 3.07Å; E315-K319 WeakPolarHBondContact OE1-CE 3.38Å; E315-K319 IonicContact OE1-NZ 2.87Å; E315-K319 PolarHBondContact OE1-NZ 3.24Å
316	E	78.4	Confident	68.1	Low	92 Å²	92	111.8 Å²	111.8	43%	0.43	60%	0.6	S	S	.	*	H	α-helix	trans	-75.3	-42.3	175.3	-59.5	-169.2	122.9	0	0	111.5	D313 K314 E318 K319 I320	D313-E316 HydrophobicContact CB-CG 4.11Å; D313-E316 PolarHBondContact N-OE2 3.42Å; D313-E316 WeakPolarHBondContact O-CB 3.38Å; D313-E316 PolarHBondContact O-N 2.84Å; K314-E316 VanDerWaalsContact C-N 3.31Å; K314-E316 PolarHBondContact O-N 3.42Å; E316-E318 VanDerWaalsContact C-N 3.31Å; E316-E318 PolarHBondContact O-N 3.38Å; E316-K319 WeakPolarHBondContact O-CB 3.42Å; E316-K319 PolarHBondContact O-N 2.94Å; E316-I320 VanDerWaalsContact O-CG1 3.32Å; E316-I320 WeakPolarHBondContact O-CG1 3.5Å; E316-I320 PolarHBondContact O-N 2.9Å
317	V	78.9	Confident	70.4	Confident	79 Å²	79	106.8 Å²	106.8	48%	0.479	59%	0.588	S	S	.	*	H	α-helix	trans	-60	-44.2	173.8	-177.6	0	0	0	0	110.5	D313 K314 K319 I320 E321	D313-V317 PolarHBondContact O-N 2.84Å; K314-V317 PolarHBondContact O-N 2.85Å; V317-K319 PolarHBondContact O-N 3.06Å; V317-I320 PolarHBondContact O-N 3.03Å; V317-E321 PolarHBondContact O-N 3.23Å
318	E	84.4	Confident	72.7	Confident	112 Å²	112	103.3 Å²	103.3	52%	0.523	57%	0.57	S	S	.	*	H	α-helix	trans	-67.5	-32.8	178.5	-165.4	162.8	-169.7	0	0	112.4	K314 E316 Q322	K314-E318 WeakPolarHBondContact O-CB 3.31Å; K314-E318 PolarHBondContact O-N 3.02Å; K314-E318 VanDerWaalsContact O-N 3.11Å; E316-E318 VanDerWaalsContact C-N 3.31Å; E316-E318 PolarHBondContact O-N 3.38Å; E318-Q322 WeakPolarHBondContact O-CB 3.31Å; E318-Q322 WeakPolarHBondContact O-CG 3.45Å; E318-Q322 PolarHBondContact O-N 2.77Å
319	K	86.5	Confident	75.3	Confident	110 Å²	110	102.2 Å²	102.2	48%	0.478	55%	0.549	S	S	.	.	H	α-helix	trans	-66.6	-41.1	169.5	-75.3	160.9	-169.2	158	0	112.6	E315 E316 V317 Q322 V323	E315-K319 WeakPolarHBondContact O-CB 3.25Å; E315-K319 VanDerWaalsContact O-CD 3.26Å; E315-K319 WeakPolarHBondContact O-CD 3.46Å; E315-K319 WeakPolarHBondContact O-CG 3.28Å; E315-K319 PolarHBondContact O-N 3.42Å; E315-K319 VanDerWaalsContact O-N 3.07Å; E315-K319 WeakPolarHBondContact OE1-CE 3.38Å; E315-K319 IonicContact OE1-NZ 2.87Å; E315-K319 PolarHBondContact OE1-NZ 3.24Å; E316-K319 WeakPolarHBondContact O-CB 3.42Å; E316-K319 PolarHBondContact O-N 2.94Å; V317-K319 PolarHBondContact O-N 3.06Å; K319-Q322 PolarHBondContact O-N 3.49Å; K319-V323 WeakPolarHBondContact O-CG2 3.15Å; K319-V323 PolarHBondContact O-N 3.18Å
320	I	84.2	Confident	77.7	Confident	113 Å²	113	106.1 Å²	106.1	58%	0.579	55%	0.55	S	S	*	.	H	α-helix	trans	-64.3	-43.3	177.3	-68.9	163	0	0	0	110.2	E316 V317 V323 A324	E316-I320 VanDerWaalsContact O-CG1 3.32Å; E316-I320 WeakPolarHBondContact O-CG1 3.5Å; E316-I320 PolarHBondContact O-N 2.9Å; V317-I320 PolarHBondContact O-N 3.03Å; I320-V323 PolarHBondContact O-N 2.87Å; I320-A324 PolarHBondContact O-N 2.62Å
321	E	83.2	Confident	79.8	Confident	123 Å²	123	103.8 Å²	103.8	58%	0.575	54%	0.536	S	S	*	.	H	α-helix	trans	-63.9	-44.1	176.4	-170.6	169	-169.9	0	0	111.9	V317 V323 A324 I325	V317-E321 PolarHBondContact O-N 3.23Å; E321-V323 PolarHBondContact O-N 3.27Å; E321-A324 PolarHBondContact O-N 2.63Å; E321-I325 HydrophobicContact CG-CD1 3.98Å; E321-I325 VanDerWaalsContact O-CG1 3.29Å; E321-I325 WeakPolarHBondContact O-CG1 3.49Å; E321-I325 PolarHBondContact O-N 3.27Å
322	Q	87.1	Confident	81.8	Confident	113 Å²	113	104.1 Å²	104.1	53%	0.528	53%	0.529	S	S	.	.	H	α-helix	trans	-54.9	-46.5	171.9	-78.1	-88.4	-9.1	0	0	112.7	E318 K319 I325 Q326	E318-Q322 WeakPolarHBondContact O-CB 3.31Å; E318-Q322 WeakPolarHBondContact O-CG 3.45Å; E318-Q322 PolarHBondContact O-N 2.77Å; K319-Q322 PolarHBondContact O-N 3.49Å; Q322-I325 PolarHBondContact O-N 3.25Å; Q322-Q326 PolarHBondContact O-N 3.15Å; Q322-Q326 VanDerWaalsContact O-N 3.08Å
323	V	87.3	Confident	82.8	Confident	85 Å²	85	104.4 Å²	104.4	52%	0.515	53%	0.53	S	S	.	.	H	α-helix	trans	-65.2	-43.9	179.4	169.3	0	0	0	0	111.2	K319 I320 E321 I325 Q326 I327	K319-V323 WeakPolarHBondContact O-CG2 3.15Å; K319-V323 PolarHBondContact O-N 3.18Å; I320-V323 PolarHBondContact O-N 2.87Å; E321-V323 PolarHBondContact O-N 3.27Å; V323-I325 PolarHBondContact O-N 3.44Å; V323-Q326 PolarHBondContact O-N 3.24Å; V323-I327 HydrophobicContact CG1-CD1 3.83Å; V323-I327 WeakPolarHBondContact O-CG1 3.35Å; V323-I327 PolarHBondContact O-N 3.11Å
324	A	78.5	Confident	83.2	Confident	43 Å²	43	101.7 Å²	101.7	36%	0.355	52%	0.524	S	S	.	.	H	α-helix	trans	-59.7	-45.5	176.5	0	0	0	0	0	112	I320 E321 Q326 I327 I328	I320-A324 PolarHBondContact O-N 2.62Å; E321-A324 PolarHBondContact O-N 2.63Å; A324-Q326 VanDerWaalsContact C-N 3.34Å; A324-Q326 PolarHBondContact O-N 3.32Å; A324-I327 PolarHBondContact O-N 3.19Å; A324-I328 VanDerWaalsContact O-CG1 3.31Å; A324-I328 WeakPolarHBondContact O-CG1 3.35Å; A324-I328 PolarHBondContact O-N 2.78Å
325	I	87.3	Confident	83.2	Confident	91 Å²	91	96.1 Å²	96.1	47%	0.467	51%	0.509	S	S	.	.	H	α-helix	trans	-60.5	-41.3	177.2	-69.5	165.9	0	0	0	111.4	E321 Q322 V323 S329	E321-I325 HydrophobicContact CG-CD1 3.98Å; E321-I325 VanDerWaalsContact O-CG1 3.29Å; E321-I325 WeakPolarHBondContact O-CG1 3.49Å; E321-I325 PolarHBondContact O-N 3.27Å; Q322-I325 PolarHBondContact O-N 3.25Å; V323-I325 PolarHBondContact O-N 3.44Å; I325-S329 VanDerWaalsContact O-CB 3.3Å; I325-S329 WeakPolarHBondContact O-CB 3.31Å; I325-S329 PolarHBondContact O-N 3.23Å; I325-S329 PolarHBondContact O-OG 3.08Å
326	Q	83.1	Confident	83.4	Confident	106 Å²	106	93.5 Å²	93.5	50%	0.495	50%	0.502	S	S	.	.	H	α-helix	trans	-66.7	-39.6	176.8	-73.9	-165.1	28.1	0	0	113.1	Q322 V323 A324 S329 K330	Q322-Q326 PolarHBondContact O-N 3.15Å; Q322-Q326 VanDerWaalsContact O-N 3.08Å; V323-Q326 PolarHBondContact O-N 3.24Å; A324-Q326 VanDerWaalsContact C-N 3.34Å; A324-Q326 PolarHBondContact O-N 3.32Å; Q326-S329 PolarHBondContact O-N 3.01Å; Q326-K330 WeakPolarHBondContact O-CG 3.22Å; Q326-K330 PolarHBondContact O-N 3.22Å
327	I	86.5	Confident	83.3	Confident	101 Å²	101	95.8 Å²	95.8	52%	0.518	51%	0.513	S	S	.	.	H	α-helix	trans	-63.7	-50.1	177.4	-68	166.2	0	0	0	110	V323 A324 S329 K330 V331	V323-I327 HydrophobicContact CG1-CD1 3.83Å; V323-I327 WeakPolarHBondContact O-CG1 3.35Å; V323-I327 PolarHBondContact O-N 3.11Å; A324-I327 PolarHBondContact O-N 3.19Å; I327-S329 VanDerWaalsContact C-N 3.31Å; I327-S329 PolarHBondContact O-N 3.13Å; I327-K330 PolarHBondContact O-N 2.92Å; I327-V331 WeakPolarHBondContact O-CG2 3.33Å; I327-V331 PolarHBondContact O-N 3.28Å; I327-V331 VanDerWaalsContact O-N 3.07Å
328	I	83.4	Confident	83	Confident	99 Å²	99	99.1 Å²	99.1	51%	0.508	52%	0.523	S	S	.	.	H	α-helix	trans	-58.6	-44.6	178.7	-66.9	164.6	0	0	0	110.6	A324 K330 V331 I332	A324-I328 VanDerWaalsContact O-CG1 3.31Å; A324-I328 WeakPolarHBondContact O-CG1 3.35Å; A324-I328 PolarHBondContact O-N 2.78Å; I328-K330 PolarHBondContact O-N 3.19Å; I328-V331 PolarHBondContact O-N 3.15Å; I328-I332 HydrophobicContact CG2-CD1 3.77Å; I328-I332 WeakPolarHBondContact O-CG1 3.26Å; I328-I332 PolarHBondContact O-N 3.38Å
329	S	88.3	Confident	82.4	Confident	59 Å²	59	99.4 Å²	99.4	41%	0.413	53%	0.532	S	S	.	.	H	α-helix	trans	-61.7	-39.7	178.9	-60.3	0	0	0	0	112.9	I325 Q326 I327 L333	I325-S329 VanDerWaalsContact O-CB 3.3Å; I325-S329 WeakPolarHBondContact O-CB 3.31Å; I325-S329 PolarHBondContact O-N 3.23Å; I325-S329 PolarHBondContact O-OG 3.08Å; Q326-S329 PolarHBondContact O-N 3.01Å; I327-S329 VanDerWaalsContact C-N 3.31Å; I327-S329 PolarHBondContact O-N 3.13Å; S329-L333 WeakPolarHBondContact O-CB 3.46Å; S329-L333 PolarHBondContact O-N 2.85Å
330	K	82.2	Confident	81.5	Confident	140 Å²	140	100.3 Å²	100.3	61%	0.609	54%	0.541	S	S	*	.	H	α-helix	trans	-67.3	-41.4	176.6	-76.1	174.4	-179.3	174.3	0	112.5	Q326 I327 I328 L333 A334	Q326-K330 WeakPolarHBondContact O-CG 3.22Å; Q326-K330 PolarHBondContact O-N 3.22Å; I327-K330 PolarHBondContact O-N 2.92Å; I328-K330 PolarHBondContact O-N 3.19Å; K330-L333 PolarHBondContact O-N 2.89Å; K330-A334 WeakPolarHBondContact O-CB 3.28Å; K330-A334 PolarHBondContact O-N 3.04Å
331	V	87.3	Confident	80.3	Confident	96 Å²	96	99.4 Å²	99.4	58%	0.582	55%	0.545	S	S	*	.	H	α-helix	trans	-64.3	-43.1	177.4	174.1	0	0	0	0	111.1	I327 I328 A334 A335	I327-V331 WeakPolarHBondContact O-CG2 3.33Å; I327-V331 PolarHBondContact O-N 3.28Å; I327-V331 VanDerWaalsContact O-N 3.07Å; I328-V331 PolarHBondContact O-N 3.15Å; V331-A334 PolarHBondContact O-N 3.24Å; V331-A335 WeakPolarHBondContact O-CB 3.29Å; V331-A335 PolarHBondContact O-N 3.42Å
332	I	86.3	Confident	79	Confident	103 Å²	103	96.6 Å²	96.6	53%	0.528	55%	0.55	S	S	.	.	H	α-helix	trans	-63.3	-42.2	176.3	-67.4	168.9	0	0	0	111.2	I328 T336	I328-I332 HydrophobicContact CG2-CD1 3.77Å; I328-I332 WeakPolarHBondContact O-CG1 3.26Å; I328-I332 PolarHBondContact O-N 3.38Å; I332-T336 WeakPolarHBondContact O-CB 3.44Å; I332-T336 PolarHBondContact O-N 3.29Å; I332-T336 PolarHBondContact O-OG1 2.95Å
333	L	83.8	Confident	76.9	Confident	120 Å²	120	95.9 Å²	95.9	63%	0.628	56%	0.557	S	S	*	*	H	α-helix	trans	-61.7	-49.2	175.7	-95	163.7	0	0	0	112.3	S329 K330 A335 T336 E337	S329-L333 WeakPolarHBondContact O-CB 3.46Å; S329-L333 PolarHBondContact O-N 2.85Å; K330-L333 PolarHBondContact O-N 2.89Å; L333-A335 PolarHBondContact O-N 2.92Å; L333-T336 WeakPolarHBondContact O-CB 3.22Å; L333-T336 PolarHBondContact O-N 2.71Å; L333-T336 VanDerWaalsContact O-N 3.11Å; L333-E337 PolarHBondContact O-N 3.21Å
334	A	79.1	Confident	74.8	Confident	59 Å²	59	98.9 Å²	98.9	49%	0.488	58%	0.575	S	S	.	*	H	α-helix	trans	-60.3	-45.8	179.8	0	0	0	0	0	112.2	K330 V331 T336 E337 E338	K330-A334 WeakPolarHBondContact O-CB 3.28Å; K330-A334 PolarHBondContact O-N 3.04Å; V331-A334 PolarHBondContact O-N 3.24Å; A334-T336 VanDerWaalsContact C-N 3.27Å; A334-T336 PolarHBondContact O-N 2.7Å; A334-E337 PolarHBondContact O-N 2.95Å; A334-E338 PolarHBondContact O-N 3.18Å
335	A	73.5	Confident	72.8	Confident	51 Å²	51	102.6 Å²	102.6	42%	0.421	60%	0.598	S	S	.	*	H	α-helix	trans	-63.8	-32.4	175.5	0	0	0	0	0	112.6	V331 L333 V339	V331-A335 WeakPolarHBondContact O-CB 3.29Å; V331-A335 PolarHBondContact O-N 3.42Å; L333-A335 PolarHBondContact O-N 2.92Å; A335-V339 VanDerWaalsContact O-CG2 3.29Å; A335-V339 WeakPolarHBondContact O-CG2 3.39Å; A335-V339 PolarHBondContact O-N 2.81Å; A335-V339 VanDerWaalsContact O-N 3.15Å
336	T	83	Confident	70.5	Confident	69 Å²	69	103.9 Å²	103.9	42%	0.423	61%	0.606	S	S	.	*	H	α-helix	trans	-70.7	-39.3	175.5	-56.6	0	0	0	0	111.4	I332 L333 A334 V339 L340	I332-T336 WeakPolarHBondContact O-CB 3.44Å; I332-T336 PolarHBondContact O-N 3.29Å; I332-T336 PolarHBondContact O-OG1 2.95Å; L333-T336 WeakPolarHBondContact O-CB 3.22Å; L333-T336 PolarHBondContact O-N 2.71Å; L333-T336 VanDerWaalsContact O-N 3.11Å; A334-T336 VanDerWaalsContact C-N 3.27Å; A334-T336 PolarHBondContact O-N 2.7Å; T336-V339 PolarHBondContact O-N 3.45Å; T336-L340 HydrophobicContact CG2-CD1 3.9Å; T336-L340 HydrophobicContact CG2-CG 4.43Å; T336-L340 WeakPolarHBondContact O-CB 3.48Å; T336-L340 VanDerWaalsContact O-CG 3.27Å; T336-L340 WeakPolarHBondContact O-CG 3.37Å; T336-L340 PolarHBondContact O-N 2.84Å
337	E	75.7	Confident	68.1	Low	140 Å²	140	105.4 Å²	105.4	65%	0.654	62%	0.622	S	S	*	*	H	α-helix	trans	-69.5	-37.7	177	-170.5	168.4	-168	0	0	112.3	L333 A334 L340 S341	L333-E337 PolarHBondContact O-N 3.21Å; A334-E337 PolarHBondContact O-N 2.95Å; E337-L340 PolarHBondContact O-N 3.2Å; E337-S341 WeakPolarHBondContact O-CB 3.36Å; E337-S341 PolarHBondContact O-N 3.24Å; E337-S341 PolarHBondContact O-OG 2.86Å
338	E	71.7	Confident	65.8	Low	149 Å²	149	106.1 Å²	106.1	70%	0.696	64%	0.637	S	S	*	*	H	α-helix	trans	-61.6	-43	171.8	-170.3	179.2	-179.9	0	0	111.7	A334 S341	A334-E338 PolarHBondContact O-N 3.18Å; E338-S341 PolarHBondContact O-OG 3.37Å
339	V	72.6	Confident	63.5	Low	118 Å²	118	105.6 Å²	105.6	72%	0.715	64%	0.641	S	S	*	*	H	α-helix	trans	-68.5	-37.1	176.7	169.3	0	0	0	0	112.4	A335 T336	A335-V339 VanDerWaalsContact O-CG2 3.29Å; A335-V339 WeakPolarHBondContact O-CG2 3.39Å; A335-V339 PolarHBondContact O-N 2.81Å; A335-V339 VanDerWaalsContact O-N 3.15Å; T336-V339 PolarHBondContact O-N 3.45Å
340	L	67.6	Low	61	Low	128 Å²	128	113.4 Å²	113.4	67%	0.67	66%	0.662	S	S	*	*	H	α-helix	trans	-79.5	-29.6	-178.5	-72.2	173.9	0	0	0	113.9	T336 E337 G342	T336-L340 HydrophobicContact CG2-CD1 3.9Å; T336-L340 HydrophobicContact CG2-CG 4.43Å; T336-L340 WeakPolarHBondContact O-CB 3.48Å; T336-L340 VanDerWaalsContact O-CG 3.27Å; T336-L340 WeakPolarHBondContact O-CG 3.37Å; T336-L340 PolarHBondContact O-N 2.84Å; E337-L340 PolarHBondContact O-N 3.2Å; L340-G342 VanDerWaalsContact C-N 3.28Å; L340-G342 PolarHBondContact O-N 3.31Å
341	S	58.8	Low	58.7	Low	94 Å²	94	114.8 Å²	114.8	66%	0.657	67%	0.674	S	S	*	*	H	α-helix	trans	-73.7	-17.6	176.4	53.4	0	0	0	0	113.4	E337 E338 S343	E337-S341 WeakPolarHBondContact O-CB 3.36Å; E337-S341 PolarHBondContact O-N 3.24Å; E337-S341 PolarHBondContact O-OG 2.86Å; E338-S341 PolarHBondContact O-OG 3.37Å; S341-S343 PolarHBondContact O-N 2.98Å; S341-S343 VanDerWaalsContact O-N 3.11Å
342	G	57	Low	56.1	Low	65 Å²	65	116.5 Å²	116.5	67%	0.67	69%	0.689	S	S	*	*			trans	-82	51.1	-175.7	0	0	0	0	0	117.5	L340	L340-G342 VanDerWaalsContact C-N 3.28Å; L340-G342 PolarHBondContact O-N 3.31Å
343	S	41.7	Very low	53.7	Low	98 Å²	98	120.9 Å²	120.9	69%	0.685	71%	0.707	S	S	*	*			trans	-139.1	100.9	174.6	64.3	0	0	0	0	119.2	S341	S341-S343 PolarHBondContact O-N 2.98Å; S341-S343 VanDerWaalsContact O-N 3.11Å
344	V	43.8	Very low	51.1	Low	148 Å²	148	120.2 Å²	120.2	90%	0.897	72%	0.719	S	S	*	*			trans	55.5	96.9	137.3	-165.4	0	0	0	0	121.1
345	S	36.8	Very low	48.7	Very low	120 Å²	120	122.4 Å²	122.4	84%	0.839	74%	0.737	S	S	*	*				-162.9	155.7	126.9	59	0	0	0	0	108.6
346	D	37.8	Very low	46.7	Very low	119 Å²	119	124.1 Å²	124.1	64%	0.636	75%	0.751	S	S	*	*			cis	-144.3	117.6	-4.9	162.1	31.5	0	0	0	109.2	S348	D346-S348 PolarHBondContact OD1-N 3.24Å
347	V	34.1	Very low	44.1	Very low	137 Å²	137	126.4 Å²	126.4	83%	0.83	77%	0.77	S	S	*	*			trans	-146.1	54.1	163.7	-162.9	0	0	0	0	111
348	S	37.2	Very low	41.9	Very low	117 Å²	117	130.7 Å²	130.7	82%	0.818	78%	0.78	S	S	*	*			trans	-98.3	4	175.1	-150.4	0	0	0	0	113.8	D346	D346-S348 PolarHBondContact OD1-N 3.24Å
349	S	36	Very low	39.9	Very low	87 Å²	87	128.1 Å²	128.1	61%	0.608	79%	0.785	S	S	*	*	S	Bend	trans	-104.6	4.2	-159.9	54.1	0	0	0	0	116.5
350	R	35.1	Very low	37.8	Very low	223 Å²	223	130.8 Å²	130.8	84%	0.842	79%	0.789	S	S	*	*	S	Bend	trans	-131	8.8	-169.5	-66.1	-165	-178.8	-165.2	2.2	118.2
351	I	33.4	Very low	36	Very low	170 Å²	170	131.1 Å²	131.1	87%	0.872	80%	0.797	S	S	*	*	S	Bend	trans	-125.4	40	176.2	-38.8	-176.3	0	0	0	112
352	C	33.8	Very low	34.6	Very low	131 Å²	131	132.9 Å²	132.9	89%	0.885	81%	0.806	S	S	*	*	S	Bend	trans	-137	34.7	175.3	-85.3	0	0	0	0	113.3
353	Q	35	Very low	33.3	Very low	196 Å²	196	137.7 Å²	137.7	92%	0.916	82%	0.815	S	S	*	*	S	Bend	trans	-148.6	50.7	176.4	-152.8	173	25.2	0	0	114.6
354	A	30.1	Very low	32.4	Very low	105 Å²	105	140.3 Å²	140.3	87%	0.868	82%	0.817	S	S	*	*	S	Bend	trans	-145.7	32.4	176.6	0	0	0	0	0	114
355	A	29.2	Very low	31.6	Very low	106 Å²	106	143 Å²	143	88%	0.876	81%	0.811	S	S	*	*			trans	-145.3	49.4	-176.3	0	0	0	0	0	113.2
356	A	31.4	Very low	31.1	Very low	87 Å²	87	141.8 Å²	141.8	72%	0.719	81%	0.808	S	S	*	*			trans	-149.6	125.5	173.3	0	0	0	0	0	111.7
357	S	27.6	Very low	30.5	Very low	117 Å²	117	140.4 Å²	140.4	82%	0.818	81%	0.808	S	S	*	*			trans	67.8	149.7	-179.2	89.9	0	0	0	0	114.9
358	R	30.3	Very low	30.1	Very low	229 Å²	229	141.8 Å²	141.8	86%	0.864	81%	0.809	S	S	*	*			cis	-161.1	141.3	-8.4	-137.5	-178.8	173.2	171.1	-3.6	111.4
359	A	28.9	Very low	29.6	Very low	96 Å²	96	140 Å²	140	79%	0.793	80%	0.802	S	S	*	*			trans	47.1	170	136.4	0	0	0	0	0	122.7
360	E	28.8	Very low	29.3	Very low	173 Å²	173	140.3 Å²	140.3	81%	0.808	81%	0.81	S	S	*	*			trans	-100.8	142.1	-160.3	-58.3	168.5	114.7	0	0	114.9
361	T	28.7	Very low	29	Very low	135 Å²	135	134.5 Å²	134.5	83%	0.828	80%	0.803	S	S	*	*			trans	62.8	152.3	149.4	67	0	0	0	0	118.6
362	P	29.5	Very low	28.8	Very low	131 Å²	131	132.3 Å²	132.3	85%	0.851	79%	0.793	S	S	*	*				-136.4	177.5	76.7	35.2	-17.5	0	0	0	115.2
363	L	29.9	Very low	28.9	Very low	166 Å²	166	132.8 Å²	132.8	87%	0.869	78%	0.782	S	S	*	*			trans	-102.4	141.1	177.4	-179.4	90	0	0	0	110.2
364	E	24.3	Very low	28.4	Very low	153 Å²	153	131.2 Å²	131.2	72%	0.715	78%	0.777	S	S	*	*			trans	155.2	161.2	153.2	-89.1	-157.1	135.8	0	0	110.8
365	R	26.5	Very low	28.3	Very low	204 Å²	204	133.2 Å²	133.2	77%	0.77	77%	0.772	S	S	*	*			cis	-176.7	137.8	-30.4	-171.5	179.5	-151.5	143.7	1.3	109.9
366	A	25.2	Very low	28.1	Very low	95 Å²	95	132.7 Å²	132.7	79%	0.785	77%	0.768	S	S	*	*			trans	64.2	163.6	163.7	0	0	0	0	0	117.7
367	S	25.2	Very low	27.8	Very low	91 Å²	91	135.3 Å²	135.3	64%	0.636	78%	0.775	S	S	*	*			cis	-176.2	172.8	-25.5	56.9	0	0	0	0	110.9
368	I	26.5	Very low	27.8	Very low	165 Å²	165	137.7 Å²	137.7	85%	0.846	77%	0.773	S	S	*	*			trans	76.6	142.7	164	-59	156.1	0	0	0	114.3
369	A	26.7	Very low	28.7	Very low	81 Å²	81	131.3 Å²	131.3	67%	0.669	76%	0.761	S	S	*	*			cis	-132.6	157.6	4	0	0	0	0	0	111.3
370	A	29.3	Very low	28.6	Very low	93 Å²	93	138 Å²	138	77%	0.769	77%	0.766	S	S	*	*				54.4	135.2	95.7	0	0	0	0	0	115.3
371	S	29.8	Very low	28.4	Very low	101 Å²	101	133.7 Å²	133.7	71%	0.706	77%	0.768	S	S	*	*			cis	-165.2	-175.4	5.2	-130.2	0	0	0	0	109
372	D	28.7	Very low	28.3	Very low	123 Å²	123	130.4 Å²	130.4	66%	0.658	76%	0.761	S	S	*	*			cis	-152.9	-146.4	9.6	-146.2	-85.8	0	0	0	112.8
373	Q	34.9	Very low	28.3	Very low	142 Å²	142	131.5 Å²	131.5	66%	0.664	76%	0.76	S	S	*	*			trans	-83.2	175.1	-178.4	-71.4	161.8	92.1	0	0	114.2	L375	Q373-L375 HydrophobicContact CG-CD1 4.39Å
374	M	24.4	Very low	28.3	Very low	163 Å²	163	131.3 Å²	131.3	80%	0.803	75%	0.754	S	S	*	*			cis	-152.2	110.2	25	-152.8	155.1	68.6	0	0	111
375	L	28.5	Very low	28.5	Very low	146 Å²	146	131.6 Å²	131.6	76%	0.764	76%	0.755	S	S	*	*				64.7	111.5	96.2	-75.2	170.9	0	0	0	117.3	Q373	Q373-L375 HydrophobicContact CG-CD1 4.39Å
376	A	24.7	Very low	28.5	Very low	96 Å²	96	127.9 Å²	127.9	79%	0.793	76%	0.755	S	S	*	*			trans	-155.6	92.9	137	0	0	0	0	0	113.3
377	V	26.6	Very low	28.6	Very low	142 Å²	142	127.7 Å²	127.7	86%	0.861	75%	0.754	S	S	*	*			trans	54.5	85.4	139.3	-166.1	0	0	0	0	120.4
378	E	27	Very low	28.7	Very low	167 Å²	167	127.7 Å²	127.7	78%	0.78	76%	0.759	S	S	*	*			trans	-69.3	-177.4	131.6	-86.9	-86.3	168.5	0	0	110.6
379	P	49.8	Very low	28.8	Very low	94 Å²	94	130 Å²	130	61%	0.61	76%	0.763	S	S	*	*			cis	-139	-166.4	-6.5	23.3	4	0	0	0	115.5
380	R	25.3	Very low	28.8	Very low	237 Å²	237	131.8 Å²	131.8	89%	0.894	77%	0.771	S	S	*	*			trans	89.6	143	154	-50.5	-178.2	179.9	-151.3	-2.4	117.5
381	G	24.4	Very low	28.6	Very low	82 Å²	82	130.7 Å²	130.7	85%	0.845	77%	0.769	S	S	*	*			cis	133.2	140.7	-7.4	0	0	0	0	0	114
382	G	27	Very low	28.5	Very low	67 Å²	67	130.5 Å²	130.5	69%	0.691	77%	0.773	S	S	*	*			trans	136.3	106.6	172.1	0	0	0	0	0	115.6
383	D	28.8	Very low	28.4	Very low	154 Å²	154	131.5 Å²	131.5	82%	0.824	78%	0.783	S	S	*	*			trans	51.9	121.9	133.4	-52.1	-19.6	0	0	0	123.8
384	E	30.7	Very low	27.9	Very low	161 Å²	161	130.4 Å²	130.4	75%	0.752	79%	0.786	S	S	*	*				66.8	114	128.8	-61.8	-156.3	111.3	0	0	124.3
385	H	28.3	Very low	27.9	Very low	160 Å²	160	128.4 Å²	128.4	74%	0.741	79%	0.788	S	S	*	*				78.1	130	126.9	-88.2	-80.6	0	0	0	124.5
386	V	27.5	Very low	27.6	Very low	125 Å²	125	127.7 Å²	127.7	76%	0.758	79%	0.79	S	S	*	*			trans	76.8	90.9	149	-174	0	0	0	0	120.4
387	A	27.4	Very low	27.5	Very low	92 Å²	92	128.5 Å²	128.5	76%	0.76	79%	0.79	S	S	*	*				47.6	129.1	121.4	0	0	0	0	0	124.6
388	A	27.5	Very low	27.3	Very low	91 Å²	91	128.9 Å²	128.9	75%	0.752	79%	0.786	S	S	*	*			trans	96.9	133.5	133.3	0	0	0	0	0	121.9
389	K	27.2	Very low	27.1	Very low	212 Å²	212	129.5 Å²	129.5	92%	0.922	79%	0.789	S	S	*	*			trans	66.9	145.8	170.9	-62	174.6	-179.5	177.3	0	114.9
390	S	26.6	Very low	25.9	Very low	120 Å²	120	129.9 Å²	129.9	84%	0.839	80%	0.8	S	S	*	*			cis	-152.8	146.9	-10.3	-173	0	0	0	0	105.1
391	G	26.2	Very low	25.9	Very low	70 Å²	70	127.4 Å²	127.4	72%	0.722	80%	0.799	S	S	*	*			cis	119.4	98.9	25.4	0	0	0	0	0	108.5
392	A	27.4	Very low	25.9	Very low	97 Å²	97	132.9 Å²	132.9	80%	0.802	80%	0.802	S	S	*	*			trans	-163.9	149.7	171.8	0	0	0	0	0	110.8
393	V	26.4	Very low	25.8	Very low	144 Å²	144	137.4 Å²	137.4	87%	0.873	81%	0.805	S	S	*	*			trans	71.4	118.1	-173.7	-171.6	0	0	0	0	114.3
394	V	23.9	Very low	25.6	Very low	119 Å²	119	137.3 Å²	137.3	72%	0.721	81%	0.805	S	S	*	*			trans	-119.9	133.9	176.9	171.8	0	0	0	0	108.3	T396	V394-T396 HydrophobicContact CG1-CG2 4.33Å
395	S	24.4	Very low	25.3	Very low	121 Å²	121	137.1 Å²	137.1	85%	0.846	80%	0.804	S	S	*	*			trans	-145.9	106.4	160.8	-70.7	0	0	0	0	108.3
396	T	22.5	Very low	25	Very low	130 Å²	130	134.3 Å²	134.3	80%	0.798	80%	0.801	S	S	*	*			trans	-107.6	128.1	-179.2	42.3	0	0	0	0	111.6	V394	V394-T396 HydrophobicContact CG1-CG2 4.33Å
397	S	22.2	Very low	24.8	Very low	113 Å²	113	134 Å²	134	79%	0.79	80%	0.799	S	S	*	*			trans	-16.5	130	159.6	-177.1	0	0	0	0	116.9
398	L	22.1	Very low	24.7	Very low	151 Å²	151	135.4 Å²	135.4	79%	0.791	80%	0.798	S	S	*	*				-164.1	148.5	121	-103.3	167.9	0	0	0	111.1
399	Q	22.9	Very low	24.6	Very low	179 Å²	179	141.4 Å²	141.4	84%	0.836	80%	0.803	S	S	*	*			trans	48	113.3	161.6	-72.2	173	-43.9	0	0	120.3
400	A	25.6	Very low	24.4	Very low	102 Å²	102	135.9 Å²	135.9	84%	0.843	79%	0.791	S	S	*	*			trans	-137.3	148.2	136.2	0	0	0	0	0	107.9
401	E	25.3	Very low	24.3	Very low	186 Å²	186	134.9 Å²	134.9	87%	0.869	78%	0.784	S	S	*	*			trans	-79.7	131.9	-168.6	-58.6	173.1	122.8	0	0	111.9
402	E	23.9	Very low	24.3	Very low	197 Å²	197	136.5 Å²	136.5	92%	0.921	78%	0.783	S	S	*	*			trans	-82.3	123.1	160.5	-85.7	-173.1	128.7	0	0	108.9	D404	E402-D404 PolarHBondContact O-N 2.83Å
403	H	24.3	Very low	24.3	Very low	161 Å²	161	139.3 Å²	139.3	75%	0.745	78%	0.784	S	S	*	*			trans	-89.8	90.8	-169.2	-148.2	-56.2	0	0	0	109.8	Q405	H403-Q405 PolarHBondContact O-N 3.33Å
404	D	24.8	Very low	24.3	Very low	153 Å²	153	138.5 Å²	138.5	82%	0.818	78%	0.78	S	S	*	*			trans	-66.1	100.8	179.2	-172.6	22.9	0	0	0	110.9	E402 C406	E402-D404 PolarHBondContact O-N 2.83Å; D404-C406 PolarHBondContact O-N 3.06Å
405	Q	24.8	Very low	24.5	Very low	157 Å²	157	141.2 Å²	141.2	73%	0.734	78%	0.784	S	S	*	*			trans	-92.2	82.6	177	-75.7	-169	-16.5	0	0	110.2	H403 V407	H403-Q405 PolarHBondContact O-N 3.33Å; Q405-V407 PolarHBondContact O-N 3.03Å
406	C	22.5	Very low	24.5	Very low	100 Å²	100	139.5 Å²	139.5	68%	0.676	79%	0.785	S	S	*	*			trans	-54.6	111.8	165.2	-178.2	0	0	0	0	110	D404 T408	D404-C406 PolarHBondContact O-N 3.06Å; C406-T408 PolarHBondContact O-N 2.9Å; C406-T408 VanDerWaalsContact O-N 3.08Å
407	V	24.1	Very low	24.7	Very low	120 Å²	120	144.4 Å²	144.4	73%	0.727	79%	0.789	S	S	*	*			trans	-79.6	90	175.2	-179.5	0	0	0	0	108.4	Q405 Y409	Q405-V407 PolarHBondContact O-N 3.03Å; V407-Y409 PolarHBondContact O-N 2.98Å
408	T	24.2	Very low	24.8	Very low	121 Å²	121	147 Å²	147	74%	0.742	79%	0.793	S	S	*	*			trans	-60.5	103.6	173.1	-53.1	0	0	0	0	110.1	C406 S410	C406-T408 PolarHBondContact O-N 2.9Å; C406-T408 VanDerWaalsContact O-N 3.08Å; T408-S410 PolarHBondContact O-N 2.83Å
409	Y	25.4	Very low	25	Very low	217 Å²	217	144.8 Å²	144.8	85%	0.851	79%	0.79	S	S	*	*			trans	-70.6	117.5	173.7	-121.6	-94.6	0	0	0	110	V407 S411	V407-Y409 PolarHBondContact O-N 2.98Å; Y409-S411 PolarHBondContact O-N 2.83Å
410	S	22.8	Very low	25.2	Very low	95 Å²	95	141.6 Å²	141.6	66%	0.664	79%	0.788	S	S	*	*			trans	-80.3	102.6	-180	-179.6	0	0	0	0	110.3	T408 C412	T408-S410 PolarHBondContact O-N 2.83Å; S410-C412 PolarHBondContact O-N 2.86Å
411	S	25.6	Very low	25.4	Very low	99 Å²	99	143.2 Å²	143.2	69%	0.692	79%	0.789	S	S	*	*			trans	-74.8	106.4	171.1	-176.6	0	0	0	0	110.7	Y409 L413	Y409-S411 PolarHBondContact O-N 2.83Å; S411-L413 VanDerWaalsContact C-N 3.33Å; S411-L413 PolarHBondContact O-N 3.39Å; S411-L413 VanDerWaalsContact O-N 3.15Å
412	C	25.4	Very low	25.4	Very low	104 Å²	104	141.1 Å²	141.1	70%	0.703	79%	0.789	S	S	*	*			trans	-87.2	58	-176.9	-67.7	0	0	0	0	112.9	S410 T414	S410-C412 PolarHBondContact O-N 2.86Å; C412-T414 PolarHBondContact O-N 3.47Å
413	L	27.2	Very low	25.6	Very low	156 Å²	156	141.1 Å²	141.1	82%	0.817	79%	0.789	S	S	*	*			trans	-88.8	77.9	176.4	-75.8	173.9	0	0	0	112.7	S411 H415	S411-L413 VanDerWaalsContact C-N 3.33Å; S411-L413 PolarHBondContact O-N 3.39Å; S411-L413 VanDerWaalsContact O-N 3.15Å; L413-H415 PolarHBondContact O-N 2.94Å
414	T	26.6	Very low	25.7	Very low	128 Å²	128	136.5 Å²	136.5	79%	0.785	79%	0.785	S	S	*	*			trans	-86.8	89.7	176	48.2	0	0	0	0	113.4	C412	C412-T414 PolarHBondContact O-N 3.47Å
415	H	28.1	Very low	25.9	Very low	176 Å²	176	135 Å²	135	82%	0.815	78%	0.777	S	S	*	*			trans	42.2	82	152.3	-67.1	-56.3	0	0	0	119.6	L413	L413-H415 PolarHBondContact O-N 2.94Å
416	G	24.2	Very low	26.3	Very low	84 Å²	84	133.2 Å²	133.2	87%	0.866	78%	0.779	S	S	*	*			trans	-75.4	126.4	148.5	0	0	0	0	0	111
417	R	26.7	Very low	26.6	Very low	234 Å²	234	136.9 Å²	136.9	88%	0.883	78%	0.784	S	S	*	*			trans	-121.8	106.3	180	-116.4	-168.5	-175.8	-111.4	6.3	111.4
418	L	25.1	Very low	26.7	Very low	168 Å²	168	139.9 Å²	139.9	88%	0.88	79%	0.79	S	S	*	*			trans	-148.2	152.7	161.3	-70	177.3	0	0	0	108.7
419	S	26.4	Very low	26.7	Very low	104 Å²	104	144.9 Å²	144.9	73%	0.727	80%	0.795	S	S	*	*			cis	-170.9	86.5	-32.6	-103	0	0	0	0	107.5
420	S	26.3	Very low	26.6	Very low	112 Å²	112	143.5 Å²	143.5	78%	0.783	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-77.6	142.8	177.5	-50.5	0	0	0	0	111.4	V422	S420-V422 PolarHBondContact O-N 3.44Å
421	P	30.8	Very low	26.7	Very low	135 Å²	135	144.3 Å²	144.3	88%	0.877	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-66.2	131.1	-178.9	-20.2	32.6	0	0	0	112.6
422	V	24.8	Very low	26.6	Very low	143 Å²	143	149 Å²	149	87%	0.867	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-96.5	121.3	166.6	174.9	0	0	0	0	108.9	S420	S420-V422 PolarHBondContact O-N 3.44Å
423	Q	26.9	Very low	26.6	Very low	196 Å²	196	151 Å²	151	92%	0.916	81%	0.809	S	S	*	*			trans	-128.2	136.5	156.5	-162.9	160.7	12.3	0	0	109.1
424	G	26.4	Very low	26.4	Very low	65 Å²	65	149 Å²	149	67%	0.67	81%	0.807	S	S	*	*			trans	-84.9	147.4	-157.9	0	0	0	0	0	116.3
425	D	29.4	Very low	26.3	Very low	122 Å²	122	148.5 Å²	148.5	65%	0.652	80%	0.803	S	S	*	*			trans	-65.6	127.7	165.2	166.8	32.1	0	0	0	112.2	K427	D425-K427 PolarHBondContact OD1-N 3.22Å; D425-K427 WeakPolarHBondContact OD2-CE 3.4Å; D425-K427 VanDerWaalsContact OD2-CG 3.28Å; D425-K427 WeakPolarHBondContact OD2-CG 3.45Å
426	P	34	Very low	26.1	Very low	119 Å²	119	148.2 Å²	148.2	77%	0.773	80%	0.802	S	S	*	*			trans	-103	97.9	163.3	35	-25.1	0	0	0	111.7	E428	P426-E428 PolarHBondContact O-N 3Å
427	K	27.9	Very low	26.1	Very low	176 Å²	176	148.5 Å²	148.5	77%	0.765	79%	0.79	S	S	*	*			trans	-71.3	119.9	170.8	-65.3	-179.8	-178.7	170.3	0	112.3	D425	D425-K427 PolarHBondContact OD1-N 3.22Å; D425-K427 WeakPolarHBondContact OD2-CE 3.4Å; D425-K427 VanDerWaalsContact OD2-CG 3.28Å; D425-K427 WeakPolarHBondContact OD2-CG 3.45Å
428	E	25.8	Very low	26.1	Very low	183 Å²	183	146.8 Å²	146.8	86%	0.855	79%	0.792	S	S	*	*				-172.7	123.3	128.9	-100.7	-178.5	169.6	0	0	107.6	P426	P426-E428 PolarHBondContact O-N 3Å
429	R	24.9	Very low	26.3	Very low	227 Å²	227	144.2 Å²	144.2	86%	0.857	79%	0.789	S	S	*	*			cis	81.6	69.2	43.1	-162.2	-151.1	-173.8	-159.3	2.6	114.8
430	Q	24.1	Very low	26.8	Very low	187 Å²	187	145.7 Å²	145.7	87%	0.874	80%	0.796	S	S	*	*			trans	-168.8	156.7	150.3	-101.5	-178.2	58.5	0	0	108.5
431	V	24	Very low	26.7	Very low	113 Å²	113	143.8 Å²	143.8	69%	0.685	79%	0.794	S	S	*	*			cis	-175.2	165.4	-27.5	119.4	0	0	0	0	107.9
432	K	24.7	Very low	26.4	Very low	196 Å²	196	144.6 Å²	144.6	85%	0.852	80%	0.796	S	S	*	*			trans	80.9	152.7	169.5	-85.2	160.9	-175.4	176.1	0	118.4
433	N	24.3	Very low	26.4	Very low	147 Å²	147	141 Å²	141	79%	0.786	79%	0.788	S	S	*	*			trans	-108.1	163.6	-167.5	-49.3	-18	0	0	0	111.5
434	C	23.5	Very low	26.4	Very low	115 Å²	115	143.5 Å²	143.5	78%	0.777	79%	0.789	S	S	*	*			trans	74.7	128.7	141.4	-77	0	0	0	0	121.6
435	V	23.3	Very low	26.5	Very low	116 Å²	116	146.6 Å²	146.6	70%	0.703	80%	0.795	S	S	*	*				97.9	135.8	124	164.1	0	0	0	0	120.8
436	H	24.2	Very low	26.8	Very low	171 Å²	171	145.9 Å²	145.9	79%	0.792	80%	0.797	S	S	*	*			trans	72.2	119.3	161.6	-73.1	-40.2	0	0	0	123.3
437	S	24.6	Very low	26.4	Very low	89 Å²	89	148.1 Å²	148.1	62%	0.622	80%	0.801	S	S	*	*			trans	13	129	133.8	55.8	0	0	0	0	122.5
438	E	25.9	Very low	26.5	Very low	198 Å²	198	143.6 Å²	143.6	93%	0.925	80%	0.796	S	S	*	*			trans	66.9	153.2	134.5	-64.2	-169.4	101.9	0	0	122.1
439	S	30	Very low	26.6	Very low	115 Å²	115	142.4 Å²	142.4	80%	0.804	80%	0.795	S	S	*	*			trans	-87.8	168.9	-171.9	-48.5	0	0	0	0	113.1
440	P	36.6	Very low	26.9	Very low	135 Å²	135	140.6 Å²	140.6	88%	0.877	80%	0.796	S	S	*	*				-141.8	169.4	91.8	38.2	-24.4	0	0	0	114.4
441	G	24.4	Very low	27.1	Very low	72 Å²	72	135.6 Å²	135.6	74%	0.742	80%	0.795	S	S	*	*			trans	-123	157.4	-177.1	0	0	0	0	0	115.5
442	V	25.5	Very low	27.2	Very low	152 Å²	152	134.1 Å²	134.1	92%	0.921	80%	0.803	S	S	*	*			trans	-150.9	145.8	172	-176.7	0	0	0	0	106.7
443	G	24.1	Very low	27.4	Very low	67 Å²	67	130.6 Å²	130.6	69%	0.691	80%	0.803	S	S	*	*			cis	158.7	103.5	-6.5	0	0	0	0	0	112.5
444	R	26.2	Very low	27.6	Very low	248 Å²	248	130.9 Å²	130.9	94%	0.936	80%	0.804	S	S	*	*			trans	42.1	142.9	162.4	-85.3	-176	170.9	177.8	-3	123
445	T	29.2	Very low	27.8	Very low	130 Å²	130	128.7 Å²	128.7	80%	0.798	80%	0.8	S	S	*	*			trans	-62.3	165.4	160.5	50.7	0	0	0	0	113.3
446	P	36.3	Very low	28	Very low	107 Å²	107	132.3 Å²	132.3	70%	0.695	81%	0.809	S	S	*	*				-147.8	153.2	114.7	38.1	-23.4	0	0	0	116.9
447	I	24.5	Very low	28	Very low	167 Å²	167	128.9 Å²	128.9	86%	0.856	80%	0.804	S	S	*	*			trans	42.5	139.7	131.2	-53.9	170	0	0	0	119.3
448	A	30.6	Very low	28.2	Very low	80 Å²	80	132.4 Å²	132.4	66%	0.661	81%	0.811	S	S	*	*			cis	177.6	158.6	-24.8	0	0	0	0	0	106.4
449	N	27.3	Very low	28.4	Very low	159 Å²	159	127.7 Å²	127.7	85%	0.85	80%	0.795	S	S	*	*			trans	-164.3	166.9	157.5	-121.1	-49.3	0	0	0	115.7
450	H	31	Very low	28.2	Very low	188 Å²	188	128.6 Å²	128.6	87%	0.87	80%	0.796	S	S	*	*			trans	-93.5	160.1	-167.8	-57.3	-96.9	0	0	0	115.4
451	G	29.8	Very low	27.8	Very low	82 Å²	82	128.3 Å²	128.3	85%	0.845	78%	0.784	S	S	*	*			trans	158.5	125.3	161.9	0	0	0	0	0	111.4
452	G	26.4	Very low	28.1	Very low	83 Å²	83	132.5 Å²	132.5	86%	0.856	79%	0.785	S	S	*	*			trans	-150.1	170.4	-173.3	0	0	0	0	0	115
453	S	27.3	Very low	28.1	Very low	121 Å²	121	131.9 Å²	131.9	85%	0.846	78%	0.776	S	S	*	*			trans	-156.4	134.6	170.9	-164.9	0	0	0	0	109.4
454	L	29.9	Very low	28.6	Very low	154 Å²	154	133.6 Å²	133.6	81%	0.806	78%	0.778	S	S	*	*			trans	-93.3	163.6	171.4	-79.6	72.4	0	0	0	109
455	G	26.1	Very low	28.6	Very low	68 Å²	68	125.3 Å²	125.3	70%	0.701	77%	0.769	S	S	*	*			cis	-163.1	-157.8	1	0	0	0	0	0	109.7
456	E	27.5	Very low	28.4	Very low	193 Å²	193	125.2 Å²	125.2	90%	0.902	77%	0.772	S	S	*	*			cis	-144.4	173.4	7.7	-69.3	-173.4	60.6	0	0	108.3
457	S	25.2	Very low	28.1	Very low	98 Å²	98	124.7 Å²	124.7	69%	0.685	77%	0.771	S	S	*	*			cis	-144.8	-159.8	16.3	67.6	0	0	0	0	112.6
458	H	27.7	Very low	28.1	Very low	163 Å²	163	122.8 Å²	122.8	76%	0.755	77%	0.767	S	S	*	*			trans	-146.5	152.3	-176.1	-73.4	-78.4	0	0	0	110
459	V	30	Very low	28	Very low	99 Å²	99	125 Å²	125	60%	0.6	78%	0.776	S	S	*	*			cis	-160.3	-174.1	-20.1	68.4	0	0	0	0	106.8	M461	V459-M461 HydrophobicContact CG1-CB 4.35Å; V459-M461 HydrophobicContact CG2-CB 3.68Å; V459-M461 HydrophobicContact CG2-SD 4.35Å
460	V	26.7	Very low	28.1	Very low	135 Å²	135	121.7 Å²	121.7	82%	0.818	77%	0.771	S	S	*	*				-169.4	131.9	81.2	174.4	0	0	0	0	107.2
461	M	27.1	Very low	28.2	Very low	128 Å²	128	117.4 Å²	117.4	63%	0.631	76%	0.762	S	S	*	*			cis	103.5	112.5	14.6	-166.5	174.3	173.3	0	0	116.4	V459	V459-M461 HydrophobicContact CG1-CB 4.35Å; V459-M461 HydrophobicContact CG2-CB 3.68Å; V459-M461 HydrophobicContact CG2-SD 4.35Å
462	E	31.2	Very low	28.5	Very low	161 Å²	161	121.9 Å²	121.9	75%	0.752	76%	0.762	S	S	*	*				9.9	159.7	129.8	-45.7	174.5	132.9	0	0	119.1
463	D	25.9	Very low	28.8	Very low	138 Å²	138	125.5 Å²	125.5	74%	0.738	76%	0.761	S	S	*	*			cis	-159.2	-178	23.5	-159.9	-8.2	0	0	0	112
464	S	35.1	Very low	29.1	Very low	104 Å²	104	122.4 Å²	122.4	73%	0.727	75%	0.749	S	S	*	*			trans	-60.2	168.7	169	61.7	0	0	0	0	116.9
465	G	25.3	Very low	29.1	Very low	73 Å²	73	121.6 Å²	121.6	75%	0.753	75%	0.75	S	S	*	*			trans	157.9	113.8	152.1	0	0	0	0	0	120.6
466	C	26	Very low	29.2	Very low	128 Å²	128	123.5 Å²	123.5	87%	0.865	75%	0.752	S	S	*	*			trans	77.1	122.6	135.5	-138	0	0	0	0	123.3
467	S	28.5	Very low	29.6	Very low	97 Å²	97	120.1 Å²	120.1	68%	0.678	75%	0.745	S	S	*	*			trans	43.7	135	131	-171.2	0	0	0	0	122.6
468	T	25.5	Very low	30	Very low	126 Å²	126	123.2 Å²	123.2	77%	0.773	75%	0.749	S	S	*	*				172.3	156.4	103.8	-67.6	0	0	0	0	112.4
469	C	29.4	Very low	30.5	Very low	126 Å²	126	122 Å²	122	85%	0.851	75%	0.748	S	S	*	*			trans	-124.2	137.4	179.5	-44.7	0	0	0	0	112.5
470	A	28.8	Very low	31.5	Very low	90 Å²	90	122.2 Å²	122.2	74%	0.744	75%	0.751	S	S	*	*			trans	-176.3	128.2	165	0	0	0	0	0	107.8
471	S	33.1	Very low	31.8	Very low	98 Å²	98	122.3 Å²	122.3	69%	0.685	75%	0.746	S	S	*	*				78.9	159.2	69.1	91.7	0	0	0	0	113.6
472	E	35.4	Very low	32.2	Very low	177 Å²	177	123.5 Å²	123.5	83%	0.827	75%	0.75	S	S	*	*			cis	-168.8	157	8.3	-132.7	154.8	110.5	0	0	107.8
473	D	33.8	Very low	32.2	Very low	159 Å²	159	121.3 Å²	121.3	85%	0.85	74%	0.744	S	S	*	*			cis	-165.7	163.2	-35	178	45.2	0	0	0	109.9
474	G	32.4	Very low	32.5	Very low	56 Å²	56	119.6 Å²	119.6	58%	0.577	74%	0.738	S	S	*	*			trans	103.4	163.9	153.4	0	0	0	0	0	119.9
475	T	30.3	Very low	32.2	Very low	136 Å²	136	122.1 Å²	122.1	83%	0.834	74%	0.74	S	S	*	*			cis	-157.8	148.4	5.2	51.4	0	0	0	0	114.8
476	S	29.1	Very low	32.5	Very low	108 Å²	108	125.2 Å²	125.2	76%	0.755	74%	0.739	S	S	*	*			trans	62.6	154	148.4	-127.9	0	0	0	0	121
477	V	34.1	Very low	32.7	Very low	123 Å²	123	123.8 Å²	123.8	75%	0.745	73%	0.73	S	S	*	*			cis	-148.8	132	25.5	-177.5	0	0	0	0	113.9
478	E	35.6	Very low	32.7	Very low	163 Å²	163	124.9 Å²	124.9	76%	0.762	73%	0.733	S	S	*	*			trans	31.8	110.5	150.6	-48.5	-71.9	90.4	0	0	124.4
479	D	36.4	Very low	32.7	Very low	138 Å²	138	125 Å²	125	74%	0.738	73%	0.733	S	S	*	*				37.2	167.3	98.6	-117.9	35.8	0	0	0	121.7
480	P	50.8	Low	32.7	Very low	103 Å²	103	124.4 Å²	124.4	67%	0.669	73%	0.731	S	S	*	*			cis	-146.9	162.6	33	46.6	-25.4	0	0	0	123.2
481	L	33.6	Very low	32.5	Very low	137 Å²	137	123.1 Å²	123.1	72%	0.717	73%	0.727	S	S	*	*			trans	74.9	127.1	163.1	-44.7	-176.2	0	0	0	117.3
482	Q	36.3	Very low	32.2	Very low	153 Å²	153	128.2 Å²	128.2	72%	0.715	74%	0.74	S	S	*	*			cis	-167.3	-175.9	-4.1	-122.4	177.8	8.3	0	0	107
483	N	30.7	Very low	31.7	Very low	115 Å²	115	128.5 Å²	128.5	62%	0.615	74%	0.74	S	S	*	*			cis	-165.9	-169.9	13.2	-111.4	-27.6	0	0	0	106.7
484	T	32.4	Very low	31.4	Very low	101 Å²	101	125.2 Å²	125.2	62%	0.62	73%	0.73	S	S	*	*			cis	157.7	135.9	-39.2	-75.3	0	0	0	0	108.3
485	M	29	Very low	31.1	Very low	157 Å²	157	129.3 Å²	129.3	77%	0.773	74%	0.739	S	S	*	*			cis	-169.1	161.4	-18.9	-87.2	-173.1	-174	0	0	106.8
486	L	31.9	Very low	31	Very low	138 Å²	138	127.8 Å²	127.8	72%	0.723	73%	0.734	S	S	*	*			cis	-168.1	130.3	-24.3	-98.6	171.2	0	0	0	109.8
487	S	29.2	Very low	30.9	Very low	98 Å²	98	129.9 Å²	129.9	69%	0.685	74%	0.735	S	S	*	*			trans	71.7	149.5	130.5	-61.6	0	0	0	0	126.8
488	V	28.6	Very low	30.5	Very low	120 Å²	120	128.8 Å²	128.8	73%	0.727	73%	0.733	S	S	*	*			trans	84.9	110.5	130.1	158.7	0	0	0	0	123.4
489	T	26.5	Very low	30.2	Very low	128 Å²	128	127.5 Å²	127.5	79%	0.785	74%	0.737	S	S	*	*			trans	49.3	155.8	139.7	73.3	0	0	0	0	124.9
490	S	28.6	Very low	29.8	Very low	115 Å²	115	126.2 Å²	126.2	80%	0.804	74%	0.739	S	S	*	*			trans	102.7	107.1	144.3	-168.6	0	0	0	0	119.3
491	G	23.8	Very low	28.9	Very low	63 Å²	63	126.4 Å²	126.4	65%	0.649	75%	0.749	S	S	*	*				82.2	116	102	0	0	0	0	0	121.1
492	Q	28.3	Very low	28.7	Very low	205 Å²	205	126 Å²	126	96%	0.958	75%	0.752	S	S	*	*			trans	73.4	160.5	146.8	-68	-169.2	-50.8	0	0	121.1
493	H	24.9	Very low	28.4	Very low	182 Å²	182	126.7 Å²	126.7	84%	0.843	76%	0.755	S	S	*	*			trans	-82.2	170.1	-166.7	-93.4	-127.2	0	0	0	115.5
494	S	27.3	Very low	28.2	Very low	91 Å²	91	127.4 Å²	127.4	64%	0.636	76%	0.759	S	S	*	*			trans	95.3	98.9	140.1	-79.9	0	0	0	0	121.1
495	D	26.3	Very low	28	Very low	141 Å²	141	128.6 Å²	128.6	75%	0.754	77%	0.767	S	S	*	*				83.2	159.5	115	-66.8	-54.2	0	0	0	121.8
496	S	26.9	Very low	28	Very low	105 Å²	105	126.2 Å²	126.2	73%	0.734	77%	0.765	S	S	*	*			trans	79.8	138.5	171.5	-57.4	0	0	0	0	116.5
497	L	27.3	Very low	28	Very low	151 Å²	151	124 Å²	124	79%	0.791	77%	0.767	S	S	*	*			cis	-164.6	173.8	-2	-120.2	171.3	0	0	0	110.5
498	S	27.1	Very low	27.9	Very low	100 Å²	100	127.4 Å²	127.4	70%	0.699	77%	0.772	S	S	*	*			trans	80.1	142.7	164	-41.7	0	0	0	0	116.7
499	T	29.1	Very low	27.7	Very low	136 Å²	136	129.5 Å²	129.5	83%	0.834	77%	0.774	S	S	*	*			cis	-150.2	156.7	-2	-5.4	0	0	0	0	111.9
500	S	27.2	Very low	27.7	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	77%	0.774	S	S	*	*			trans	-83.2	149.2	-177.3	55.3	0	0	0	0	115.4
501	A	32.3	Very low	27.6	Very low	106 Å²	106	128.9 Å²	128.9	88%	0.876	77%	0.774	S	S	*	*			trans	-148.5	133.4	147	0	0	0	0	0	110.3
502	T	29.4	Very low	27.9	Very low	128 Å²	128	132.2 Å²	132.2	79%	0.785	78%	0.782	S	S	*	*			trans	-103.5	154.6	-178.5	48.4	0	0	0	0	111.8
503	Q	28.7	Very low	28.5	Very low	168 Å²	168	128.3 Å²	128.3	79%	0.785	78%	0.775	S	S	*	*				152.7	108.1	105.1	-165.2	155.6	33.1	0	0	115
504	D	27.8	Very low	28.6	Very low	131 Å²	131	124.3 Å²	124.3	70%	0.701	77%	0.767	S	S	*	*			trans	40.3	139.6	137.1	-63.6	-48.9	0	0	0	126.4
505	T	28.8	Very low	28.6	Very low	126 Å²	126	128.3 Å²	128.3	77%	0.773	78%	0.776	S	S	*	*			trans	90.6	120	134.8	45.2	0	0	0	0	125.2
506	S	27.9	Very low	28.6	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	78%	0.777	S	S	*	*				74.9	112.1	129.4	67.8	0	0	0	0	124.4
507	A	31.9	Very low	29	Very low	91 Å²	91	130.3 Å²	130.3	75%	0.752	78%	0.776	S	S	*	*				74.3	120.4	117.7	0	0	0	0	0	124.3
508	E	26.7	Very low	29	Very low	171 Å²	171	131.8 Å²	131.8	80%	0.799	78%	0.778	S	S	*	*			trans	80.7	153.6	133.3	-83.6	-155	77.9	0	0	125.2
509	Q	26.1	Very low	28.9	Very low	163 Å²	163	132.9 Å²	132.9	76%	0.762	78%	0.781	S	S	*	*			trans	75.5	94.8	159.6	-73.7	172.4	39.7	0	0	123.2
510	S	26.3	Very low	29.4	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	78%	0.781	S	S	*	*				42.3	123.9	116.2	-167.5	0	0	0	0	122.3
511	S	25.7	Very low	29.2	Very low	116 Å²	116	135.7 Å²	135.7	81%	0.811	78%	0.78	S	S	*	*				178.4	168.9	121	44.9	0	0	0	0	113.2
512	V	30.3	Very low	29	Very low	134 Å²	134	136.7 Å²	136.7	81%	0.812	77%	0.771	S	S	*	*			trans	-141.4	138.3	-173.2	173.1	0	0	0	0	110.5
513	P	40.5	Very low	29.9	Very low	123 Å²	123	135.5 Å²	135.5	80%	0.799	77%	0.765	S	S	*	*				-149.5	129.4	129.2	33.8	-15.1	0	0	0	117.7
514	S	26.6	Very low	30.3	Very low	98 Å²	98	135.5 Å²	135.5	69%	0.685	77%	0.765	S	S	*	*			trans	17.2	138.1	134.3	-166.6	0	0	0	0	122.6
515	E	27.1	Very low	30.6	Very low	174 Å²	174	136.6 Å²	136.6	81%	0.813	77%	0.771	S	S	*	*				-174.3	176.5	112.8	-95.8	-83.8	72.9	0	0	114.4
516	K	26.2	Very low	30.6	Very low	180 Å²	180	135.7 Å²	135.7	78%	0.783	77%	0.77	S	S	*	*			trans	-97.1	179.7	-163.9	-103	165.6	-172.4	165.6	0	113.9
517	P	36.9	Very low	30.8	Very low	109 Å²	109	139.3 Å²	139.3	71%	0.708	77%	0.772	S	S	*	*			cis	-160	162.2	42.9	42.7	-18.6	0	0	0	124.5
518	H	26.2	Very low	30.6	Very low	181 Å²	181	141.1 Å²	141.1	84%	0.838	77%	0.773	S	S	*	*			trans	75.9	160.2	139.8	-74.5	-50.1	0	0	0	126
519	T	25.8	Very low	31.5	Very low	123 Å²	123	138.1 Å²	138.1	76%	0.755	77%	0.769	S	S	*	*			trans	-148.8	163	-154.7	49.9	0	0	0	0	114.5
520	P	38.5	Very low	31.6	Very low	130 Å²	130	141.3 Å²	141.3	84%	0.844	78%	0.776	S	S	*	*			trans	-139.9	-165.3	143.2	38.8	-24	0	0	0	112.9
521	K	23.9	Very low	31.8	Very low	177 Å²	177	140.6 Å²	140.6	77%	0.77	77%	0.77	S	S	*	*				-148.9	173.6	-82.5	-158.2	-111.1	156.2	-164	0	110.3
522	L	28.7	Very low	32	Very low	128 Å²	128	143 Å²	143	67%	0.67	77%	0.774	S	S	*	*			trans	-117.2	165.7	-173.2	-98.1	165.8	0	0	0	114.8
523	P	47.9	Very low	31.8	Very low	102 Å²	102	140.2 Å²	140.2	66%	0.662	77%	0.772	S	S	*	*				-136.4	149.3	108.6	21.8	-1.9	0	0	0	112.8
524	E	36.2	Very low	31.1	Very low	169 Å²	169	142.6 Å²	142.6	79%	0.79	78%	0.775	S	S	*	*				73.3	134.1	57.2	-73.2	176	152.9	0	0	114.4
525	D	35.3	Very low	31.3	Very low	153 Å²	153	144.5 Å²	144.5	82%	0.818	78%	0.777	S	S	*	*			cis	-167.1	167.7	-6.5	-176.8	23.1	0	0	0	111
526	S	27.1	Very low	31.5	Very low	108 Å²	108	143 Å²	143	76%	0.755	77%	0.768	S	S	*	*			trans	151.7	85.6	147.3	-177	0	0	0	0	119.4
527	K	32.1	Very low	31.8	Very low	181 Å²	181	141 Å²	141	79%	0.787	76%	0.761	S	S	*	*				62.9	100.7	118.5	-146.6	164.9	-168.8	171.1	0	125.3
528	V	29	Very low	31.3	Very low	129 Å²	129	142.9 Å²	142.9	78%	0.782	77%	0.765	S	S	*	*			trans	18.3	174.8	133.5	-93.5	0	0	0	0	124.2
529	P	45.5	Very low	31.5	Very low	108 Å²	108	139.5 Å²	139.5	70%	0.701	76%	0.762	S	S	*	*			cis	-145.2	167.6	-0.2	30.1	-4.8	0	0	0	121.5
530	Y	28.6	Very low	33	Very low	231 Å²	231	139 Å²	139	91%	0.906	76%	0.761	S	S	*	*			trans	68.3	173.1	141	-89.2	-106.8	0	0	0	125.6
531	S	29.5	Very low	32.4	Very low	98 Å²	98	139.2 Å²	139.2	69%	0.685	76%	0.755	S	S	*	*			trans	-137.9	175	-156	-42.5	0	0	0	0	116.5
532	N	29.7	Very low	32.8	Very low	168 Å²	168	136.3 Å²	136.3	90%	0.898	75%	0.747	S	S	*	*			trans	100.2	144.7	157.2	-61.6	-7.6	0	0	0	121
533	G	26.8	Very low	32.8	Very low	75 Å²	75	140 Å²	140	77%	0.773	75%	0.752	S	S	*	*			trans	114.2	122.9	169.9	0	0	0	0	0	114.9
534	M	25.3	Very low	31.9	Very low	172 Å²	172	141.8 Å²	141.8	85%	0.847	75%	0.751	S	S	*	*			cis	103.6	136.2	-3.3	-159.4	54.2	173.6	0	0	118.8
535	L	32.1	Very low	31.5	Very low	139 Å²	139	140.4 Å²	140.4	73%	0.728	75%	0.749	S	S	*	*			trans	70.6	156.5	-176.4	-50.6	-174.8	0	0	0	115.1
536	K	31.3	Very low	31.3	Very low	143 Å²	143	137.9 Å²	137.9	62%	0.622	74%	0.743	S	S	*	*			cis	-157.7	149	-7.3	-129.9	179.2	179.3	-87.3	0	110.6
537	E	31.6	Very low	31.3	Very low	137 Å²	137	139.5 Å²	139.5	64%	0.64	74%	0.744	S	S	*	*				41.4	127.2	124.9	-171.7	177	-81.2	0	0	122.6
538	D	26.9	Very low	31.1	Very low	149 Å²	149	140.5 Å²	140.5	80%	0.797	74%	0.743	S	S	*	*				-175.9	170.8	124.7	-104.5	-27.2	0	0	0	114.3
539	S	29.5	Very low	31	Very low	110 Å²	110	138.7 Å²	138.7	77%	0.769	73%	0.732	S	S	*	*			trans	-157.9	-177	178.5	-66.6	0	0	0	0	109.1
540	P	57.6	Low	30.4	Very low	112 Å²	112	138.9 Å²	138.9	73%	0.727	73%	0.731	S	S	*	*			cis	-126.1	-166.8	-9.7	42.2	-25.4	0	0	0	112.6
541	D	26.6	Very low	30.6	Very low	135 Å²	135	135.6 Å²	135.6	72%	0.722	73%	0.725	S	S	*	*				177	156.6	103.3	-130.6	-2.7	0	0	0	117.9
542	L	31.1	Very low	30.9	Very low	116 Å²	116	137.5 Å²	137.5	61%	0.607	73%	0.732	S	S	*	*			trans	39.5	116.2	152.8	-65.8	165.2	0	0	0	125.4
543	R	28.5	Very low	31.6	Very low	205 Å²	205	137.4 Å²	137.4	77%	0.774	73%	0.732	S	S	*	*				57.5	163.7	126.1	-57.6	-178.8	-166.5	-102.3	-2.3	120.1
544	H	30.4	Very low	32	Very low	139 Å²	139	137.5 Å²	137.5	64%	0.644	73%	0.733	S	S	*	*			cis	-155.4	157.2	13.2	-126.4	-64.5	0	0	0	110.9
545	D	28.2	Very low	33	Very low	140 Å²	140	136.8 Å²	136.8	75%	0.749	73%	0.732	S	S	*	*			trans	57.9	131.5	150	-61.6	-8.8	0	0	0	125.8
546	S	31.1	Very low	33.2	Very low	100 Å²	100	139.6 Å²	139.6	70%	0.699	74%	0.741	S	S	*	*			trans	-79.6	158.7	164.3	53.3	0	0	0	0	114.1
547	N	26.6	Very low	33.9	Very low	143 Å²	143	138.9 Å²	138.9	77%	0.765	75%	0.754	S	S	*	*			trans	179.2	156.8	147.5	-97.2	-7.2	0	0	0	110.2
548	W	26.7	Very low	34.2	Very low	201 Å²	201	136.1 Å²	136.1	76%	0.761	76%	0.763	S	S	*	*			cis	-171.4	117.1	-7	166.6	-80	0	0	0	110.8
549	T	27.2	Very low	34.8	Very low	92 Å²	92	132.7 Å²	132.7	56%	0.564	76%	0.762	S	S	*	*			trans	62.1	142.9	149.1	86.8	0	0	0	0	120
550	T	33	Very low	35.3	Very low	111 Å²	111	132.9 Å²	132.9	68%	0.681	76%	0.764	S	S	*	*				69	134.8	89.6	-57.2	0	0	0	0	113.7
551	E	33.8	Very low	34.7	Very low	163 Å²	163	135.1 Å²	135.1	76%	0.762	77%	0.77	S	S	*	*			cis	-161.1	171.5	-1.2	-123.2	159.5	-146.3	0	0	108.5
552	T	35.7	Very low	35.2	Very low	137 Å²	137	135.4 Å²	135.4	84%	0.84	78%	0.776	S	S	*	*				157.1	152.8	129.8	40.7	0	0	0	0	113.6
553	D	44.1	Very low	35.3	Very low	167 Å²	167	137.2 Å²	137.2	89%	0.893	79%	0.786	S	S	*	*			trans	-83.1	166.9	-169.6	-51.3	-88.3	0	0	0	115.8
554	G	35.2	Very low	35.7	Very low	77 Å²	77	133.5 Å²	133.5	79%	0.794	79%	0.791	S	S	*	*			trans	-177.4	79	171.6	0	0	0	0	0	114.2
555	D	45.2	Very low	36.1	Very low	156 Å²	156	134.5 Å²	134.5	83%	0.834	80%	0.798	S	S	*	*			trans	-57.8	143	162.6	-87.3	-41.4	0	0	0	110.6
556	H	37.4	Very low	36.3	Very low	199 Å²	199	134.4 Å²	134.4	92%	0.921	80%	0.798	S	S	*	*			trans	-163.1	148.7	135.7	-89.9	-12.1	0	0	0	111.7
557	S	46.3	Very low	36.8	Very low	128 Å²	128	135.5 Å²	135.5	90%	0.895	81%	0.806	S	S	*	*			trans	-93.6	147.4	-177.1	-176.8	0	0	0	0	111.9
558	G	37.3	Very low	37.4	Very low	79 Å²	79	135 Å²	135	81%	0.814	81%	0.807	S	S	*	*			trans	-166.3	97	174.9	0	0	0	0	0	111.6
559	G	38.4	Very low	37.6	Very low	77 Å²	77	132.1 Å²	132.1	79%	0.794	81%	0.807	S	S	*	*			trans	-103.1	151.2	172.5	0	0	0	0	0	111.8
560	S	41.2	Very low	38.3	Very low	114 Å²	114	133.7 Å²	133.7	80%	0.797	82%	0.822	S	S	*	*			trans	-155.2	114	169.8	58.8	0	0	0	0	111.2
561	D	44.6	Very low	38.3	Very low	159 Å²	159	131.5 Å²	131.5	85%	0.85	82%	0.821	S	S	*	*			trans	-71.8	138	158.1	-52.8	-75.2	0	0	0	109.5
562	V	36.7	Very low	38.4	Very low	140 Å²	140	130.4 Å²	130.4	85%	0.848	83%	0.829	S	S	*	*			trans	-165.1	149.1	138	-99.8	0	0	0	0	110.3
563	N	32.9	Very low	38.3	Very low	155 Å²	155	129.2 Å²	129.2	83%	0.829	83%	0.833	S	S	*	*			trans	-76.6	157.6	178.2	-50.8	-53.7	0	0	0	111.9
564	S	36.7	Very low	37.8	Very low	126 Å²	126	130 Å²	130	88%	0.881	84%	0.837	S	S	*	*			trans	-149.1	120.8	153.5	-72.9	0	0	0	0	109.5
565	M	38.8	Very low	37.6	Very low	161 Å²	161	129.5 Å²	129.5	79%	0.793	83%	0.831	S	S	*	*			trans	-101.1	174.9	166.5	-81.6	-173.6	60.1	0	0	109.8
566	D	33.3	Very low	37	Very low	138 Å²	138	131.6 Å²	131.6	74%	0.738	83%	0.833	S	S	*	*			trans	70.8	104.4	158.6	-53.1	-33.1	0	0	0	119
567	S	41.3	Very low	36.5	Very low	123 Å²	123	127.8 Å²	127.8	86%	0.86	82%	0.824	S	S	*	*			trans	-142.5	128.9	136.6	64.4	0	0	0	0	108.9
568	V	39.1	Very low	35.7	Very low	131 Å²	131	129.8 Å²	129.8	79%	0.794	82%	0.819	S	S	*	*			trans	-108.3	165.8	-173.3	-68.1	0	0	0	0	112.9
569	D	32.4	Very low	35.1	Very low	142 Å²	142	132.1 Å²	132.1	76%	0.759	82%	0.818	S	S	*	*			trans	71.2	114.5	155	-166.4	28	0	0	0	120.1
570	S	41.4	Very low	34.7	Very low	125 Å²	125	137.1 Å²	137.1	87%	0.874	82%	0.82	S	S	*	*			trans	-166.5	126.2	130.6	-79.2	0	0	0	0	109
571	G	33.5	Very low	34.6	Very low	64 Å²	64	137.3 Å²	137.3	66%	0.66	82%	0.819	S	S	*	*			trans	-109.5	168.9	-169.1	0	0	0	0	0	117.3
572	C	35.3	Very low	33.8	Very low	140 Å²	140	137.3 Å²	137.3	95%	0.946	82%	0.819	S	S	*	*			trans	57.2	109.3	150.2	-59.7	0	0	0	0	120.8
573	A	32.4	Very low	33.6	Very low	112 Å²	112	135.2 Å²	135.2	93%	0.926	81%	0.81	S	S	*	*			trans	-152.6	150.5	138.8	0	0	0	0	0	112.8
574	L	35.3	Very low	33.6	Very low	184 Å²	184	137.5 Å²	137.5	96%	0.963	81%	0.813	S	S	*	*			trans	-96.6	144.3	-171.2	-171.9	82	0	0	0	112.1
575	G	30.9	Very low	33.6	Very low	66 Å²	66	136.6 Å²	136.6	68%	0.68	81%	0.813	S	S	*	*			trans	140.2	120.4	142.9	0	0	0	0	0	121.6
576	K	30.9	Very low	33.2	Very low	201 Å²	201	132.9 Å²	132.9	87%	0.874	82%	0.816	S	S	*	*			trans	70	107.3	136.8	-60.7	-174.2	177.5	-176.3	0	122.2
577	T	28.7	Very low	33.2	Very low	119 Å²	119	130.3 Å²	130.3	73%	0.73	82%	0.822	S	S	*	*			trans	13.5	136.9	132.2	35.2	0	0	0	0	123.4
578	E	27.7	Very low	33	Very low	169 Å²	169	133.1 Å²	133.1	79%	0.79	82%	0.821	S	S	*	*			trans	59.6	124	143.8	-60.2	179.5	-163.4	0	0	120
579	T	26.1	Very low	33	Very low	129 Å²	129	132 Å²	132	79%	0.791	82%	0.82	S	S	*	*				-170.6	177.9	77.6	24.5	0	0	0	0	114
580	H	29.4	Very low	33.6	Very low	182 Å²	182	129.9 Å²	129.9	84%	0.843	82%	0.816	S	S	*	*			trans	-41.6	157.9	-173.6	-71.4	-88	0	0	0	121.1
581	P	38.5	Very low	34	Very low	117 Å²	117	133.4 Å²	133.4	76%	0.76	82%	0.815	S	S	*	*			trans	-94	150.6	179.1	37.2	-35.1	0	0	0	114.9
582	N	28.1	Very low	35.1	Very low	159 Å²	159	134.7 Å²	134.7	85%	0.85	81%	0.814	S	S	*	*			trans	-162.7	157.3	139.1	-141.7	-27.7	0	0	0	115.5
583	S	33.3	Very low	36.9	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	81%	0.809	S	S	*	*			trans	81.3	101.9	153.3	68.7	0	0	0	0	122.2
584	K	32.8	Very low	39.3	Very low	203 Å²	203	136.2 Å²	136.2	88%	0.883	79%	0.791	S	S	*	*			trans	66.1	96.8	134.9	-67.9	-173.3	175	-178.5	0	121.7
585	A	36.2	Very low	41.7	Very low	107 Å²	107	128.9 Å²	128.9	88%	0.884	75%	0.754	S	S	*	*				64.8	116	114.7	0	0	0	0	0	121.4
586	G	29.5	Very low	44.6	Very low	82 Å²	82	130 Å²	130	85%	0.845	74%	0.744	S	S	*	*			trans	159.3	130.6	153.6	0	0	0	0	0	114.6
587	G	33.3	Very low	47.6	Very low	84 Å²	84	123 Å²	123	87%	0.866	71%	0.711	S	S	*	*			trans	96.3	126.3	164.1	0	0	0	0	0	116.3
588	E	39	Very low	50.7	Low	182 Å²	182	118.4 Å²	118.4	85%	0.85	68%	0.682	S	S	*	*			trans	-80.7	147.7	-177.6	-61.8	160.8	103.3	0	0	113.7
589	S	38.8	Very low	53.8	Low	109 Å²	109	110.4 Å²	110.4	76%	0.762	64%	0.644	S	S	*	*				-140.1	108	122.2	75.8	0	0	0	0	108.7	K591	S589-K591 VanDerWaalsContact C-N 3.31Å; S589-K591 PolarHBondContact O-N 2.88Å
590	S	45.2	Very low	57	Low	96 Å²	96	108.8 Å²	108.8	67%	0.671	63%	0.628	S	S	*	*			trans	-75.6	80.6	-178.6	41.4	0	0	0	0	111.1	S592	S590-S592 PolarHBondContact O-N 2.82Å
591	K	49.7	Very low	60	Low	199 Å²	199	100.1 Å²	100.1	87%	0.865	59%	0.588	S	S	*	*			trans	-61.5	95.6	153.7	-93.1	-169.9	173.7	-176.8	0	107.2	S589 E593	S589-K591 VanDerWaalsContact C-N 3.31Å; S589-K591 PolarHBondContact O-N 2.88Å; K591-E593 PolarHBondContact O-N 3.06Å
592	S	56.6	Low	62.6	Low	91 Å²	91	96.6 Å²	96.6	64%	0.636	57%	0.565	S	S	*	*			trans	-56.2	111	167.4	-61.1	0	0	0	0	108	S590 L594	S590-S592 PolarHBondContact O-N 2.82Å; S592-L594 PolarHBondContact O-N 3.04Å
593	E	71.6	Confident	65.5	Low	178 Å²	178	93.3 Å²	93.3	83%	0.832	54%	0.543	S	S	*	.			trans	-61.9	118.7	179.4	-167.8	163	-159.4	0	0	108.7	K591 T595	K591-E593 PolarHBondContact O-N 3.06Å; E593-T595 PolarHBondContact O-N 2.74Å
594	L	83.8	Confident	68.2	Low	107 Å²	107	94.5 Å²	94.5	56%	0.56	54%	0.538	S	S	*	.			trans	-84.7	99.9	-178.1	-69.5	175.8	0	0	0	108.3	S592 I596 G646	S592-L594 PolarHBondContact O-N 3.04Å; L594-I596 PolarHBondContact O-N 3.17Å; L594-G646 CarbonylContact C-O 3.58Å; L594-G646 WeakPolarHBondContact CA-O 3.33Å
595	T	86.7	Confident	71	Confident	29 Å²	29	85 Å²	85	18%	0.178	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	120	167.1	-53.7	0	0	0	0	108.6	E593 W597 E645 G646 Q648 V651	E593-T595 PolarHBondContact O-N 2.74Å; T595-W597 HydrophobicContact CG2-CE3 4.39Å; T595-E645 WeakPolarHBondContact O-CA 3.27Å; T595-G646 PolarHBondContact N-O 2.76Å; T595-G646 PolarHBondContact O-N 2.73Å; T595-G646 VanDerWaalsContact O-N 3.1Å; T595-Q648 VanDerWaalsContact CG2-OE1 3.3Å; T595-Q648 PolarHBondContact OG1-OE1 3Å; T595-V651 HydrophobicContact CG2-CB 4.44Å; T595-V651 HydrophobicContact CG2-CG1 4.35Å; T595-V651 HydrophobicContact CG2-CG2 4.01Å
596	I	91.3	Very high	73.7	Confident	91 Å²	91	80.4 Å²	80.4	47%	0.467	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	125.9	165.4	-58.1	176.1	0	0	0	107.1	L594 E598 E645 N669	L594-I596 PolarHBondContact O-N 3.17Å; I596-E598 HydrophobicContact CG2-CG 4.1Å; I596-E645 HydrophobicContact CG1-CG 4.37Å; I596-N669 PolarHBondContact O-ND2 2.9Å; I596-N669 VanDerWaalsContact O-ND2 3.14Å
597	W	93.1	Very high	76.7	Confident	52 Å²	52	79 Å²	79	20%	0.197	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	120.7	-178.1	-168.3	-67.9	0	0	0	109.9	T595 I644 V651 L655 L667 N669	T595-W597 HydrophobicContact CG2-CE3 4.39Å; W597-I644 HydrophobicContact CB-CB 4.39Å; W597-I644 PolarHBondContact N-O 2.81Å; W597-I644 WeakPolarHBondContact O-CB 3.36Å; W597-I644 PolarHBondContact O-N 3.28Å; W597-V651 HydrophobicContact CB-CG1 3.54Å; W597-V651 HydrophobicContact CD2-CG1 3.96Å; W597-V651 HydrophobicContact CE3-CG1 4.03Å; W597-V651 HydrophobicContact CG-CG1 3.79Å; W597-L655 HydrophobicContact CD2-CD1 3.82Å; W597-L655 HydrophobicContact CE3-CD1 4.42Å; W597-L655 HydrophobicContact CG-CD1 4.16Å; W597-L655 HydrophobicContact CH2-CD1 4.46Å; W597-L655 HydrophobicContact CZ2-CD1 3.86Å; W597-L667 VanDerWaalsContact CZ2-O 3.32Å; W597-L667 WeakPolarHBondContact CZ2-O 3.31Å; W597-L667 PolarHBondContact NE1-O 2.81Å; W597-N669 HydrophobicContact CD2-CB 3.61Å; W597-N669 HydrophobicContact CE3-CB 3.94Å; W597-N669 HydrophobicContact CG-CB 4.05Å; W597-N669 HydrophobicContact CH2-CB 4.14Å; W597-N669 HydrophobicContact CZ2-CB 3.83Å; W597-N669 HydrophobicContact CZ3-CB 4.19Å
598	E	93.8	Very high	79.5	Confident	24 Å²	24	80.7 Å²	80.7	11%	0.112	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.4	-174.3	-54.3	-159.4	174.9	0	0	110.2	I596 I641 C642 H643 N669 I670 Y671	I596-E598 HydrophobicContact CG2-CG 4.1Å; E598-I641 HydrophobicContact CB-CG2 3.92Å; E598-I641 HydrophobicContact CG-CG2 4.49Å; E598-I641 WeakPolarHBondContact OE2-CG2 3.46Å; E598-C642 WeakPolarHBondContact CA-O 3.25Å; E598-H643 VanDerWaalsContact CD-CE1 3.45Å; E598-H643 IonicContact OE1-CE1 1.91Å; E598-H643 PolarHBondContact OE1-CE1 2.94Å; E598-H643 IonicContact OE1-CG 3.33Å; E598-H643 IonicContact OE1-ND1 3.9Å; E598-H643 PolarHBondContact OE1-ND1 2.84Å; E598-H643 IonicContact OE2-CE1 2.76Å; E598-H643 PolarHBondContact OE2-CE1 3.42Å; E598-H643 IonicContact OE2-ND1 2.41Å; E598-H643 PolarHBondContact OE2-ND1 3.25Å; E598-N669 PolarHBondContact N-OD1 3.07Å; E598-N669 WeakPolarHBondContact O-CA 3.4Å; E598-I670 HydrophobicContact CB-CB 4.48Å; E598-I670 HydrophobicContact CB-CD1 4.04Å; E598-I670 WeakPolarHBondContact O-CG1 3.45Å; E598-I670 PolarHBondContact O-N 3.49Å; E598-Y671 HydrophobicContact CG-CD2 4.26Å; E598-Y671 HydrophobicContact CG-CE2 4.3Å
599	I	93.6	Very high	82.2	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.3	-179.5	64.5	-175.1	0	0	0	110.5	V601 C642 I644 L655 I658 L665 L667	I599-V601 HydrophobicContact CG1-CG2 4.22Å; I599-C642 HydrophobicContact CD1-CB 4.36Å; I599-C642 HydrophobicContact CG1-CB 3.78Å; I599-C642 PolarHBondContact N-O 3.07Å; I599-C642 PolarHBondContact O-N 3Å; I599-I644 HydrophobicContact CD1-CD1 4.21Å; I599-L655 HydrophobicContact CG2-CD2 4.26Å; I599-I658 HydrophobicContact CD1-CD1 4.09Å; I599-L665 HydrophobicContact CD1-CD2 4Å; I599-L667 HydrophobicContact CD1-CD2 3.98Å
600	E	93.2	Very high	84.8	Confident	95 Å²	95	70 Å²	70	44%	0.444	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130.6	173.5	-61	-168	155	0	0	110.6	F639 I641 I670	E600-F639 HydrophobicContact CB-CD2 4.16Å; E600-F639 HydrophobicContact CG-CD2 4.04Å; E600-F639 HydrophobicContact CG-CE2 4.14Å; E600-F639 VanDerWaalsContact OE1-CE2 3.32Å; E600-F639 WeakPolarHBondContact OE1-CE2 3.25Å; E600-I641 HydrophobicContact CG-CD1 4.14Å; E600-I670 HydrophobicContact CG-CD1 3.66Å; E600-I670 HydrophobicContact CG-CG1 4.07Å
601	V	93.1	Very high	87.2	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	107.5	-179.2	-173.5	0	0	0	0	108.6	I599 K603 L605 V606 L609 F639 Q640 C642 L665	I599-V601 HydrophobicContact CG1-CG2 4.22Å; V601-K603 PolarHBondContact O-N 2.69Å; V601-L605 HydrophobicContact CG1-CB 4.09Å; V601-V606 HydrophobicContact CB-CG2 4.06Å; V601-V606 HydrophobicContact CG1-CB 4.39Å; V601-V606 HydrophobicContact CG1-CG2 3.65Å; V601-L609 HydrophobicContact CB-CD2 4.43Å; V601-L609 HydrophobicContact CG1-CD2 3.87Å; V601-L609 HydrophobicContact CG2-CD2 3.71Å; V601-F639 CarbonylContact O-C 3.57Å; V601-F639 WeakPolarHBondContact O-CA 3.19Å; V601-Q640 PolarHBondContact N-O 2.93Å; V601-Q640 PolarHBondContact O-N 3.25Å; V601-C642 HydrophobicContact CG2-CB 3.52Å; V601-L665 HydrophobicContact CB-CD1 4.34Å; V601-L665 HydrophobicContact CG1-CD1 3.93Å; V601-L665 HydrophobicContact CG2-CD1 4.24Å
602	P	91.9	Very high	89.2	Confident	43 Å²	43	65.8 Å²	65.8	28%	0.279	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50	137.5	172.2	-29.5	34.9	0	0	0	111.7	H604 L605 V606	P602-H604 PolarHBondContact O-N 2.91Å; P602-H604 VanDerWaalsContact O-N 3.08Å; P602-L605 HydrophobicContact CB-CD1 4.33Å; P602-L605 HydrophobicContact CB-CG 4.31Å; P602-L605 HydrophobicContact CG-CD1 4.2Å; P602-L605 WeakPolarHBondContact O-CA 3.28Å; P602-L605 WeakPolarHBondContact O-CB 3.22Å; P602-L605 PolarHBondContact O-N 3.48Å; P602-V606 PolarHBondContact O-N 3.05Å
603	K	88.9	Confident	90.8	Very high	90 Å²	90	69.3 Å²	69.3	39%	0.391	34%	0.344	S	S	.	.	H	α-helix	trans	-56.4	-33.1	-171.4	-79.2	176.7	-174.6	-177.3	0	113.5	V601 L605 V606 T636 Q637 D638 Q640	V601-K603 PolarHBondContact O-N 2.69Å; K603-L605 PolarHBondContact O-N 3.18Å; K603-V606 PolarHBondContact O-N 2.95Å; K603-T636 WeakPolarHBondContact CE-O 3.17Å; K603-T636 PolarHBondContact NZ-O 3.01Å; K603-Q637 VanDerWaalsContact CD-O 3.28Å; K603-Q637 WeakPolarHBondContact CD-O 3.4Å; K603-Q637 WeakPolarHBondContact CE-O 3.33Å; K603-Q637 PolarHBondContact NZ-O 3.27Å; K603-D638 WeakPolarHBondContact CG-O 3.04Å; K603-D638 PolarHBondContact N-O 3.33Å; K603-Q640 HydrophobicContact CG-CG 4.36Å
604	H	89.7	Confident	91.7	Very high	123 Å²	123	61.5 Å²	61.5	57%	0.569	31%	0.311	S	S	*	.	H	α-helix	trans	-69.9	-13.7	176.2	74.4	-97.8	0	0	0	114	P602 R608	P602-H604 PolarHBondContact O-N 2.91Å; P602-H604 VanDerWaalsContact O-N 3.08Å; H604-R608 PolarHBondContact O-NE 2.96Å
605	L	92.8	Very high	92.3	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-100.7	-27.9	175.2	-56.4	-176.6	0	0	0	113.1	V601 P602 K603 G607 R608 L609 F662 E664 L665	V601-L605 HydrophobicContact CG1-CB 4.09Å; P602-L605 HydrophobicContact CB-CD1 4.33Å; P602-L605 HydrophobicContact CB-CG 4.31Å; P602-L605 HydrophobicContact CG-CD1 4.2Å; P602-L605 WeakPolarHBondContact O-CA 3.28Å; P602-L605 WeakPolarHBondContact O-CB 3.22Å; P602-L605 PolarHBondContact O-N 3.48Å; K603-L605 PolarHBondContact O-N 3.18Å; L605-G607 VanDerWaalsContact C-N 3.32Å; L605-G607 PolarHBondContact O-N 3.12Å; L605-R608 CarbonylContact O-C 3.56Å; L605-R608 WeakPolarHBondContact O-CA 3.15Å; L605-R608 VanDerWaalsContact O-CB 3.29Å; L605-R608 WeakPolarHBondContact O-CB 3.38Å; L605-R608 PolarHBondContact O-N 3.31Å; L605-L609 PolarHBondContact O-N 3.42Å; L605-F662 HydrophobicContact CB-CE1 4.44Å; L605-F662 HydrophobicContact CD2-CE1 4.5Å; L605-E664 HydrophobicContact CD1-CG 3.95Å; L605-E664 HydrophobicContact CD2-CG 4.46Å; L605-E664 WeakPolarHBondContact CD2-OE1 3.24Å; L605-L665 HydrophobicContact CD1-CB 4.33Å; L605-L665 HydrophobicContact CD1-CD1 3.89Å
606	V	92.4	Very high	92.7	Very high	12 Å²	12	65 Å²	65	7%	0.073	31%	0.314	C	S	.	.	H	α-helix	trans	-48.3	-50.9	179.2	172.4	0	0	0	0	111.9	V601 P602 K603 R608 L609 I610 I630 Q640	V601-V606 HydrophobicContact CB-CG2 4.06Å; V601-V606 HydrophobicContact CG1-CB 4.39Å; V601-V606 HydrophobicContact CG1-CG2 3.65Å; P602-V606 PolarHBondContact O-N 3.05Å; K603-V606 PolarHBondContact O-N 2.95Å; V606-R608 VanDerWaalsContact C-N 3.26Å; V606-R608 PolarHBondContact O-N 3.47Å; V606-L609 PolarHBondContact O-N 3.15Å; V606-I610 HydrophobicContact CG1-CD1 3.78Å; V606-I610 HydrophobicContact CG1-CG1 4.4Å; V606-I610 WeakPolarHBondContact O-CG1 3.44Å; V606-I610 PolarHBondContact O-N 2.96Å; V606-I630 HydrophobicContact CG1-CG2 4.3Å; V606-Q640 HydrophobicContact CG2-CB 3.93Å; V606-Q640 HydrophobicContact CG2-CG 4.1Å
607	G	92	Very high	92.9	Very high	53 Å²	53	61.6 Å²	61.6	55%	0.546	30%	0.297	S	S	.	.	H	α-helix	trans	-63.1	-29.7	178.3	0	0	0	0	0	113.9	L605 G611	L605-G607 VanDerWaalsContact C-N 3.32Å; L605-G607 PolarHBondContact O-N 3.12Å; G607-G611 WeakPolarHBondContact O-CA 3.28Å; G607-G611 PolarHBondContact O-N 2.97Å
608	R	93.6	Very high	93.1	Very high	119 Å²	119	62.1 Å²	62.1	45%	0.449	31%	0.309	S	S	.	.	H	α-helix	trans	-75.4	-29.2	173.9	-50.2	-177.7	-164.7	172	1.6	111.9	H604 L605 V606 K661 F662 E664	H604-R608 PolarHBondContact O-NE 2.96Å; L605-R608 CarbonylContact O-C 3.56Å; L605-R608 WeakPolarHBondContact O-CA 3.15Å; L605-R608 VanDerWaalsContact O-CB 3.29Å; L605-R608 WeakPolarHBondContact O-CB 3.38Å; L605-R608 PolarHBondContact O-N 3.31Å; V606-R608 VanDerWaalsContact C-N 3.26Å; V606-R608 PolarHBondContact O-N 3.47Å; R608-K661 PolarHBondContact O-NZ 2.93Å; R608-F662 HydrophobicContact CB-CE1 3.71Å; R608-F662 HydrophobicContact CB-CZ 3.81Å; R608-E664 IonicContact CZ-OE1 3.95Å; R608-E664 IonicContact NH1-OE1 2.77Å; R608-E664 PolarHBondContact NH1-OE1 3.37Å; R608-E664 IonicContact NH1-OE2 3.87Å
609	L	94.6	Very high	93.2	Very high	2 Å²	2	65.1 Å²	65.1	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-83.7	-39.4	-177.4	-178.6	64.1	0	0	0	111.8	V601 L605 V606 G611 Y616 V617 L620 I630 C642 I658 F662	V601-L609 HydrophobicContact CB-CD2 4.43Å; V601-L609 HydrophobicContact CG1-CD2 3.87Å; V601-L609 HydrophobicContact CG2-CD2 3.71Å; L605-L609 PolarHBondContact O-N 3.42Å; V606-L609 PolarHBondContact O-N 3.15Å; L609-G611 VanDerWaalsContact C-N 3.35Å; L609-Y616 HydrophobicContact CD1-CD1 4.35Å; L609-Y616 HydrophobicContact CD1-CE1 4.34Å; L609-Y616 WeakPolarHBondContact O-CD1 3.45Å; L609-V617 PolarHBondContact O-N 3.31Å; L609-L620 HydrophobicContact CD1-CD1 3.94Å; L609-I630 HydrophobicContact CD2-CD1 3.92Å; L609-I630 HydrophobicContact CG-CD1 4.21Å; L609-C642 HydrophobicContact CD2-CB 4.23Å; L609-I658 HydrophobicContact CD1-CG1 4.17Å; L609-I658 HydrophobicContact CD1-CG2 4.26Å; L609-F662 HydrophobicContact CB-CE2 4.21Å; L609-F662 HydrophobicContact CB-CZ 3.94Å; L609-F662 HydrophobicContact CD1-CD2 4.26Å; L609-F662 HydrophobicContact CD1-CE2 3.63Å; L609-F662 HydrophobicContact CD1-CZ 4.24Å
610	I	94.3	Very high	93.4	Very high	64 Å²	64	65.2 Å²	65.2	33%	0.328	32%	0.322	S	S	.	.	H	α-helix	trans	-63.1	-47.7	164.7	-62.4	171.4	0	0	0	108.9	V606 G614 Y616 V617 I630	V606-I610 HydrophobicContact CG1-CD1 3.78Å; V606-I610 HydrophobicContact CG1-CG1 4.4Å; V606-I610 WeakPolarHBondContact O-CG1 3.44Å; V606-I610 PolarHBondContact O-N 2.96Å; I610-G614 CarbonylContact O-C 3.55Å; I610-G614 VanDerWaalsContact O-CA 3.29Å; I610-G614 WeakPolarHBondContact O-CA 3.23Å; I610-Y616 PolarHBondContact O-N 2.73Å; I610-Y616 VanDerWaalsContact O-N 3.08Å; I610-V617 HydrophobicContact CG2-CG1 4.26Å; I610-V617 PolarHBondContact O-N 2.97Å; I610-V617 VanDerWaalsContact O-N 3.15Å; I610-I630 HydrophobicContact CD1-CD1 4.31Å; I610-I630 HydrophobicContact CG1-CD1 3.68Å
611	G	93.9	Very high	93.5	Very high	18 Å²	18	65 Å²	65	19%	0.186	32%	0.32	C	S	.	.			trans	76.4	166.1	-174.8	0	0	0	0	0	112.6	G607 L609 Q613 G614	G607-G611 WeakPolarHBondContact O-CA 3.28Å; G607-G611 PolarHBondContact O-N 2.97Å; L609-G611 VanDerWaalsContact C-N 3.35Å; G611-Q613 PolarHBondContact O-N 3.42Å; G611-G614 PolarHBondContact O-N 3.45Å
612	K	91.8	Very high	93.7	Very high	189 Å²	189	73.3 Å²	73.3	82%	0.822	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-56.1	125.3	178.9	-64.2	-176.4	179.6	-178.4	0	109.7	G614 R615	K612-G614 PolarHBondContact O-N 3.5Å; K612-R615 WeakPolarHBondContact O-CB 3.49Å; K612-R615 VanDerWaalsContact O-CG 3.22Å; K612-R615 WeakPolarHBondContact O-CG 3.35Å; K612-R615 PolarHBondContact O-N 3.37Å
613	Q	90.4	Very high	93.8	Very high	164 Å²	164	73.4 Å²	73.4	77%	0.766	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	56	29	-176.3	-57.8	171.8	-23	0	0	114.4	G611 R615	G611-Q613 PolarHBondContact O-N 3.42Å; Q613-R615 HydrophobicContact CB-CG 4.47Å; Q613-R615 PolarHBondContact O-N 3.02Å
614	G	91.8	Very high	94.2	Very high	14 Å²	14	69.3 Å²	69.3	14%	0.144	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	72.2	4.7	-178.7	0	0	0	0	0	114.9	I610 G611 K612 Y616 V617 S618	I610-G614 CarbonylContact O-C 3.55Å; I610-G614 VanDerWaalsContact O-CA 3.29Å; I610-G614 WeakPolarHBondContact O-CA 3.23Å; G611-G614 PolarHBondContact O-N 3.45Å; K612-G614 PolarHBondContact O-N 3.5Å; G614-Y616 PolarHBondContact O-N 2.83Å; G614-Y616 VanDerWaalsContact O-N 3.13Å; G614-V617 VanDerWaalsContact O-CG1 3.28Å; G614-V617 WeakPolarHBondContact O-CG1 3.4Å; G614-V617 PolarHBondContact O-N 3.44Å; G614-S618 WeakPolarHBondContact O-CB 3.4Å; G614-S618 PolarHBondContact O-N 3.45Å; G614-S618 PolarHBondContact O-OG 2.97Å
615	R	94.6	Very high	94.4	Very high	171 Å²	171	65.6 Å²	65.6	65%	0.645	34%	0.336	S	S	*	.	H	α-helix	trans	-58.2	-31.8	-171.9	-70	176.2	-168.6	-164.4	2.2	113.8	K612 Q613 F619	K612-R615 WeakPolarHBondContact O-CB 3.49Å; K612-R615 VanDerWaalsContact O-CG 3.22Å; K612-R615 WeakPolarHBondContact O-CG 3.35Å; K612-R615 PolarHBondContact O-N 3.37Å; Q613-R615 HydrophobicContact CB-CG 4.47Å; Q613-R615 PolarHBondContact O-N 3.02Å; R615-F619 VanDerWaalsContact O-CB 3.26Å; R615-F619 WeakPolarHBondContact O-CB 3.27Å; R615-F619 PolarHBondContact O-N 3.1Å
616	Y	96.3	Very high	94.5	Very high	40 Å²	40	65.7 Å²	65.7	16%	0.157	34%	0.338	C	S	.	.	H	α-helix	trans	-80	-43.5	-179.5	-164.9	-105.2	0	0	0	112	L609 I610 G614 S618 F619 L620 L657 K661 F662	L609-Y616 HydrophobicContact CD1-CD1 4.35Å; L609-Y616 HydrophobicContact CD1-CE1 4.34Å; L609-Y616 WeakPolarHBondContact O-CD1 3.45Å; I610-Y616 PolarHBondContact O-N 2.73Å; I610-Y616 VanDerWaalsContact O-N 3.08Å; G614-Y616 PolarHBondContact O-N 2.83Å; G614-Y616 VanDerWaalsContact O-N 3.13Å; Y616-S618 VanDerWaalsContact C-N 3.31Å; Y616-S618 PolarHBondContact O-N 2.85Å; Y616-F619 AromaticContact CD2-CD1 3.97Å; Y616-F619 HydrophobicContact CD2-CD1 3.97Å; Y616-F619 AromaticContact CE2-CD1 3.61Å; Y616-F619 HydrophobicContact CE2-CD1 3.61Å; Y616-F619 AromaticContact CE2-CE1 3.91Å; Y616-F619 HydrophobicContact CE2-CE1 3.91Å; Y616-F619 WeakPolarHBondContact O-CB 3.33Å; Y616-F619 PolarHBondContact O-N 2.87Å; Y616-L620 HydrophobicContact CD1-CD1 3.93Å; Y616-L620 HydrophobicContact CD1-CG 4.09Å; Y616-L620 HydrophobicContact CE1-CD1 3.69Å; Y616-L620 HydrophobicContact CE1-CD2 3.86Å; Y616-L620 HydrophobicContact CE1-CG 3.74Å; Y616-L620 WeakPolarHBondContact O-CG 3.36Å; Y616-L620 PolarHBondContact O-N 2.72Å; Y616-L657 PolarHBondContact OH-O 2.74Å; Y616-K661 HydrophobicContact CD1-CD 4.16Å; Y616-K661 HydrophobicContact CD2-CD 3.97Å; Y616-K661 HydrophobicContact CE1-CD 3.68Å; Y616-K661 HydrophobicContact CE2-CD 3.47Å; Y616-K661 VanDerWaalsContact CE2-CD 3.47Å; Y616-K661 HydrophobicContact CG-CD 4.3Å; Y616-F662 HydrophobicContact CD1-CE2 4.43Å; Y616-F662 HydrophobicContact CE1-CE2 4.06Å
617	V	95.9	Very high	94.7	Very high	18 Å²	18	70.6 Å²	70.6	11%	0.109	36%	0.358	C	S	.	.	H	α-helix	trans	-65.8	-33.2	174	64.6	0	0	0	0	112.3	L609 I610 G614 L620 K621 I628	L609-V617 PolarHBondContact O-N 3.31Å; I610-V617 HydrophobicContact CG2-CG1 4.26Å; I610-V617 PolarHBondContact O-N 2.97Å; I610-V617 VanDerWaalsContact O-N 3.15Å; G614-V617 VanDerWaalsContact O-CG1 3.28Å; G614-V617 WeakPolarHBondContact O-CG1 3.4Å; G614-V617 PolarHBondContact O-N 3.44Å; V617-L620 PolarHBondContact O-N 2.92Å; V617-K621 WeakPolarHBondContact O-CG 3.48Å; V617-K621 PolarHBondContact O-N 3.39Å; V617-I628 HydrophobicContact CG2-CB 4.29Å; V617-I628 HydrophobicContact CG2-CG2 3.86Å
618	S	95.8	Very high	94.9	Very high	64 Å²	64	68.1 Å²	68.1	45%	0.448	33%	0.332	S	S	.	.	H	α-helix	trans	-67.4	-42.1	171.1	-64.5	0	0	0	0	112.6	G614 Y616 L620 K621 Q622	G614-S618 WeakPolarHBondContact O-CB 3.4Å; G614-S618 PolarHBondContact O-N 3.45Å; G614-S618 PolarHBondContact O-OG 2.97Å; Y616-S618 VanDerWaalsContact C-N 3.31Å; Y616-S618 PolarHBondContact O-N 2.85Å; S618-L620 VanDerWaalsContact C-N 3.35Å; S618-L620 PolarHBondContact O-N 3.21Å; S618-K621 PolarHBondContact O-N 3.37Å; S618-Q622 WeakPolarHBondContact O-CB 3.31Å; S618-Q622 PolarHBondContact O-N 2.81Å
619	F	96.6	Very high	94.9	Very high	87 Å²	87	66.9 Å²	66.9	38%	0.382	33%	0.328	S	S	.	.	H	α-helix	trans	-59.8	-43.2	171.8	163.9	-96.9	0	0	0	111.9	R615 Y616 T623 L657	R615-F619 VanDerWaalsContact O-CB 3.26Å; R615-F619 WeakPolarHBondContact O-CB 3.27Å; R615-F619 PolarHBondContact O-N 3.1Å; Y616-F619 AromaticContact CD2-CD1 3.97Å; Y616-F619 HydrophobicContact CD2-CD1 3.97Å; Y616-F619 AromaticContact CE2-CD1 3.61Å; Y616-F619 HydrophobicContact CE2-CD1 3.61Å; Y616-F619 AromaticContact CE2-CE1 3.91Å; Y616-F619 HydrophobicContact CE2-CE1 3.91Å; Y616-F619 WeakPolarHBondContact O-CB 3.33Å; Y616-F619 PolarHBondContact O-N 2.87Å; F619-T623 WeakPolarHBondContact CD2-OG1 3.23Å; F619-T623 HydrophobicContact CE2-CG2 4.44Å; F619-T623 VanDerWaalsContact CE2-OG1 3.22Å; F619-T623 WeakPolarHBondContact CE2-OG1 3.27Å; F619-T623 HydrophobicContact CZ-CG2 4.36Å; F619-T623 WeakPolarHBondContact O-CB 3.46Å; F619-T623 PolarHBondContact O-N 2.75Å; F619-T623 PolarHBondContact O-OG1 2.95Å; F619-L657 HydrophobicContact CE1-CD1 4.5Å; F619-L657 HydrophobicContact CE1-CD2 4.17Å; F619-L657 HydrophobicContact CZ-CD2 4.2Å
620	L	96.9	Very high	94.8	Very high	1 Å²	1	68.5 Å²	68.5	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-58.1	-53.4	175.5	-71.5	175.1	0	0	0	110.4	L609 Y616 V617 S618 Q622 T623 S624 I628 L657 I658	L609-L620 HydrophobicContact CD1-CD1 3.94Å; Y616-L620 HydrophobicContact CD1-CD1 3.93Å; Y616-L620 HydrophobicContact CD1-CG 4.09Å; Y616-L620 HydrophobicContact CE1-CD1 3.69Å; Y616-L620 HydrophobicContact CE1-CD2 3.86Å; Y616-L620 HydrophobicContact CE1-CG 3.74Å; Y616-L620 WeakPolarHBondContact O-CG 3.36Å; Y616-L620 PolarHBondContact O-N 2.72Å; V617-L620 PolarHBondContact O-N 2.92Å; S618-L620 VanDerWaalsContact C-N 3.35Å; S618-L620 PolarHBondContact O-N 3.21Å; L620-Q622 PolarHBondContact O-N 2.9Å; L620-T623 PolarHBondContact O-N 3.4Å; L620-S624 VanDerWaalsContact O-CB 3.28Å; L620-S624 WeakPolarHBondContact O-CB 3.5Å; L620-S624 PolarHBondContact O-N 3.41Å; L620-S624 PolarHBondContact O-OG 3.48Å; L620-I628 HydrophobicContact CB-CD1 3.63Å; L620-L657 HydrophobicContact CD2-CB 3.43Å; L620-L657 VanDerWaalsContact CD2-CB 3.43Å; L620-L657 HydrophobicContact CD2-CD1 4.2Å; L620-L657 HydrophobicContact CD2-CG 4.45Å; L620-I658 HydrophobicContact CD1-CD1 4.2Å; L620-I658 HydrophobicContact CD1-CG1 3.75Å; L620-I658 HydrophobicContact CD2-CG1 3.98Å
621	K	96.4	Very high	94.5	Very high	91 Å²	91	67.1 Å²	67.1	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-52.7	-54.9	177	-72.6	170.4	178.4	-177.3	0	112.5	V617 S618 T623 G625 I628	V617-K621 WeakPolarHBondContact O-CG 3.48Å; V617-K621 PolarHBondContact O-N 3.39Å; S618-K621 PolarHBondContact O-N 3.37Å; K621-T623 VanDerWaalsContact C-N 3.3Å; K621-T623 PolarHBondContact O-N 2.86Å; K621-G625 PolarHBondContact O-N 2.87Å; K621-I628 WeakPolarHBondContact CE-O 3.44Å; K621-I628 HydrophobicContact CG-CB 4.11Å; K621-I628 HydrophobicContact CG-CG1 4.47Å; K621-I628 PolarHBondContact NZ-O 3.4Å; K621-I628 VanDerWaalsContact NZ-O 3.07Å
622	Q	96.3	Very high	93.7	Very high	174 Å²	174	71.2 Å²	71.2	81%	0.813	35%	0.354	S	S	*	.	H	α-helix	trans	-65.2	-34	-175.4	-170.5	178.3	17.2	0	0	112.2	S618 L620	S618-Q622 WeakPolarHBondContact O-CB 3.31Å; S618-Q622 PolarHBondContact O-N 2.81Å; L620-Q622 PolarHBondContact O-N 2.9Å
623	T	95.7	Very high	92.9	Very high	46 Å²	46	65.9 Å²	65.9	28%	0.282	33%	0.334	S	S	.	.	H	α-helix	trans	-85.9	-35.8	-177.5	-49.7	0	0	0	0	112.4	F619 L620 K621 K653 L657	F619-T623 WeakPolarHBondContact CD2-OG1 3.23Å; F619-T623 HydrophobicContact CE2-CG2 4.44Å; F619-T623 VanDerWaalsContact CE2-OG1 3.22Å; F619-T623 WeakPolarHBondContact CE2-OG1 3.27Å; F619-T623 HydrophobicContact CZ-CG2 4.36Å; F619-T623 WeakPolarHBondContact O-CB 3.46Å; F619-T623 PolarHBondContact O-N 2.75Å; F619-T623 PolarHBondContact O-OG1 2.95Å; L620-T623 PolarHBondContact O-N 3.4Å; K621-T623 VanDerWaalsContact C-N 3.3Å; K621-T623 PolarHBondContact O-N 2.86Å; T623-K653 WeakPolarHBondContact O-CE 3.11Å; T623-K653 PolarHBondContact O-NZ 3.48Å; T623-L657 HydrophobicContact CG2-CD1 3.72Å; T623-L657 HydrophobicContact CG2-CD2 4.48Å
624	S	96.3	Very high	91	Very high	3 Å²	3	63.4 Å²	63.4	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-84.7	-33.8	-178.2	70	0	0	0	0	113.7	L620 A626 H650	L620-S624 VanDerWaalsContact O-CB 3.28Å; L620-S624 WeakPolarHBondContact O-CB 3.5Å; L620-S624 PolarHBondContact O-N 3.41Å; L620-S624 PolarHBondContact O-OG 3.48Å; S624-A626 VanDerWaalsContact C-N 3.28Å; S624-A626 WeakPolarHBondContact OG-CB 3.28Å; S624-A626 PolarHBondContact OG-N 3.33Å; S624-H650 WeakPolarHBondContact O-CA 3.41Å; S624-H650 WeakPolarHBondContact O-CB 3.37Å; S624-H650 PolarHBondContact O-CD2 2.84Å
625	G	94.2	Very high	89.3	Confident	45 Å²	45	72.9 Å²	72.9	46%	0.464	37%	0.365	S	S	.	.			trans	80.2	7	-166.2	0	0	0	0	0	113.8	K621 H650	K621-G625 PolarHBondContact O-N 2.87Å; G625-H650 PolarHBondContact O-ND1 3.03Å
626	A	95.4	Very high	87.9	Confident	5 Å²	5	65.8 Å²	65.8	4%	0.041	34%	0.34	C	S	.	.			trans	-92.8	145.2	177.4	0	0	0	0	0	112	S624 I628 I644 E645 H650 A654	S624-A626 VanDerWaalsContact C-N 3.28Å; S624-A626 WeakPolarHBondContact OG-CB 3.28Å; S624-A626 PolarHBondContact OG-N 3.33Å; A626-I628 HydrophobicContact CB-CD1 4.4Å; A626-I628 HydrophobicContact CB-CG1 4.12Å; A626-I628 PolarHBondContact O-N 2.87Å; A626-I644 HydrophobicContact CB-CG2 3.86Å; A626-E645 CarbonylContact C-O 3.57Å; A626-E645 WeakPolarHBondContact CA-O 3.28Å; A626-H650 HydrophobicContact CB-CB 4.12Å; A626-A654 HydrophobicContact CB-CB 4.34Å
627	K	95.6	Very high	86.5	Confident	114 Å²	114	71.7 Å²	71.7	50%	0.496	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	110.7	168.2	169.2	178.8	158	-151.3	0	108.1	Y629 E645	K627-Y629 HydrophobicContact CG-CD1 4.49Å; K627-E645 HydrophobicContact CB-CB 4.21Å; K627-E645 WeakPolarHBondContact CD-OE2 3.4Å; K627-E645 WeakPolarHBondContact CE-OE2 3.48Å; K627-E645 PolarHBondContact N-O 3.49Å; K627-E645 IonicContact NZ-OE1 3.19Å; K627-E645 PolarHBondContact NZ-OE1 2.88Å; K627-E645 IonicContact NZ-OE2 2.73Å; K627-E645 PolarHBondContact NZ-OE2 2.9Å; K627-E645 PolarHBondContact O-N 2.89Å
628	I	96.1	Very high	85.9	Confident	2 Å²	2	76.7 Å²	76.7	1%	0.01	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.6	-175.3	-57.9	170.2	0	0	0	110.4	V617 L620 K621 A626 H643 I644 A654	V617-I628 HydrophobicContact CG2-CB 4.29Å; V617-I628 HydrophobicContact CG2-CG2 3.86Å; L620-I628 HydrophobicContact CB-CD1 3.63Å; K621-I628 WeakPolarHBondContact CE-O 3.44Å; K621-I628 HydrophobicContact CG-CB 4.11Å; K621-I628 HydrophobicContact CG-CG1 4.47Å; K621-I628 PolarHBondContact NZ-O 3.4Å; K621-I628 VanDerWaalsContact NZ-O 3.07Å; A626-I628 HydrophobicContact CB-CD1 4.4Å; A626-I628 HydrophobicContact CB-CG1 4.12Å; A626-I628 PolarHBondContact O-N 2.87Å; I628-H643 VanDerWaalsContact CA-O 3.31Å; I628-H643 WeakPolarHBondContact CA-O 3.47Å; I628-I644 HydrophobicContact CG1-CG1 4.34Å; I628-I644 HydrophobicContact CG1-CG2 4.18Å; I628-A654 HydrophobicContact CD1-CB 3.98Å
629	Y	94.1	Very high	85.6	Confident	92 Å²	92	76.5 Å²	76.5	36%	0.361	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	159.6	173.4	61.8	-85.1	0	0	0	111.1	K627 H643	K627-Y629 HydrophobicContact CG-CD1 4.49Å; Y629-H643 HydrophobicContact CD1-CB 4.04Å; Y629-H643 HydrophobicContact CD2-CB 4.13Å; Y629-H643 AromaticContact CD2-CD2 3.53Å; Y629-H643 AromaticContact CD2-CG 3.98Å; Y629-H643 HydrophobicContact CE1-CB 3.64Å; Y629-H643 HydrophobicContact CE2-CB 3.74Å; Y629-H643 AromaticContact CE2-CD2 3.19Å; Y629-H643 WeakPolarHBondContact CE2-CD2 3.35Å; Y629-H643 AromaticContact CE2-CG 3.37Å; Y629-H643 AromaticContact CE2-NE2 3.79Å; Y629-H643 HydrophobicContact CG-CB 4.27Å; Y629-H643 VanDerWaalsContact CZ-CB 3.46Å; Y629-H643 AromaticContact CZ-CD2 3.84Å; Y629-H643 AromaticContact CZ-CG 3.49Å; Y629-H643 VanDerWaalsContact CZ-CG 3.49Å; Y629-H643 PolarHBondContact N-O 2.86Å; Y629-H643 VanDerWaalsContact N-O 3.09Å; Y629-H643 PolarHBondContact O-N 2.66Å
630	I	93.1	Very high	85.3	Confident	37 Å²	37	73.8 Å²	73.8	19%	0.19	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	122.3	-177	-61	172.1	0	0	0	108.3	V606 L609 I610 Q640 I641 C642	V606-I630 HydrophobicContact CG1-CG2 4.3Å; L609-I630 HydrophobicContact CD2-CD1 3.92Å; L609-I630 HydrophobicContact CG-CD1 4.21Å; I610-I630 HydrophobicContact CD1-CD1 4.31Å; I610-I630 HydrophobicContact CG1-CD1 3.68Å; I630-Q640 HydrophobicContact CG2-CB 3.99Å; I630-I641 CarbonylContact C-O 3.6Å; I630-I641 VanDerWaalsContact CA-O 3.25Å; I630-I641 WeakPolarHBondContact CA-O 3.49Å; I630-C642 HydrophobicContact CG1-CB 4Å
631	S	87.9	Confident	85.1	Confident	35 Å²	35	74.3 Å²	74.3	25%	0.245	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	125.1	-179.4	-64.1	0	0	0	0	110.6	L633 I641 H643	S631-L633 PolarHBondContact O-N 3.1Å; S631-I641 PolarHBondContact N-O 3.41Å; S631-I641 PolarHBondContact O-N 3.4Å; S631-H643 WeakPolarHBondContact CB-NE2 3.37Å; S631-H643 PolarHBondContact OG-CD2 2.88Å; S631-H643 VanDerWaalsContact OG-CD2 3.27Å; S631-H643 PolarHBondContact OG-NE2 3.45Å
632	T	77.6	Confident	85	Confident	103 Å²	103	70 Å²	70	63%	0.632	36%	0.359	S	S	*	.			trans	-86.1	105.2	169.1	-59.7	0	0	0	0	108.6	Q640	T632-Q640 PolarHBondContact OG1-NE2 2.67Å; T632-Q640 PolarHBondContact OG1-OE1 2.82Å
633	L	73.6	Confident	84.9	Confident	78 Å²	78	62.5 Å²	62.5	41%	0.408	32%	0.324	S	S	.	.			trans	-79.3	140.8	172.1	-62.2	177.5	0	0	0	109.7	S631 Y635 T636 I641	S631-L633 PolarHBondContact O-N 3.1Å; L633-Y635 PolarHBondContact O-N 2.69Å; L633-T636 HydrophobicContact CB-CG2 4Å; L633-T636 HydrophobicContact CD1-CG2 4Å; L633-I641 HydrophobicContact CD1-CD1 4.49Å; L633-I641 HydrophobicContact CD1-CG1 3.79Å; L633-I641 HydrophobicContact CG-CG1 4.43Å
634	P	51.2	Low	85	Confident	111 Å²	111	60.3 Å²	60.3	72%	0.721	31%	0.311	S	S	*	.	S	Bend	trans	-74.8	-11.5	-175.1	28.6	-34.1	0	0	0	114.1
635	Y	55.2	Low	84.9	Confident	213 Å²	213	62 Å²	62	84%	0.835	32%	0.318	S	S	*	.	S	Bend	trans	-109.6	-13.3	-174.9	-54.3	-64	0	0	0	114.5	L633 Q637	L633-Y635 PolarHBondContact O-N 2.69Å; Y635-Q637 PolarHBondContact O-N 3Å
636	T	65.3	Low	84.9	Confident	22 Å²	22	60.1 Å²	60.1	14%	0.135	30%	0.299	C	S	.	.			trans	-83.1	113.1	-178.2	57.2	0	0	0	0	110	K603 L633 F639	K603-T636 WeakPolarHBondContact CE-O 3.17Å; K603-T636 PolarHBondContact NZ-O 3.01Å; L633-T636 HydrophobicContact CB-CG2 4Å; L633-T636 HydrophobicContact CD1-CG2 4Å; T636-F639 WeakPolarHBondContact CB-O 3.28Å; T636-F639 HydrophobicContact CG2-CD1 4.48Å; T636-F639 HydrophobicContact CG2-CD2 4.19Å; T636-F639 HydrophobicContact CG2-CE1 3.94Å; T636-F639 HydrophobicContact CG2-CE2 3.62Å; T636-F639 HydrophobicContact CG2-CZ 3.48Å; T636-F639 VanDerWaalsContact CG2-CZ 3.48Å; T636-F639 PolarHBondContact OG1-O 3.27Å
637	Q	67	Low	84.8	Confident	165 Å²	165	61.7 Å²	61.7	77%	0.771	31%	0.31	S	S	*	.	S	Bend	trans	-78.2	-26	-177.3	-62.3	-151.4	38.8	0	0	113.2	K603 Y635	K603-Q637 VanDerWaalsContact CD-O 3.28Å; K603-Q637 WeakPolarHBondContact CD-O 3.4Å; K603-Q637 WeakPolarHBondContact CE-O 3.33Å; K603-Q637 PolarHBondContact NZ-O 3.27Å; Y635-Q637 PolarHBondContact O-N 3Å
638	D	83.2	Confident	84.7	Confident	123 Å²	123	60.3 Å²	60.3	66%	0.658	31%	0.305	S	S	*	.	S	Bend	trans	-121.1	-17.8	-169.2	-57.3	-74.3	0	0	0	115.7	K603	K603-D638 WeakPolarHBondContact CG-O 3.04Å; K603-D638 PolarHBondContact N-O 3.33Å
639	F	89.1	Confident	84.6	Confident	60 Å²	60	65.9 Å²	65.9	26%	0.263	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	170.8	-176.4	65.6	-83.9	0	0	0	113.7	E600 V601 T636 I641	E600-F639 HydrophobicContact CB-CD2 4.16Å; E600-F639 HydrophobicContact CG-CD2 4.04Å; E600-F639 HydrophobicContact CG-CE2 4.14Å; E600-F639 VanDerWaalsContact OE1-CE2 3.32Å; E600-F639 WeakPolarHBondContact OE1-CE2 3.25Å; V601-F639 CarbonylContact O-C 3.57Å; V601-F639 WeakPolarHBondContact O-CA 3.19Å; T636-F639 WeakPolarHBondContact CB-O 3.28Å; T636-F639 HydrophobicContact CG2-CD1 4.48Å; T636-F639 HydrophobicContact CG2-CD2 4.19Å; T636-F639 HydrophobicContact CG2-CE1 3.94Å; T636-F639 HydrophobicContact CG2-CE2 3.62Å; T636-F639 HydrophobicContact CG2-CZ 3.48Å; T636-F639 VanDerWaalsContact CG2-CZ 3.48Å; T636-F639 PolarHBondContact OG1-O 3.27Å; F639-I641 HydrophobicContact CD2-CD1 4Å; F639-I641 HydrophobicContact CE2-CD1 3.85Å
640	Q	91.3	Very high	84.7	Confident	29 Å²	29	64.6 Å²	64.6	14%	0.136	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	158.4	170.1	-64.4	-167.1	-11.1	0	0	109.8	V601 K603 V606 I630 T632	V601-Q640 PolarHBondContact N-O 2.93Å; V601-Q640 PolarHBondContact O-N 3.25Å; K603-Q640 HydrophobicContact CG-CG 4.36Å; V606-Q640 HydrophobicContact CG2-CB 3.93Å; V606-Q640 HydrophobicContact CG2-CG 4.1Å; I630-Q640 HydrophobicContact CG2-CB 3.99Å; T632-Q640 PolarHBondContact OG1-NE2 2.67Å; T632-Q640 PolarHBondContact OG1-OE1 2.82Å
641	I	92.3	Very high	84.8	Confident	12 Å²	12	62.8 Å²	62.8	6%	0.062	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	129.2	-179.1	-51.6	-52.5	0	0	0	110.1	E598 E600 I630 S631 L633 F639 I670	E598-I641 HydrophobicContact CB-CG2 3.92Å; E598-I641 HydrophobicContact CG-CG2 4.49Å; E598-I641 WeakPolarHBondContact OE2-CG2 3.46Å; E600-I641 HydrophobicContact CG-CD1 4.14Å; I630-I641 CarbonylContact C-O 3.6Å; I630-I641 VanDerWaalsContact CA-O 3.25Å; I630-I641 WeakPolarHBondContact CA-O 3.49Å; S631-I641 PolarHBondContact N-O 3.41Å; S631-I641 PolarHBondContact O-N 3.4Å; L633-I641 HydrophobicContact CD1-CD1 4.49Å; L633-I641 HydrophobicContact CD1-CG1 3.79Å; L633-I641 HydrophobicContact CG-CG1 4.43Å; F639-I641 HydrophobicContact CD2-CD1 4Å; F639-I641 HydrophobicContact CE2-CD1 3.85Å; I641-I670 HydrophobicContact CD1-CD1 3.75Å; I641-I670 HydrophobicContact CG2-CD1 4.25Å
642	C	94.9	Very high	85.1	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	112.6	168.7	178.9	0	0	0	0	109.7	E598 I599 V601 L609 I630	E598-C642 WeakPolarHBondContact CA-O 3.25Å; I599-C642 HydrophobicContact CD1-CB 4.36Å; I599-C642 HydrophobicContact CG1-CB 3.78Å; I599-C642 PolarHBondContact N-O 3.07Å; I599-C642 PolarHBondContact O-N 3Å; V601-C642 HydrophobicContact CG2-CB 3.52Å; L609-C642 HydrophobicContact CD2-CB 4.23Å; I630-C642 HydrophobicContact CG1-CB 4Å
643	H	94.6	Very high	86	Confident	17 Å²	17	64.1 Å²	64.1	8%	0.079	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.1	177.6	-50	-100.1	0	0	0	109.6	E598 I628 Y629 S631	E598-H643 VanDerWaalsContact CD-CE1 3.45Å; E598-H643 IonicContact OE1-CE1 1.91Å; E598-H643 PolarHBondContact OE1-CE1 2.94Å; E598-H643 IonicContact OE1-CG 3.33Å; E598-H643 IonicContact OE1-ND1 3.9Å; E598-H643 PolarHBondContact OE1-ND1 2.84Å; E598-H643 IonicContact OE2-CE1 2.76Å; E598-H643 PolarHBondContact OE2-CE1 3.42Å; E598-H643 IonicContact OE2-ND1 2.41Å; E598-H643 PolarHBondContact OE2-ND1 3.25Å; I628-H643 VanDerWaalsContact CA-O 3.31Å; I628-H643 WeakPolarHBondContact CA-O 3.47Å; Y629-H643 HydrophobicContact CD1-CB 4.04Å; Y629-H643 HydrophobicContact CD2-CB 4.13Å; Y629-H643 AromaticContact CD2-CD2 3.53Å; Y629-H643 AromaticContact CD2-CG 3.98Å; Y629-H643 HydrophobicContact CE1-CB 3.64Å; Y629-H643 HydrophobicContact CE2-CB 3.74Å; Y629-H643 AromaticContact CE2-CD2 3.19Å; Y629-H643 WeakPolarHBondContact CE2-CD2 3.35Å; Y629-H643 AromaticContact CE2-CG 3.37Å; Y629-H643 AromaticContact CE2-NE2 3.79Å; Y629-H643 HydrophobicContact CG-CB 4.27Å; Y629-H643 VanDerWaalsContact CZ-CB 3.46Å; Y629-H643 AromaticContact CZ-CD2 3.84Å; Y629-H643 AromaticContact CZ-CG 3.49Å; Y629-H643 VanDerWaalsContact CZ-CG 3.49Å; Y629-H643 PolarHBondContact N-O 2.86Å; Y629-H643 VanDerWaalsContact N-O 3.09Å; Y629-H643 PolarHBondContact O-N 2.66Å; S631-H643 WeakPolarHBondContact CB-NE2 3.37Å; S631-H643 PolarHBondContact OG-CD2 2.88Å; S631-H643 VanDerWaalsContact OG-CD2 3.27Å; S631-H643 PolarHBondContact OG-NE2 3.45Å
644	I	96.4	Very high	87.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	110	178.8	-53.5	176.5	0	0	0	107.4	W597 I599 A626 I628 V651 A654 L655 I658	W597-I644 HydrophobicContact CB-CB 4.39Å; W597-I644 PolarHBondContact N-O 2.81Å; W597-I644 WeakPolarHBondContact O-CB 3.36Å; W597-I644 PolarHBondContact O-N 3.28Å; I599-I644 HydrophobicContact CD1-CD1 4.21Å; A626-I644 HydrophobicContact CB-CG2 3.86Å; I628-I644 HydrophobicContact CG1-CG1 4.34Å; I628-I644 HydrophobicContact CG1-CG2 4.18Å; I644-V651 HydrophobicContact CG2-CB 4.45Å; I644-V651 HydrophobicContact CG2-CG1 4.39Å; I644-V651 HydrophobicContact CG2-CG2 4.17Å; I644-A654 HydrophobicContact CD1-CB 4.4Å; I644-A654 HydrophobicContact CG2-CB 3.71Å; I644-L655 HydrophobicContact CD1-CD2 3.73Å; I644-L655 HydrophobicContact CD1-CG 4.38Å; I644-I658 HydrophobicContact CD1-CD1 3.68Å
645	E	94.2	Very high	89.2	Confident	38 Å²	38	55.9 Å²	55.9	18%	0.178	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.2	-173.6	176.4	-171	146.6	0	0	110.4	T595 I596 A626 K627	T595-E645 WeakPolarHBondContact O-CA 3.27Å; I596-E645 HydrophobicContact CG1-CG 4.37Å; A626-E645 CarbonylContact C-O 3.57Å; A626-E645 WeakPolarHBondContact CA-O 3.28Å; K627-E645 HydrophobicContact CB-CB 4.21Å; K627-E645 WeakPolarHBondContact CD-OE2 3.4Å; K627-E645 WeakPolarHBondContact CE-OE2 3.48Å; K627-E645 PolarHBondContact N-O 3.49Å; K627-E645 IonicContact NZ-OE1 3.19Å; K627-E645 PolarHBondContact NZ-OE1 2.88Å; K627-E645 IonicContact NZ-OE2 2.73Å; K627-E645 PolarHBondContact NZ-OE2 2.9Å; K627-E645 PolarHBondContact O-N 2.89Å
646	G	94.6	Very high	91.1	Very high	6 Å²	6	48.3 Å²	48.3	6%	0.062	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.5	-165.8	178.4	0	0	0	0	0	113	L594 T595	L594-G646 CarbonylContact C-O 3.58Å; L594-G646 WeakPolarHBondContact CA-O 3.33Å; T595-G646 PolarHBondContact N-O 2.76Å; T595-G646 PolarHBondContact O-N 2.73Å; T595-G646 VanDerWaalsContact O-N 3.1Å
647	S	94.4	Very high	92.6	Very high	38 Å²	38	48.7 Å²	48.7	27%	0.266	25%	0.245	S	C	.	.			trans	-68.7	158	163.8	64.9	0	0	0	0	110	H649 H650 V651	S647-H649 PolarHBondContact O-N 2.69Å; S647-H650 WeakPolarHBondContact O-CA 3.49Å; S647-H650 WeakPolarHBondContact O-CB 3.4Å; S647-H650 PolarHBondContact O-N 3.11Å; S647-H650 PolarHBondContact OG-CD2 3.46Å; S647-H650 VanDerWaalsContact OG-CG 3.29Å; S647-H650 PolarHBondContact OG-N 2.91Å; S647-V651 PolarHBondContact O-N 3.43Å
648	Q	92.4	Very high	93.9	Very high	85 Å²	85	40.9 Å²	40.9	40%	0.397	21%	0.208	S	C	.	.	H	α-helix	trans	-49.3	-46.5	178.1	-168.9	59.8	42.3	0	0	112.3	T595 H650 V651 D652	T595-Q648 VanDerWaalsContact CG2-OE1 3.3Å; T595-Q648 PolarHBondContact OG1-OE1 3Å; Q648-H650 VanDerWaalsContact C-N 3.32Å; Q648-H650 PolarHBondContact O-N 3.24Å; Q648-V651 WeakPolarHBondContact O-CB 3.47Å; Q648-V651 PolarHBondContact O-N 2.96Å; Q648-V651 VanDerWaalsContact O-N 3.12Å; Q648-D652 PolarHBondContact NE2-OD1 3.31Å; Q648-D652 WeakPolarHBondContact O-CB 3.44Å; Q648-D652 PolarHBondContact O-N 3.04Å
649	H	94.1	Very high	94.4	Very high	120 Å²	120	36 Å²	36	56%	0.556	19%	0.187	S	C	*	.	H	α-helix	trans	-59.9	-34.9	175.9	172.9	-111.5	0	0	0	113.9	S647 K653	S647-H649 PolarHBondContact O-N 2.69Å; H649-K653 WeakPolarHBondContact O-CB 3.46Å; H649-K653 PolarHBondContact O-N 3.37Å; H649-K653 VanDerWaalsContact O-N 3.11Å
650	H	95.6	Very high	94.5	Very high	64 Å²	64	40.2 Å²	40.2	30%	0.296	21%	0.205	S	C	.	.	H	α-helix	trans	-72.6	-38.3	175.2	-64.8	-177.8	0	0	0	111.5	S624 G625 A626 S647 Q648 A654	S624-H650 WeakPolarHBondContact O-CA 3.41Å; S624-H650 WeakPolarHBondContact O-CB 3.37Å; S624-H650 PolarHBondContact O-CD2 2.84Å; G625-H650 PolarHBondContact O-ND1 3.03Å; A626-H650 HydrophobicContact CB-CB 4.12Å; S647-H650 WeakPolarHBondContact O-CA 3.49Å; S647-H650 WeakPolarHBondContact O-CB 3.4Å; S647-H650 PolarHBondContact O-N 3.11Å; S647-H650 PolarHBondContact OG-CD2 3.46Å; S647-H650 VanDerWaalsContact OG-CG 3.29Å; S647-H650 PolarHBondContact OG-N 2.91Å; Q648-H650 VanDerWaalsContact C-N 3.32Å; Q648-H650 PolarHBondContact O-N 3.24Å; H650-A654 WeakPolarHBondContact O-CB 3.33Å; H650-A654 PolarHBondContact O-N 3.07Å
651	V	94.9	Very high	94.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.6	-54	174.3	173.1	0	0	0	0	110.5	T595 W597 I644 S647 Q648 K653 A654 L655	T595-V651 HydrophobicContact CG2-CB 4.44Å; T595-V651 HydrophobicContact CG2-CG1 4.35Å; T595-V651 HydrophobicContact CG2-CG2 4.01Å; W597-V651 HydrophobicContact CB-CG1 3.54Å; W597-V651 HydrophobicContact CD2-CG1 3.96Å; W597-V651 HydrophobicContact CE3-CG1 4.03Å; W597-V651 HydrophobicContact CG-CG1 3.79Å; I644-V651 HydrophobicContact CG2-CB 4.45Å; I644-V651 HydrophobicContact CG2-CG1 4.39Å; I644-V651 HydrophobicContact CG2-CG2 4.17Å; S647-V651 PolarHBondContact O-N 3.43Å; Q648-V651 WeakPolarHBondContact O-CB 3.47Å; Q648-V651 PolarHBondContact O-N 2.96Å; Q648-V651 VanDerWaalsContact O-N 3.12Å; V651-K653 PolarHBondContact O-N 3.36Å; V651-A654 WeakPolarHBondContact O-CA 3.45Å; V651-A654 WeakPolarHBondContact O-CB 3.5Å; V651-A654 PolarHBondContact O-N 3.07Å; V651-L655 HydrophobicContact CG1-CD1 3.78Å; V651-L655 HydrophobicContact CG1-CG 4.28Å; V651-L655 WeakPolarHBondContact O-CG 3.2Å; V651-L655 PolarHBondContact O-N 2.97Å
652	D	94.3	Very high	94.6	Very high	77 Å²	77	42.9 Å²	42.9	41%	0.412	22%	0.216	S	C	.	.	H	α-helix	trans	-55.6	-41	178.5	-60.5	-25.6	0	0	0	111.7	Q648 L655 S656	Q648-D652 PolarHBondContact NE2-OD1 3.31Å; Q648-D652 WeakPolarHBondContact O-CB 3.44Å; Q648-D652 PolarHBondContact O-N 3.04Å; D652-L655 PolarHBondContact O-N 3.39Å; D652-S656 VanDerWaalsContact O-CB 3.27Å; D652-S656 WeakPolarHBondContact O-CB 3.31Å; D652-S656 PolarHBondContact O-N 3.42Å
653	K	96.4	Very high	94.2	Very high	89 Å²	89	52.4 Å²	52.4	39%	0.387	26%	0.257	S	S	.	.	H	α-helix	trans	-68.3	-37	177.4	-167.8	174.4	-176.6	-159	0	112.1	T623 H649 V651 L657	T623-K653 WeakPolarHBondContact O-CE 3.11Å; T623-K653 PolarHBondContact O-NZ 3.48Å; H649-K653 WeakPolarHBondContact O-CB 3.46Å; H649-K653 PolarHBondContact O-N 3.37Å; H649-K653 VanDerWaalsContact O-N 3.11Å; V651-K653 PolarHBondContact O-N 3.36Å; K653-L657 WeakPolarHBondContact O-CD1 3.31Å; K653-L657 VanDerWaalsContact O-CG 3.25Å; K653-L657 WeakPolarHBondContact O-CG 3.38Å; K653-L657 PolarHBondContact O-N 2.81Å
654	A	96.7	Very high	93.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.6	-49.6	172.3	0	0	0	0	0	111.5	A626 I628 I644 H650 V651 S656 L657 I658	A626-A654 HydrophobicContact CB-CB 4.34Å; I628-A654 HydrophobicContact CD1-CB 3.98Å; I644-A654 HydrophobicContact CD1-CB 4.4Å; I644-A654 HydrophobicContact CG2-CB 3.71Å; H650-A654 WeakPolarHBondContact O-CB 3.33Å; H650-A654 PolarHBondContact O-N 3.07Å; V651-A654 WeakPolarHBondContact O-CA 3.45Å; V651-A654 WeakPolarHBondContact O-CB 3.5Å; V651-A654 PolarHBondContact O-N 3.07Å; A654-S656 VanDerWaalsContact C-N 3.33Å; A654-S656 PolarHBondContact O-N 2.98Å; A654-L657 PolarHBondContact O-N 3.09Å; A654-L657 VanDerWaalsContact O-N 3.1Å; A654-I658 WeakPolarHBondContact O-CG1 3.45Å; A654-I658 PolarHBondContact O-N 3.27Å
655	L	95.9	Very high	93.2	Very high	16 Å²	16	58 Å²	58	8%	0.084	28%	0.284	C	S	.	.	H	α-helix	trans	-59	-43.2	178	-65.5	171.3	0	0	0	111.6	W597 I599 I644 V651 D652 L657 I658 G659 L667	W597-L655 HydrophobicContact CD2-CD1 3.82Å; W597-L655 HydrophobicContact CE3-CD1 4.42Å; W597-L655 HydrophobicContact CG-CD1 4.16Å; W597-L655 HydrophobicContact CH2-CD1 4.46Å; W597-L655 HydrophobicContact CZ2-CD1 3.86Å; I599-L655 HydrophobicContact CG2-CD2 4.26Å; I644-L655 HydrophobicContact CD1-CD2 3.73Å; I644-L655 HydrophobicContact CD1-CG 4.38Å; V651-L655 HydrophobicContact CG1-CD1 3.78Å; V651-L655 HydrophobicContact CG1-CG 4.28Å; V651-L655 WeakPolarHBondContact O-CG 3.2Å; V651-L655 PolarHBondContact O-N 2.97Å; D652-L655 PolarHBondContact O-N 3.39Å; L655-L657 VanDerWaalsContact C-N 3.31Å; L655-L657 PolarHBondContact O-N 2.83Å; L655-I658 PolarHBondContact O-N 2.84Å; L655-G659 PolarHBondContact O-N 3.32Å; L655-L667 HydrophobicContact CD2-CB 4.31Å; L655-L667 HydrophobicContact CD2-CD2 3.99Å
656	S	96	Very high	92.9	Very high	54 Å²	54	59.7 Å²	59.7	38%	0.378	30%	0.3	S	S	.	.	H	α-helix	trans	-59.5	-39.3	175.2	-168.7	0	0	0	0	112.6	D652 A654 K660	D652-S656 VanDerWaalsContact O-CB 3.27Å; D652-S656 WeakPolarHBondContact O-CB 3.31Å; D652-S656 PolarHBondContact O-N 3.42Å; A654-S656 VanDerWaalsContact C-N 3.33Å; A654-S656 PolarHBondContact O-N 2.98Å; S656-K660 WeakPolarHBondContact O-CB 3.37Å; S656-K660 VanDerWaalsContact O-CD 3.24Å; S656-K660 WeakPolarHBondContact O-CD 3.44Å; S656-K660 WeakPolarHBondContact O-CG 3.43Å; S656-K660 PolarHBondContact O-N 2.9Å; S656-K660 PolarHBondContact OG-NZ 3.31Å
657	L	95.8	Very high	92.7	Very high	30 Å²	30	61.8 Å²	61.8	16%	0.157	31%	0.31	C	S	.	.	H	α-helix	trans	-71.3	-38.2	176.7	-69.3	166.7	0	0	0	112.1	Y616 F619 L620 T623 K653 A654 L655	Y616-L657 PolarHBondContact OH-O 2.74Å; F619-L657 HydrophobicContact CE1-CD1 4.5Å; F619-L657 HydrophobicContact CE1-CD2 4.17Å; F619-L657 HydrophobicContact CZ-CD2 4.2Å; L620-L657 HydrophobicContact CD2-CB 3.43Å; L620-L657 VanDerWaalsContact CD2-CB 3.43Å; L620-L657 HydrophobicContact CD2-CD1 4.2Å; L620-L657 HydrophobicContact CD2-CG 4.45Å; T623-L657 HydrophobicContact CG2-CD1 3.72Å; T623-L657 HydrophobicContact CG2-CD2 4.48Å; K653-L657 WeakPolarHBondContact O-CD1 3.31Å; K653-L657 VanDerWaalsContact O-CG 3.25Å; K653-L657 WeakPolarHBondContact O-CG 3.38Å; K653-L657 PolarHBondContact O-N 2.81Å; A654-L657 PolarHBondContact O-N 3.09Å; A654-L657 VanDerWaalsContact O-N 3.1Å; L655-L657 VanDerWaalsContact C-N 3.31Å; L655-L657 PolarHBondContact O-N 2.83Å
658	I	95.4	Very high	92.3	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-65.5	-54.8	176.3	-63.4	166.4	0	0	0	109.9	I599 L609 L620 I644 A654 L655 K660 K661 F662 L665 L667	I599-I658 HydrophobicContact CD1-CD1 4.09Å; L609-I658 HydrophobicContact CD1-CG1 4.17Å; L609-I658 HydrophobicContact CD1-CG2 4.26Å; L620-I658 HydrophobicContact CD1-CD1 4.2Å; L620-I658 HydrophobicContact CD1-CG1 3.75Å; L620-I658 HydrophobicContact CD2-CG1 3.98Å; I644-I658 HydrophobicContact CD1-CD1 3.68Å; A654-I658 WeakPolarHBondContact O-CG1 3.45Å; A654-I658 PolarHBondContact O-N 3.27Å; L655-I658 PolarHBondContact O-N 2.84Å; I658-K660 VanDerWaalsContact C-N 3.28Å; I658-K660 PolarHBondContact O-N 3.47Å; I658-K661 CarbonylContact O-C 3.51Å; I658-K661 PolarHBondContact O-N 2.98Å; I658-F662 HydrophobicContact CG2-CB 4.44Å; I658-F662 HydrophobicContact CG2-CD2 3.93Å; I658-F662 WeakPolarHBondContact O-CD2 3.49Å; I658-F662 PolarHBondContact O-N 2.99Å; I658-L665 HydrophobicContact CG2-CD2 4.04Å; I658-L667 HydrophobicContact CB-CD2 4.13Å; I658-L667 HydrophobicContact CG2-CD2 3.75Å
659	G	92	Very high	92.1	Very high	21 Å²	21	61.3 Å²	61.3	22%	0.216	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-32	-178.8	0	0	0	0	0	114.3	L655 K661 F662	L655-G659 PolarHBondContact O-N 3.32Å; G659-K661 PolarHBondContact O-N 3Å; G659-F662 CarbonylContact O-C 3.55Å
660	K	93.3	Very high	91.4	Very high	149 Å²	149	59 Å²	59	65%	0.648	30%	0.301	S	S	*	.	H	α-helix	trans	-61	-26.8	172	-81.4	166.1	-177.1	143.6	0	113.5	S656 I658	S656-K660 WeakPolarHBondContact O-CB 3.37Å; S656-K660 VanDerWaalsContact O-CD 3.24Å; S656-K660 WeakPolarHBondContact O-CD 3.44Å; S656-K660 WeakPolarHBondContact O-CG 3.43Å; S656-K660 PolarHBondContact O-N 2.9Å; S656-K660 PolarHBondContact OG-NZ 3.31Å; I658-K660 VanDerWaalsContact C-N 3.28Å; I658-K660 PolarHBondContact O-N 3.47Å
661	K	91.6	Very high	90.1	Very high	93 Å²	93	63.8 Å²	63.8	40%	0.404	32%	0.318	S	S	.	.	H	α-helix	trans	-106.2	-22.5	-179.7	-175.7	171.9	171.3	-75.2	0	113.5	R608 Y616 I658 G659	R608-K661 PolarHBondContact O-NZ 2.93Å; Y616-K661 HydrophobicContact CD1-CD 4.16Å; Y616-K661 HydrophobicContact CD2-CD 3.97Å; Y616-K661 HydrophobicContact CE1-CD 3.68Å; Y616-K661 HydrophobicContact CE2-CD 3.47Å; Y616-K661 VanDerWaalsContact CE2-CD 3.47Å; Y616-K661 HydrophobicContact CG-CD 4.3Å; I658-K661 CarbonylContact O-C 3.51Å; I658-K661 PolarHBondContact O-N 2.98Å; G659-K661 PolarHBondContact O-N 3Å
662	F	93.6	Very high	88.4	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.018	34%	0.335	C	S	.	.			trans	-130	76.5	-175.4	-62.7	-81.8	0	0	0	110.3	L605 R608 L609 Y616 I658 G659 E664 L665	L605-F662 HydrophobicContact CB-CE1 4.44Å; L605-F662 HydrophobicContact CD2-CE1 4.5Å; R608-F662 HydrophobicContact CB-CE1 3.71Å; R608-F662 HydrophobicContact CB-CZ 3.81Å; L609-F662 HydrophobicContact CB-CE2 4.21Å; L609-F662 HydrophobicContact CB-CZ 3.94Å; L609-F662 HydrophobicContact CD1-CD2 4.26Å; L609-F662 HydrophobicContact CD1-CE2 3.63Å; L609-F662 HydrophobicContact CD1-CZ 4.24Å; Y616-F662 HydrophobicContact CD1-CE2 4.43Å; Y616-F662 HydrophobicContact CE1-CE2 4.06Å; I658-F662 HydrophobicContact CG2-CB 4.44Å; I658-F662 HydrophobicContact CG2-CD2 3.93Å; I658-F662 WeakPolarHBondContact O-CD2 3.49Å; I658-F662 PolarHBondContact O-N 2.99Å; G659-F662 CarbonylContact O-C 3.55Å; F662-E664 PolarHBondContact O-N 3.12Å; F662-L665 HydrophobicContact CB-CB 3.78Å; F662-L665 PolarHBondContact O-N 3.11Å
663	K	86.9	Confident	86	Confident	200 Å²	200	67.6 Å²	67.6	87%	0.87	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-19.1	175.1	-62.8	-174.5	177.9	-174.7	0	113.3
664	E	81.1	Confident	83.5	Confident	120 Å²	120	68.8 Å²	68.8	56%	0.561	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	0.9	-179.4	65.2	-165	161.3	0	0	113.6	L605 R608 F662	L605-E664 HydrophobicContact CD1-CG 3.95Å; L605-E664 HydrophobicContact CD2-CG 4.46Å; L605-E664 WeakPolarHBondContact CD2-OE1 3.24Å; R608-E664 IonicContact CZ-OE1 3.95Å; R608-E664 IonicContact NH1-OE1 2.77Å; R608-E664 PolarHBondContact NH1-OE1 3.37Å; R608-E664 IonicContact NH1-OE2 3.87Å; F662-E664 PolarHBondContact O-N 3.12Å
665	L	88	Confident	80.8	Confident	14 Å²	14	73.6 Å²	73.6	7%	0.073	40%	0.399	C	S	.	.	S	Bend	trans	-116.4	127.9	-170.5	-175.8	137.6	0	0	0	111.5	I599 V601 L605 I658 F662 L667	I599-L665 HydrophobicContact CD1-CD2 4Å; V601-L665 HydrophobicContact CB-CD1 4.34Å; V601-L665 HydrophobicContact CG1-CD1 3.93Å; V601-L665 HydrophobicContact CG2-CD1 4.24Å; L605-L665 HydrophobicContact CD1-CB 4.33Å; L605-L665 HydrophobicContact CD1-CD1 3.89Å; I658-L665 HydrophobicContact CG2-CD2 4.04Å; F662-L665 HydrophobicContact CB-CB 3.78Å; F662-L665 PolarHBondContact O-N 3.11Å; L665-L667 HydrophobicContact CD2-CD2 3.74Å
666	S	86.9	Confident	78.1	Confident	74 Å²	74	78.9 Å²	78.9	52%	0.517	43%	0.434	S	S	.	.			trans	-64.5	132.9	173.9	-174.3	0	0	0	0	110.9	T668	S666-T668 PolarHBondContact OG-OG1 3.23Å
667	L	90.4	Very high	75.4	Confident	50 Å²	50	81.9 Å²	81.9	26%	0.262	46%	0.455	S	S	.	.			trans	-106.9	3.7	178.4	-66.7	177.5	0	0	0	113.1	W597 I599 L655 I658 L665	W597-L667 VanDerWaalsContact CZ2-O 3.32Å; W597-L667 WeakPolarHBondContact CZ2-O 3.31Å; W597-L667 PolarHBondContact NE1-O 2.81Å; I599-L667 HydrophobicContact CD1-CD2 3.98Å; L655-L667 HydrophobicContact CD2-CB 4.31Å; L655-L667 HydrophobicContact CD2-CD2 3.99Å; I658-L667 HydrophobicContact CB-CD2 4.13Å; I658-L667 HydrophobicContact CG2-CD2 3.75Å; L665-L667 HydrophobicContact CD2-CD2 3.74Å
668	T	86.8	Confident	72.4	Confident	96 Å²	96	87.7 Å²	87.7	59%	0.589	49%	0.485	S	S	*	.			trans	-62.7	135.3	179.5	-51.3	0	0	0	0	111	S666 I670	S666-T668 PolarHBondContact OG-OG1 3.23Å; T668-I670 PolarHBondContact O-N 3.05Å
669	N	87.5	Confident	69.5	Low	17 Å²	17	91.2 Å²	91.2	9%	0.091	51%	0.507	C	S	.	.			trans	-69.5	125.5	173.8	-164.7	-8	0	0	0	109.9	I596 W597 E598 Y671 A672	I596-N669 PolarHBondContact O-ND2 2.9Å; I596-N669 VanDerWaalsContact O-ND2 3.14Å; W597-N669 HydrophobicContact CD2-CB 3.61Å; W597-N669 HydrophobicContact CE3-CB 3.94Å; W597-N669 HydrophobicContact CG-CB 4.05Å; W597-N669 HydrophobicContact CH2-CB 4.14Å; W597-N669 HydrophobicContact CZ2-CB 3.83Å; W597-N669 HydrophobicContact CZ3-CB 4.19Å; E598-N669 PolarHBondContact N-OD1 3.07Å; E598-N669 WeakPolarHBondContact O-CA 3.4Å; N669-Y671 PolarHBondContact O-N 2.81Å; N669-Y671 VanDerWaalsContact O-N 3.14Å; N669-Y671 PolarHBondContact OD1-N 2.8Å; N669-A672 HydrophobicContact CB-CB 3.88Å; N669-A672 PolarHBondContact O-N 3.44Å
670	I	79.9	Confident	67	Low	70 Å²	70	94.5 Å²	94.5	36%	0.359	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-27.4	175.5	-61.6	160.8	0	0	0	111.3	E598 E600 I641 T668	E598-I670 HydrophobicContact CB-CB 4.48Å; E598-I670 HydrophobicContact CB-CD1 4.04Å; E598-I670 WeakPolarHBondContact O-CG1 3.45Å; E598-I670 PolarHBondContact O-N 3.49Å; E600-I670 HydrophobicContact CG-CD1 3.66Å; E600-I670 HydrophobicContact CG-CG1 4.07Å; I641-I670 HydrophobicContact CD1-CD1 3.75Å; I641-I670 HydrophobicContact CG2-CD1 4.25Å; T668-I670 PolarHBondContact O-N 3.05Å
671	Y	68.5	Low	64.6	Low	166 Å²	166	91.6 Å²	91.6	65%	0.651	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	12.9	178.2	-59.2	-56.5	0	0	0	114.8	E598 N669	E598-Y671 HydrophobicContact CG-CD2 4.26Å; E598-Y671 HydrophobicContact CG-CE2 4.3Å; N669-Y671 PolarHBondContact O-N 2.81Å; N669-Y671 VanDerWaalsContact O-N 3.14Å; N669-Y671 PolarHBondContact OD1-N 2.8Å
672	A	60	Low	62.5	Low	44 Å²	44	92.5 Å²	92.5	36%	0.364	53%	0.526	S	S	.	.	S	Bend	trans	-65.7	134	165.9	0	0	0	0	0	109.2	N669	N669-A672 HydrophobicContact CB-CB 3.88Å; N669-A672 PolarHBondContact O-N 3.44Å
673	P	44.1	Very low	60.8	Low	113 Å²	113	93.9 Å²	93.9	73%	0.734	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-53.4	133.1	160.8	-21.1	32.6	0	0	0	108.2
674	P	42.9	Very low	59.6	Low	114 Å²	114	88 Å²	88	74%	0.74	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-57.1	143	176.5	24	-33.1	0	0	0	109.3
675	P	40.4	Very low	58.4	Low	101 Å²	101	89.3 Å²	89.3	66%	0.656	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-54.8	145.5	175.2	24.8	-33.9	0	0	0	109.7	S677	P675-S677 PolarHBondContact O-N 2.82Å; P675-S677 VanDerWaalsContact O-N 3.15Å
676	P	39.4	Very low	57.3	Low	126 Å²	126	94.1 Å²	94.1	82%	0.818	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.4	124.5	-172.2	19.4	-32.5	0	0	0	110.5	L678	P676-L678 PolarHBondContact O-N 2.94Å
677	S	38.8	Very low	57.1	Low	118 Å²	118	91.3 Å²	91.3	83%	0.825	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	100.2	-145.7	55.7	0	0	0	0	115.5	P675	P675-S677 PolarHBondContact O-N 2.82Å; P675-S677 VanDerWaalsContact O-N 3.15Å
678	L	33	Very low	56.9	Low	151 Å²	151	91.5 Å²	91.5	79%	0.791	53%	0.531	S	S	*	.			trans	-88.5	102.9	151.5	-65.1	-177.8	0	0	0	107.8	P676	P676-L678 PolarHBondContact O-N 2.94Å
679	T	34	Very low	57.2	Low	74 Å²	74	87.8 Å²	87.8	45%	0.454	51%	0.507	S	S	.	.			trans	56.7	121.4	154.2	55.9	0	0	0	0	119.2	H681	T679-H681 PolarHBondContact O-N 3.01Å; T679-H681 PolarHBondContact OG1-CD2 2.77Å
680	L	39.4	Very low	57.3	Low	91 Å²	91	91 Å²	91	48%	0.476	52%	0.523	S	S	.	.			trans	-75.2	63.3	168.3	-71.3	174.8	0	0	0	111.5	L683	L680-L683 HydrophobicContact CD2-CD2 4.44Å
681	H	43.3	Very low	57.9	Low	88 Å²	88	88 Å²	88	41%	0.407	51%	0.507	S	S	.	.			trans	-92.7	113.2	-177.1	-72.8	-5.9	0	0	0	110.9	T679 E747 V750	T679-H681 PolarHBondContact O-N 3.01Å; T679-H681 PolarHBondContact OG1-CD2 2.77Å; H681-E747 IonicContact CD2-OE2 3.79Å; H681-E747 WeakPolarHBondContact CE1-CB 3.24Å; H681-E747 WeakPolarHBondContact CE1-CG 3.38Å; H681-E747 IonicContact CE1-OE1 2.72Å; H681-E747 PolarHBondContact CE1-OE1 3.37Å; H681-E747 IonicContact CE1-OE2 3.27Å; H681-E747 PolarHBondContact CE1-OE2 3.46Å; H681-E747 IonicContact NE2-OE1 2.66Å; H681-E747 PolarHBondContact NE2-OE1 3.14Å; H681-E747 IonicContact NE2-OE2 3.58Å; H681-E747 PolarHBondContact NE2-OE2 2.83Å; H681-V750 VanDerWaalsContact CE1-CG2 3.45Å; H681-V750 WeakPolarHBondContact CE1-CG2 3.27Å
682	S	48.5	Very low	59	Low	112 Å²	112	82.2 Å²	82.2	78%	0.783	49%	0.49	S	S	*	.	S	Bend	trans	58.8	91.3	-169.1	-159.7	0	0	0	0	112.6
683	L	57.9	Low	60.3	Low	33 Å²	33	85.6 Å²	85.6	17%	0.173	50%	0.502	C	S	.	.			trans	-59.4	143.9	159	-76.3	179.7	0	0	0	109.3	L680 I751 V802 F806	L680-L683 HydrophobicContact CD2-CD2 4.44Å; L683-I751 HydrophobicContact CD1-CD1 4.38Å; L683-I751 HydrophobicContact CD1-CG1 3.61Å; L683-I751 HydrophobicContact CG-CG1 4.38Å; L683-V802 HydrophobicContact CD1-CB 4.45Å; L683-F806 HydrophobicContact CD1-CE2 3.65Å; L683-F806 HydrophobicContact CD1-CZ 3.5Å
684	P	60.9	Low	62.3	Low	75 Å²	75	82.4 Å²	82.4	49%	0.487	49%	0.49	S	S	.	.			trans	-60	154.6	-179.2	27.6	-36.2	0	0	0	111	T686 S687	P684-T686 WeakPolarHBondContact CG-OG1 3.29Å; P684-T686 PolarHBondContact O-N 3.01Å; P684-S687 WeakPolarHBondContact O-CB 3.36Å; P684-S687 PolarHBondContact O-N 2.95Å
685	M	56.4	Low	64.6	Low	148 Å²	148	80.8 Å²	80.8	73%	0.729	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-54.4	-27.5	178	-176.3	176.3	-82.8	0	0	112.8	S687 W688 M690	M685-S687 PolarHBondContact O-N 3.05Å; M685-S687 VanDerWaalsContact O-N 3.14Å; M685-W688 PolarHBondContact O-N 2.96Å; M685-M690 HydrophobicContact CG-CG 4.49Å
686	T	63.8	Low	67.3	Low	116 Å²	116	79.2 Å²	79.2	71%	0.712	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-61.9	-13.9	172.8	55.4	0	0	0	0	114.9	P684 W688	P684-T686 WeakPolarHBondContact CG-OG1 3.29Å; P684-T686 PolarHBondContact O-N 3.01Å; T686-W688 VanDerWaalsContact C-N 3.3Å
687	S	82.3	Confident	70	Confident	15 Å²	15	74.5 Å²	74.5	11%	0.105	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-80.3	-7	171.7	-67.7	0	0	0	0	113.2	P684 M685 P805 F806	P684-S687 WeakPolarHBondContact O-CB 3.36Å; P684-S687 PolarHBondContact O-N 2.95Å; M685-S687 PolarHBondContact O-N 3.05Å; M685-S687 VanDerWaalsContact O-N 3.14Å; S687-P805 CarbonylContact O-C 3.57Å; S687-P805 WeakPolarHBondContact O-CA 3.44Å; S687-F806 WeakPolarHBondContact O-CD2 3.44Å; S687-F806 WeakPolarHBondContact O-CG 3.48Å; S687-F806 PolarHBondContact O-N 3.05Å
688	W	86.9	Confident	72.7	Confident	53 Å²	53	72.5 Å²	72.5	20%	0.201	41%	0.413	C	S	.	.	B	Isolated β-bridge	trans	-108.2	135.3	175.7	-65.4	90.8	0	0	0	110.9	M685 T686 M690 V781 F806	M685-W688 PolarHBondContact O-N 2.96Å; T686-W688 VanDerWaalsContact C-N 3.3Å; W688-M690 VanDerWaalsContact C-N 3.3Å; W688-M690 HydrophobicContact CB-CG 4.49Å; W688-M690 HydrophobicContact CB-SD 3.79Å; W688-M690 PolarHBondContact O-N 2.82Å; W688-V781 HydrophobicContact CH2-CB 4.01Å; W688-V781 HydrophobicContact CH2-CG1 3.72Å; W688-V781 HydrophobicContact CZ3-CB 4.13Å; W688-V781 HydrophobicContact CZ3-CG1 4.33Å; W688-F806 HydrophobicContact CD2-CB 4.18Å; W688-F806 AromaticContact CD2-CD2 3.69Å; W688-F806 HydrophobicContact CD2-CD2 3.69Å; W688-F806 HydrophobicContact CD2-CG 4.43Å; W688-F806 AromaticContact CE2-CD2 3.58Å; W688-F806 HydrophobicContact CE3-CB 3.65Å; W688-F806 AromaticContact CE3-CD2 3.91Å; W688-F806 HydrophobicContact CE3-CD2 3.91Å; W688-F806 HydrophobicContact CE3-CG 4.25Å; W688-F806 HydrophobicContact CG-CD2 4.23Å; W688-F806 HydrophobicContact CH2-CB 4.48Å; W688-F806 AromaticContact CH2-CD2 3.91Å; W688-F806 HydrophobicContact CH2-CD2 3.91Å; W688-F806 HydrophobicContact CH2-CG 4.46Å; W688-F806 AromaticContact CZ2-CD2 3.71Å; W688-F806 HydrophobicContact CZ2-CD2 3.71Å; W688-F806 HydrophobicContact CZ2-CE2 4.14Å; W688-F806 HydrophobicContact CZ3-CB 3.82Å; W688-F806 HydrophobicContact CZ3-CD2 4.02Å; W688-F806 HydrophobicContact CZ3-CG 4.27Å
689	L	93.6	Very high	75.8	Confident	18 Å²	18	65.3 Å²	65.3	9%	0.094	38%	0.375	C	S	.	.			trans	-81.2	79.2	171.4	-176.3	60.1	0	0	0	110	Q714 H717 P805 F806	L689-Q714 HydrophobicContact CD2-CB 4.33Å; L689-H717 VanDerWaalsContact CD1-CE1 3.46Å; L689-H717 WeakPolarHBondContact CD1-CE1 3.38Å; L689-H717 HydrophobicContact CD2-CB 4.25Å; L689-P805 HydrophobicContact CB-CB 4.2Å; L689-F806 VanDerWaalsContact CB-O 3.24Å; L689-F806 WeakPolarHBondContact CB-O 3.47Å; L689-F806 PolarHBondContact N-O 3.28Å
690	M	90	Very high	78.8	Confident	85 Å²	85	63.9 Å²	63.9	42%	0.419	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-60.4	143.4	178.6	-57.7	-53.3	-62.9	0	0	111.8	M685 W688 Q714	M685-M690 HydrophobicContact CG-CG 4.49Å; W688-M690 VanDerWaalsContact C-N 3.3Å; W688-M690 HydrophobicContact CB-CG 4.49Å; W688-M690 HydrophobicContact CB-SD 3.79Å; W688-M690 PolarHBondContact O-N 2.82Å; M690-Q714 PolarHBondContact O-NE2 2.84Å
691	L	92.6	Very high	81.6	Confident	6 Å²	6	60.9 Å²	60.9	3%	0.031	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-70.1	140	163.3	-63.3	173.9	0	0	0	109.1	V697 V699 V712 Q714 A809 V811 V846 I858	L691-V697 HydrophobicContact CD2-CG2 3.87Å; L691-V699 HydrophobicContact CD2-CG1 3.95Å; L691-V712 HydrophobicContact CD1-CG2 3.99Å; L691-V712 HydrophobicContact CD2-CG2 4.27Å; L691-Q714 HydrophobicContact CD2-CG 3.72Å; L691-A809 HydrophobicContact CD1-CB 4.45Å; L691-A809 HydrophobicContact CG-CB 4.08Å; L691-V811 HydrophobicContact CD1-CG1 3.61Å; L691-V846 HydrophobicContact CB-CG2 3.48Å; L691-V846 VanDerWaalsContact CB-CG2 3.48Å; L691-V846 HydrophobicContact CD1-CG2 4.1Å; L691-V846 HydrophobicContact CG-CG2 4.46Å; L691-I858 HydrophobicContact CD1-CG2 4.03Å
692	P	90.5	Very high	84.1	Confident	46 Å²	46	58.9 Å²	58.9	30%	0.299	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-78.5	127.9	-178.7	30	-34.1	0	0	0	113.3	G694 V695 V697	P692-G694 PolarHBondContact O-N 2.88Å; P692-V695 HydrophobicContact CB-CB 4.1Å; P692-V695 HydrophobicContact CG-CB 3.94Å; P692-V695 HydrophobicContact CG-CG1 4.22Å; P692-V695 PolarHBondContact O-N 3.06Å; P692-V697 HydrophobicContact CG-CG1 3.46Å; P692-V697 VanDerWaalsContact CG-CG1 3.46Å; P692-V697 HydrophobicContact CG-CG2 4.46Å
693	D	88.4	Confident	86.4	Confident	114 Å²	114	56.3 Å²	56.3	61%	0.61	32%	0.321	S	S	*	.	B	Isolated β-bridge	trans	-48.7	123.4	177.7	-55.5	52.8	0	0	0	112.7	V695	D693-V695 PolarHBondContact O-N 3.42Å
694	G	84.6	Confident	88.2	Confident	46 Å²	46	56.9 Å²	56.9	47%	0.474	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	2.7	174.5	0	0	0	0	0	116	P692 Q845 V846	P692-G694 PolarHBondContact O-N 2.88Å; G694-Q845 PolarHBondContact O-NE2 2.89Å; G694-V846 WeakPolarHBondContact CA-O 3.44Å; G694-V846 PolarHBondContact N-O 2.94Å
695	V	92.5	Very high	89.9	Confident	81 Å²	81	56.3 Å²	56.3	49%	0.491	32%	0.318	S	S	.	.			trans	-104.2	125.9	177.6	175.6	0	0	0	0	109.5	P692 D693 V697	P692-V695 HydrophobicContact CB-CB 4.1Å; P692-V695 HydrophobicContact CG-CB 3.94Å; P692-V695 HydrophobicContact CG-CG1 4.22Å; P692-V695 PolarHBondContact O-N 3.06Å; D693-V695 PolarHBondContact O-N 3.42Å; V695-V697 HydrophobicContact CG1-CG1 4.31Å; V695-V697 PolarHBondContact O-N 3.04Å
696	T	95.6	Very high	91.8	Very high	68 Å²	68	51.4 Å²	51.4	42%	0.417	29%	0.294	S	S	.	.			trans	-70.4	123.2	172.8	-44.8	0	0	0	0	110	L843 A844	T696-L843 HydrophobicContact CG2-CB 3.76Å; T696-L843 HydrophobicContact CG2-CD1 4.47Å; T696-L843 HydrophobicContact CG2-CD2 4.37Å; T696-L843 HydrophobicContact CG2-CG 4.42Å; T696-A844 CarbonylContact C-O 3.58Å; T696-A844 WeakPolarHBondContact CA-O 3.42Å
697	V	96.1	Very high	93.4	Very high	27 Å²	27	45.9 Å²	45.9	16%	0.164	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	154.4	177.5	-71.8	0	0	0	0	111.4	L691 P692 V695 V699 A844	L691-V697 HydrophobicContact CD2-CG2 3.87Å; P692-V697 HydrophobicContact CG-CG1 3.46Å; P692-V697 VanDerWaalsContact CG-CG1 3.46Å; P692-V697 HydrophobicContact CG-CG2 4.46Å; V695-V697 HydrophobicContact CG1-CG1 4.31Å; V695-V697 PolarHBondContact O-N 3.04Å; V697-V699 HydrophobicContact CG2-CG1 4.08Å; V697-A844 PolarHBondContact N-O 2.85Å; V697-A844 PolarHBondContact O-N 2.94Å
698	E	96.8	Very high	94.1	Very high	75 Å²	75	45.4 Å²	45.4	35%	0.35	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	124.6	178	-160.3	-173.8	154	0	0	110.6	H715 T716 A841 L842 L843	E698-H715 VanDerWaalsContact CD-NE2 3.25Å; E698-H715 IonicContact OE1-CD2 3.32Å; E698-H715 IonicContact OE1-CE1 3.11Å; E698-H715 PolarHBondContact OE1-CE1 3.04Å; E698-H715 VanDerWaalsContact OE1-CE1 3.24Å; E698-H715 IonicContact OE1-NE2 3.98Å; E698-H715 PolarHBondContact OE1-NE2 3.45Å; E698-T716 HydrophobicContact CB-CG2 4.21Å; E698-T716 HydrophobicContact CG-CG2 4.49Å; E698-T716 WeakPolarHBondContact OE2-CG2 3.39Å; E698-A841 HydrophobicContact CG-CB 4.2Å; E698-A841 VanDerWaalsContact OE1-CB 3.3Å; E698-A841 WeakPolarHBondContact OE1-CB 2.73Å; E698-L842 CarbonylContact C-O 3.51Å; E698-L842 WeakPolarHBondContact CA-O 3.47Å; E698-L843 HydrophobicContact CB-CD2 4.49Å
699	V	97.8	Very high	94.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	164.1	-174.2	-57.7	0	0	0	0	112.2	L691 V697 V712 Q713 Q714 L842 A844 L860	L691-V699 HydrophobicContact CD2-CG1 3.95Å; V697-V699 HydrophobicContact CG2-CG1 4.08Å; V699-V712 HydrophobicContact CB-CB 4.13Å; V699-V712 HydrophobicContact CG1-CG2 4.42Å; V699-V712 HydrophobicContact CG2-CB 4.25Å; V699-V712 HydrophobicContact CG2-CG1 4.32Å; V699-Q713 CarbonylContact C-O 3.55Å; V699-Q713 VanDerWaalsContact CA-O 3.22Å; V699-Q713 WeakPolarHBondContact CA-O 3.49Å; V699-Q713 WeakPolarHBondContact CB-O 3.5Å; V699-Q714 HydrophobicContact CG1-CG 4.15Å; V699-L842 HydrophobicContact CG2-CB 4.32Å; V699-L842 PolarHBondContact N-O 2.83Å; V699-L842 PolarHBondContact O-N 2.98Å; V699-A844 HydrophobicContact CG1-CB 4.13Å; V699-A844 HydrophobicContact CG2-CB 3.6Å; V699-L860 HydrophobicContact CG2-CD1 4.17Å
700	I	97.4	Very high	94.7	Very high	44 Å²	44	43.5 Å²	43.5	23%	0.226	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	141.7	164.4	54.9	176.2	0	0	0	109.3	V702 V712 Q713 H715 F720	I700-V702 HydrophobicContact CD1-CG1 4.12Å; I700-V702 HydrophobicContact CG1-CG1 4.05Å; I700-V712 CarbonylContact O-C 3.58Å; I700-V712 WeakPolarHBondContact O-CA 3.48Å; I700-Q713 HydrophobicContact CG1-CB 4.06Å; I700-Q713 PolarHBondContact N-O 3.39Å; I700-Q713 PolarHBondContact O-N 2.79Å; I700-H715 HydrophobicContact CD1-CB 4.18Å; I700-H715 HydrophobicContact CG1-CB 4.22Å; I700-H715 HydrophobicContact CG2-CB 4.45Å; I700-F720 HydrophobicContact CD1-CE2 4.09Å; I700-F720 HydrophobicContact CD1-CZ 4.2Å
701	V	97.7	Very high	95.1	Very high	28 Å²	28	39.5 Å²	39.5	17%	0.17	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	124.7	168.3	177.6	0	0	0	0	108.3	M710 V712 T837 L842	V701-M710 HydrophobicContact CG1-CB 4.34Å; V701-M710 HydrophobicContact CG1-SD 4.42Å; V701-M710 HydrophobicContact CG2-SD 3.82Å; V701-V712 HydrophobicContact CG2-CG1 4.01Å; V701-T837 HydrophobicContact CG2-CG2 3.9Å; V701-L842 HydrophobicContact CG2-CD1 4.02Å
702	V	95.9	Very high	95.4	Very high	47 Å²	47	39.3 Å²	39.3	29%	0.285	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-27.8	-177.1	-71.6	0	0	0	0	113.4	I700 F711 Q713 Y783	I700-V702 HydrophobicContact CD1-CG1 4.12Å; I700-V702 HydrophobicContact CG1-CG1 4.05Å; V702-F711 HydrophobicContact CG2-CB 4.02Å; V702-F711 WeakPolarHBondContact CG2-O 3.49Å; V702-F711 PolarHBondContact N-O 2.87Å; V702-Q713 HydrophobicContact CB-CG 4.48Å; V702-Q713 HydrophobicContact CG1-CB 4.13Å; V702-Q713 HydrophobicContact CG1-CG 3.74Å; V702-Q713 HydrophobicContact CG2-CG 3.96Å; V702-Y783 WeakPolarHBondContact CG2-O 3.36Å
703	N	96.9	Very high	95.7	Very high	58 Å²	58	37.5 Å²	37.5	31%	0.31	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	150.5	173.3	-166	-81	0	0	0	109.7	M710 F711 Y783 G785	N703-M710 WeakPolarHBondContact O-CA 3.39Å; N703-M710 WeakPolarHBondContact O-CB 3.37Å; N703-F711 HydrophobicContact CB-CB 4.14Å; N703-F711 HydrophobicContact CB-CD2 4.1Å; N703-F711 HydrophobicContact CB-CG 4.44Å; N703-F711 PolarHBondContact O-N 3.33Å; N703-Y783 WeakPolarHBondContact CB-O 3.46Å; N703-G785 VanDerWaalsContact CG-CA 3.4Å; N703-G785 WeakPolarHBondContact OD1-CA 3.45Å
704	Q	96.3	Very high	96.1	Very high	45 Å²	45	33 Å²	33	21%	0.21	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.7	-179.8	178.7	-174.5	-21.5	0	0	107.7	N706 D830	Q704-N706 WeakPolarHBondContact CG-O 3.25Å; Q704-D830 VanDerWaalsContact NE2-CA 3.33Å; Q704-D830 PolarHBondContact NE2-O 3.44Å
705	V	96.4	Very high	96.6	Very high	62 Å²	62	32.9 Å²	32.9	38%	0.376	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-43.9	174.1	-173.3	0	0	0	0	109.4	H709 F711 Y786	V705-H709 WeakPolarHBondContact CA-O 3.45Å; V705-H709 HydrophobicContact CB-CB 4.27Å; V705-H709 WeakPolarHBondContact CB-O 3.45Å; V705-H709 PolarHBondContact N-O 2.92Å; V705-F711 HydrophobicContact CG2-CD2 4.25Å; V705-F711 HydrophobicContact CG2-CE2 3.7Å; V705-Y786 HydrophobicContact CG2-CD2 4.21Å; V705-Y786 HydrophobicContact CG2-CE2 4.24Å
706	N	96.2	Very high	96.6	Very high	45 Å²	45	33 Å²	33	24%	0.241	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	-179.1	167.2	61.4	67	0	0	0	109.6	Q704 G708 H709 F825 D830	Q704-N706 WeakPolarHBondContact CG-O 3.25Å; N706-G708 PolarHBondContact O-N 2.41Å; N706-G708 WeakPolarHBondContact OD1-CA 3.14Å; N706-G708 PolarHBondContact OD1-N 1.91Å; N706-H709 PolarHBondContact N-O 3.38Å; N706-H709 VanDerWaalsContact N-O 3.07Å; N706-H709 CarbonylContact O-C 3.52Å; N706-H709 PolarHBondContact O-N 3.49Å; N706-H709 PolarHBondContact OD1-N 2.94Å; N706-F825 VanDerWaalsContact OD1-CD2 3.31Å; N706-F825 WeakPolarHBondContact OD1-CD2 3.41Å; N706-D830 VanDerWaalsContact C-OD1 3.24Å; N706-D830 WeakPolarHBondContact CA-OD1 3.5Å; N706-D830 WeakPolarHBondContact CB-OD1 3.31Å
707	A	97.1	Very high	96.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-32.7	-177.2	0	0	0	0	0	114.2	M710 L813 F825 A829 D830 V833	A707-M710 WeakPolarHBondContact O-CE 3.19Å; A707-L813 VanDerWaalsContact O-CD1 3.27Å; A707-L813 WeakPolarHBondContact O-CD1 3.47Å; A707-F825 HydrophobicContact CB-CB 3.94Å; A707-F825 HydrophobicContact CB-CD1 3.9Å; A707-F825 HydrophobicContact CB-CD2 4.43Å; A707-F825 HydrophobicContact CB-CG 3.84Å; A707-A829 HydrophobicContact CB-CB 3.86Å; A707-D830 PolarHBondContact N-OD1 3.28Å; A707-V833 HydrophobicContact CB-CB 4.47Å; A707-V833 HydrophobicContact CB-CG2 3.66Å
708	G	96.3	Very high	96.4	Very high	6 Å²	6	36.3 Å²	36.3	6%	0.062	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-6.5	177.4	0	0	0	0	0	115.1	N706 L812 L813	N706-G708 PolarHBondContact O-N 2.41Å; N706-G708 WeakPolarHBondContact OD1-CA 3.14Å; N706-G708 PolarHBondContact OD1-N 1.91Å; G708-L812 CarbonylContact O-C 3.56Å; G708-L812 VanDerWaalsContact O-CA 3.23Å; G708-L812 WeakPolarHBondContact O-CA 3.32Å; G708-L813 PolarHBondContact O-N 2.91Å
709	H	97.1	Very high	96.2	Very high	31 Å²	31	33.8 Å²	33.8	14%	0.144	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	116.8	-169.3	179.2	-157.1	0	0	0	111.7	V705 N706 E810 L812	V705-H709 WeakPolarHBondContact CA-O 3.45Å; V705-H709 HydrophobicContact CB-CB 4.27Å; V705-H709 WeakPolarHBondContact CB-O 3.45Å; V705-H709 PolarHBondContact N-O 2.92Å; N706-H709 PolarHBondContact N-O 3.38Å; N706-H709 VanDerWaalsContact N-O 3.07Å; N706-H709 CarbonylContact O-C 3.52Å; N706-H709 PolarHBondContact O-N 3.49Å; N706-H709 PolarHBondContact OD1-N 2.94Å; H709-E810 IonicContact CD2-OE1 3.92Å; H709-E810 IonicContact CE1-OE1 2.65Å; H709-E810 PolarHBondContact CE1-OE1 3.1Å; H709-E810 IonicContact NE2-OE1 2.74Å; H709-E810 PolarHBondContact NE2-OE1 2.9Å; H709-L812 HydrophobicContact CB-CD2 3.7Å
710	M	97.6	Very high	96.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	176.3	-169.7	63.7	-169.7	68.7	0	0	112.7	V701 N703 A707 V811 L813 V833 L860	V701-M710 HydrophobicContact CG1-CB 4.34Å; V701-M710 HydrophobicContact CG1-SD 4.42Å; V701-M710 HydrophobicContact CG2-SD 3.82Å; N703-M710 WeakPolarHBondContact O-CA 3.39Å; N703-M710 WeakPolarHBondContact O-CB 3.37Å; A707-M710 WeakPolarHBondContact O-CE 3.19Å; M710-V811 HydrophobicContact CG-CG2 3.5Å; M710-V811 VanDerWaalsContact CG-CG2 3.5Å; M710-V811 PolarHBondContact N-O 2.98Å; M710-V811 WeakPolarHBondContact O-CG2 3.44Å; M710-V811 PolarHBondContact O-N 2.82Å; M710-V811 VanDerWaalsContact O-O 3.13Å; M710-L813 HydrophobicContact CE-CD1 3.94Å; M710-L813 HydrophobicContact CE-CD2 3.96Å; M710-L813 HydrophobicContact CE-CG 3.77Å; M710-L813 HydrophobicContact SD-CD2 4.29Å; M710-V833 HydrophobicContact CE-CG1 3.73Å; M710-L860 HydrophobicContact SD-CD2 4.06Å
711	F	97.9	Very high	95.8	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.6	176.7	-67.7	-99.6	0	0	0	110.2	V702 N703 V705 R779 G785 Y786 A809 E810	V702-F711 HydrophobicContact CG2-CB 4.02Å; V702-F711 WeakPolarHBondContact CG2-O 3.49Å; V702-F711 PolarHBondContact N-O 2.87Å; N703-F711 HydrophobicContact CB-CB 4.14Å; N703-F711 HydrophobicContact CB-CD2 4.1Å; N703-F711 HydrophobicContact CB-CG 4.44Å; N703-F711 PolarHBondContact O-N 3.33Å; V705-F711 HydrophobicContact CG2-CD2 4.25Å; V705-F711 HydrophobicContact CG2-CE2 3.7Å; F711-R779 HydrophobicContact CE1-CG 4.06Å; F711-R779 HydrophobicContact CZ-CG 4.03Å; F711-G785 VanDerWaalsContact CD2-N 3.25Å; F711-Y786 HydrophobicContact CE2-CD2 4.31Å; F711-Y786 AromaticContact CE2-CE2 3.93Å; F711-Y786 HydrophobicContact CE2-CE2 3.93Å; F711-Y786 HydrophobicContact CZ-CD2 4.31Å; F711-Y786 AromaticContact CZ-CE2 3.68Å; F711-Y786 HydrophobicContact CZ-CE2 3.68Å; F711-A809 CarbonylContact C-O 3.13Å; F711-A809 WeakPolarHBondContact CA-O 3.26Å; F711-E810 HydrophobicContact CD1-CB 3.76Å; F711-E810 HydrophobicContact CD1-CG 4.04Å; F711-E810 HydrophobicContact CE1-CB 3.5Å; F711-E810 VanDerWaalsContact CE1-CB 3.5Å; F711-E810 HydrophobicContact CE1-CG 3.55Å; F711-E810 WeakPolarHBondContact CE1-OE2 3.4Å; F711-E810 HydrophobicContact CE2-CG 4.19Å; F711-E810 HydrophobicContact CZ-CB 4.12Å; F711-E810 HydrophobicContact CZ-CG 3.63Å; F711-E810 WeakPolarHBondContact CZ-OE2 3.26Å
712	V	98.1	Very high	95.6	Very high	1 Å²	1	43 Å²	43	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.6	-177.9	-59.5	0	0	0	0	112.3	L691 V699 I700 V701 A809 V811	L691-V712 HydrophobicContact CD1-CG2 3.99Å; L691-V712 HydrophobicContact CD2-CG2 4.27Å; V699-V712 HydrophobicContact CB-CB 4.13Å; V699-V712 HydrophobicContact CG1-CG2 4.42Å; V699-V712 HydrophobicContact CG2-CB 4.25Å; V699-V712 HydrophobicContact CG2-CG1 4.32Å; I700-V712 CarbonylContact O-C 3.58Å; I700-V712 WeakPolarHBondContact O-CA 3.48Å; V701-V712 HydrophobicContact CG2-CG1 4.01Å; V712-A809 HydrophobicContact CG2-CB 4.11Å; V712-A809 PolarHBondContact N-O 3.29Å; V712-A809 PolarHBondContact O-N 3.28Å; V712-V811 HydrophobicContact CG1-CG2 4.07Å; V712-V811 HydrophobicContact CG2-CG1 3.79Å; V712-V811 HydrophobicContact CG2-CG2 4.37Å
713	Q	97.6	Very high	95.6	Very high	9 Å²	9	41 Å²	41	4%	0.042	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135.8	171.2	-72.5	-177.1	-19.7	0	0	110.4	V699 I700 V702 H715 F720 D782 Q807	V699-Q713 CarbonylContact C-O 3.55Å; V699-Q713 VanDerWaalsContact CA-O 3.22Å; V699-Q713 WeakPolarHBondContact CA-O 3.49Å; V699-Q713 WeakPolarHBondContact CB-O 3.5Å; I700-Q713 HydrophobicContact CG1-CB 4.06Å; I700-Q713 PolarHBondContact N-O 3.39Å; I700-Q713 PolarHBondContact O-N 2.79Å; V702-Q713 HydrophobicContact CB-CG 4.48Å; V702-Q713 HydrophobicContact CG1-CB 4.13Å; V702-Q713 HydrophobicContact CG1-CG 3.74Å; V702-Q713 HydrophobicContact CG2-CG 3.96Å; Q713-H715 PolarHBondContact O-N 2.84Å; Q713-F720 HydrophobicContact CB-CD2 4.44Å; Q713-F720 HydrophobicContact CB-CE2 4.46Å; Q713-F720 VanDerWaalsContact OE1-CE2 3.28Å; Q713-D782 PolarHBondContact NE2-O 3Å; Q713-Q807 HydrophobicContact CG-CB 4.35Å
714	Q	96.7	Very high	95.4	Very high	19 Å²	19	47.6 Å²	47.6	9%	0.089	24%	0.241	C	C	.	.			trans	-77.2	84	171.2	-65.5	178.2	61.5	0	0	109.6	L689 M690 L691 V699 T716 H717	L689-Q714 HydrophobicContact CD2-CB 4.33Å; M690-Q714 PolarHBondContact O-NE2 2.84Å; L691-Q714 HydrophobicContact CD2-CG 3.72Å; V699-Q714 HydrophobicContact CG1-CG 4.15Å; Q714-T716 PolarHBondContact O-N 2.91Å; Q714-H717 HydrophobicContact CB-CB 3.81Å; Q714-H717 VanDerWaalsContact O-CB 3.28Å; Q714-H717 WeakPolarHBondContact O-CB 3.36Å; Q714-H717 PolarHBondContact O-N 2.85Å
715	H	93.8	Very high	95.3	Very high	43 Å²	43	48.5 Å²	48.5	20%	0.199	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-23.2	-169.5	82.7	88.6	0	0	0	114.3	E698 I700 Q713 F720	E698-H715 VanDerWaalsContact CD-NE2 3.25Å; E698-H715 IonicContact OE1-CD2 3.32Å; E698-H715 IonicContact OE1-CE1 3.11Å; E698-H715 PolarHBondContact OE1-CE1 3.04Å; E698-H715 VanDerWaalsContact OE1-CE1 3.24Å; E698-H715 IonicContact OE1-NE2 3.98Å; E698-H715 PolarHBondContact OE1-NE2 3.45Å; I700-H715 HydrophobicContact CD1-CB 4.18Å; I700-H715 HydrophobicContact CG1-CB 4.22Å; I700-H715 HydrophobicContact CG2-CB 4.45Å; Q713-H715 PolarHBondContact O-N 2.84Å; H715-F720 HydrophobicContact CB-CD1 4.16Å; H715-F720 HydrophobicContact CB-CD2 4.24Å; H715-F720 HydrophobicContact CB-CE1 3.91Å; H715-F720 HydrophobicContact CB-CE2 3.96Å; H715-F720 HydrophobicContact CB-CG 4.33Å; H715-F720 HydrophobicContact CB-CZ 3.8Å; H715-F720 WeakPolarHBondContact O-CD1 3.4Å; H715-F720 WeakPolarHBondContact O-CG 3.32Å
716	T	94.3	Very high	95.3	Very high	83 Å²	83	46 Å²	46	51%	0.509	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-8.2	174.6	55.6	0	0	0	0	113.9	E698 Q714	E698-T716 HydrophobicContact CB-CG2 4.21Å; E698-T716 HydrophobicContact CG-CG2 4.49Å; E698-T716 WeakPolarHBondContact OE2-CG2 3.39Å; Q714-T716 PolarHBondContact O-N 2.91Å
717	H	94.7	Very high	95.3	Very high	64 Å²	64	45.6 Å²	45.6	30%	0.296	24%	0.235	S	C	.	.	S	Bend	trans	-75.7	138.2	-178.9	-171.4	-101.6	0	0	0	111.3	L689 Q714 T719 F720	L689-H717 VanDerWaalsContact CD1-CE1 3.46Å; L689-H717 WeakPolarHBondContact CD1-CE1 3.38Å; L689-H717 HydrophobicContact CD2-CB 4.25Å; Q714-H717 HydrophobicContact CB-CB 3.81Å; Q714-H717 VanDerWaalsContact O-CB 3.28Å; Q714-H717 WeakPolarHBondContact O-CB 3.36Å; Q714-H717 PolarHBondContact O-N 2.85Å; H717-T719 PolarHBondContact ND1-OG1 2.97Å; H717-T719 PolarHBondContact O-N 3.09Å; H717-F720 VanDerWaalsContact O-CB 3.31Å; H717-F720 WeakPolarHBondContact O-CB 3.32Å; H717-F720 PolarHBondContact O-N 2.93Å
718	P	91.8	Very high	95.2	Very high	102 Å²	102	51.1 Å²	51.1	66%	0.662	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-21.1	-173	-30	37	0	0	0	116.6
719	T	92.9	Very high	95.2	Very high	22 Å²	22	55.8 Å²	55.8	14%	0.135	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-23.5	176.1	54.6	0	0	0	0	113.8	H717 H721 V722 L723 L804 P805 Q807	H717-T719 PolarHBondContact ND1-OG1 2.97Å; H717-T719 PolarHBondContact O-N 3.09Å; T719-H721 VanDerWaalsContact C-N 3.34Å; T719-H721 PolarHBondContact O-N 2.83Å; T719-V722 WeakPolarHBondContact O-CA 3.42Å; T719-V722 WeakPolarHBondContact O-CB 3.38Å; T719-V722 PolarHBondContact O-N 2.91Å; T719-L723 PolarHBondContact O-N 2.79Å; T719-L804 HydrophobicContact CG2-CD1 3.99Å; T719-P805 HydrophobicContact CG2-CG 4.48Å; T719-Q807 VanDerWaalsContact C-OE1 3.28Å; T719-Q807 VanDerWaalsContact CB-OE1 3.29Å; T719-Q807 VanDerWaalsContact OG1-CD 3.31Å; T719-Q807 PolarHBondContact OG1-NE2 3.49Å; T719-Q807 VanDerWaalsContact OG1-NE2 3.14Å; T719-Q807 PolarHBondContact OG1-OE1 2.92Å
720	F	94.8	Very high	95.2	Very high	55 Å²	55	54.3 Å²	54.3	24%	0.241	27%	0.274	C	S	.	.	H	α-helix	trans	-59.3	-44.1	-175.4	173.1	-103.8	0	0	0	111.7	I700 Q713 H715 H717 V722 L723	I700-F720 HydrophobicContact CD1-CE2 4.09Å; I700-F720 HydrophobicContact CD1-CZ 4.2Å; Q713-F720 HydrophobicContact CB-CD2 4.44Å; Q713-F720 HydrophobicContact CB-CE2 4.46Å; Q713-F720 VanDerWaalsContact OE1-CE2 3.28Å; H715-F720 HydrophobicContact CB-CD1 4.16Å; H715-F720 HydrophobicContact CB-CD2 4.24Å; H715-F720 HydrophobicContact CB-CE1 3.91Å; H715-F720 HydrophobicContact CB-CE2 3.96Å; H715-F720 HydrophobicContact CB-CG 4.33Å; H715-F720 HydrophobicContact CB-CZ 3.8Å; H715-F720 WeakPolarHBondContact O-CD1 3.4Å; H715-F720 WeakPolarHBondContact O-CG 3.32Å; H717-F720 VanDerWaalsContact O-CB 3.31Å; H717-F720 WeakPolarHBondContact O-CB 3.32Å; H717-F720 PolarHBondContact O-N 2.93Å; F720-V722 PolarHBondContact O-N 2.85Å; F720-L723 WeakPolarHBondContact O-CB 3.46Å; F720-L723 PolarHBondContact O-N 3.41Å
721	H	91.6	Very high	95.1	Very high	137 Å²	137	59.8 Å²	59.8	63%	0.634	30%	0.295	S	S	*	.	H	α-helix	trans	-68.2	-19.4	176.1	-58.5	-34.5	0	0	0	113.9	T719	T719-H721 VanDerWaalsContact C-N 3.34Å; T719-H721 PolarHBondContact O-N 2.83Å
722	V	93.5	Very high	94.9	Very high	72 Å²	72	63.7 Å²	63.7	44%	0.436	32%	0.319	S	S	.	.	H	α-helix	trans	-79.2	-28.8	177.8	-172.4	0	0	0	0	111.2	T719 F720 R724 S725 L726 L804	T719-V722 WeakPolarHBondContact O-CA 3.42Å; T719-V722 WeakPolarHBondContact O-CB 3.38Å; T719-V722 PolarHBondContact O-N 2.91Å; F720-V722 PolarHBondContact O-N 2.85Å; V722-R724 VanDerWaalsContact C-N 3.32Å; V722-R724 PolarHBondContact O-N 3.06Å; V722-S725 WeakPolarHBondContact O-CB 3.42Å; V722-S725 PolarHBondContact O-N 3.32Å; V722-L726 PolarHBondContact O-N 3.29Å; V722-L726 VanDerWaalsContact O-N 3.12Å; V722-L804 HydrophobicContact CB-CD1 3.82Å; V722-L804 HydrophobicContact CB-CD2 4.46Å; V722-L804 HydrophobicContact CG1-CD1 3.82Å; V722-L804 HydrophobicContact CG1-CD2 4.43Å
723	L	95.9	Very high	94.7	Very high	6 Å²	6	64.5 Å²	64.5	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-51.7	-49.4	177.4	-177.3	61.6	0	0	0	111.3	T719 F720 S725 L726 D727 D782 Y783 L804 Q807	T719-L723 PolarHBondContact O-N 2.79Å; F720-L723 WeakPolarHBondContact O-CB 3.46Å; F720-L723 PolarHBondContact O-N 3.41Å; L723-S725 PolarHBondContact O-N 2.81Å; L723-L726 CarbonylContact O-C 3.52Å; L723-L726 WeakPolarHBondContact O-CA 3.34Å; L723-L726 VanDerWaalsContact O-CB 3.3Å; L723-L726 WeakPolarHBondContact O-CB 3.33Å; L723-L726 PolarHBondContact O-N 2.73Å; L723-D727 WeakPolarHBondContact CD1-OD1 3.14Å; L723-D727 PolarHBondContact O-N 3.07Å; L723-D727 VanDerWaalsContact O-OD1 3.11Å; L723-D782 HydrophobicContact CD1-CB 3.79Å; L723-D782 HydrophobicContact CD2-CB 4.08Å; L723-Y783 HydrophobicContact CD2-CE1 3.89Å; L723-L804 HydrophobicContact CB-CD2 4.33Å; L723-L804 HydrophobicContact CD1-CD2 4.33Å; L723-Q807 HydrophobicContact CB-CG 4.34Å; L723-Q807 HydrophobicContact CD1-CG 4.38Å; L723-Q807 HydrophobicContact CD2-CB 4.32Å; L723-Q807 HydrophobicContact CD2-CG 4.14Å
724	R	93.4	Very high	94.7	Very high	196 Å²	196	64.3 Å²	64.3	74%	0.74	32%	0.323	S	S	*	.	H	α-helix	trans	-54.3	-32.1	177.9	-165.1	-170.7	69.4	163.5	1.4	114.1	V722 D727 Q728	V722-R724 VanDerWaalsContact C-N 3.32Å; V722-R724 PolarHBondContact O-N 3.06Å; R724-D727 WeakPolarHBondContact CA-OD2 3.21Å; R724-Q728 PolarHBondContact O-N 3.5Å
725	S	93.8	Very high	94.5	Very high	64 Å²	64	66.2 Å²	66.2	45%	0.448	34%	0.339	S	S	.	.	H	α-helix	trans	-79	-32.8	175.5	-75.9	0	0	0	0	112.5	V722 L723 Q729	V722-S725 WeakPolarHBondContact O-CB 3.42Å; V722-S725 PolarHBondContact O-N 3.32Å; L723-S725 PolarHBondContact O-N 2.81Å; S725-Q729 VanDerWaalsContact O-CG 3.3Å; S725-Q729 WeakPolarHBondContact O-CG 3.13Å; S725-Q729 PolarHBondContact O-N 2.74Å
726	L	96.4	Very high	94.3	Very high	10 Å²	10	69.4 Å²	69.4	5%	0.052	35%	0.354	C	S	.	.	H	α-helix	trans	-67.2	-43.8	171.3	-179.5	58.5	0	0	0	111.2	V722 L723 Q728 Q729 M730 F801 L804	V722-L726 PolarHBondContact O-N 3.29Å; V722-L726 VanDerWaalsContact O-N 3.12Å; L723-L726 CarbonylContact O-C 3.52Å; L723-L726 WeakPolarHBondContact O-CA 3.34Å; L723-L726 VanDerWaalsContact O-CB 3.3Å; L723-L726 WeakPolarHBondContact O-CB 3.33Å; L723-L726 PolarHBondContact O-N 2.73Å; L726-Q728 VanDerWaalsContact C-N 3.29Å; L726-Q728 PolarHBondContact O-N 3.03Å; L726-Q729 CarbonylContact O-C 3.51Å; L726-Q729 WeakPolarHBondContact O-CA 3.32Å; L726-Q729 WeakPolarHBondContact O-CB 3.24Å; L726-Q729 PolarHBondContact O-N 3.42Å; L726-M730 HydrophobicContact CD1-CG 4.13Å; L726-M730 HydrophobicContact CG-CG 4.18Å; L726-M730 VanDerWaalsContact O-CG 3.29Å; L726-M730 WeakPolarHBondContact O-CG 3.5Å; L726-M730 PolarHBondContact O-N 3.2Å; L726-F801 HydrophobicContact CD1-CB 3.9Å; L726-F801 HydrophobicContact CD1-CD1 3.5Å; L726-F801 HydrophobicContact CD1-CE1 4.24Å; L726-F801 HydrophobicContact CD1-CG 3.86Å; L726-L804 HydrophobicContact CB-CD2 4.38Å; L726-L804 HydrophobicContact CD2-CB 4.04Å; L726-L804 HydrophobicContact CD2-CD2 3.7Å
727	D	95.9	Very high	94	Very high	37 Å²	37	71.5 Å²	71.5	20%	0.198	37%	0.369	C	S	.	.	H	α-helix	trans	-56.3	-44.1	178.4	-53.7	-23.5	0	0	0	111.4	L723 R724 Q729 M730 Y731 Y783	L723-D727 WeakPolarHBondContact CD1-OD1 3.14Å; L723-D727 PolarHBondContact O-N 3.07Å; L723-D727 VanDerWaalsContact O-OD1 3.11Å; R724-D727 WeakPolarHBondContact CA-OD2 3.21Å; D727-Q729 VanDerWaalsContact C-N 3.34Å; D727-Q729 PolarHBondContact O-N 3.08Å; D727-M730 PolarHBondContact O-N 3.42Å; D727-Y731 WeakPolarHBondContact O-CB 3.22Å; D727-Y731 PolarHBondContact O-N 3.41Å; D727-Y783 PolarHBondContact OD1-OH 2.98Å; D727-Y783 PolarHBondContact OD2-OH 3.38Å
728	Q	95.1	Very high	93.6	Very high	115 Å²	115	72.4 Å²	72.4	54%	0.537	40%	0.395	S	S	.	.	H	α-helix	trans	-64.7	-36.9	176.3	-177.7	61.3	96.5	0	0	112.4	R724 L726 V732	R724-Q728 PolarHBondContact O-N 3.5Å; L726-Q728 VanDerWaalsContact C-N 3.29Å; L726-Q728 PolarHBondContact O-N 3.03Å; Q728-V732 WeakPolarHBondContact O-CB 3.38Å; Q728-V732 VanDerWaalsContact O-CG2 3.28Å; Q728-V732 WeakPolarHBondContact O-CG2 3.42Å; Q728-V732 PolarHBondContact O-N 3.26Å; Q728-V732 VanDerWaalsContact O-N 3.14Å
729	Q	95.4	Very high	93.7	Very high	104 Å²	104	69.6 Å²	69.6	49%	0.486	37%	0.374	S	S	.	.	H	α-helix	trans	-72.9	-39.4	176.4	-70.6	172.1	1.6	0	0	112.1	S725 L726 D727 V732 C733 F801	S725-Q729 VanDerWaalsContact O-CG 3.3Å; S725-Q729 WeakPolarHBondContact O-CG 3.13Å; S725-Q729 PolarHBondContact O-N 2.74Å; L726-Q729 CarbonylContact O-C 3.51Å; L726-Q729 WeakPolarHBondContact O-CA 3.32Å; L726-Q729 WeakPolarHBondContact O-CB 3.24Å; L726-Q729 PolarHBondContact O-N 3.42Å; D727-Q729 VanDerWaalsContact C-N 3.34Å; D727-Q729 PolarHBondContact O-N 3.08Å; Q729-V732 PolarHBondContact O-N 3.08Å; Q729-C733 WeakPolarHBondContact O-CB 3.15Å; Q729-C733 PolarHBondContact O-N 2.65Å; Q729-F801 HydrophobicContact CB-CE1 3.74Å; Q729-F801 HydrophobicContact CB-CZ 3.91Å
730	M	97.4	Very high	93.6	Very high	1 Å²	1	72 Å²	72	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-60.1	-52.3	174	-70.8	-76.4	-65.9	0	0	110.2	L726 D727 V732 C733 Y734 A753 W761 W762 R763 F801	L726-M730 HydrophobicContact CD1-CG 4.13Å; L726-M730 HydrophobicContact CG-CG 4.18Å; L726-M730 VanDerWaalsContact O-CG 3.29Å; L726-M730 WeakPolarHBondContact O-CG 3.5Å; L726-M730 PolarHBondContact O-N 3.2Å; D727-M730 PolarHBondContact O-N 3.42Å; M730-V732 PolarHBondContact O-N 3Å; M730-C733 PolarHBondContact O-N 3.26Å; M730-C733 VanDerWaalsContact O-N 3.15Å; M730-Y734 HydrophobicContact CB-CD2 4.43Å; M730-Y734 HydrophobicContact CE-CD2 4.02Å; M730-Y734 HydrophobicContact CE-CE2 3.96Å; M730-Y734 WeakPolarHBondContact O-CB 3.16Å; M730-Y734 VanDerWaalsContact O-CD2 3.29Å; M730-Y734 WeakPolarHBondContact O-CD2 3.12Å; M730-Y734 PolarHBondContact O-N 3.03Å; M730-Y734 HydrophobicContact SD-CD2 4.05Å; M730-Y734 HydrophobicContact SD-CE2 3.67Å; M730-A753 HydrophobicContact CE-CB 3.62Å; M730-W761 HydrophobicContact CB-CB 4.34Å; M730-W761 WeakPolarHBondContact CB-O 3.4Å; M730-W762 VanDerWaalsContact CE-C 3.45Å; M730-W762 WeakPolarHBondContact CE-O 3.34Å; M730-R763 HydrophobicContact CE-CG 3.83Å; M730-R763 HydrophobicContact SD-CG 4.14Å; M730-F801 HydrophobicContact CG-CD2 4.46Å; M730-F801 HydrophobicContact SD-CB 4Å; M730-F801 HydrophobicContact SD-CD2 3.42Å; M730-F801 WeakPolarHBondContact SD-CD2 3.38Å; M730-F801 HydrophobicContact SD-CE2 4.01Å; M730-F801 HydrophobicContact SD-CG 3.87Å
731	Y	95.9	Very high	93.5	Very high	114 Å²	114	72.7 Å²	72.7	45%	0.447	40%	0.399	S	S	.	.	H	α-helix	trans	-56	-48.9	176.2	175.7	-99.7	0	0	0	112.2	D727 C733 S735 G759	D727-Y731 WeakPolarHBondContact O-CB 3.22Å; D727-Y731 PolarHBondContact O-N 3.41Å; Y731-C733 VanDerWaalsContact C-N 3.29Å; Y731-C733 PolarHBondContact O-N 2.86Å; Y731-S735 WeakPolarHBondContact CD2-OG 2.87Å; Y731-S735 WeakPolarHBondContact CE2-OG 3.45Å; Y731-S735 WeakPolarHBondContact O-CB 3.38Å; Y731-S735 PolarHBondContact O-N 2.93Å; Y731-S735 VanDerWaalsContact O-N 3.12Å; Y731-S735 PolarHBondContact O-OG 3.1Å; Y731-S735 VanDerWaalsContact O-OG 3.08Å; Y731-G759 WeakPolarHBondContact CD2-O 3.28Å; Y731-G759 WeakPolarHBondContact CE2-O 3.43Å
732	V	93.9	Very high	93.4	Very high	84 Å²	84	66.4 Å²	66.4	51%	0.509	37%	0.37	S	S	.	.	H	α-helix	trans	-64.3	-32.7	179.1	168.4	0	0	0	0	112.3	Q728 Q729 M730 Q736	Q728-V732 WeakPolarHBondContact O-CB 3.38Å; Q728-V732 VanDerWaalsContact O-CG2 3.28Å; Q728-V732 WeakPolarHBondContact O-CG2 3.42Å; Q728-V732 PolarHBondContact O-N 3.26Å; Q728-V732 VanDerWaalsContact O-N 3.14Å; Q729-V732 PolarHBondContact O-N 3.08Å; M730-V732 PolarHBondContact O-N 3Å; V732-Q736 PolarHBondContact O-NE2 3.47Å
733	C	94.8	Very high	93	Very high	17 Å²	17	67 Å²	67	12%	0.115	38%	0.376	C	S	.	.	H	α-helix	trans	-80.3	-42.6	-179.3	-168.3	0	0	0	0	113.2	Q729 M730 Y731 I739 R798 F801	Q729-C733 WeakPolarHBondContact O-CB 3.15Å; Q729-C733 PolarHBondContact O-N 2.65Å; M730-C733 PolarHBondContact O-N 3.26Å; M730-C733 VanDerWaalsContact O-N 3.15Å; Y731-C733 VanDerWaalsContact C-N 3.29Å; Y731-C733 PolarHBondContact O-N 2.86Å; C733-I739 WeakPolarHBondContact O-CD1 3.41Å; C733-R798 WeakPolarHBondContact SG-CD 3.47Å; C733-F801 HydrophobicContact CB-CE2 3.8Å; C733-F801 HydrophobicContact CB-CZ 4.05Å
734	Y	96.4	Very high	92.3	Very high	5 Å²	5	71.8 Å²	71.8	2%	0.02	41%	0.405	C	S	.	.	H	α-helix	trans	-97.7	-17.2	-167.8	-69.8	-73.5	0	0	0	114.8	M730 Q736 I739 A753 W761 R795 Q796 I797 R798 F801	M730-Y734 HydrophobicContact CB-CD2 4.43Å; M730-Y734 HydrophobicContact CE-CD2 4.02Å; M730-Y734 HydrophobicContact CE-CE2 3.96Å; M730-Y734 WeakPolarHBondContact O-CB 3.16Å; M730-Y734 VanDerWaalsContact O-CD2 3.29Å; M730-Y734 WeakPolarHBondContact O-CD2 3.12Å; M730-Y734 PolarHBondContact O-N 3.03Å; M730-Y734 HydrophobicContact SD-CD2 4.05Å; M730-Y734 HydrophobicContact SD-CE2 3.67Å; Y734-Q736 PolarHBondContact O-N 3.22Å; Y734-I739 HydrophobicContact CD1-CG2 3.72Å; Y734-I739 HydrophobicContact CE1-CG2 3.63Å; Y734-A753 HydrophobicContact CD1-CB 3.7Å; Y734-A753 HydrophobicContact CD2-CB 3.66Å; Y734-A753 HydrophobicContact CE1-CB 3.59Å; Y734-A753 HydrophobicContact CE2-CB 3.56Å; Y734-A753 HydrophobicContact CG-CB 3.76Å; Y734-W761 HydrophobicContact CG-CD2 4.3Å; Y734-W761 HydrophobicContact CG-CE3 4.24Å; Y734-W761 HydrophobicContact CG-CG 4.44Å; Y734-R795 HydrophobicContact CD1-CB 3.58Å; Y734-R795 HydrophobicContact CD1-CG 3.97Å; Y734-R795 HydrophobicContact CE1-CB 3.7Å; Y734-Q796 WeakPolarHBondContact CE1-O 3.34Å; Y734-Q796 PolarHBondContact OH-O 3.01Å; Y734-I797 VanDerWaalsContact OH-CA 3.28Å; Y734-I797 WeakPolarHBondContact OH-CA 3.32Å; Y734-R798 PolarHBondContact OH-N 3.3Å; Y734-F801 AromaticContact CE2-CD2 3.77Å; Y734-F801 HydrophobicContact CE2-CD2 3.77Å; Y734-F801 AromaticContact CE2-CE2 3.71Å; Y734-F801 HydrophobicContact CE2-CE2 3.71Å
735	S	92.6	Very high	91.7	Very high	59 Å²	59	67.1 Å²	67.1	41%	0.413	40%	0.4	S	S	.	.	S	Bend	trans	-71.8	0.6	167.8	-62.5	0	0	0	0	113.6	Y731 W761	Y731-S735 WeakPolarHBondContact CD2-OG 2.87Å; Y731-S735 WeakPolarHBondContact CE2-OG 3.45Å; Y731-S735 WeakPolarHBondContact O-CB 3.38Å; Y731-S735 PolarHBondContact O-N 2.93Å; Y731-S735 VanDerWaalsContact O-N 3.12Å; Y731-S735 PolarHBondContact O-OG 3.1Å; Y731-S735 VanDerWaalsContact O-OG 3.08Å; S735-W761 PolarHBondContact OG-NE1 3.14Å
736	Q	89.1	Confident	91.3	Very high	111 Å²	111	64.6 Å²	64.6	52%	0.519	38%	0.382	S	S	.	.	S	Bend	trans	-89.7	145.3	176.8	-64.2	-174.7	48	0	0	112.2	V732 Y734 I739	V732-Q736 PolarHBondContact O-NE2 3.47Å; Y734-Q736 PolarHBondContact O-N 3.22Å; Q736-I739 WeakPolarHBondContact O-CG1 3.26Å
737	P	89.4	Confident	90.8	Very high	127 Å²	127	68.1 Å²	68.1	83%	0.825	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	155.6	173.2	31.2	-35.6	0	0	0	111.7	I739	P737-I739 PolarHBondContact O-N 3.37Å
738	G	86.5	Confident	90.4	Very high	82 Å²	82	70.6 Å²	70.6	85%	0.845	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	-0.2	173.7	0	0	0	0	0	115.9
739	I	92.3	Very high	90	Very high	44 Å²	44	66 Å²	66	23%	0.226	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-66.2	132.2	171.6	-53.4	-63.4	0	0	0	110	C733 Y734 Q736 P737 T741 R795	C733-I739 WeakPolarHBondContact O-CD1 3.41Å; Y734-I739 HydrophobicContact CD1-CG2 3.72Å; Y734-I739 HydrophobicContact CE1-CG2 3.63Å; Q736-I739 WeakPolarHBondContact O-CG1 3.26Å; P737-I739 PolarHBondContact O-N 3.37Å; I739-T741 PolarHBondContact O-N 3.27Å; I739-R795 HydrophobicContact CG2-CB 4.08Å; I739-R795 HydrophobicContact CG2-CG 4.28Å; I739-R795 WeakPolarHBondContact O-CD 2.99Å
740	P	91.9	Very high	89.8	Confident	72 Å²	72	62.2 Å²	62.2	47%	0.468	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-59.4	135.2	-178.4	-27.1	35.7	0	0	0	114.3	R795 Q796	P740-R795 WeakPolarHBondContact O-CA 3.34Å; P740-Q796 HydrophobicContact CB-CG 4.3Å; P740-Q796 PolarHBondContact O-N 3.32Å
741	T	92.5	Very high	89.7	Confident	70 Å²	70	62.4 Å²	62.4	43%	0.429	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-66	163.6	163	55.4	0	0	0	0	110.6	I739 L794 Q796	I739-T741 PolarHBondContact O-N 3.27Å; T741-L794 WeakPolarHBondContact CA-O 3.39Å; T741-Q796 WeakPolarHBondContact O-CG 3.46Å; T741-Q796 PolarHBondContact O-NE2 3Å
742	L	89.1	Confident	89.8	Confident	5 Å²	5	57 Å²	57	3%	0.026	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-58.5	149.3	169.6	-63.5	-176.8	0	0	0	111.5	V746 V750 C752 V766 L794 Q796	L742-V746 HydrophobicContact CD1-CG2 3.84Å; L742-V750 HydrophobicContact CD2-CG1 4.49Å; L742-C752 HydrophobicContact CD1-CB 3.88Å; L742-C752 HydrophobicContact CD2-CB 3.83Å; L742-C752 HydrophobicContact CG-CB 4.27Å; L742-V766 HydrophobicContact CD1-CG2 4.21Å; L742-L794 HydrophobicContact CD1-CB 3.76Å; L742-L794 HydrophobicContact CD1-CD1 3.69Å; L742-L794 HydrophobicContact CD1-CG 4.4Å; L742-L794 HydrophobicContact CG-CB 3.93Å; L742-Q796 HydrophobicContact CD2-CG 4.1Å
743	P	85.3	Confident	89.9	Confident	85 Å²	85	53 Å²	53	55%	0.552	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-66.1	151.7	169.8	29.9	-34.9	0	0	0	110.8	P745 V746	P743-P745 CarbonylContact O-C 3.49Å; P743-V746 PolarHBondContact O-N 2.72Å
744	T	81.5	Confident	90.1	Very high	105 Å²	105	52.1 Å²	52.1	64%	0.644	33%	0.332	S	S	*	.	S	Bend	trans	-117.3	131.5	178	-51.1	0	0	0	0	109.3	I791	T744-I791 HydrophobicContact CG2-CD1 4.28Å
745	P	80.8	Confident	90	Very high	99 Å²	99	53.9 Å²	53.9	64%	0.643	34%	0.344	S	S	*	.	S	Bend	cis	-65.5	146.6	-1.7	30.1	-36.1	0	0	0	112.4	P743	P743-P745 CarbonylContact O-C 3.49Å
746	V	85.3	Confident	89.9	Confident	10 Å²	10	51.9 Å²	51.9	6%	0.061	33%	0.332	C	S	.	.			trans	-85.9	144.1	170.8	63.6	0	0	0	0	109.3	L742 P743 V766 Y769 V776 I791	L742-V746 HydrophobicContact CD1-CG2 3.84Å; P743-V746 PolarHBondContact O-N 2.72Å; V746-V766 HydrophobicContact CG2-CG1 4.31Å; V746-V766 HydrophobicContact CG2-CG2 3.95Å; V746-Y769 HydrophobicContact CG1-CD2 3.86Å; V746-Y769 HydrophobicContact CG1-CE2 4.15Å; V746-Y769 HydrophobicContact CG1-CG 4.08Å; V746-V776 HydrophobicContact CG1-CG1 3.51Å; V746-I791 HydrophobicContact CB-CD1 3.77Å; V746-I791 HydrophobicContact CB-CG1 4.4Å; V746-I791 HydrophobicContact CG1-CD1 3.66Å; V746-I791 HydrophobicContact CG1-CG1 4.27Å
747	E	85.8	Confident	89.9	Confident	84 Å²	84	52.7 Å²	52.7	39%	0.393	34%	0.339	S	S	.	.			trans	-112.1	148.1	-176.2	-65.4	-176.5	-100.7	0	0	111.1	H681 V750	H681-E747 IonicContact CD2-OE2 3.79Å; H681-E747 WeakPolarHBondContact CE1-CB 3.24Å; H681-E747 WeakPolarHBondContact CE1-CG 3.38Å; H681-E747 IonicContact CE1-OE1 2.72Å; H681-E747 PolarHBondContact CE1-OE1 3.37Å; H681-E747 IonicContact CE1-OE2 3.27Å; H681-E747 PolarHBondContact CE1-OE2 3.46Å; H681-E747 IonicContact NE2-OE1 2.66Å; H681-E747 PolarHBondContact NE2-OE1 3.14Å; H681-E747 IonicContact NE2-OE2 3.58Å; H681-E747 PolarHBondContact NE2-OE2 2.83Å; E747-V750 HydrophobicContact CB-CG2 4.07Å; E747-V750 WeakPolarHBondContact O-CB 3.16Å; E747-V750 VanDerWaalsContact O-CG2 3.26Å; E747-V750 WeakPolarHBondContact O-CG2 3.5Å; E747-V750 PolarHBondContact O-N 3.18Å
748	V	87.4	Confident	89.8	Confident	90 Å²	90	55.1 Å²	55.1	55%	0.545	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	140.7	176.5	173.6	0	0	0	0	109.8	V767	V748-V767 WeakPolarHBondContact CG1-O 3.28Å
749	G	87.9	Confident	89.9	Confident	19 Å²	19	53.3 Å²	53.3	20%	0.196	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-15.7	-175.8	0	0	0	0	0	114.5	Q765 V766	G749-Q765 PolarHBondContact O-NE2 3.3Å; G749-V766 PolarHBondContact N-O 2.86Å
750	V	90.4	Very high	90	Very high	23 Å²	23	52.4 Å²	52.4	14%	0.139	33%	0.326	C	S	.	.			trans	-63	133	179.2	171.3	0	0	0	0	111.3	H681 L742 E747 Q765 V766	H681-V750 VanDerWaalsContact CE1-CG2 3.45Å; H681-V750 WeakPolarHBondContact CE1-CG2 3.27Å; L742-V750 HydrophobicContact CD2-CG1 4.49Å; E747-V750 HydrophobicContact CB-CG2 4.07Å; E747-V750 WeakPolarHBondContact O-CB 3.16Å; E747-V750 VanDerWaalsContact O-CG2 3.26Å; E747-V750 WeakPolarHBondContact O-CG2 3.5Å; E747-V750 PolarHBondContact O-N 3.18Å; V750-Q765 WeakPolarHBondContact O-CA 3.3Å; V750-V766 PolarHBondContact O-N 2.97Å
751	I	95.8	Very high	90.3	Very high	5 Å²	5	50.5 Å²	50.5	3%	0.026	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	136.1	172.8	-48.6	-57.7	0	0	0	110.3	L683 A764 Q765 I797 V802 F806	L683-I751 HydrophobicContact CD1-CD1 4.38Å; L683-I751 HydrophobicContact CD1-CG1 3.61Å; L683-I751 HydrophobicContact CG-CG1 4.38Å; I751-A764 CarbonylContact C-O 3.47Å; I751-A764 WeakPolarHBondContact CA-O 3.28Å; I751-A764 WeakPolarHBondContact CG2-O 3.35Å; I751-Q765 HydrophobicContact CD1-CB 3.68Å; I751-Q765 HydrophobicContact CD1-CG 3.8Å; I751-I797 HydrophobicContact CB-CG2 4.14Å; I751-I797 HydrophobicContact CG2-CD1 3.88Å; I751-I797 HydrophobicContact CG2-CG2 3.99Å; I751-I797 WeakPolarHBondContact O-CG2 3.36Å; I751-V802 HydrophobicContact CG2-CG1 4.04Å; I751-F806 HydrophobicContact CD1-CE2 4.08Å; I751-F806 HydrophobicContact CD1-CZ 3.97Å; I751-F806 HydrophobicContact CG1-CE2 4.43Å; I751-F806 HydrophobicContact CG1-CZ 3.98Å; I751-F806 HydrophobicContact CG2-CE1 4.46Å; I751-F806 HydrophobicContact CG2-CZ 4.18Å
752	C	96.3	Very high	90.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	164.3	-178.8	60	0	0	0	0	111.7	L742 A764 R795	L742-C752 HydrophobicContact CD1-CB 3.88Å; L742-C752 HydrophobicContact CD2-CB 3.83Å; L742-C752 HydrophobicContact CG-CB 4.27Å; C752-A764 PolarHBondContact N-O 2.65Å; C752-A764 PolarHBondContact O-N 2.8Å; C752-A764 PolarHBondContact SG-O 3.14Å; C752-R795 WeakPolarHBondContact CA-O 3.36Å; C752-R795 WeakPolarHBondContact CB-O 3.26Å
753	A	97.9	Very high	90.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	130.4	158.4	0	0	0	0	0	108.8	M730 Y734 W761 W762 R795	M730-A753 HydrophobicContact CE-CB 3.62Å; Y734-A753 HydrophobicContact CD1-CB 3.7Å; Y734-A753 HydrophobicContact CD2-CB 3.66Å; Y734-A753 HydrophobicContact CE1-CB 3.59Å; Y734-A753 HydrophobicContact CE2-CB 3.56Å; Y734-A753 HydrophobicContact CG-CB 3.76Å; A753-W761 HydrophobicContact CB-CE3 4.27Å; A753-W762 WeakPolarHBondContact CA-O 3.28Å; A753-R795 HydrophobicContact CB-CB 4.24Å; A753-R795 PolarHBondContact N-O 2.97Å; A753-R795 PolarHBondContact O-N 3.44Å
754	A	97.4	Very high	91.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	147.2	-178.5	0	0	0	0	0	110.5	G756 W761 W762 A764 I778 Y780 L794	A754-G756 PolarHBondContact O-N 3Å; A754-W761 WeakPolarHBondContact O-CA 3.47Å; A754-W762 PolarHBondContact N-O 2.86Å; A754-W762 PolarHBondContact O-N 3.06Å; A754-A764 HydrophobicContact CB-CB 3.77Å; A754-I778 HydrophobicContact CB-CD1 3.62Å; A754-Y780 HydrophobicContact CB-CE1 3.87Å; A754-L794 HydrophobicContact CB-CD2 3.5Å
755	P	95.2	Very high	92.2	Very high	41 Å²	41	41.5 Å²	41.5	27%	0.266	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	128.5	173.6	30.2	-33.8	0	0	0	109.8	W761 Y780	P755-W761 HydrophobicContact CB-CH2 4.4Å; P755-W761 HydrophobicContact CB-CZ3 4.44Å; P755-Y780 PolarHBondContact O-OH 2.84Å
756	G	91.1	Very high	92.9	Very high	17 Å²	17	36.9 Å²	36.9	18%	0.175	22%	0.216	C	C	.	.			trans	-104	-166.3	177.5	0	0	0	0	0	113.1	A754 A760	A754-G756 PolarHBondContact O-N 3Å; G756-A760 PolarHBondContact N-O 2.9Å
757	L	87.4	Confident	93.3	Very high	128 Å²	128	38.3 Å²	38.3	67%	0.67	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-59.6	150.3	175.7	-64.2	178.1	0	0	0	112	G759 A760 W762	L757-G759 PolarHBondContact O-N 3.24Å; L757-A760 WeakPolarHBondContact O-CB 3.44Å; L757-A760 PolarHBondContact O-N 3.14Å; L757-W762 HydrophobicContact CB-CH2 3.96Å; L757-W762 HydrophobicContact CB-CZ2 4.5Å; L757-W762 HydrophobicContact CD1-CH2 4.17Å; L757-W762 HydrophobicContact CG-CH2 3.95Å; L757-W762 HydrophobicContact CG-CZ3 4.37Å
758	D	88.7	Confident	93.6	Very high	178 Å²	178	35 Å²	35	95%	0.952	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	51.4	24.9	177.3	-59.2	-34	0	0	0	115.8
759	G	88	Confident	93.8	Very high	45 Å²	45	34 Å²	34	46%	0.464	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	80.3	14.2	-178.7	0	0	0	0	0	114.3	Y731 L757	Y731-G759 WeakPolarHBondContact CD2-O 3.28Å; Y731-G759 WeakPolarHBondContact CE2-O 3.43Å; L757-G759 PolarHBondContact O-N 3.24Å
760	A	94.3	Very high	93.8	Very high	24 Å²	24	36.8 Å²	36.8	20%	0.198	21%	0.207	C	C	.	.			trans	-62.6	166.4	168.5	0	0	0	0	0	111.7	G756 L757 W762	G756-A760 PolarHBondContact N-O 2.9Å; L757-A760 WeakPolarHBondContact O-CB 3.44Å; L757-A760 PolarHBondContact O-N 3.14Å; A760-W762 HydrophobicContact CB-CZ2 4.39Å
761	W	97.5	Very high	93.6	Very high	32 Å²	32	43.1 Å²	43.1	12%	0.121	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.4	168.8	-77.6	90	0	0	0	109.2	M730 Y734 S735 A753 A754 P755 T793 R795	M730-W761 HydrophobicContact CB-CB 4.34Å; M730-W761 WeakPolarHBondContact CB-O 3.4Å; Y734-W761 HydrophobicContact CG-CD2 4.3Å; Y734-W761 HydrophobicContact CG-CE3 4.24Å; Y734-W761 HydrophobicContact CG-CG 4.44Å; S735-W761 PolarHBondContact OG-NE1 3.14Å; A753-W761 HydrophobicContact CB-CE3 4.27Å; A754-W761 WeakPolarHBondContact O-CA 3.47Å; P755-W761 HydrophobicContact CB-CH2 4.4Å; P755-W761 HydrophobicContact CB-CZ3 4.44Å; W761-T793 WeakPolarHBondContact CH2-O 3.48Å; W761-R795 HydrophobicContact CH2-CG 3.74Å; W761-R795 HydrophobicContact CZ3-CB 4.37Å; W761-R795 HydrophobicContact CZ3-CG 3.69Å
762	W	97.4	Very high	93.2	Very high	45 Å²	45	51 Å²	51	17%	0.17	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	161.7	-172	-65.4	-24.1	0	0	0	111.4	M730 A753 A754 L757 A760 Y780 Y783	M730-W762 VanDerWaalsContact CE-C 3.45Å; M730-W762 WeakPolarHBondContact CE-O 3.34Å; A753-W762 WeakPolarHBondContact CA-O 3.28Å; A754-W762 PolarHBondContact N-O 2.86Å; A754-W762 PolarHBondContact O-N 3.06Å; L757-W762 HydrophobicContact CB-CH2 3.96Å; L757-W762 HydrophobicContact CB-CZ2 4.5Å; L757-W762 HydrophobicContact CD1-CH2 4.17Å; L757-W762 HydrophobicContact CG-CH2 3.95Å; L757-W762 HydrophobicContact CG-CZ3 4.37Å; A760-W762 HydrophobicContact CB-CZ2 4.39Å; W762-Y780 HydrophobicContact CB-CD1 3.89Å; W762-Y780 HydrophobicContact CB-CE1 4.13Å; W762-Y780 AromaticContact CE3-CD1 3.84Å; W762-Y780 HydrophobicContact CE3-CD1 3.84Å; W762-Y780 AromaticContact CE3-CE1 3.86Å; W762-Y780 HydrophobicContact CE3-CE1 3.86Å; W762-Y780 HydrophobicContact CE3-CG 4.26Å; W762-Y783 HydrophobicContact CB-CE2 4.25Å; W762-Y783 AromaticContact CD1-CE2 3.43Å; W762-Y783 VanDerWaalsContact CD1-CE2 3.43Å; W762-Y783 AromaticContact CD2-CD2 3.69Å; W762-Y783 HydrophobicContact CD2-CD2 3.69Å; W762-Y783 AromaticContact CD2-CE2 3.56Å; W762-Y783 HydrophobicContact CD2-CE2 3.56Å; W762-Y783 AromaticContact CE2-CD2 3.9Å; W762-Y783 AromaticContact CE2-CE2 3.49Å; W762-Y783 VanDerWaalsContact CE2-CE2 3.49Å; W762-Y783 AromaticContact CE3-CD2 3.95Å; W762-Y783 HydrophobicContact CE3-CD2 3.95Å; W762-Y783 HydrophobicContact CE3-CE2 4.28Å; W762-Y783 AromaticContact CG-CD2 3.99Å; W762-Y783 HydrophobicContact CG-CD2 3.99Å; W762-Y783 AromaticContact CG-CE2 3.53Å; W762-Y783 HydrophobicContact CG-CE2 3.53Å; W762-Y783 HydrophobicContact CZ2-CD2 4.34Å; W762-Y783 HydrophobicContact CZ2-CE2 4.17Å; W762-Y783 HydrophobicContact CZ3-CD2 4.37Å; W762-Y783 AromaticContact NE1-CE2 3.38Å; W762-Y783 AromaticContact NE1-CZ 3.79Å
763	R	98.1	Very high	92.9	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.008	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	133.6	173.1	-55	-167.5	-66.4	173.8	3.2	108.7	M730 V781 D782 I797 F801 L804 P805	M730-R763 HydrophobicContact CE-CG 3.83Å; M730-R763 HydrophobicContact SD-CG 4.14Å; R763-V781 HydrophobicContact CB-CG2 3.51Å; R763-V781 PolarHBondContact O-N 3.14Å; R763-V781 VanDerWaalsContact O-N 3.14Å; R763-D782 IonicContact CZ-OD1 2.63Å; R763-D782 IonicContact CZ-OD2 2.73Å; R763-D782 VanDerWaalsContact CZ-OD2 3.32Å; R763-D782 IonicContact NE-OD1 2.9Å; R763-D782 IonicContact NE-OD2 3.7Å; R763-D782 PolarHBondContact NE-OD2 3.12Å; R763-D782 VanDerWaalsContact NH2-CG 3.31Å; R763-D782 IonicContact NH2-OD1 3.88Å; R763-D782 PolarHBondContact NH2-OD1 2.61Å; R763-D782 IonicContact NH2-OD2 2.71Å; R763-D782 PolarHBondContact NH2-OD2 3.1Å; R763-D782 VanDerWaalsContact NH2-OD2 3.11Å; R763-I797 HydrophobicContact CB-CD1 4.19Å; R763-I797 HydrophobicContact CG-CD1 3.73Å; R763-F801 WeakPolarHBondContact CD-O 3.18Å; R763-F801 PolarHBondContact NH1-O 3.21Å; R763-L804 PolarHBondContact NH1-O 2.84Å; R763-L804 PolarHBondContact NH2-O 3.22Å; R763-P805 PolarHBondContact NH2-O 3.18Å
764	A	97.6	Very high	92.5	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	159.6	177.3	0	0	0	0	0	111.1	I751 C752 A754 I778 R779 Y780	I751-A764 CarbonylContact C-O 3.47Å; I751-A764 WeakPolarHBondContact CA-O 3.28Å; I751-A764 WeakPolarHBondContact CG2-O 3.35Å; C752-A764 PolarHBondContact N-O 2.65Å; C752-A764 PolarHBondContact O-N 2.8Å; C752-A764 PolarHBondContact SG-O 3.14Å; A754-A764 HydrophobicContact CB-CB 3.77Å; A764-I778 HydrophobicContact CB-CB 4.18Å; A764-I778 HydrophobicContact CB-CD1 4.03Å; A764-R779 CarbonylContact C-O 3.55Å; A764-R779 VanDerWaalsContact CA-O 3.25Å; A764-R779 WeakPolarHBondContact CA-O 3.25Å; A764-Y780 HydrophobicContact CB-CD1 3.99Å; A764-Y780 HydrophobicContact CB-CE1 4.28Å
765	Q	96.6	Very high	92.4	Very high	30 Å²	30	57.7 Å²	57.7	14%	0.14	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	133.4	174.2	179.8	169.2	49.5	0	0	109.4	G749 V750 I751 V767 I778 R779 V781	G749-Q765 PolarHBondContact O-NE2 3.3Å; V750-Q765 WeakPolarHBondContact O-CA 3.3Å; I751-Q765 HydrophobicContact CD1-CB 3.68Å; I751-Q765 HydrophobicContact CD1-CG 3.8Å; Q765-V767 PolarHBondContact O-N 3.18Å; Q765-I778 CarbonylContact O-C 3.54Å; Q765-I778 VanDerWaalsContact O-CA 3.24Å; Q765-I778 WeakPolarHBondContact O-CA 3.19Å; Q765-R779 PolarHBondContact N-O 2.93Å; Q765-R779 PolarHBondContact O-N 2.93Å; Q765-V781 HydrophobicContact CB-CG1 3.69Å
766	V	95	Very high	92.4	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	121.1	169.8	177.9	0	0	0	0	108.7	L742 V746 G749 V750 V776 I778 L794	L742-V766 HydrophobicContact CD1-CG2 4.21Å; V746-V766 HydrophobicContact CG2-CG1 4.31Å; V746-V766 HydrophobicContact CG2-CG2 3.95Å; G749-V766 PolarHBondContact N-O 2.86Å; V750-V766 PolarHBondContact O-N 2.97Å; V766-V776 HydrophobicContact CG1-CB 4.14Å; V766-V776 HydrophobicContact CG1-CG1 3.89Å; V766-I778 HydrophobicContact CG2-CG2 4.28Å; V766-L794 HydrophobicContact CG2-CD1 4.33Å
767	V	93.4	Very high	92.7	Very high	41 Å²	41	58.4 Å²	58.4	25%	0.248	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-23.1	178.9	-62.2	0	0	0	0	112.9	V748 Q765 E777 R779 Y786	V748-V767 WeakPolarHBondContact CG1-O 3.28Å; Q765-V767 PolarHBondContact O-N 3.18Å; V767-E777 HydrophobicContact CG2-CB 3.83Å; V767-E777 HydrophobicContact CG2-CG 3.66Å; V767-E777 WeakPolarHBondContact CG2-O 3.41Å; V767-E777 PolarHBondContact N-O 2.74Å; V767-R779 HydrophobicContact CG1-CB 3.78Å; V767-Y786 HydrophobicContact CG1-CE1 4.41Å; V767-Y786 HydrophobicContact CG2-CD1 3.97Å; V767-Y786 HydrophobicContact CG2-CE1 3.96Å
768	G	91.8	Very high	93.1	Very high	14 Å²	14	52.3 Å²	52.3	14%	0.144	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	160.1	177.8	0	0	0	0	0	112.8	V776 E777	G768-V776 CarbonylContact O-C 3.59Å; G768-V776 VanDerWaalsContact O-CA 3.26Å; G768-V776 WeakPolarHBondContact O-CA 3.49Å; G768-V776 WeakPolarHBondContact O-CB 3.31Å; G768-E777 PolarHBondContact N-O 3.24Å; G768-E777 PolarHBondContact O-N 2.89Å
769	Y	91.4	Very high	93.5	Very high	69 Å²	69	45.5 Å²	45.5	27%	0.271	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	125.2	179.3	177.5	-133.4	0	0	0	112.1	V746 K771 E775 V776	V746-Y769 HydrophobicContact CG1-CD2 3.86Å; V746-Y769 HydrophobicContact CG1-CE2 4.15Å; V746-Y769 HydrophobicContact CG1-CG 4.08Å; Y769-K771 HydrophobicContact CD1-CG 3.98Å; Y769-K771 HydrophobicContact CE1-CG 3.59Å; Y769-E775 VanDerWaalsContact CD2-O 3.28Å; Y769-E775 WeakPolarHBondContact CD2-O 3.31Å; Y769-V776 HydrophobicContact CD2-CG1 3.64Å; Y769-V776 HydrophobicContact CG-CG1 4.31Å
770	F	89.6	Confident	94	Very high	77 Å²	77	44 Å²	44	34%	0.338	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	102.5	-179.5	-53.2	-82	0	0	0	109.1	E772 S774 E775 E777 R788	F770-E772 PolarHBondContact O-N 3.38Å; F770-S774 WeakPolarHBondContact O-CA 3.36Å; F770-S774 PolarHBondContact O-N 2.8Å; F770-E775 HydrophobicContact CD2-CB 4.48Å; F770-E775 PolarHBondContact N-O 3.01Å; F770-E775 PolarHBondContact O-N 2.73Å; F770-E777 HydrophobicContact CE2-CB 4.03Å; F770-R788 HydrophobicContact CD2-CG 4.08Å; F770-R788 HydrophobicContact CE2-CG 3.84Å
771	K	84.4	Confident	94.1	Very high	157 Å²	157	42.9 Å²	42.9	68%	0.683	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-30.3	-172.6	-70.9	171.5	-178.7	170.8	0	112.4	Y769	Y769-K771 HydrophobicContact CD1-CG 3.98Å; Y769-K771 HydrophobicContact CE1-CG 3.59Å
772	E	87.1	Confident	94.1	Very high	171 Å²	171	41.5 Å²	41.5	80%	0.799	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-35.1	-171.9	-61.4	66.3	-145.6	0	0	112.1	F770	F770-E772 PolarHBondContact O-N 3.38Å
773	S	90.4	Very high	94.1	Very high	53 Å²	53	41.7 Å²	41.7	37%	0.371	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-7.2	176.4	57.8	0	0	0	0	113.9	E775	S773-E775 VanDerWaalsContact CB-OE2 3.28Å; S773-E775 WeakPolarHBondContact CB-OE2 3.46Å; S773-E775 PolarHBondContact O-N 3.02Å; S773-E775 WeakPolarHBondContact OG-CB 3.09Å; S773-E775 VanDerWaalsContact OG-CD 3.29Å; S773-E775 WeakPolarHBondContact OG-CG 3.47Å; S773-E775 PolarHBondContact OG-OE2 3.15Å
774	S	90	Very high	94	Very high	52 Å²	52	41.8 Å²	41.8	36%	0.364	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	32.4	-169.5	-170	0	0	0	0	113.4	F770 I791	F770-S774 WeakPolarHBondContact O-CA 3.36Å; F770-S774 PolarHBondContact O-N 2.8Å; S774-I791 PolarHBondContact O-N 3.33Å; S774-I791 WeakPolarHBondContact OG-CG2 3.45Å
775	E	94.9	Very high	93.8	Very high	34 Å²	34	41.9 Å²	41.9	16%	0.159	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	153.5	177.4	-65.9	165.4	158.9	0	0	110.7	Y769 F770 S773 R788 V789 K790	Y769-E775 VanDerWaalsContact CD2-O 3.28Å; Y769-E775 WeakPolarHBondContact CD2-O 3.31Å; F770-E775 HydrophobicContact CD2-CB 4.48Å; F770-E775 PolarHBondContact N-O 3.01Å; F770-E775 PolarHBondContact O-N 2.73Å; S773-E775 VanDerWaalsContact CB-OE2 3.28Å; S773-E775 WeakPolarHBondContact CB-OE2 3.46Å; S773-E775 PolarHBondContact O-N 3.02Å; S773-E775 WeakPolarHBondContact OG-CB 3.09Å; S773-E775 VanDerWaalsContact OG-CD 3.29Å; S773-E775 WeakPolarHBondContact OG-CG 3.47Å; S773-E775 PolarHBondContact OG-OE2 3.15Å; E775-R788 HydrophobicContact CB-CG 4.25Å; E775-R788 IonicContact OE1-NH2 3.24Å; E775-R788 IonicContact OE2-CZ 3.89Å; E775-R788 IonicContact OE2-NE 3.4Å; E775-R788 PolarHBondContact OE2-NE 3.38Å; E775-R788 IonicContact OE2-NH2 2.74Å; E775-R788 PolarHBondContact OE2-NH2 3.11Å; E775-V789 CarbonylContact C-O 3.52Å; E775-V789 VanDerWaalsContact CA-O 3.25Å; E775-V789 WeakPolarHBondContact CA-O 3.39Å; E775-V789 WeakPolarHBondContact CB-O 3.35Å; E775-K790 HydrophobicContact CG-CG 3.96Å
776	V	95.4	Very high	93.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	151.6	170.4	-75.9	0	0	0	0	109.6	V746 V766 G768 Y769 I778 R788 V789 L794	V746-V776 HydrophobicContact CG1-CG1 3.51Å; V766-V776 HydrophobicContact CG1-CB 4.14Å; V766-V776 HydrophobicContact CG1-CG1 3.89Å; G768-V776 CarbonylContact O-C 3.59Å; G768-V776 VanDerWaalsContact O-CA 3.26Å; G768-V776 WeakPolarHBondContact O-CA 3.49Å; G768-V776 WeakPolarHBondContact O-CB 3.31Å; Y769-V776 HydrophobicContact CD2-CG1 3.64Å; Y769-V776 HydrophobicContact CG-CG1 4.31Å; V776-I778 HydrophobicContact CG2-CG2 4.06Å; V776-R788 CarbonylContact O-C 3.55Å; V776-R788 WeakPolarHBondContact O-CA 3.28Å; V776-V789 HydrophobicContact CG2-CG2 3.92Å; V776-V789 PolarHBondContact N-O 2.71Å; V776-V789 PolarHBondContact O-N 2.73Å; V776-L794 HydrophobicContact CG2-CD1 3.52Å
777	E	96.6	Very high	93.9	Very high	73 Å²	73	48.8 Å²	48.8	34%	0.341	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	129.2	160	-166.1	162.3	-119.2	0	0	108.2	V767 G768 F770 Y786 E787	V767-E777 HydrophobicContact CG2-CB 3.83Å; V767-E777 HydrophobicContact CG2-CG 3.66Å; V767-E777 WeakPolarHBondContact CG2-O 3.41Å; V767-E777 PolarHBondContact N-O 2.74Å; G768-E777 PolarHBondContact N-O 3.24Å; G768-E777 PolarHBondContact O-N 2.89Å; F770-E777 HydrophobicContact CE2-CB 4.03Å; E777-Y786 HydrophobicContact CG-CD1 4.4Å; E777-E787 WeakPolarHBondContact CA-O 3.3Å
778	I	97	Very high	94	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	151.2	174.7	58	163.2	0	0	0	110.6	A754 A764 Q765 V766 V776 Y780 Y786 E787 V789 L794	A754-I778 HydrophobicContact CB-CD1 3.62Å; A764-I778 HydrophobicContact CB-CB 4.18Å; A764-I778 HydrophobicContact CB-CD1 4.03Å; Q765-I778 CarbonylContact O-C 3.54Å; Q765-I778 VanDerWaalsContact O-CA 3.24Å; Q765-I778 WeakPolarHBondContact O-CA 3.19Å; V766-I778 HydrophobicContact CG2-CG2 4.28Å; V776-I778 HydrophobicContact CG2-CG2 4.06Å; I778-Y780 HydrophobicContact CD1-CE1 4.08Å; I778-Y780 HydrophobicContact CD1-CE2 4.31Å; I778-Y786 CarbonylContact O-C 3.57Å; I778-Y786 VanDerWaalsContact O-CA 3.28Å; I778-Y786 WeakPolarHBondContact O-CA 3Å; I778-E787 HydrophobicContact CD1-CB 4.45Å; I778-E787 HydrophobicContact CG1-CB 4.09Å; I778-E787 VanDerWaalsContact CG1-O 3.28Å; I778-E787 WeakPolarHBondContact CG1-O 3.37Å; I778-E787 PolarHBondContact N-O 2.72Å; I778-E787 PolarHBondContact O-N 3.49Å; I778-V789 HydrophobicContact CD1-CG1 4.13Å; I778-V789 HydrophobicContact CD1-CG2 3.95Å; I778-V789 HydrophobicContact CG1-CG1 4.38Å; I778-V789 HydrophobicContact CG1-CG2 4.03Å; I778-V789 HydrophobicContact CG2-CG2 4.14Å; I778-L794 HydrophobicContact CD1-CD2 4.36Å; I778-L794 HydrophobicContact CG2-CD1 3.84Å; I778-L794 HydrophobicContact CG2-CD2 4.42Å
779	R	97.3	Very high	94.2	Very high	36 Å²	36	53.8 Å²	53.8	14%	0.136	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.1	170.6	-178.6	176.4	63.5	147.7	-1.6	108.9	F711 A764 Q765 V767 V781 G785 Y786 E810	F711-R779 HydrophobicContact CE1-CG 4.06Å; F711-R779 HydrophobicContact CZ-CG 4.03Å; A764-R779 CarbonylContact C-O 3.55Å; A764-R779 VanDerWaalsContact CA-O 3.25Å; A764-R779 WeakPolarHBondContact CA-O 3.25Å; Q765-R779 PolarHBondContact N-O 2.93Å; Q765-R779 PolarHBondContact O-N 2.93Å; V767-R779 HydrophobicContact CG1-CB 3.78Å; R779-V781 PolarHBondContact O-N 3.32Å; R779-G785 WeakPolarHBondContact CA-O 3.42Å; R779-Y786 HydrophobicContact CB-CD1 3.93Å; R779-Y786 HydrophobicContact CB-CE1 3.79Å; R779-Y786 HydrophobicContact CG-CD1 4.3Å; R779-Y786 HydrophobicContact CG-CE1 3.93Å; R779-E810 WeakPolarHBondContact CD-OE2 3.38Å; R779-E810 IonicContact CZ-OE2 3.19Å; R779-E810 IonicContact NE-OE2 3.82Å; R779-E810 IonicContact NH1-OE2 2.73Å; R779-E810 PolarHBondContact NH1-OE2 2.99Å
780	Y	97.8	Very high	94.3	Very high	13 Å²	13	55.8 Å²	55.8	5%	0.051	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	117	176.4	-67.5	-76.1	0	0	0	109.8	A754 P755 W762 A764 I778 D782 G784 G785 E787	A754-Y780 HydrophobicContact CB-CE1 3.87Å; P755-Y780 PolarHBondContact O-OH 2.84Å; W762-Y780 HydrophobicContact CB-CD1 3.89Å; W762-Y780 HydrophobicContact CB-CE1 4.13Å; W762-Y780 AromaticContact CE3-CD1 3.84Å; W762-Y780 HydrophobicContact CE3-CD1 3.84Å; W762-Y780 AromaticContact CE3-CE1 3.86Å; W762-Y780 HydrophobicContact CE3-CE1 3.86Å; W762-Y780 HydrophobicContact CE3-CG 4.26Å; A764-Y780 HydrophobicContact CB-CD1 3.99Å; A764-Y780 HydrophobicContact CB-CE1 4.28Å; I778-Y780 HydrophobicContact CD1-CE1 4.08Å; I778-Y780 HydrophobicContact CD1-CE2 4.31Å; Y780-D782 VanDerWaalsContact C-N 3.31Å; Y780-D782 PolarHBondContact O-N 2.85Å; Y780-G784 WeakPolarHBondContact O-CA 3.41Å; Y780-G784 PolarHBondContact O-N 3.44Å; Y780-G785 PolarHBondContact N-O 2.73Å; Y780-G785 VanDerWaalsContact N-O 3.09Å; Y780-E787 HydrophobicContact CE2-CB 4.05Å; Y780-E787 WeakPolarHBondContact CE2-OE2 3.44Å; Y780-E787 PolarHBondContact OH-OE2 3.43Å
781	V	97.4	Very high	94.5	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.006	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-14.4	-167	-57.4	0	0	0	0	113.6	W688 R763 Q765 R779 F806 Q807 G808	W688-V781 HydrophobicContact CH2-CB 4.01Å; W688-V781 HydrophobicContact CH2-CG1 3.72Å; W688-V781 HydrophobicContact CZ3-CB 4.13Å; W688-V781 HydrophobicContact CZ3-CG1 4.33Å; R763-V781 HydrophobicContact CB-CG2 3.51Å; R763-V781 PolarHBondContact O-N 3.14Å; R763-V781 VanDerWaalsContact O-N 3.14Å; Q765-V781 HydrophobicContact CB-CG1 3.69Å; R779-V781 PolarHBondContact O-N 3.32Å; V781-F806 HydrophobicContact CB-CB 3.93Å; V781-F806 HydrophobicContact CB-CD1 3.82Å; V781-F806 HydrophobicContact CB-CD2 4.3Å; V781-F806 HydrophobicContact CB-CE1 4.43Å; V781-F806 HydrophobicContact CB-CG 3.75Å; V781-F806 HydrophobicContact CG2-CB 4.17Å; V781-F806 HydrophobicContact CG2-CD1 3.19Å; V781-F806 HydrophobicContact CG2-CD2 4.47Å; V781-F806 HydrophobicContact CG2-CE1 3.62Å; V781-F806 HydrophobicContact CG2-CG 3.7Å; V781-F806 HydrophobicContact CG2-CZ 4.4Å; V781-F806 WeakPolarHBondContact O-CB 3.49Å; V781-Q807 PolarHBondContact O-N 2.96Å; V781-G808 PolarHBondContact O-N 3.28Å
782	D	97.6	Very high	94.9	Very high	2 Å²	2	50 Å²	50	1%	0.011	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-48.1	175.8	-66.9	-59.3	0	0	0	112.7	Q713 L723 R763 Y780 Q807 G808	Q713-D782 PolarHBondContact NE2-O 3Å; L723-D782 HydrophobicContact CD1-CB 3.79Å; L723-D782 HydrophobicContact CD2-CB 4.08Å; R763-D782 IonicContact CZ-OD1 2.63Å; R763-D782 IonicContact CZ-OD2 2.73Å; R763-D782 VanDerWaalsContact CZ-OD2 3.32Å; R763-D782 IonicContact NE-OD1 2.9Å; R763-D782 IonicContact NE-OD2 3.7Å; R763-D782 PolarHBondContact NE-OD2 3.12Å; R763-D782 VanDerWaalsContact NH2-CG 3.31Å; R763-D782 IonicContact NH2-OD1 3.88Å; R763-D782 PolarHBondContact NH2-OD1 2.61Å; R763-D782 IonicContact NH2-OD2 2.71Å; R763-D782 PolarHBondContact NH2-OD2 3.1Å; R763-D782 VanDerWaalsContact NH2-OD2 3.11Å; Y780-D782 VanDerWaalsContact C-N 3.31Å; Y780-D782 PolarHBondContact O-N 2.85Å; D782-Q807 HydrophobicContact CB-CB 4.41Å; D782-Q807 PolarHBondContact OD1-N 3.22Å; D782-G808 WeakPolarHBondContact O-CA 3.11Å; D782-G808 PolarHBondContact O-N 2.95Å
783	Y	96	Very high	95.3	Very high	50 Å²	50	44.1 Å²	44.1	20%	0.196	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-7.7	-175.7	-48.8	-78.3	0	0	0	114.2	V702 N703 L723 D727 W762	V702-Y783 WeakPolarHBondContact CG2-O 3.36Å; N703-Y783 WeakPolarHBondContact CB-O 3.46Å; L723-Y783 HydrophobicContact CD2-CE1 3.89Å; D727-Y783 PolarHBondContact OD1-OH 2.98Å; D727-Y783 PolarHBondContact OD2-OH 3.38Å; W762-Y783 HydrophobicContact CB-CE2 4.25Å; W762-Y783 AromaticContact CD1-CE2 3.43Å; W762-Y783 VanDerWaalsContact CD1-CE2 3.43Å; W762-Y783 AromaticContact CD2-CD2 3.69Å; W762-Y783 HydrophobicContact CD2-CD2 3.69Å; W762-Y783 AromaticContact CD2-CE2 3.56Å; W762-Y783 HydrophobicContact CD2-CE2 3.56Å; W762-Y783 AromaticContact CE2-CD2 3.9Å; W762-Y783 AromaticContact CE2-CE2 3.49Å; W762-Y783 VanDerWaalsContact CE2-CE2 3.49Å; W762-Y783 AromaticContact CE3-CD2 3.95Å; W762-Y783 HydrophobicContact CE3-CD2 3.95Å; W762-Y783 HydrophobicContact CE3-CE2 4.28Å; W762-Y783 AromaticContact CG-CD2 3.99Å; W762-Y783 HydrophobicContact CG-CD2 3.99Å; W762-Y783 AromaticContact CG-CE2 3.53Å; W762-Y783 HydrophobicContact CG-CE2 3.53Å; W762-Y783 HydrophobicContact CZ2-CD2 4.34Å; W762-Y783 HydrophobicContact CZ2-CE2 4.17Å; W762-Y783 HydrophobicContact CZ3-CD2 4.37Å; W762-Y783 AromaticContact NE1-CE2 3.38Å; W762-Y783 AromaticContact NE1-CZ 3.79Å
784	G	95.7	Very high	95.6	Very high	3 Å²	3	41.6 Å²	41.6	3%	0.031	20%	0.195	C	C	.	.			trans	74	-179.4	-176.8	0	0	0	0	0	114.7	Y780	Y780-G784 WeakPolarHBondContact O-CA 3.41Å; Y780-G784 PolarHBondContact O-N 3.44Å
785	G	95	Very high	95.9	Very high	3 Å²	3	41.7 Å²	41.7	3%	0.031	19%	0.187	C	C	.	.			trans	82.6	164.2	-176.5	0	0	0	0	0	113.5	N703 F711 R779 Y780	N703-G785 VanDerWaalsContact CG-CA 3.4Å; N703-G785 WeakPolarHBondContact OD1-CA 3.45Å; F711-G785 VanDerWaalsContact CD2-N 3.25Å; R779-G785 WeakPolarHBondContact CA-O 3.42Å; Y780-G785 PolarHBondContact N-O 2.73Å; Y780-G785 VanDerWaalsContact N-O 3.09Å
786	Y	96.4	Very high	95.9	Very high	89 Å²	89	44.3 Å²	44.3	35%	0.349	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	144.5	-174.7	-66.5	-89.7	0	0	0	110.9	V705 F711 V767 E777 I778 R779 E810	V705-Y786 HydrophobicContact CG2-CD2 4.21Å; V705-Y786 HydrophobicContact CG2-CE2 4.24Å; F711-Y786 HydrophobicContact CE2-CD2 4.31Å; F711-Y786 AromaticContact CE2-CE2 3.93Å; F711-Y786 HydrophobicContact CE2-CE2 3.93Å; F711-Y786 HydrophobicContact CZ-CD2 4.31Å; F711-Y786 AromaticContact CZ-CE2 3.68Å; F711-Y786 HydrophobicContact CZ-CE2 3.68Å; V767-Y786 HydrophobicContact CG1-CE1 4.41Å; V767-Y786 HydrophobicContact CG2-CD1 3.97Å; V767-Y786 HydrophobicContact CG2-CE1 3.96Å; E777-Y786 HydrophobicContact CG-CD1 4.4Å; I778-Y786 CarbonylContact O-C 3.57Å; I778-Y786 VanDerWaalsContact O-CA 3.28Å; I778-Y786 WeakPolarHBondContact O-CA 3Å; R779-Y786 HydrophobicContact CB-CD1 3.93Å; R779-Y786 HydrophobicContact CB-CE1 3.79Å; R779-Y786 HydrophobicContact CG-CD1 4.3Å; R779-Y786 HydrophobicContact CG-CE1 3.93Å; Y786-E810 VanDerWaalsContact OH-CD 3.26Å; Y786-E810 PolarHBondContact OH-OE1 2.78Å; Y786-E810 PolarHBondContact OH-OE2 3.33Å; Y786-E810 VanDerWaalsContact OH-OE2 3.1Å
787	E	96.2	Very high	95.9	Very high	87 Å²	87	45.3 Å²	45.3	41%	0.407	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	141.8	175.5	-164.4	-179.3	161.7	0	0	110.9	E777 I778 Y780 V789	E777-E787 WeakPolarHBondContact CA-O 3.3Å; I778-E787 HydrophobicContact CD1-CB 4.45Å; I778-E787 HydrophobicContact CG1-CB 4.09Å; I778-E787 VanDerWaalsContact CG1-O 3.28Å; I778-E787 WeakPolarHBondContact CG1-O 3.37Å; I778-E787 PolarHBondContact N-O 2.72Å; I778-E787 PolarHBondContact O-N 3.49Å; Y780-E787 HydrophobicContact CE2-CB 4.05Å; Y780-E787 WeakPolarHBondContact CE2-OE2 3.44Å; Y780-E787 PolarHBondContact OH-OE2 3.43Å; E787-V789 HydrophobicContact CB-CG1 4.27Å; E787-V789 HydrophobicContact CG-CG1 3.75Å
788	R	96.1	Very high	95.6	Very high	147 Å²	147	47.5 Å²	47.5	56%	0.555	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100	109.3	174.3	-156	-179.1	89.1	-142.7	5	110.2	F770 E775 V776	F770-R788 HydrophobicContact CD2-CG 4.08Å; F770-R788 HydrophobicContact CE2-CG 3.84Å; E775-R788 HydrophobicContact CB-CG 4.25Å; E775-R788 IonicContact OE1-NH2 3.24Å; E775-R788 IonicContact OE2-CZ 3.89Å; E775-R788 IonicContact OE2-NE 3.4Å; E775-R788 PolarHBondContact OE2-NE 3.38Å; E775-R788 IonicContact OE2-NH2 2.74Å; E775-R788 PolarHBondContact OE2-NH2 3.11Å; V776-R788 CarbonylContact O-C 3.55Å; V776-R788 WeakPolarHBondContact O-CA 3.28Å
789	V	95.5	Very high	95.2	Very high	12 Å²	12	52.4 Å²	52.4	7%	0.073	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	160.8	-173.1	-56.9	0	0	0	0	111.1	E775 V776 I778 E787 L794	E775-V789 CarbonylContact C-O 3.52Å; E775-V789 VanDerWaalsContact CA-O 3.25Å; E775-V789 WeakPolarHBondContact CA-O 3.39Å; E775-V789 WeakPolarHBondContact CB-O 3.35Å; V776-V789 HydrophobicContact CG2-CG2 3.92Å; V776-V789 PolarHBondContact N-O 2.71Å; V776-V789 PolarHBondContact O-N 2.73Å; I778-V789 HydrophobicContact CD1-CG1 4.13Å; I778-V789 HydrophobicContact CD1-CG2 3.95Å; I778-V789 HydrophobicContact CG1-CG1 4.38Å; I778-V789 HydrophobicContact CG1-CG2 4.03Å; I778-V789 HydrophobicContact CG2-CG2 4.14Å; E787-V789 HydrophobicContact CB-CG1 4.27Å; E787-V789 HydrophobicContact CG-CG1 3.75Å; V789-L794 HydrophobicContact CG2-CD1 4.15Å; V789-L794 HydrophobicContact CG2-CD2 3.92Å; V789-L794 HydrophobicContact CG2-CG 4.03Å
790	K	94.6	Very high	94.7	Very high	112 Å²	112	53.8 Å²	53.8	49%	0.487	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	146.1	173.5	-64.7	-177.8	177.2	-176	0	111.4	E775 D792 T793	E775-K790 HydrophobicContact CG-CG 3.96Å; K790-D792 WeakPolarHBondContact CB-OD1 3.25Å; K790-D792 PolarHBondContact O-N 2.93Å; K790-D792 VanDerWaalsContact O-N 3.1Å; K790-T793 HydrophobicContact CB-CG2 4.42Å; K790-T793 PolarHBondContact O-N 3.3Å; K790-T793 VanDerWaalsContact O-N 3.12Å; K790-T793 PolarHBondContact O-OG1 3.42Å
791	I	93.4	Very high	94.5	Very high	15 Å²	15	53.4 Å²	53.4	8%	0.077	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.5	177.7	-167.4	176.5	0	0	0	113.5	T744 V746 S774 L794	T744-I791 HydrophobicContact CG2-CD1 4.28Å; V746-I791 HydrophobicContact CB-CD1 3.77Å; V746-I791 HydrophobicContact CB-CG1 4.4Å; V746-I791 HydrophobicContact CG1-CD1 3.66Å; V746-I791 HydrophobicContact CG1-CG1 4.27Å; S774-I791 PolarHBondContact O-N 3.33Å; S774-I791 WeakPolarHBondContact OG-CG2 3.45Å; I791-L794 PolarHBondContact O-N 3.43Å
792	D	93.1	Very high	94.3	Very high	96 Å²	96	54.3 Å²	54.3	51%	0.513	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.8	-178.4	69.2	-26.5	0	0	0	114.5	K790 R795	K790-D792 WeakPolarHBondContact CB-OD1 3.25Å; K790-D792 PolarHBondContact O-N 2.93Å; K790-D792 VanDerWaalsContact O-N 3.1Å; D792-R795 PolarHBondContact O-NH1 3.41Å
793	T	94.7	Very high	93.9	Very high	49 Å²	49	59.7 Å²	59.7	30%	0.301	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-25.7	169.4	69.4	0	0	0	0	112.1	W761 K790 R795	W761-T793 WeakPolarHBondContact CH2-O 3.48Å; K790-T793 HydrophobicContact CB-CG2 4.42Å; K790-T793 PolarHBondContact O-N 3.3Å; K790-T793 VanDerWaalsContact O-N 3.12Å; K790-T793 PolarHBondContact O-OG1 3.42Å; T793-R795 VanDerWaalsContact C-NH1 3.32Å; T793-R795 PolarHBondContact O-NH1 2.96Å; T793-R795 VanDerWaalsContact O-NH1 3.16Å
794	L	96	Very high	93.7	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.286	C	S	.	.			trans	-78.2	152.8	-177.1	-61.8	-176.3	0	0	0	113.3	T741 L742 A754 V766 V776 I778 V789 I791	T741-L794 WeakPolarHBondContact CA-O 3.39Å; L742-L794 HydrophobicContact CD1-CB 3.76Å; L742-L794 HydrophobicContact CD1-CD1 3.69Å; L742-L794 HydrophobicContact CD1-CG 4.4Å; L742-L794 HydrophobicContact CG-CB 3.93Å; A754-L794 HydrophobicContact CB-CD2 3.5Å; V766-L794 HydrophobicContact CG2-CD1 4.33Å; V776-L794 HydrophobicContact CG2-CD1 3.52Å; I778-L794 HydrophobicContact CD1-CD2 4.36Å; I778-L794 HydrophobicContact CG2-CD1 3.84Å; I778-L794 HydrophobicContact CG2-CD2 4.42Å; V789-L794 HydrophobicContact CG2-CD1 4.15Å; V789-L794 HydrophobicContact CG2-CD2 3.92Å; V789-L794 HydrophobicContact CG2-CG 4.03Å; I791-L794 PolarHBondContact O-N 3.43Å
795	R	96.7	Very high	93.7	Very high	54 Å²	54	59.5 Å²	59.5	20%	0.204	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	150.4	-179.4	-58.9	-66.9	175.2	-93.5	-0.2	111.2	Y734 I739 P740 C752 A753 W761 D792 T793 I797	Y734-R795 HydrophobicContact CD1-CB 3.58Å; Y734-R795 HydrophobicContact CD1-CG 3.97Å; Y734-R795 HydrophobicContact CE1-CB 3.7Å; I739-R795 HydrophobicContact CG2-CB 4.08Å; I739-R795 HydrophobicContact CG2-CG 4.28Å; I739-R795 WeakPolarHBondContact O-CD 2.99Å; P740-R795 WeakPolarHBondContact O-CA 3.34Å; C752-R795 WeakPolarHBondContact CA-O 3.36Å; C752-R795 WeakPolarHBondContact CB-O 3.26Å; A753-R795 HydrophobicContact CB-CB 4.24Å; A753-R795 PolarHBondContact N-O 2.97Å; A753-R795 PolarHBondContact O-N 3.44Å; W761-R795 HydrophobicContact CH2-CG 3.74Å; W761-R795 HydrophobicContact CZ3-CB 4.37Å; W761-R795 HydrophobicContact CZ3-CG 3.69Å; D792-R795 PolarHBondContact O-NH1 3.41Å; T793-R795 VanDerWaalsContact C-NH1 3.32Å; T793-R795 PolarHBondContact O-NH1 2.96Å; T793-R795 VanDerWaalsContact O-NH1 3.16Å; R795-I797 PolarHBondContact O-N 3.45Å
796	Q	94.8	Very high	93.8	Very high	89 Å²	89	59.4 Å²	59.4	42%	0.416	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	125.7	173.8	-66.7	178.5	35.3	0	0	109.8	Y734 P740 T741 L742	Y734-Q796 WeakPolarHBondContact CE1-O 3.34Å; Y734-Q796 PolarHBondContact OH-O 3.01Å; P740-Q796 HydrophobicContact CB-CG 4.3Å; P740-Q796 PolarHBondContact O-N 3.32Å; T741-Q796 WeakPolarHBondContact O-CG 3.46Å; T741-Q796 PolarHBondContact O-NE2 3Å; L742-Q796 HydrophobicContact CD2-CG 4.1Å
797	I	95.5	Very high	93.9	Very high	20 Å²	20	55.3 Å²	55.3	10%	0.103	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-73.1	139.8	177	-161.6	162	0	0	0	110.2	Y734 I751 R763 R795 F801 V802	Y734-I797 VanDerWaalsContact OH-CA 3.28Å; Y734-I797 WeakPolarHBondContact OH-CA 3.32Å; I751-I797 HydrophobicContact CB-CG2 4.14Å; I751-I797 HydrophobicContact CG2-CD1 3.88Å; I751-I797 HydrophobicContact CG2-CG2 3.99Å; I751-I797 WeakPolarHBondContact O-CG2 3.36Å; R763-I797 HydrophobicContact CB-CD1 4.19Å; R763-I797 HydrophobicContact CG-CD1 3.73Å; R795-I797 PolarHBondContact O-N 3.45Å; I797-F801 HydrophobicContact CD1-CB 4.25Å; I797-F801 HydrophobicContact CG1-CB 4.03Å; I797-V802 HydrophobicContact CD1-CG1 3.76Å; I797-V802 HydrophobicContact CG1-CG1 4.17Å; I797-V802 HydrophobicContact CG2-CG1 3.79Å
798	R	90.8	Very high	93.9	Very high	120 Å²	120	51.3 Å²	51.3	45%	0.453	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-72.8	146.2	171.5	-68	165.6	46.6	149.1	-4.8	110.4	C733 Y734 D800 F801	C733-R798 WeakPolarHBondContact SG-CD 3.47Å; Y734-R798 PolarHBondContact OH-N 3.3Å; R798-D800 VanDerWaalsContact C-N 3.27Å; R798-D800 WeakPolarHBondContact CB-OD1 3.4Å; R798-D800 IonicContact CZ-OD1 3.34Å; R798-D800 IonicContact CZ-OD2 3.57Å; R798-D800 IonicContact NE-OD1 3.55Å; R798-D800 PolarHBondContact NE-OD1 2.99Å; R798-D800 IonicContact NE-OD2 2.81Å; R798-D800 IonicContact NH2-OD1 3.66Å; R798-D800 PolarHBondContact NH2-OD1 2.97Å; R798-D800 IonicContact NH2-OD2 2.69Å; R798-D800 PolarHBondContact NH2-OD2 2.94Å; R798-D800 PolarHBondContact O-N 3.35Å; R798-F801 HydrophobicContact CB-CD2 3.92Å; R798-F801 HydrophobicContact CB-CE2 4.36Å; R798-F801 HydrophobicContact CB-CG 4.32Å; R798-F801 HydrophobicContact CG-CD2 4.37Å; R798-F801 HydrophobicContact CG-CE2 4.39Å; R798-F801 PolarHBondContact O-N 2.91Å; R798-F801 VanDerWaalsContact O-N 3.1Å
799	S	88.3	Confident	93.9	Very high	102 Å²	102	45 Å²	45	71%	0.713	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.2	-178.3	49.7	0	0	0	0	114.2	V802	S799-V802 VanDerWaalsContact O-CG2 3.26Å; S799-V802 WeakPolarHBondContact O-CG2 3.29Å
800	D	86.9	Confident	94	Very high	65 Å²	65	45.1 Å²	45.1	35%	0.348	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-30.7	173.5	58.1	-36.9	0	0	0	112.5	R798 V802 T803	R798-D800 VanDerWaalsContact C-N 3.27Å; R798-D800 WeakPolarHBondContact CB-OD1 3.4Å; R798-D800 IonicContact CZ-OD1 3.34Å; R798-D800 IonicContact CZ-OD2 3.57Å; R798-D800 IonicContact NE-OD1 3.55Å; R798-D800 PolarHBondContact NE-OD1 2.99Å; R798-D800 IonicContact NE-OD2 2.81Å; R798-D800 IonicContact NH2-OD1 3.66Å; R798-D800 PolarHBondContact NH2-OD1 2.97Å; R798-D800 IonicContact NH2-OD2 2.69Å; R798-D800 PolarHBondContact NH2-OD2 2.94Å; R798-D800 PolarHBondContact O-N 3.35Å; D800-V802 VanDerWaalsContact C-N 3.3Å; D800-V802 PolarHBondContact O-N 2.98Å; D800-T803 WeakPolarHBondContact O-CB 3.37Å; D800-T803 WeakPolarHBondContact O-CG2 3.15Å; D800-T803 PolarHBondContact O-N 2.63Å; D800-T803 PolarHBondContact O-OG1 3.28Å
801	F	94.1	Very high	94.1	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.026	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-9.5	178.7	-62.5	-23.1	0	0	0	114.5	L726 Q729 M730 C733 Y734 R763 I797 R798	L726-F801 HydrophobicContact CD1-CB 3.9Å; L726-F801 HydrophobicContact CD1-CD1 3.5Å; L726-F801 HydrophobicContact CD1-CE1 4.24Å; L726-F801 HydrophobicContact CD1-CG 3.86Å; Q729-F801 HydrophobicContact CB-CE1 3.74Å; Q729-F801 HydrophobicContact CB-CZ 3.91Å; M730-F801 HydrophobicContact CG-CD2 4.46Å; M730-F801 HydrophobicContact SD-CB 4Å; M730-F801 HydrophobicContact SD-CD2 3.42Å; M730-F801 WeakPolarHBondContact SD-CD2 3.38Å; M730-F801 HydrophobicContact SD-CE2 4.01Å; M730-F801 HydrophobicContact SD-CG 3.87Å; C733-F801 HydrophobicContact CB-CE2 3.8Å; C733-F801 HydrophobicContact CB-CZ 4.05Å; Y734-F801 AromaticContact CE2-CD2 3.77Å; Y734-F801 HydrophobicContact CE2-CD2 3.77Å; Y734-F801 AromaticContact CE2-CE2 3.71Å; Y734-F801 HydrophobicContact CE2-CE2 3.71Å; R763-F801 WeakPolarHBondContact CD-O 3.18Å; R763-F801 PolarHBondContact NH1-O 3.21Å; I797-F801 HydrophobicContact CD1-CB 4.25Å; I797-F801 HydrophobicContact CG1-CB 4.03Å; R798-F801 HydrophobicContact CB-CD2 3.92Å; R798-F801 HydrophobicContact CB-CE2 4.36Å; R798-F801 HydrophobicContact CB-CG 4.32Å; R798-F801 HydrophobicContact CG-CD2 4.37Å; R798-F801 HydrophobicContact CG-CE2 4.39Å; R798-F801 PolarHBondContact O-N 2.91Å; R798-F801 VanDerWaalsContact O-N 3.1Å
802	V	92.3	Very high	94.3	Very high	20 Å²	20	40.7 Å²	40.7	12%	0.121	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	7.8	170.3	-62	0	0	0	0	113.6	L683 I751 I797 S799 D800	L683-V802 HydrophobicContact CD1-CB 4.45Å; I751-V802 HydrophobicContact CG2-CG1 4.04Å; I797-V802 HydrophobicContact CD1-CG1 3.76Å; I797-V802 HydrophobicContact CG1-CG1 4.17Å; I797-V802 HydrophobicContact CG2-CG1 3.79Å; S799-V802 VanDerWaalsContact O-CG2 3.26Å; S799-V802 WeakPolarHBondContact O-CG2 3.29Å; D800-V802 VanDerWaalsContact C-N 3.3Å; D800-V802 PolarHBondContact O-N 2.98Å
803	T	89.2	Confident	94.5	Very high	114 Å²	114	36.4 Å²	36.4	70%	0.699	20%	0.197	S	C	*	.	S	Bend	trans	-80	-30.9	179.7	60.8	0	0	0	0	113.9	D800	D800-T803 WeakPolarHBondContact O-CB 3.37Å; D800-T803 WeakPolarHBondContact O-CG2 3.15Å; D800-T803 PolarHBondContact O-N 2.63Å; D800-T803 PolarHBondContact O-OG1 3.28Å
804	L	92.8	Very high	94.5	Very high	18 Å²	18	34.5 Å²	34.5	9%	0.094	19%	0.185	C	C	.	.	S	Bend	trans	-70.8	131.4	168	-173.1	70.2	0	0	0	108.4	T719 V722 L723 L726 R763	T719-L804 HydrophobicContact CG2-CD1 3.99Å; V722-L804 HydrophobicContact CB-CD1 3.82Å; V722-L804 HydrophobicContact CB-CD2 4.46Å; V722-L804 HydrophobicContact CG1-CD1 3.82Å; V722-L804 HydrophobicContact CG1-CD2 4.43Å; L723-L804 HydrophobicContact CB-CD2 4.33Å; L723-L804 HydrophobicContact CD1-CD2 4.33Å; L726-L804 HydrophobicContact CB-CD2 4.38Å; L726-L804 HydrophobicContact CD2-CB 4.04Å; L726-L804 HydrophobicContact CD2-CD2 3.7Å; R763-L804 PolarHBondContact NH1-O 2.84Å; R763-L804 PolarHBondContact NH2-O 3.22Å
805	P	95.5	Very high	94.5	Very high	32 Å²	32	35.1 Å²	35.1	21%	0.208	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-55.1	150.5	171.3	-26.3	35.7	0	0	0	111.7	S687 L689 T719 R763 Q807	S687-P805 CarbonylContact O-C 3.57Å; S687-P805 WeakPolarHBondContact O-CA 3.44Å; L689-P805 HydrophobicContact CB-CB 4.2Å; T719-P805 HydrophobicContact CG2-CG 4.48Å; R763-P805 PolarHBondContact NH2-O 3.18Å; P805-Q807 PolarHBondContact O-N 2.68Å; P805-Q807 PolarHBondContact O-NE2 3.28Å
806	F	96.9	Very high	94.4	Very high	1 Å²	1	33 Å²	33	0%	0.004	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-68.7	120.9	173.7	-59.1	-40.4	0	0	0	109.4	L683 S687 W688 L689 I751 V781	L683-F806 HydrophobicContact CD1-CE2 3.65Å; L683-F806 HydrophobicContact CD1-CZ 3.5Å; S687-F806 WeakPolarHBondContact O-CD2 3.44Å; S687-F806 WeakPolarHBondContact O-CG 3.48Å; S687-F806 PolarHBondContact O-N 3.05Å; W688-F806 HydrophobicContact CD2-CB 4.18Å; W688-F806 AromaticContact CD2-CD2 3.69Å; W688-F806 HydrophobicContact CD2-CD2 3.69Å; W688-F806 HydrophobicContact CD2-CG 4.43Å; W688-F806 AromaticContact CE2-CD2 3.58Å; W688-F806 HydrophobicContact CE3-CB 3.65Å; W688-F806 AromaticContact CE3-CD2 3.91Å; W688-F806 HydrophobicContact CE3-CD2 3.91Å; W688-F806 HydrophobicContact CE3-CG 4.25Å; W688-F806 HydrophobicContact CG-CD2 4.23Å; W688-F806 HydrophobicContact CH2-CB 4.48Å; W688-F806 AromaticContact CH2-CD2 3.91Å; W688-F806 HydrophobicContact CH2-CD2 3.91Å; W688-F806 HydrophobicContact CH2-CG 4.46Å; W688-F806 AromaticContact CZ2-CD2 3.71Å; W688-F806 HydrophobicContact CZ2-CD2 3.71Å; W688-F806 HydrophobicContact CZ2-CE2 4.14Å; W688-F806 HydrophobicContact CZ3-CB 3.82Å; W688-F806 HydrophobicContact CZ3-CD2 4.02Å; W688-F806 HydrophobicContact CZ3-CG 4.27Å; L689-F806 VanDerWaalsContact CB-O 3.24Å; L689-F806 WeakPolarHBondContact CB-O 3.47Å; L689-F806 PolarHBondContact N-O 3.28Å; I751-F806 HydrophobicContact CD1-CE2 4.08Å; I751-F806 HydrophobicContact CD1-CZ 3.97Å; I751-F806 HydrophobicContact CG1-CE2 4.43Å; I751-F806 HydrophobicContact CG1-CZ 3.98Å; I751-F806 HydrophobicContact CG2-CE1 4.46Å; I751-F806 HydrophobicContact CG2-CZ 4.18Å; V781-F806 HydrophobicContact CB-CB 3.93Å; V781-F806 HydrophobicContact CB-CD1 3.82Å; V781-F806 HydrophobicContact CB-CD2 4.3Å; V781-F806 HydrophobicContact CB-CE1 4.43Å; V781-F806 HydrophobicContact CB-CG 3.75Å; V781-F806 HydrophobicContact CG2-CB 4.17Å; V781-F806 HydrophobicContact CG2-CD1 3.19Å; V781-F806 HydrophobicContact CG2-CD2 4.47Å; V781-F806 HydrophobicContact CG2-CE1 3.62Å; V781-F806 HydrophobicContact CG2-CG 3.7Å; V781-F806 HydrophobicContact CG2-CZ 4.4Å; V781-F806 WeakPolarHBondContact O-CB 3.49Å
807	Q	97.8	Very high	94.4	Very high	3 Å²	3	31.2 Å²	31.2	1%	0.014	18%	0.176	C	C	.	.			trans	-82.6	-21.1	-167.5	-60.4	-60.1	-84.7	0	0	113.7	Q713 T719 L723 V781 D782 P805 A809	Q713-Q807 HydrophobicContact CG-CB 4.35Å; T719-Q807 VanDerWaalsContact C-OE1 3.28Å; T719-Q807 VanDerWaalsContact CB-OE1 3.29Å; T719-Q807 VanDerWaalsContact OG1-CD 3.31Å; T719-Q807 PolarHBondContact OG1-NE2 3.49Å; T719-Q807 VanDerWaalsContact OG1-NE2 3.14Å; T719-Q807 PolarHBondContact OG1-OE1 2.92Å; L723-Q807 HydrophobicContact CB-CG 4.34Å; L723-Q807 HydrophobicContact CD1-CG 4.38Å; L723-Q807 HydrophobicContact CD2-CB 4.32Å; L723-Q807 HydrophobicContact CD2-CG 4.14Å; V781-Q807 PolarHBondContact O-N 2.96Å; D782-Q807 HydrophobicContact CB-CB 4.41Å; D782-Q807 PolarHBondContact OD1-N 3.22Å; P805-Q807 PolarHBondContact O-N 2.68Å; P805-Q807 PolarHBondContact O-NE2 3.28Å; Q807-A809 PolarHBondContact O-N 3.36Å
808	G	97.1	Very high	94.5	Very high	2 Å²	2	31.7 Å²	31.7	2%	0.021	18%	0.18	C	C	.	.			trans	-89.7	98.7	-176.1	0	0	0	0	0	111.2	V781 D782	V781-G808 PolarHBondContact O-N 3.28Å; D782-G808 WeakPolarHBondContact O-CA 3.11Å; D782-G808 PolarHBondContact O-N 2.95Å
809	A	96.4	Very high	94.7	Very high	15 Å²	15	29.4 Å²	29.4	12%	0.124	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	121.3	171.6	0	0	0	0	0	109.3	L691 F711 V712 Q807	L691-A809 HydrophobicContact CD1-CB 4.45Å; L691-A809 HydrophobicContact CG-CB 4.08Å; F711-A809 CarbonylContact C-O 3.13Å; F711-A809 WeakPolarHBondContact CA-O 3.26Å; V712-A809 HydrophobicContact CG2-CB 4.11Å; V712-A809 PolarHBondContact N-O 3.29Å; V712-A809 PolarHBondContact O-N 3.28Å; Q807-A809 PolarHBondContact O-N 3.36Å
810	E	96.9	Very high	94.7	Very high	14 Å²	14	29.1 Å²	29.1	7%	0.065	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	132.1	172.2	-168.2	168.4	175.5	0	0	109.8	H709 F711 R779 Y786 L855 P856	H709-E810 IonicContact CD2-OE1 3.92Å; H709-E810 IonicContact CE1-OE1 2.65Å; H709-E810 PolarHBondContact CE1-OE1 3.1Å; H709-E810 IonicContact NE2-OE1 2.74Å; H709-E810 PolarHBondContact NE2-OE1 2.9Å; F711-E810 HydrophobicContact CD1-CB 3.76Å; F711-E810 HydrophobicContact CD1-CG 4.04Å; F711-E810 HydrophobicContact CE1-CB 3.5Å; F711-E810 VanDerWaalsContact CE1-CB 3.5Å; F711-E810 HydrophobicContact CE1-CG 3.55Å; F711-E810 WeakPolarHBondContact CE1-OE2 3.4Å; F711-E810 HydrophobicContact CE2-CG 4.19Å; F711-E810 HydrophobicContact CZ-CB 4.12Å; F711-E810 HydrophobicContact CZ-CG 3.63Å; F711-E810 WeakPolarHBondContact CZ-OE2 3.26Å; R779-E810 WeakPolarHBondContact CD-OE2 3.38Å; R779-E810 IonicContact CZ-OE2 3.19Å; R779-E810 IonicContact NE-OE2 3.82Å; R779-E810 IonicContact NH1-OE2 2.73Å; R779-E810 PolarHBondContact NH1-OE2 2.99Å; Y786-E810 VanDerWaalsContact OH-CD 3.26Å; Y786-E810 PolarHBondContact OH-OE1 2.78Å; Y786-E810 PolarHBondContact OH-OE2 3.33Å; Y786-E810 VanDerWaalsContact OH-OE2 3.1Å; E810-L855 HydrophobicContact CB-CD2 3.9Å; E810-L855 HydrophobicContact CG-CD1 4.11Å; E810-L855 HydrophobicContact CG-CD2 3.86Å; E810-P856 WeakPolarHBondContact O-CD 3.29Å; E810-P856 WeakPolarHBondContact O-CG 3.35Å
811	V	97.4	Very high	94.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	153	-170.5	-55.6	0	0	0	0	111.6	L691 M710 V712 P856 I858	L691-V811 HydrophobicContact CD1-CG1 3.61Å; M710-V811 HydrophobicContact CG-CG2 3.5Å; M710-V811 VanDerWaalsContact CG-CG2 3.5Å; M710-V811 PolarHBondContact N-O 2.98Å; M710-V811 WeakPolarHBondContact O-CG2 3.44Å; M710-V811 PolarHBondContact O-N 2.82Å; M710-V811 VanDerWaalsContact O-O 3.13Å; V712-V811 HydrophobicContact CG1-CG2 4.07Å; V712-V811 HydrophobicContact CG2-CG1 3.79Å; V712-V811 HydrophobicContact CG2-CG2 4.37Å; V811-P856 HydrophobicContact CB-CG 4.49Å; V811-P856 HydrophobicContact CG1-CG 4.02Å; V811-I858 HydrophobicContact CB-CD1 4.02Å; V811-I858 HydrophobicContact CB-CG1 4.12Å; V811-I858 HydrophobicContact CB-CG2 4.18Å; V811-I858 HydrophobicContact CG1-CD1 4.34Å; V811-I858 HydrophobicContact CG1-CG2 4.13Å; V811-I858 HydrophobicContact CG2-CD1 3.67Å; V811-I858 HydrophobicContact CG2-CG1 4.15Å
812	L	97.2	Very high	94.6	Very high	34 Å²	34	38.2 Å²	38.2	18%	0.178	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	146.2	168.5	-59.2	173.9	0	0	0	109.4	G708 H709 D814 D850 L855 P856 L857 I858	G708-L812 CarbonylContact O-C 3.56Å; G708-L812 VanDerWaalsContact O-CA 3.23Å; G708-L812 WeakPolarHBondContact O-CA 3.32Å; H709-L812 HydrophobicContact CB-CD2 3.7Å; L812-D814 PolarHBondContact O-N 2.91Å; L812-D850 HydrophobicContact CD1-CB 3.95Å; L812-L855 HydrophobicContact CD1-CB 4.07Å; L812-L855 HydrophobicContact CD1-CD1 4.26Å; L812-L855 HydrophobicContact CD2-CD1 4.24Å; L812-L855 HydrophobicContact CG-CB 4.12Å; L812-L855 HydrophobicContact CG-CD1 4.08Å; L812-P856 PolarHBondContact N-O 3.4Å; L812-L857 HydrophobicContact CB-CD2 3.72Å; L812-L857 HydrophobicContact CD1-CD2 4Å; L812-L857 HydrophobicContact CG-CD2 4.46Å; L812-L857 CarbonylContact O-C 3.5Å; L812-L857 WeakPolarHBondContact O-CA 3.18Å; L812-I858 WeakPolarHBondContact O-CG1 3.21Å; L812-I858 PolarHBondContact O-N 3.05Å
813	L	96.9	Very high	94.5	Very high	7 Å²	7	45.3 Å²	45.3	4%	0.037	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	124.6	171.3	-68.3	-170.7	0	0	0	110.2	A707 G708 M710 V816 I858 L860 L875	A707-L813 VanDerWaalsContact O-CD1 3.27Å; A707-L813 WeakPolarHBondContact O-CD1 3.47Å; G708-L813 PolarHBondContact O-N 2.91Å; M710-L813 HydrophobicContact CE-CD1 3.94Å; M710-L813 HydrophobicContact CE-CD2 3.96Å; M710-L813 HydrophobicContact CE-CG 3.77Å; M710-L813 HydrophobicContact SD-CD2 4.29Å; L813-V816 HydrophobicContact CB-CG2 3.37Å; L813-V816 HydrophobicContact CD1-CG2 4.13Å; L813-V816 HydrophobicContact CG-CG2 4.4Å; L813-I858 HydrophobicContact CD2-CD1 4.42Å; L813-I858 HydrophobicContact CD2-CG1 4.09Å; L813-L860 HydrophobicContact CD2-CB 3.97Å; L813-L860 HydrophobicContact CD2-CD2 4.02Å; L813-L875 HydrophobicContact CD1-CD1 3.84Å
814	D	96	Very high	94.7	Very high	9 Å²	9	45.7 Å²	45.7	5%	0.048	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	153.6	173.9	-163.8	8.4	0	0	0	111.4	L812 V816 T847 L857 I858 Q859 N872	L812-D814 PolarHBondContact O-N 2.91Å; D814-V816 PolarHBondContact O-N 3.49Å; D814-T847 VanDerWaalsContact CG-OG1 3.31Å; D814-T847 VanDerWaalsContact OD2-CB 3.31Å; D814-T847 WeakPolarHBondContact OD2-CB 3.46Å; D814-T847 PolarHBondContact OD2-OG1 2.93Å; D814-L857 HydrophobicContact CB-CB 3.91Å; D814-I858 PolarHBondContact N-O 2.91Å; D814-Q859 HydrophobicContact CB-CG 4.15Å; D814-N872 PolarHBondContact N-ND2 2.88Å; D814-N872 PolarHBondContact O-ND2 3.5Å
815	N	94.9	Very high	94.9	Very high	12 Å²	12	46 Å²	46	6%	0.064	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	7.6	174.7	-55.1	118.1	0	0	0	117.5	Q859 W883 I884 S886	N815-Q859 PolarHBondContact OD1-NE2 3.49Å; N815-W883 HydrophobicContact CB-CD2 3.84Å; N815-W883 HydrophobicContact CB-CE3 3.83Å; N815-W883 HydrophobicContact CB-CH2 3.24Å; N815-W883 HydrophobicContact CB-CZ2 3.22Å; N815-W883 HydrophobicContact CB-CZ3 3.56Å; N815-W883 CarbonylContact O-C 3.58Å; N815-W883 WeakPolarHBondContact O-CA 3.37Å; N815-I884 VanDerWaalsContact CA-O 3.26Å; N815-I884 WeakPolarHBondContact CA-O 3.22Å; N815-I884 VanDerWaalsContact CB-O 3.31Å; N815-I884 WeakPolarHBondContact CB-O 3.34Å; N815-I884 PolarHBondContact ND2-O 3.46Å; N815-I884 PolarHBondContact O-N 2.83Å; N815-S886 PolarHBondContact ND2-N 3.04Å; N815-S886 PolarHBondContact ND2-OG 3.13Å
816	V	95.3	Very high	94.9	Very high	10 Å²	10	46.3 Å²	46.3	6%	0.061	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134	177.9	-64.2	0	0	0	0	111.7	L813 D814 N872 V876 A881 W883	L813-V816 HydrophobicContact CB-CG2 3.37Å; L813-V816 HydrophobicContact CD1-CG2 4.13Å; L813-V816 HydrophobicContact CG-CG2 4.4Å; D814-V816 PolarHBondContact O-N 3.49Å; V816-N872 HydrophobicContact CG1-CB 4.07Å; V816-N872 VanDerWaalsContact CG1-O 3.28Å; V816-N872 WeakPolarHBondContact CG1-O 3.4Å; V816-V876 HydrophobicContact CG1-CG2 3.97Å; V816-A881 HydrophobicContact CB-CB 4.19Å; V816-A881 HydrophobicContact CG1-CB 4.46Å; V816-W883 HydrophobicContact CG1-CE3 4.41Å
817	V	95	Very high	94.9	Very high	51 Å²	51	50.1 Å²	50.1	31%	0.309	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	165.3	175.7	-66.4	0	0	0	0	109.8	F825 A881 Q882 I884	V817-F825 VanDerWaalsContact C-CE1 3.46Å; V817-F825 WeakPolarHBondContact O-CE1 3.16Å; V817-A881 WeakPolarHBondContact O-CA 3.39Å; V817-A881 WeakPolarHBondContact O-CB 3.42Å; V817-Q882 HydrophobicContact CG2-CB 4.02Å; V817-Q882 PolarHBondContact N-O 3.32Å; V817-Q882 PolarHBondContact O-N 2.99Å; V817-I884 HydrophobicContact CG1-CG2 3.88Å; V817-I884 HydrophobicContact CG2-CG2 4.32Å
818	P	95.9	Very high	94.9	Very high	31 Å²	31	54.9 Å²	54.9	20%	0.201	30%	0.301	C	S	.	.			trans	-50.4	166.9	168.4	-31.1	39.2	0	0	0	113.9	E822 F825	P818-E822 VanDerWaalsContact CB-O 3.28Å; P818-E822 WeakPolarHBondContact CB-O 3.28Å; P818-F825 HydrophobicContact CG-CD1 4.45Å; P818-F825 HydrophobicContact CG-CD2 4.08Å; P818-F825 HydrophobicContact CG-CE1 4.48Å; P818-F825 HydrophobicContact CG-CE2 4.1Å; P818-F825 HydrophobicContact CG-CG 4.27Å; P818-F825 HydrophobicContact CG-CZ 4.32Å
819	L	95	Very high	94.9	Very high	72 Å²	72	54.8 Å²	54.8	38%	0.377	30%	0.3	S	S	.	.			trans	-69.7	153	174.4	-63.6	176.5	0	0	0	110.4	D821 E822	L819-D821 PolarHBondContact O-N 3.16Å; L819-E822 PolarHBondContact O-N 3.5Å
820	P	88.9	Confident	95	Very high	96 Å²	96	56.3 Å²	56.3	62%	0.623	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.8	-169.1	-27.4	34.7	0	0	0	116.9
821	D	89.4	Confident	95	Very high	158 Å²	158	58.5 Å²	58.5	85%	0.845	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	1.9	-178.3	-58.8	-63.1	0	0	0	112.9	L819	L819-D821 PolarHBondContact O-N 3.16Å
822	E	90.3	Very high	95	Very high	104 Å²	104	58.8 Å²	58.8	49%	0.486	33%	0.329	S	S	.	.			trans	-125.9	128.1	-173.3	-62.7	-69	174.4	0	0	112.1	P818 L819 H824	P818-E822 VanDerWaalsContact CB-O 3.28Å; P818-E822 WeakPolarHBondContact CB-O 3.28Å; L819-E822 PolarHBondContact O-N 3.5Å; E822-H824 PolarHBondContact O-N 3.43Å; E822-H824 VanDerWaalsContact O-N 3.17Å
823	D	89.5	Confident	95	Very high	169 Å²	169	57.1 Å²	57.1	90%	0.904	32%	0.321	S	S	*	.	S	Bend	trans	-70.8	-6.3	177.3	-68.8	-51.4	0	0	0	113.9
824	H	93.8	Very high	95	Very high	122 Å²	122	58.3 Å²	58.3	57%	0.565	33%	0.329	S	S	*	.	S	Bend	trans	-154.2	160.4	-170.6	58.6	-63.8	0	0	0	111.9	E822	E822-H824 PolarHBondContact O-N 3.43Å; E822-H824 VanDerWaalsContact O-N 3.17Å
825	F	96.4	Very high	94.9	Very high	25 Å²	25	64.9 Å²	64.9	11%	0.11	36%	0.36	C	S	.	.			trans	-67.2	142.8	172.8	-68.1	-80.1	0	0	0	110.6	N706 A707 V817 P818 A829 A881	N706-F825 VanDerWaalsContact OD1-CD2 3.31Å; N706-F825 WeakPolarHBondContact OD1-CD2 3.41Å; A707-F825 HydrophobicContact CB-CB 3.94Å; A707-F825 HydrophobicContact CB-CD1 3.9Å; A707-F825 HydrophobicContact CB-CD2 4.43Å; A707-F825 HydrophobicContact CB-CG 3.84Å; V817-F825 VanDerWaalsContact C-CE1 3.46Å; V817-F825 WeakPolarHBondContact O-CE1 3.16Å; P818-F825 HydrophobicContact CG-CD1 4.45Å; P818-F825 HydrophobicContact CG-CD2 4.08Å; P818-F825 HydrophobicContact CG-CE1 4.48Å; P818-F825 HydrophobicContact CG-CE2 4.1Å; P818-F825 HydrophobicContact CG-CG 4.27Å; P818-F825 HydrophobicContact CG-CZ 4.32Å; F825-A829 HydrophobicContact CB-CB 4.23Å; F825-A829 HydrophobicContact CD1-CB 4.38Å; F825-A881 HydrophobicContact CE1-CB 3.98Å
826	S	96.5	Very high	94.9	Very high	38 Å²	38	65.6 Å²	65.6	27%	0.266	36%	0.363	S	S	.	.			trans	-80.8	163.9	-178.9	87.6	0	0	0	0	112.5	E828 A829 D830	S826-E828 WeakPolarHBondContact CB-OE2 3.37Å; S826-E828 PolarHBondContact O-N 2.9Å; S826-E828 VanDerWaalsContact O-N 3.12Å; S826-E828 PolarHBondContact OG-N 3.32Å; S826-E828 PolarHBondContact OG-OE2 2.92Å; S826-A829 WeakPolarHBondContact O-CB 3.42Å; S826-A829 PolarHBondContact O-N 3.07Å; S826-A829 PolarHBondContact OG-N 2.87Å; S826-D830 PolarHBondContact O-N 2.89Å
827	S	96.7	Very high	94.9	Very high	81 Å²	81	65.4 Å²	65.4	57%	0.566	36%	0.362	S	S	*	.	H	α-helix	trans	-57.4	-26	175.5	34.5	0	0	0	0	113.9	A831	S827-A831 VanDerWaalsContact O-CB 3.28Å; S827-A831 WeakPolarHBondContact O-CB 3.33Å; S827-A831 PolarHBondContact O-N 3.47Å
828	E	97.5	Very high	94.8	Very high	103 Å²	103	71.2 Å²	71.2	48%	0.481	38%	0.378	S	S	.	.	H	α-helix	trans	-79.7	-37.4	178.4	-56.7	64.7	-130.2	0	0	110.8	S826 A831 A832 F880	S826-E828 WeakPolarHBondContact CB-OE2 3.37Å; S826-E828 PolarHBondContact O-N 2.9Å; S826-E828 VanDerWaalsContact O-N 3.12Å; S826-E828 PolarHBondContact OG-N 3.32Å; S826-E828 PolarHBondContact OG-OE2 2.92Å; E828-A831 PolarHBondContact O-N 3.47Å; E828-A832 VanDerWaalsContact O-CB 3.28Å; E828-A832 WeakPolarHBondContact O-CB 3.42Å; E828-A832 PolarHBondContact O-N 3.25Å; E828-F880 HydrophobicContact CB-CD1 4.07Å; E828-F880 HydrophobicContact CB-CE1 3.68Å
829	A	97.5	Very high	94.4	Very high	0 Å²	0	74 Å²	74	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-62.7	-45	169.9	0	0	0	0	0	110.8	A707 F825 S826 A832 V833 F880	A707-A829 HydrophobicContact CB-CB 3.86Å; F825-A829 HydrophobicContact CB-CB 4.23Å; F825-A829 HydrophobicContact CD1-CB 4.38Å; S826-A829 WeakPolarHBondContact O-CB 3.42Å; S826-A829 PolarHBondContact O-N 3.07Å; S826-A829 PolarHBondContact OG-N 2.87Å; A829-A832 PolarHBondContact O-N 3.45Å; A829-V833 PolarHBondContact O-N 3.11Å; A829-F880 HydrophobicContact CB-CB 3.78Å; A829-F880 HydrophobicContact CB-CG 4.42Å
830	D	97.6	Very high	94.2	Very high	47 Å²	47	73 Å²	73	25%	0.251	41%	0.41	S	S	.	.	H	α-helix	trans	-59.9	-48	176.1	-75.1	-20.5	0	0	0	111.6	Q704 N706 A707 S826 A832 V833 S834	Q704-D830 VanDerWaalsContact NE2-CA 3.33Å; Q704-D830 PolarHBondContact NE2-O 3.44Å; N706-D830 VanDerWaalsContact C-OD1 3.24Å; N706-D830 WeakPolarHBondContact CA-OD1 3.5Å; N706-D830 WeakPolarHBondContact CB-OD1 3.31Å; A707-D830 PolarHBondContact N-OD1 3.28Å; S826-D830 PolarHBondContact O-N 2.89Å; D830-A832 VanDerWaalsContact C-N 3.33Å; D830-A832 PolarHBondContact O-N 2.86Å; D830-V833 PolarHBondContact O-N 3.37Å; D830-S834 VanDerWaalsContact O-CB 3.31Å; D830-S834 WeakPolarHBondContact O-CB 3.49Å; D830-S834 PolarHBondContact O-N 2.99Å
831	A	97.9	Very high	94.5	Very high	60 Å²	60	70.2 Å²	70.2	50%	0.496	39%	0.394	S	S	.	.	H	α-helix	trans	-61.3	-40.5	176.8	0	0	0	0	0	112	S827 E828 S834 E835	S827-A831 VanDerWaalsContact O-CB 3.28Å; S827-A831 WeakPolarHBondContact O-CB 3.33Å; S827-A831 PolarHBondContact O-N 3.47Å; E828-A831 PolarHBondContact O-N 3.47Å; A831-S834 CarbonylContact O-C 3.45Å; A831-S834 PolarHBondContact O-N 3.32Å; A831-E835 WeakPolarHBondContact O-CB 3.44Å; A831-E835 PolarHBondContact O-N 2.9Å
832	A	96.9	Very high	94.9	Very high	5 Å²	5	62.7 Å²	62.7	4%	0.041	35%	0.354	C	S	.	.	H	α-helix	trans	-66.4	-40.7	179.2	0	0	0	0	0	112.8	E828 A829 D830 E835 M836 L875 F880	E828-A832 VanDerWaalsContact O-CB 3.28Å; E828-A832 WeakPolarHBondContact O-CB 3.42Å; E828-A832 PolarHBondContact O-N 3.25Å; A829-A832 PolarHBondContact O-N 3.45Å; D830-A832 VanDerWaalsContact C-N 3.33Å; D830-A832 PolarHBondContact O-N 2.86Å; A832-E835 PolarHBondContact O-N 3.37Å; A832-M836 HydrophobicContact CB-CE 4.31Å; A832-M836 WeakPolarHBondContact O-CB 3.42Å; A832-M836 VanDerWaalsContact O-CE 3.31Å; A832-M836 WeakPolarHBondContact O-CE 3.32Å; A832-M836 VanDerWaalsContact O-CG 3.31Å; A832-M836 WeakPolarHBondContact O-CG 3.33Å; A832-M836 PolarHBondContact O-N 3.04Å; A832-L875 HydrophobicContact CB-CD2 4.23Å; A832-F880 HydrophobicContact CB-CD2 3.56Å; A832-F880 HydrophobicContact CB-CE2 3.45Å; A832-F880 VanDerWaalsContact CB-CE2 3.45Å; A832-F880 HydrophobicContact CB-CG 4.44Å; A832-F880 HydrophobicContact CB-CZ 4.26Å
833	V	96.8	Very high	95.3	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.9	-44.2	170.6	174.2	0	0	0	0	110.6	A707 M710 A829 D830 E835 M836 T837 L875	A707-V833 HydrophobicContact CB-CB 4.47Å; A707-V833 HydrophobicContact CB-CG2 3.66Å; M710-V833 HydrophobicContact CE-CG1 3.73Å; A829-V833 PolarHBondContact O-N 3.11Å; D830-V833 PolarHBondContact O-N 3.37Å; V833-E835 PolarHBondContact O-N 3.38Å; V833-M836 PolarHBondContact O-N 3.12Å; V833-T837 HydrophobicContact CG1-CG2 3.94Å; V833-T837 WeakPolarHBondContact O-CB 3.4Å; V833-T837 VanDerWaalsContact O-CG2 3.31Å; V833-T837 WeakPolarHBondContact O-CG2 3.47Å; V833-T837 PolarHBondContact O-N 3.34Å; V833-T837 PolarHBondContact O-OG1 2.77Å; V833-L875 HydrophobicContact CG2-CD1 3.59Å; V833-L875 HydrophobicContact CG2-CD2 3.6Å; V833-L875 HydrophobicContact CG2-CG 4.09Å
834	S	96.4	Very high	95.7	Very high	32 Å²	32	52.2 Å²	52.2	22%	0.224	30%	0.301	C	S	.	.	H	α-helix	trans	-67.7	-19.1	179.6	-153.1	0	0	0	0	113.9	D830 A831 R838	D830-S834 VanDerWaalsContact O-CB 3.31Å; D830-S834 WeakPolarHBondContact O-CB 3.49Å; D830-S834 PolarHBondContact O-N 2.99Å; A831-S834 CarbonylContact O-C 3.45Å; A831-S834 PolarHBondContact O-N 3.32Å; S834-R838 WeakPolarHBondContact O-CB 3.1Å; S834-R838 PolarHBondContact O-NE 3.31Å; S834-R838 PolarHBondContact OG-NH2 3.29Å
835	E	95.6	Very high	95.9	Very high	146 Å²	146	49 Å²	49	68%	0.682	29%	0.286	S	S	*	.	H	α-helix	trans	-82.1	-50.4	169.4	-175.1	-179.7	-157.6	0	0	110.8	A831 A832 V833 T837	A831-E835 WeakPolarHBondContact O-CB 3.44Å; A831-E835 PolarHBondContact O-N 2.9Å; A832-E835 PolarHBondContact O-N 3.37Å; V833-E835 PolarHBondContact O-N 3.38Å; E835-T837 VanDerWaalsContact C-N 3.31Å; E835-T837 PolarHBondContact O-N 2.69Å
836	M	94.6	Very high	95.9	Very high	28 Å²	28	48.1 Å²	48.1	14%	0.138	28%	0.283	C	S	.	.	H	α-helix	trans	-68.5	-23.3	-175.2	-71.4	-174.1	-72.9	0	0	114.8	A832 V833 I871 A874 L875 R878	A832-M836 HydrophobicContact CB-CE 4.31Å; A832-M836 WeakPolarHBondContact O-CB 3.42Å; A832-M836 VanDerWaalsContact O-CE 3.31Å; A832-M836 WeakPolarHBondContact O-CE 3.32Å; A832-M836 VanDerWaalsContact O-CG 3.31Å; A832-M836 WeakPolarHBondContact O-CG 3.33Å; A832-M836 PolarHBondContact O-N 3.04Å; V833-M836 PolarHBondContact O-N 3.12Å; M836-I871 HydrophobicContact CB-CD1 4.21Å; M836-I871 HydrophobicContact CE-CG2 3.91Å; M836-I871 HydrophobicContact SD-CG2 4.37Å; M836-A874 HydrophobicContact CE-CB 4.45Å; M836-A874 HydrophobicContact SD-CB 3.78Å; M836-L875 HydrophobicContact CE-CD2 3.73Å; M836-L875 HydrophobicContact CE-CG 4.04Å; M836-R878 PolarHBondContact SD-NH1 3.22Å
837	T	95.4	Very high	95.8	Very high	6 Å²	6	49 Å²	49	4%	0.037	29%	0.287	C	S	.	.	S	Bend	trans	-105.2	-16.8	-173.5	59.9	0	0	0	0	114.4	V701 V833 E835 G839 L842 L860 I871	V701-T837 HydrophobicContact CG2-CG2 3.9Å; V833-T837 HydrophobicContact CG1-CG2 3.94Å; V833-T837 WeakPolarHBondContact O-CB 3.4Å; V833-T837 VanDerWaalsContact O-CG2 3.31Å; V833-T837 WeakPolarHBondContact O-CG2 3.47Å; V833-T837 PolarHBondContact O-N 3.34Å; V833-T837 PolarHBondContact O-OG1 2.77Å; E835-T837 VanDerWaalsContact C-N 3.31Å; E835-T837 PolarHBondContact O-N 2.69Å; T837-G839 PolarHBondContact O-N 3Å; T837-L842 HydrophobicContact CG2-CD1 3.78Å; T837-L860 HydrophobicContact CG2-CD2 4.26Å; T837-I871 HydrophobicContact CG2-CD1 3.74Å
838	R	92.8	Very high	95.5	Very high	173 Å²	173	49.1 Å²	49.1	65%	0.653	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	128.7	-167.4	171.7	-176.8	-55	-112.4	-4.8	112.8	S834 T840	S834-R838 WeakPolarHBondContact O-CB 3.1Å; S834-R838 PolarHBondContact O-NE 3.31Å; S834-R838 PolarHBondContact OG-NH2 3.29Å; R838-T840 PolarHBondContact O-N 3.44Å; R838-T840 PolarHBondContact O-OG1 2.79Å
839	G	87	Confident	95.2	Very high	88 Å²	88	47.8 Å²	47.8	91%	0.907	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	12.2	174.2	0	0	0	0	0	114.9	T837	T837-G839 PolarHBondContact O-N 3Å
840	T	91.6	Very high	94.7	Very high	53 Å²	53	49.7 Å²	49.7	33%	0.325	28%	0.283	S	S	.	.			trans	-118.8	137.8	-170.1	-57.3	0	0	0	0	109.1	R838 L842	R838-T840 PolarHBondContact O-N 3.44Å; R838-T840 PolarHBondContact O-OG1 2.79Å; T840-L842 HydrophobicContact CG2-CD2 4.06Å
841	A	95.3	Very high	94.1	Very high	36 Å²	36	53.4 Å²	53.4	30%	0.298	31%	0.312	S	S	.	.			trans	-79	130.9	170.9	0	0	0	0	0	109.7	E698	E698-A841 HydrophobicContact CG-CB 4.2Å; E698-A841 VanDerWaalsContact OE1-CB 3.3Å; E698-A841 WeakPolarHBondContact OE1-CB 2.73Å
842	L	97.6	Very high	93.4	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	153.9	-173.1	-56.3	175.9	0	0	0	109.9	E698 V699 V701 T837 T840 L860 W861 I871	E698-L842 CarbonylContact C-O 3.51Å; E698-L842 WeakPolarHBondContact CA-O 3.47Å; V699-L842 HydrophobicContact CG2-CB 4.32Å; V699-L842 PolarHBondContact N-O 2.83Å; V699-L842 PolarHBondContact O-N 2.98Å; V701-L842 HydrophobicContact CG2-CD1 4.02Å; T837-L842 HydrophobicContact CG2-CD1 3.78Å; T840-L842 HydrophobicContact CG2-CD2 4.06Å; L842-L860 HydrophobicContact CB-CD1 3.8Å; L842-L860 HydrophobicContact CB-CG 4.45Å; L842-L860 HydrophobicContact CD1-CD1 3.93Å; L842-L860 HydrophobicContact CD1-CD2 3.92Å; L842-L860 HydrophobicContact CD1-CG 4.04Å; L842-W861 WeakPolarHBondContact CA-O 3.28Å; L842-W861 WeakPolarHBondContact CB-O 3.2Å; L842-I871 HydrophobicContact CD1-CD1 3.98Å; L842-I871 HydrophobicContact CD2-CD1 4.03Å
843	L	97.4	Very high	92.9	Very high	52 Å²	52	58.7 Å²	58.7	27%	0.272	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	127.2	168.6	-62.4	179.9	0	0	0	108.4	T696 E698 L860 W861 M863	T696-L843 HydrophobicContact CG2-CB 3.76Å; T696-L843 HydrophobicContact CG2-CD1 4.47Å; T696-L843 HydrophobicContact CG2-CD2 4.37Å; T696-L843 HydrophobicContact CG2-CG 4.42Å; E698-L843 HydrophobicContact CB-CD2 4.49Å; L843-L860 CarbonylContact O-C 3.57Å; L843-L860 WeakPolarHBondContact O-CA 3.44Å; L843-W861 HydrophobicContact CB-CB 4.38Å; L843-W861 HydrophobicContact CB-CE3 4.38Å; L843-W861 PolarHBondContact N-O 3.11Å; L843-W861 PolarHBondContact O-N 3.48Å; L843-M863 HydrophobicContact CD1-CG 4.43Å; L843-M863 HydrophobicContact CD1-SD 3.81Å
844	A	98	Very high	92.5	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.008	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	141.8	174.5	0	0	0	0	0	110.5	T696 V697 V699 I858 Q859 L860	T696-A844 CarbonylContact C-O 3.58Å; T696-A844 WeakPolarHBondContact CA-O 3.42Å; V697-A844 PolarHBondContact N-O 2.85Å; V697-A844 PolarHBondContact O-N 2.94Å; V699-A844 HydrophobicContact CG1-CB 4.13Å; V699-A844 HydrophobicContact CG2-CB 3.6Å; A844-I858 HydrophobicContact CB-CD1 4.09Å; A844-Q859 WeakPolarHBondContact CA-O 3.44Å; A844-L860 HydrophobicContact CB-CD1 3.86Å
845	Q	97.8	Very high	92.2	Very high	54 Å²	54	61 Å²	61	25%	0.252	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	128.1	173.3	-174.1	-179.5	29.6	0	0	109	G694 T847 I858 Q859 W861	G694-Q845 PolarHBondContact O-NE2 2.89Å; Q845-T847 PolarHBondContact O-N 2.88Å; Q845-I858 VanDerWaalsContact O-CA 3.28Å; Q845-I858 WeakPolarHBondContact O-CA 3.48Å; Q845-Q859 PolarHBondContact N-O 3.4Å; Q845-Q859 PolarHBondContact O-N 3.04Å; Q845-W861 HydrophobicContact CB-CH2 4.03Å; Q845-W861 HydrophobicContact CB-CZ3 3.72Å
846	V	96.6	Very high	92.2	Very high	6 Å²	6	54.5 Å²	54.5	4%	0.036	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	119.6	170.4	-176.7	0	0	0	0	108.5	L691 G694 Y849 P856 L857 I858	L691-V846 HydrophobicContact CB-CG2 3.48Å; L691-V846 VanDerWaalsContact CB-CG2 3.48Å; L691-V846 HydrophobicContact CD1-CG2 4.1Å; L691-V846 HydrophobicContact CG-CG2 4.46Å; G694-V846 WeakPolarHBondContact CA-O 3.44Å; G694-V846 PolarHBondContact N-O 2.94Å; V846-Y849 HydrophobicContact CG1-CE1 4.48Å; V846-Y849 HydrophobicContact CG1-CE2 4.04Å; V846-P856 HydrophobicContact CG1-CB 3.89Å; V846-P856 HydrophobicContact CG2-CB 4.16Å; V846-L857 WeakPolarHBondContact CA-O 3.48Å; V846-I858 HydrophobicContact CG2-CG2 4.17Å
847	T	93.9	Very high	92.3	Very high	57 Å²	57	54.5 Å²	54.5	35%	0.35	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-38.7	-179.8	49.7	0	0	0	0	112	D814 Q845 L857 Q859	D814-T847 VanDerWaalsContact CG-OG1 3.31Å; D814-T847 VanDerWaalsContact OD2-CB 3.31Å; D814-T847 WeakPolarHBondContact OD2-CB 3.46Å; D814-T847 PolarHBondContact OD2-OG1 2.93Å; Q845-T847 PolarHBondContact O-N 2.88Å; T847-L857 PolarHBondContact N-O 3.42Å; T847-L857 PolarHBondContact OG1-O 3.34Å; T847-Q859 HydrophobicContact CG2-CB 4.22Å; T847-Q859 HydrophobicContact CG2-CG 3.83Å
848	N	91.3	Very high	92.4	Very high	84 Å²	84	54.2 Å²	54.2	45%	0.449	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	-172	-178.9	-160.4	-0	0	0	0	110	L857	N848-L857 HydrophobicContact CB-CB 4.46Å; N848-L857 HydrophobicContact CB-CD1 4.28Å; N848-L857 PolarHBondContact O-N 3.41Å
849	Y	91.1	Very high	92.6	Very high	75 Å²	75	48.2 Å²	48.2	29%	0.294	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.1	171.8	-66	-94.7	0	0	0	110.1	V846 S851 L855 P856	V846-Y849 HydrophobicContact CG1-CE1 4.48Å; V846-Y849 HydrophobicContact CG1-CE2 4.04Å; Y849-S851 PolarHBondContact O-N 2.86Å; Y849-L855 CarbonylContact C-O 3.53Å; Y849-L855 WeakPolarHBondContact CA-O 3.29Å; Y849-P856 HydrophobicContact CD1-CB 4.05Å; Y849-P856 HydrophobicContact CE1-CB 3.76Å
850	D	87.9	Confident	93.1	Very high	40 Å²	40	44 Å²	44	21%	0.214	27%	0.274	C	S	.	.			trans	-67.3	131.7	172.7	168	42.5	0	0	0	110.8	L812 A852 T853 G854 L855 L857	L812-D850 HydrophobicContact CD1-CB 3.95Å; D850-A852 VanDerWaalsContact C-N 3.3Å; D850-A852 PolarHBondContact O-N 3.15Å; D850-A852 PolarHBondContact OD1-N 3.39Å; D850-A852 VanDerWaalsContact OD1-N 3.16Å; D850-A852 PolarHBondContact OD2-N 3.42Å; D850-T853 VanDerWaalsContact OD2-CB 3.31Å; D850-T853 WeakPolarHBondContact OD2-CB 3.3Å; D850-T853 WeakPolarHBondContact OD2-CG2 3.35Å; D850-T853 PolarHBondContact OD2-N 2.94Å; D850-T853 PolarHBondContact OD2-OG1 3Å; D850-G854 VanDerWaalsContact O-CA 3.25Å; D850-G854 WeakPolarHBondContact O-CA 3.38Å; D850-G854 PolarHBondContact O-N 3.5Å; D850-L855 PolarHBondContact N-O 2.94Å; D850-L857 HydrophobicContact CB-CD2 3.98Å
851	S	84.9	Confident	93.4	Very high	125 Å²	125	43.7 Å²	43.7	87%	0.874	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-22.6	-179.7	67	0	0	0	0	114.9	Y849	Y849-S851 PolarHBondContact O-N 2.86Å
852	A	83.6	Confident	93.4	Very high	90 Å²	90	42.6 Å²	42.6	74%	0.744	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-42.7	-176.5	0	0	0	0	0	113	D850	D850-A852 VanDerWaalsContact C-N 3.3Å; D850-A852 PolarHBondContact O-N 3.15Å; D850-A852 PolarHBondContact OD1-N 3.39Å; D850-A852 VanDerWaalsContact OD1-N 3.16Å; D850-A852 PolarHBondContact OD2-N 3.42Å
853	T	85.6	Confident	93	Very high	86 Å²	86	46.7 Å²	46.7	53%	0.528	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-22.5	-176.3	61.9	0	0	0	0	113.8	D850 L855	D850-T853 VanDerWaalsContact OD2-CB 3.31Å; D850-T853 WeakPolarHBondContact OD2-CB 3.3Å; D850-T853 WeakPolarHBondContact OD2-CG2 3.35Å; D850-T853 PolarHBondContact OD2-N 2.94Å; D850-T853 PolarHBondContact OD2-OG1 3Å; T853-L855 PolarHBondContact O-N 2.75Å; T853-L855 WeakPolarHBondContact OG1-CB 3.5Å; T853-L855 WeakPolarHBondContact OG1-CG 3.3Å; T853-L855 PolarHBondContact OG1-N 3.47Å
854	G	88.4	Confident	92.5	Very high	50 Å²	50	49.6 Å²	49.6	52%	0.515	29%	0.29	S	S	.	.			trans	73	7.9	-169.9	0	0	0	0	0	114.3	D850	D850-G854 VanDerWaalsContact O-CA 3.25Å; D850-G854 WeakPolarHBondContact O-CA 3.38Å; D850-G854 PolarHBondContact O-N 3.5Å
855	L	90.8	Very high	91.9	Very high	29 Å²	29	52.6 Å²	52.6	15%	0.152	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-72.6	143.8	177.2	-67.5	176	0	0	0	111.3	E810 L812 Y849 D850 T853 L857	E810-L855 HydrophobicContact CB-CD2 3.9Å; E810-L855 HydrophobicContact CG-CD1 4.11Å; E810-L855 HydrophobicContact CG-CD2 3.86Å; L812-L855 HydrophobicContact CD1-CB 4.07Å; L812-L855 HydrophobicContact CD1-CD1 4.26Å; L812-L855 HydrophobicContact CD2-CD1 4.24Å; L812-L855 HydrophobicContact CG-CB 4.12Å; L812-L855 HydrophobicContact CG-CD1 4.08Å; Y849-L855 CarbonylContact C-O 3.53Å; Y849-L855 WeakPolarHBondContact CA-O 3.29Å; D850-L855 PolarHBondContact N-O 2.94Å; T853-L855 PolarHBondContact O-N 2.75Å; T853-L855 WeakPolarHBondContact OG1-CB 3.5Å; T853-L855 WeakPolarHBondContact OG1-CG 3.3Å; T853-L855 PolarHBondContact OG1-N 3.47Å; L855-L857 PolarHBondContact O-N 2.97Å
856	P	94.9	Very high	91.4	Very high	10 Å²	10	58.3 Å²	58.3	7%	0.065	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	129.6	173.7	27.2	-34.8	0	0	0	111.1	E810 V811 L812 V846 Y849 I858	E810-P856 WeakPolarHBondContact O-CD 3.29Å; E810-P856 WeakPolarHBondContact O-CG 3.35Å; V811-P856 HydrophobicContact CB-CG 4.49Å; V811-P856 HydrophobicContact CG1-CG 4.02Å; L812-P856 PolarHBondContact N-O 3.4Å; V846-P856 HydrophobicContact CG1-CB 3.89Å; V846-P856 HydrophobicContact CG2-CB 4.16Å; Y849-P856 HydrophobicContact CD1-CB 4.05Å; Y849-P856 HydrophobicContact CE1-CB 3.76Å; P856-I858 HydrophobicContact CB-CG2 4.48Å
857	L	95.7	Very high	91.2	Very high	28 Å²	28	64.8 Å²	64.8	15%	0.147	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	129.9	163.7	-55	-170.3	0	0	0	108.2	L812 D814 V846 T847 N848 D850 L855	L812-L857 HydrophobicContact CB-CD2 3.72Å; L812-L857 HydrophobicContact CD1-CD2 4Å; L812-L857 HydrophobicContact CG-CD2 4.46Å; L812-L857 CarbonylContact O-C 3.5Å; L812-L857 WeakPolarHBondContact O-CA 3.18Å; D814-L857 HydrophobicContact CB-CB 3.91Å; V846-L857 WeakPolarHBondContact CA-O 3.48Å; T847-L857 PolarHBondContact N-O 3.42Å; T847-L857 PolarHBondContact OG1-O 3.34Å; N848-L857 HydrophobicContact CB-CB 4.46Å; N848-L857 HydrophobicContact CB-CD1 4.28Å; N848-L857 PolarHBondContact O-N 3.41Å; D850-L857 HydrophobicContact CB-CD2 3.98Å; L855-L857 PolarHBondContact O-N 2.97Å
858	I	97.4	Very high	91.1	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	142.7	-179.3	69.7	162.4	0	0	0	112.8	L691 V811 L812 L813 D814 A844 Q845 V846 P856 L860 N872	L691-I858 HydrophobicContact CD1-CG2 4.03Å; V811-I858 HydrophobicContact CB-CD1 4.02Å; V811-I858 HydrophobicContact CB-CG1 4.12Å; V811-I858 HydrophobicContact CB-CG2 4.18Å; V811-I858 HydrophobicContact CG1-CD1 4.34Å; V811-I858 HydrophobicContact CG1-CG2 4.13Å; V811-I858 HydrophobicContact CG2-CD1 3.67Å; V811-I858 HydrophobicContact CG2-CG1 4.15Å; L812-I858 WeakPolarHBondContact O-CG1 3.21Å; L812-I858 PolarHBondContact O-N 3.05Å; L813-I858 HydrophobicContact CD2-CD1 4.42Å; L813-I858 HydrophobicContact CD2-CG1 4.09Å; D814-I858 PolarHBondContact N-O 2.91Å; A844-I858 HydrophobicContact CB-CD1 4.09Å; Q845-I858 VanDerWaalsContact O-CA 3.28Å; Q845-I858 WeakPolarHBondContact O-CA 3.48Å; V846-I858 HydrophobicContact CG2-CG2 4.17Å; P856-I858 HydrophobicContact CB-CG2 4.48Å; I858-L860 HydrophobicContact CD1-CB 4.4Å; I858-L860 HydrophobicContact CD1-CD1 4.21Å; I858-N872 PolarHBondContact O-ND2 3.2Å
859	Q	97.3	Very high	91.3	Very high	47 Å²	47	64.1 Å²	64.1	22%	0.22	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	137.7	156.5	-70.8	-177.9	7.1	0	0	108.9	D814 N815 A844 Q845 T847 W861	D814-Q859 HydrophobicContact CB-CG 4.15Å; N815-Q859 PolarHBondContact OD1-NE2 3.49Å; A844-Q859 WeakPolarHBondContact CA-O 3.44Å; Q845-Q859 PolarHBondContact N-O 3.4Å; Q845-Q859 PolarHBondContact O-N 3.04Å; T847-Q859 HydrophobicContact CG2-CB 4.22Å; T847-Q859 HydrophobicContact CG2-CG 3.83Å; Q859-W861 HydrophobicContact CB-CH2 3.36Å; Q859-W861 HydrophobicContact CB-CZ2 3.68Å; Q859-W861 HydrophobicContact CB-CZ3 3.88Å; Q859-W861 VanDerWaalsContact O-CZ3 3.23Å; Q859-W861 WeakPolarHBondContact O-CZ3 3.31Å
860	L	97.6	Very high	91.6	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	131.6	-169.7	-171.7	68.4	0	0	0	109.5	V699 M710 L813 T837 L842 L843 A844 I858 S870 I871 N872	V699-L860 HydrophobicContact CG2-CD1 4.17Å; M710-L860 HydrophobicContact SD-CD2 4.06Å; L813-L860 HydrophobicContact CD2-CB 3.97Å; L813-L860 HydrophobicContact CD2-CD2 4.02Å; T837-L860 HydrophobicContact CG2-CD2 4.26Å; L842-L860 HydrophobicContact CB-CD1 3.8Å; L842-L860 HydrophobicContact CB-CG 4.45Å; L842-L860 HydrophobicContact CD1-CD1 3.93Å; L842-L860 HydrophobicContact CD1-CD2 3.92Å; L842-L860 HydrophobicContact CD1-CG 4.04Å; L843-L860 CarbonylContact O-C 3.57Å; L843-L860 WeakPolarHBondContact O-CA 3.44Å; A844-L860 HydrophobicContact CB-CD1 3.86Å; I858-L860 HydrophobicContact CD1-CB 4.4Å; I858-L860 HydrophobicContact CD1-CD1 4.21Å; L860-S870 WeakPolarHBondContact O-CA 3.35Å; L860-I871 HydrophobicContact CD2-CB 4.49Å; L860-I871 HydrophobicContact CD2-CD1 4.01Å; L860-I871 HydrophobicContact CG-CD1 4.12Å; L860-I871 PolarHBondContact O-N 2.86Å; L860-N872 PolarHBondContact N-OD1 3.38Å; L860-N872 PolarHBondContact O-OD1 3.46Å
861	W	97.6	Very high	92	Very high	47 Å²	47	59.8 Å²	59.8	18%	0.178	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	142.5	-178.1	-57.3	-97.7	0	0	0	111.9	L842 L843 Q845 Q859 V868 V869 S870	L842-W861 WeakPolarHBondContact CA-O 3.28Å; L842-W861 WeakPolarHBondContact CB-O 3.2Å; L843-W861 HydrophobicContact CB-CB 4.38Å; L843-W861 HydrophobicContact CB-CE3 4.38Å; L843-W861 PolarHBondContact N-O 3.11Å; L843-W861 PolarHBondContact O-N 3.48Å; Q845-W861 HydrophobicContact CB-CH2 4.03Å; Q845-W861 HydrophobicContact CB-CZ3 3.72Å; Q859-W861 HydrophobicContact CB-CH2 3.36Å; Q859-W861 HydrophobicContact CB-CZ2 3.68Å; Q859-W861 HydrophobicContact CB-CZ3 3.88Å; Q859-W861 VanDerWaalsContact O-CZ3 3.23Å; Q859-W861 WeakPolarHBondContact O-CZ3 3.31Å; W861-V868 HydrophobicContact CB-CG1 3.8Å; W861-V868 HydrophobicContact CG-CG1 4.04Å; W861-V869 CarbonylContact C-O 3.57Å; W861-V869 VanDerWaalsContact CA-O 3.27Å; W861-V869 WeakPolarHBondContact CA-O 3.43Å; W861-S870 VanDerWaalsContact CD1-CA 3.46Å
862	S	95.3	Very high	92.6	Very high	12 Å²	12	53.8 Å²	53.8	8%	0.084	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	142.7	170.1	-172.8	0	0	0	0	110.7	V869	S862-V869 PolarHBondContact N-O 2.89Å; S862-V869 PolarHBondContact O-N 3.35Å
863	M	91	Very high	93.2	Very high	88 Å²	88	54.6 Å²	54.6	43%	0.433	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	105	174.7	-63.6	-60	-55.3	0	0	109.2	L843 V868	L843-M863 HydrophobicContact CD1-CG 4.43Å; L843-M863 HydrophobicContact CD1-SD 3.81Å; M863-V868 HydrophobicContact CE-CG2 3.91Å; M863-V868 HydrophobicContact SD-CB 4.42Å; M863-V868 HydrophobicContact SD-CG1 4.2Å; M863-V868 HydrophobicContact SD-CG2 3.79Å
864	M	85.6	Confident	93.7	Very high	113 Å²	113	50.7 Å²	50.7	56%	0.557	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	81.9	179.1	-68.6	-162	-67.7	0	0	110	D866 E867 V869	M864-D866 PolarHBondContact O-N 2.91Å; M864-E867 PolarHBondContact N-O 3.46Å; M864-E867 PolarHBondContact O-N 3.13Å; M864-V869 HydrophobicContact CE-CB 3.84Å; M864-V869 HydrophobicContact CE-CG1 4.13Å; M864-V869 HydrophobicContact CE-CG2 3.51Å
865	G	85.4	Confident	94.1	Very high	64 Å²	64	48.3 Å²	48.3	66%	0.66	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	-125.8	-168	0	0	0	0	0	110.2	E867	G865-E867 VanDerWaalsContact C-N 3.33Å
866	D	87.3	Confident	94.4	Very high	173 Å²	173	48.9 Å²	48.9	93%	0.925	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-6.3	176.3	-62.3	-33.7	0	0	0	113.1	M864	M864-D866 PolarHBondContact O-N 2.91Å
867	E	91.7	Very high	94.5	Very high	142 Å²	142	55.8 Å²	55.8	66%	0.664	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	138.9	-179.2	-64.9	-169	169.1	0	0	112.8	M864 G865	M864-E867 PolarHBondContact N-O 3.46Å; M864-E867 PolarHBondContact O-N 3.13Å; G865-E867 VanDerWaalsContact C-N 3.33Å
868	V	93.3	Very high	94.5	Very high	85 Å²	85	60.5 Å²	60.5	52%	0.515	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	108.8	178.1	-170	0	0	0	0	109.1	W861 M863	W861-V868 HydrophobicContact CB-CG1 3.8Å; W861-V868 HydrophobicContact CG-CG1 4.04Å; M863-V868 HydrophobicContact CE-CG2 3.91Å; M863-V868 HydrophobicContact SD-CB 4.42Å; M863-V868 HydrophobicContact SD-CG1 4.2Å; M863-V868 HydrophobicContact SD-CG2 3.79Å
869	V	94.9	Very high	94.4	Very high	43 Å²	43	62.5 Å²	62.5	26%	0.261	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.6	-174.3	177.5	0	0	0	0	110.7	W861 S862 M864 I871	W861-V869 CarbonylContact C-O 3.57Å; W861-V869 VanDerWaalsContact CA-O 3.27Å; W861-V869 WeakPolarHBondContact CA-O 3.43Å; S862-V869 PolarHBondContact N-O 2.89Å; S862-V869 PolarHBondContact O-N 3.35Å; M864-V869 HydrophobicContact CE-CB 3.84Å; M864-V869 HydrophobicContact CE-CG1 4.13Å; M864-V869 HydrophobicContact CE-CG2 3.51Å; V869-I871 PolarHBondContact O-N 2.8Å
870	S	96.9	Very high	94.4	Very high	20 Å²	20	63 Å²	63	14%	0.14	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	123.5	176.3	175.7	0	0	0	0	110.7	L860 W861 R873 A874	L860-S870 WeakPolarHBondContact O-CA 3.35Å; W861-S870 VanDerWaalsContact CD1-CA 3.46Å; S870-R873 PolarHBondContact O-N 3.08Å; S870-R873 PolarHBondContact OG-N 3.45Å; S870-A874 WeakPolarHBondContact O-CB 3.4Å; S870-A874 PolarHBondContact O-N 3.49Å
871	I	97.1	Very high	94.4	Very high	3 Å²	3	63.2 Å²	63.2	2%	0.015	34%	0.336	C	S	.	.	H	α-helix	trans	-69.6	-39.4	177.6	-60	-170.8	0	0	0	110	M836 T837 L842 L860 V869 R873 A874 L875	M836-I871 HydrophobicContact CB-CD1 4.21Å; M836-I871 HydrophobicContact CE-CG2 3.91Å; M836-I871 HydrophobicContact SD-CG2 4.37Å; T837-I871 HydrophobicContact CG2-CD1 3.74Å; L842-I871 HydrophobicContact CD1-CD1 3.98Å; L842-I871 HydrophobicContact CD2-CD1 4.03Å; L860-I871 HydrophobicContact CD2-CB 4.49Å; L860-I871 HydrophobicContact CD2-CD1 4.01Å; L860-I871 HydrophobicContact CG-CD1 4.12Å; L860-I871 PolarHBondContact O-N 2.86Å; V869-I871 PolarHBondContact O-N 2.8Å; I871-R873 VanDerWaalsContact C-N 3.33Å; I871-R873 PolarHBondContact O-N 3.12Å; I871-A874 PolarHBondContact O-N 3.37Å; I871-L875 PolarHBondContact O-N 3.14Å
872	N	96.8	Very high	94.3	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-55	-46.5	173.9	-50	60.4	0	0	0	111.1	D814 V816 I858 L860 W883	D814-N872 PolarHBondContact N-ND2 2.88Å; D814-N872 PolarHBondContact O-ND2 3.5Å; V816-N872 HydrophobicContact CG1-CB 4.07Å; V816-N872 VanDerWaalsContact CG1-O 3.28Å; V816-N872 WeakPolarHBondContact CG1-O 3.4Å; I858-N872 PolarHBondContact O-ND2 3.2Å; L860-N872 PolarHBondContact N-OD1 3.38Å; L860-N872 PolarHBondContact O-OD1 3.46Å; N872-W883 HydrophobicContact CB-CZ3 4.13Å
873	R	96.4	Very high	94.3	Very high	107 Å²	107	67 Å²	67	40%	0.404	35%	0.352	S	S	.	.	H	α-helix	trans	-69.6	-43.9	176.3	-68.6	-70	-176.5	-172.4	-3.3	112.3	S870 I871 L875 V876 E877 W883	S870-R873 PolarHBondContact O-N 3.08Å; S870-R873 PolarHBondContact OG-N 3.45Å; I871-R873 VanDerWaalsContact C-N 3.33Å; I871-R873 PolarHBondContact O-N 3.12Å; R873-L875 VanDerWaalsContact C-N 3.25Å; R873-L875 PolarHBondContact O-N 3.4Å; R873-V876 PolarHBondContact O-N 3.18Å; R873-E877 WeakPolarHBondContact O-CG 3.46Å; R873-E877 PolarHBondContact O-N 3.05Å; R873-W883 HydrophobicContact CG-CZ3 4.11Å; R873-W883 VanDerWaalsContact NH2-CE2 3.32Å
874	A	96.4	Very high	94.3	Very high	4 Å²	4	67 Å²	67	3%	0.033	35%	0.352	C	S	.	.	H	α-helix	trans	-60.8	-30.2	-178.2	0	0	0	0	0	113.6	M836 S870 I871 R878	M836-A874 HydrophobicContact CE-CB 4.45Å; M836-A874 HydrophobicContact SD-CB 3.78Å; S870-A874 WeakPolarHBondContact O-CB 3.4Å; S870-A874 PolarHBondContact O-N 3.49Å; I871-A874 PolarHBondContact O-N 3.37Å; A874-R878 WeakPolarHBondContact O-CB 3.21Å; A874-R878 WeakPolarHBondContact O-CD 3.47Å; A874-R878 WeakPolarHBondContact O-CG 3.38Å; A874-R878 PolarHBondContact O-N 3.47Å
875	L	97	Very high	94.3	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-64.8	-45.1	171.9	-72.3	170	0	0	0	112.3	L813 A832 V833 M836 I871 R873 R878 G879 F880 A881	L813-L875 HydrophobicContact CD1-CD1 3.84Å; A832-L875 HydrophobicContact CB-CD2 4.23Å; V833-L875 HydrophobicContact CG2-CD1 3.59Å; V833-L875 HydrophobicContact CG2-CD2 3.6Å; V833-L875 HydrophobicContact CG2-CG 4.09Å; M836-L875 HydrophobicContact CE-CD2 3.73Å; M836-L875 HydrophobicContact CE-CG 4.04Å; I871-L875 PolarHBondContact O-N 3.14Å; R873-L875 VanDerWaalsContact C-N 3.25Å; R873-L875 PolarHBondContact O-N 3.4Å; L875-R878 PolarHBondContact O-N 3.35Å; L875-G879 PolarHBondContact O-N 3.44Å; L875-F880 HydrophobicContact CD2-CB 4.16Å; L875-F880 HydrophobicContact CD2-CD2 4.35Å; L875-F880 WeakPolarHBondContact O-CB 3.28Å; L875-F880 PolarHBondContact O-N 3.09Å; L875-A881 HydrophobicContact CB-CB 4.02Å
876	V	96.8	Very high	93.2	Very high	40 Å²	40	67 Å²	67	24%	0.242	35%	0.345	C	S	.	.	H	α-helix	trans	-71	-42.2	-179.7	-177.9	0	0	0	0	111.2	V816 R873 R878 G879 A881 W883	V816-V876 HydrophobicContact CG1-CG2 3.97Å; R873-V876 PolarHBondContact O-N 3.18Å; V876-R878 PolarHBondContact O-N 3.27Å; V876-G879 PolarHBondContact O-N 3.07Å; V876-A881 WeakPolarHBondContact CA-O 3.45Å; V876-A881 HydrophobicContact CG2-CB 4.06Å; V876-W883 HydrophobicContact CG1-CB 3.99Å; V876-W883 HydrophobicContact CG2-CB 4.01Å; V876-W883 HydrophobicContact CG2-CE3 4.3Å
877	E	96.7	Very high	91.3	Very high	156 Å²	156	72.6 Å²	72.6	73%	0.729	36%	0.355	S	S	*	.	H	α-helix	trans	-63.7	-27.7	178.1	-71.5	169.8	-170.8	0	0	113	R873	R873-E877 WeakPolarHBondContact O-CG 3.46Å; R873-E877 PolarHBondContact O-N 3.05Å
878	R	96.1	Very high	91.2	Very high	126 Å²	126	69.1 Å²	69.1	48%	0.475	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-3.8	172.9	-66	171.9	-170.1	-171.6	3.9	113.7	M836 A874 L875 V876 F880	M836-R878 PolarHBondContact SD-NH1 3.22Å; A874-R878 WeakPolarHBondContact O-CB 3.21Å; A874-R878 WeakPolarHBondContact O-CD 3.47Å; A874-R878 WeakPolarHBondContact O-CG 3.38Å; A874-R878 PolarHBondContact O-N 3.47Å; L875-R878 PolarHBondContact O-N 3.35Å; V876-R878 PolarHBondContact O-N 3.27Å; R878-F880 HydrophobicContact CB-CD2 3.51Å; R878-F880 HydrophobicContact CB-CE2 3.54Å; R878-F880 HydrophobicContact CB-CG 4.38Å; R878-F880 HydrophobicContact CB-CZ 4.41Å; R878-F880 HydrophobicContact CG-CE2 4.32Å
879	G	96.2	Very high	91.1	Very high	43 Å²	43	68.3 Å²	68.3	44%	0.443	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	19.6	179.6	0	0	0	0	0	115.1	L875 V876	L875-G879 PolarHBondContact O-N 3.44Å; V876-G879 PolarHBondContact O-N 3.07Å
880	F	96.8	Very high	90.9	Very high	58 Å²	58	69.7 Å²	69.7	25%	0.254	33%	0.334	S	S	.	.	S	Bend	trans	-92.3	-12.3	-179.7	-63.7	-47.1	0	0	0	114.3	E828 A829 A832 L875 R878	E828-F880 HydrophobicContact CB-CD1 4.07Å; E828-F880 HydrophobicContact CB-CE1 3.68Å; A829-F880 HydrophobicContact CB-CB 3.78Å; A829-F880 HydrophobicContact CB-CG 4.42Å; A832-F880 HydrophobicContact CB-CD2 3.56Å; A832-F880 HydrophobicContact CB-CE2 3.45Å; A832-F880 VanDerWaalsContact CB-CE2 3.45Å; A832-F880 HydrophobicContact CB-CG 4.44Å; A832-F880 HydrophobicContact CB-CZ 4.26Å; L875-F880 HydrophobicContact CD2-CB 4.16Å; L875-F880 HydrophobicContact CD2-CD2 4.35Å; L875-F880 WeakPolarHBondContact O-CB 3.28Å; L875-F880 PolarHBondContact O-N 3.09Å; R878-F880 HydrophobicContact CB-CD2 3.51Å; R878-F880 HydrophobicContact CB-CE2 3.54Å; R878-F880 HydrophobicContact CB-CG 4.38Å; R878-F880 HydrophobicContact CB-CZ 4.41Å; R878-F880 HydrophobicContact CG-CE2 4.32Å
881	A	96.6	Very high	90.6	Very high	4 Å²	4	72.6 Å²	72.6	3%	0.033	35%	0.346	C	S	.	.	S	Bend	trans	-148.9	159.2	-179.8	0	0	0	0	0	110.2	V816 V817 F825 L875 V876	V816-A881 HydrophobicContact CB-CB 4.19Å; V816-A881 HydrophobicContact CG1-CB 4.46Å; V817-A881 WeakPolarHBondContact O-CA 3.39Å; V817-A881 WeakPolarHBondContact O-CB 3.42Å; F825-A881 HydrophobicContact CE1-CB 3.98Å; L875-A881 HydrophobicContact CB-CB 4.02Å; V876-A881 WeakPolarHBondContact CA-O 3.45Å; V876-A881 HydrophobicContact CG2-CB 4.06Å
882	Q	95.9	Very high	90.2	Very high	92 Å²	92	76.9 Å²	76.9	43%	0.43	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	138.3	165.5	-178.1	173.8	39	0	0	109.9	V817	V817-Q882 HydrophobicContact CG2-CB 4.02Å; V817-Q882 PolarHBondContact N-O 3.32Å; V817-Q882 PolarHBondContact O-N 2.99Å
883	W	95.8	Very high	89.7	Confident	46 Å²	46	82.1 Å²	82.1	17%	0.174	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	132.9	169.1	-173.7	-91.3	0	0	0	110.5	N815 V816 N872 R873 V876 D885	N815-W883 HydrophobicContact CB-CD2 3.84Å; N815-W883 HydrophobicContact CB-CE3 3.83Å; N815-W883 HydrophobicContact CB-CH2 3.24Å; N815-W883 HydrophobicContact CB-CZ2 3.22Å; N815-W883 HydrophobicContact CB-CZ3 3.56Å; N815-W883 CarbonylContact O-C 3.58Å; N815-W883 WeakPolarHBondContact O-CA 3.37Å; V816-W883 HydrophobicContact CG1-CE3 4.41Å; N872-W883 HydrophobicContact CB-CZ3 4.13Å; R873-W883 HydrophobicContact CG-CZ3 4.11Å; R873-W883 VanDerWaalsContact NH2-CE2 3.32Å; V876-W883 HydrophobicContact CG1-CB 3.99Å; V876-W883 HydrophobicContact CG2-CB 4.01Å; V876-W883 HydrophobicContact CG2-CE3 4.3Å; W883-D885 PolarHBondContact NE1-OD1 3.34Å
884	I	91.4	Very high	89.2	Confident	87 Å²	87	80.3 Å²	80.3	45%	0.446	39%	0.39	S	S	.	.			trans	-125.2	124	169.4	-168.9	167.5	0	0	0	109.8	N815 V817 S886	N815-I884 VanDerWaalsContact CA-O 3.26Å; N815-I884 WeakPolarHBondContact CA-O 3.22Å; N815-I884 VanDerWaalsContact CB-O 3.31Å; N815-I884 WeakPolarHBondContact CB-O 3.34Å; N815-I884 PolarHBondContact ND2-O 3.46Å; N815-I884 PolarHBondContact O-N 2.83Å; V817-I884 HydrophobicContact CG1-CG2 3.88Å; V817-I884 HydrophobicContact CG2-CG2 4.32Å; I884-S886 PolarHBondContact O-N 3.24Å
885	D	84.3	Confident	88.7	Confident	109 Å²	109	86.2 Å²	86.2	58%	0.583	42%	0.418	S	S	*	.			trans	-72	124.4	171.5	-64.4	-52.9	0	0	0	108.9	W883	W883-D885 PolarHBondContact NE1-OD1 3.34Å
886	S	63.4	Low	88	Confident	68 Å²	68	93.3 Å²	93.3	48%	0.476	45%	0.452	S	S	.	.			trans	-71.9	135.1	177	22.9	0	0	0	0	110.6	N815 I884	N815-S886 PolarHBondContact ND2-N 3.04Å; N815-S886 PolarHBondContact ND2-OG 3.13Å; I884-S886 PolarHBondContact O-N 3.24Å
887	Y	46.2	Very low	87.2	Confident	291 Å²	291	98.2 Å²	98.2	100%	1.141	47%	0.471	S	S	*	.			trans	-95.1	0	-173	-84.8	-91.2	0	0	0	113.5

Retrieved 887 of 887 residues in 969.2 ms (Link to these results)

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