A0A3Q0KTA9_SCHMA Loading...

Fbxl16, putative AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KTA9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 943 aa.

						>A0A3Q0KTA9_SCHMA|A0A3Q0KTA9
MTSFAKACIDFSNNLKNLRFTKSNATTTSSTVTVNNSTATMTKSSVVLNFQSDTIKNSVTNEYIISVTNRIVANNSKTNNHHSNVNSTEEKHRNEKNHKNSEHFTDDKCTICNKLFPIPNNISASDASNTNNNTTSINSTNLGGRISDEKEDSSVLGKSMVVKHSEINSLENPTISPNTTAMTQNRKNIIPNGSVNSDSLKNMISNYSDYRLSNSKISNSLPSSPVPRHSFTMKNKPSSEIRQDSNTADNRRAHSNINSLTDSPFTFKATLSPTMTHRLAILARNCKNSIVSNGNSISGSDSTGFTYNRYSNNSISSSSPLSSHRGTTVAAIKQRLVNQGLRINLNIPVKKLSCTRYRDYVRRQKRGCPHTIESLWLNKNFMNNIFAYLTGTELIHYSIVCRTWYEFMCLNGFQNKLCFVLNIKKLIKEIENSHEDSKSNQHTDYKDPIIISNHSDHIPLPNDLLYSYLEDSIRIRIVSAINRHLETIKIVQLVERFSSILYNILEMLLSPNHNVIMTSLSQSSTVESYFPQINTTVANTLTKTKTFNNRILLTSNESCSTWINDTDKDNKSVFKTNDFINSFQKQVKKQQQQNGFIQDNSVITVNHSIQNKLPSNTDSPSTPSDTWTFKRTSGSKNSISSNLSSLENVNSNSSYTHKFTHIIFKSCSIPDQSLSRLINLFPSIKQLEFECCNDFTELAFWSCLLPSIEYLTVFDCINVSDESMNAIGHLLPELKCFKFQAYHITDAALSYFSTKQRINMHTMELTQCMDVTNQGIMTLAYTLNNLQVLSLSGCSKLTDDGLDVICENLKRLISLNLSWCSKITDSGLECVACDLVLLKKLLLDRCTELTDLGISHLATMSNLQHLSVRWCINLSDGSIPHLLSTTGLSYLCLSGCKRISEDGLCTLARHPRLNYLELAHLPAATQPVKLYLNKNLPCCKLLC
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	39.5	Very low	52.8	Low	193 Å²	193	99.5 Å²	99.5	95%	0.951	54%	0.536	S	S	*	.				0	-52.9	0	-86.9	-158.2	77.4	0	0	113.6	S3 F4 A5	M1-S3 VanDerWaalsContact C-N 3.28Å; M1-S3 PolarHBondContact O-N 2.89Å; M1-F4 PolarHBondContact O-N 2.92Å; M1-F4 VanDerWaalsContact O-N 3.13Å; M1-A5 PolarHBondContact O-N 2.92Å
2	T	35.7	Very low	53.2	Low	128 Å²	128	95.2 Å²	95.2	79%	0.785	52%	0.519	S	S	*	.	H	α-helix	trans	-56.1	-37.6	179.6	40.8	0	0	0	0	113.7	A5 K6	T2-A5 PolarHBondContact O-N 3.35Å; T2-K6 PolarHBondContact O-N 3.11Å
3	S	37.5	Very low	53.5	Low	46 Å²	46	92.7 Å²	92.7	32%	0.322	51%	0.505	S	S	.	.	H	α-helix	trans	-59.6	-51.4	171.1	45.8	0	0	0	0	113	M1 A5 K6 A7	M1-S3 VanDerWaalsContact C-N 3.28Å; M1-S3 PolarHBondContact O-N 2.89Å; S3-A5 VanDerWaalsContact C-N 3.33Å; S3-A5 PolarHBondContact O-N 3.29Å; S3-K6 WeakPolarHBondContact O-CB 3.43Å; S3-K6 PolarHBondContact O-N 2.99Å; S3-K6 VanDerWaalsContact O-N 3.15Å; S3-A7 PolarHBondContact O-N 2.95Å
4	F	53	Low	53.3	Low	133 Å²	133	89.8 Å²	89.8	58%	0.583	49%	0.489	S	S	*	.	H	α-helix	trans	-60.1	-40.6	174.2	-178.6	-98.3	0	0	0	112.3	M1 K6 A7 C8	M1-F4 PolarHBondContact O-N 2.92Å; M1-F4 VanDerWaalsContact O-N 3.13Å; F4-K6 VanDerWaalsContact C-N 3.34Å; F4-K6 PolarHBondContact O-N 3.47Å; F4-A7 PolarHBondContact O-N 3.1Å; F4-C8 VanDerWaalsContact CE1-SG 3.6Å; F4-C8 WeakPolarHBondContact O-CB 3.44Å; F4-C8 PolarHBondContact O-N 3.3Å; F4-C8 PolarHBondContact O-SG 3.01Å; F4-C8 VanDerWaalsContact O-SG 3.38Å
5	A	50.4	Low	53.2	Low	44 Å²	44	90 Å²	90	36%	0.364	49%	0.489	S	S	.	.	H	α-helix	trans	-61.9	-41.6	174.3	0	0	0	0	0	111.5	M1 T2 S3 C8 I9	M1-A5 PolarHBondContact O-N 2.92Å; T2-A5 PolarHBondContact O-N 3.35Å; S3-A5 VanDerWaalsContact C-N 3.33Å; S3-A5 PolarHBondContact O-N 3.29Å; A5-C8 PolarHBondContact O-N 3.3Å; A5-I9 WeakPolarHBondContact O-CB 3.46Å; A5-I9 WeakPolarHBondContact O-CD1 3.5Å; A5-I9 WeakPolarHBondContact O-CG1 3.37Å; A5-I9 PolarHBondContact O-N 3.19Å
6	K	56.9	Low	52.8	Low	133 Å²	133	92.3 Å²	92.3	58%	0.578	49%	0.492	S	S	*	.	H	α-helix	trans	-62.9	-48	174.2	-172.1	178.9	177.8	-171.8	0	111.7	T2 S3 F4 C8 I9 D10	T2-K6 PolarHBondContact O-N 3.11Å; S3-K6 WeakPolarHBondContact O-CB 3.43Å; S3-K6 PolarHBondContact O-N 2.99Å; S3-K6 VanDerWaalsContact O-N 3.15Å; F4-K6 VanDerWaalsContact C-N 3.34Å; F4-K6 PolarHBondContact O-N 3.47Å; K6-C8 VanDerWaalsContact C-N 3.32Å; K6-C8 PolarHBondContact O-N 3.34Å; K6-I9 PolarHBondContact O-N 3.49Å; K6-I9 VanDerWaalsContact O-N 3.08Å; K6-D10 WeakPolarHBondContact CG-OD2 3.47Å; K6-D10 PolarHBondContact O-N 3.47Å
7	A	55.2	Low	52.2	Low	53 Å²	53	93.7 Å²	93.7	44%	0.438	50%	0.5	S	S	.	.	H	α-helix	trans	-57.8	-42.6	175.7	0	0	0	0	0	112.3	S3 F4 D10 F11	S3-A7 PolarHBondContact O-N 2.95Å; F4-A7 PolarHBondContact O-N 3.1Å; A7-D10 PolarHBondContact O-N 3.04Å; A7-F11 VanDerWaalsContact O-CB 3.25Å; A7-F11 WeakPolarHBondContact O-CB 3.46Å; A7-F11 PolarHBondContact O-N 3.21Å
8	C	60.8	Low	51.5	Low	59 Å²	59	92.3 Å²	92.3	40%	0.399	49%	0.492	S	S	.	.	H	α-helix	trans	-67.1	-34.9	174.2	-73.8	0	0	0	0	113.3	F4 A5 K6 S12	F4-C8 VanDerWaalsContact CE1-SG 3.6Å; F4-C8 WeakPolarHBondContact O-CB 3.44Å; F4-C8 PolarHBondContact O-N 3.3Å; F4-C8 PolarHBondContact O-SG 3.01Å; F4-C8 VanDerWaalsContact O-SG 3.38Å; A5-C8 PolarHBondContact O-N 3.3Å; K6-C8 VanDerWaalsContact C-N 3.32Å; K6-C8 PolarHBondContact O-N 3.34Å; C8-S12 WeakPolarHBondContact O-CB 3.46Å; C8-S12 PolarHBondContact O-N 2.95Å
9	I	69.1	Low	50.7	Low	97 Å²	97	99.2 Å²	99.2	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-68	-45.2	174.4	-75	163	0	0	0	110.4	A5 K6 S12 N13	A5-I9 WeakPolarHBondContact O-CB 3.46Å; A5-I9 WeakPolarHBondContact O-CD1 3.5Å; A5-I9 WeakPolarHBondContact O-CG1 3.37Å; A5-I9 PolarHBondContact O-N 3.19Å; K6-I9 PolarHBondContact O-N 3.49Å; K6-I9 VanDerWaalsContact O-N 3.08Å; I9-S12 CarbonylContact O-C 3.57Å; I9-S12 WeakPolarHBondContact O-CB 3.31Å; I9-S12 PolarHBondContact O-N 3.45Å; I9-N13 WeakPolarHBondContact CG2-ND2 3.37Å; I9-N13 WeakPolarHBondContact O-CB 3.46Å; I9-N13 PolarHBondContact O-N 3.4Å; I9-N13 PolarHBondContact O-ND2 3.26Å
10	D	59.7	Low	49.8	Very low	65 Å²	65	104.1 Å²	104.1	35%	0.348	53%	0.528	S	S	.	.	H	α-helix	trans	-70.2	-35.7	179.8	-67.2	-27.8	0	0	0	111.2	K6 A7 N13 N14	K6-D10 WeakPolarHBondContact CG-OD2 3.47Å; K6-D10 PolarHBondContact O-N 3.47Å; A7-D10 PolarHBondContact O-N 3.04Å; D10-N13 PolarHBondContact O-N 3.18Å; D10-N14 WeakPolarHBondContact O-CB 3.35Å; D10-N14 PolarHBondContact O-N 3.37Å; D10-N14 PolarHBondContact O-ND2 2.86Å
11	F	62.9	Low	48.8	Very low	143 Å²	143	105.8 Å²	105.8	63%	0.627	54%	0.544	S	S	*	.	H	α-helix	trans	-64.2	-43.7	168	-169.1	-102.3	0	0	0	111.9	A7 N13 N14 L15	A7-F11 VanDerWaalsContact O-CB 3.25Å; A7-F11 WeakPolarHBondContact O-CB 3.46Å; A7-F11 PolarHBondContact O-N 3.21Å; F11-N13 PolarHBondContact O-N 3.3Å; F11-N14 PolarHBondContact O-N 2.91Å; F11-L15 HydrophobicContact CD1-CD1 3.82Å; F11-L15 HydrophobicContact CD1-CG 4.39Å; F11-L15 HydrophobicContact CE1-CD1 3.63Å; F11-L15 HydrophobicContact CE1-CG 4.26Å; F11-L15 HydrophobicContact CZ-CD1 4.46Å; F11-L15 WeakPolarHBondContact O-CG 3.35Å; F11-L15 PolarHBondContact O-N 3.31Å
12	S	57.6	Low	48.5	Very low	48 Å²	48	105.6 Å²	105.6	34%	0.336	54%	0.538	S	S	.	.	H	α-helix	trans	-62.6	-39.6	175.4	-177.1	0	0	0	0	112.4	C8 I9 L15 K16	C8-S12 WeakPolarHBondContact O-CB 3.46Å; C8-S12 PolarHBondContact O-N 2.95Å; I9-S12 CarbonylContact O-C 3.57Å; I9-S12 WeakPolarHBondContact O-CB 3.31Å; I9-S12 PolarHBondContact O-N 3.45Å; S12-L15 PolarHBondContact O-N 3.01Å; S12-K16 WeakPolarHBondContact O-CG 3.34Å; S12-K16 PolarHBondContact O-N 3.39Å
13	N	57.3	Low	48.2	Very low	63 Å²	63	104.9 Å²	104.9	34%	0.337	54%	0.538	S	S	.	.	H	α-helix	trans	-69.9	-37.9	177	-67.9	-24	0	0	0	111.4	I9 D10 F11 L15 K16 N17	I9-N13 WeakPolarHBondContact CG2-ND2 3.37Å; I9-N13 WeakPolarHBondContact O-CB 3.46Å; I9-N13 PolarHBondContact O-N 3.4Å; I9-N13 PolarHBondContact O-ND2 3.26Å; D10-N13 PolarHBondContact O-N 3.18Å; F11-N13 PolarHBondContact O-N 3.3Å; N13-L15 VanDerWaalsContact C-N 3.33Å; N13-L15 PolarHBondContact O-N 3.17Å; N13-K16 PolarHBondContact O-N 3.2Å; N13-K16 PolarHBondContact OD1-NZ 2.92Å; N13-N17 PolarHBondContact O-N 3.19Å
14	N	50.8	Low	47.8	Very low	52 Å²	52	110.4 Å²	110.4	28%	0.278	56%	0.564	S	S	.	*	H	α-helix	trans	-62.5	-37.4	169.6	-84.3	-65.2	0	0	0	113	D10 F11 N17 W819	D10-N14 WeakPolarHBondContact O-CB 3.35Å; D10-N14 PolarHBondContact O-N 3.37Å; D10-N14 PolarHBondContact O-ND2 2.86Å; F11-N14 PolarHBondContact O-N 2.91Å; N14-N17 PolarHBondContact O-N 3.33Å; N14-W819 VanDerWaalsContact OD1-CZ3 3.29Å; N14-W819 WeakPolarHBondContact OD1-CZ3 3.42Å
15	L	51.1	Low	46.8	Very low	93 Å²	93	108.6 Å²	108.6	49%	0.487	57%	0.574	S	S	.	*	H	α-helix	trans	-68.5	-36.2	172	-72.8	174.4	0	0	0	112.8	F11 S12 N13 N17 L18	F11-L15 HydrophobicContact CD1-CD1 3.82Å; F11-L15 HydrophobicContact CD1-CG 4.39Å; F11-L15 HydrophobicContact CE1-CD1 3.63Å; F11-L15 HydrophobicContact CE1-CG 4.26Å; F11-L15 HydrophobicContact CZ-CD1 4.46Å; F11-L15 WeakPolarHBondContact O-CG 3.35Å; F11-L15 PolarHBondContact O-N 3.31Å; S12-L15 PolarHBondContact O-N 3.01Å; N13-L15 VanDerWaalsContact C-N 3.33Å; N13-L15 PolarHBondContact O-N 3.17Å; L15-N17 PolarHBondContact O-N 3.33Å; L15-L18 HydrophobicContact CD2-CD1 4.22Å; L15-L18 WeakPolarHBondContact O-CA 3.22Å; L15-L18 WeakPolarHBondContact O-CB 3.11Å; L15-L18 PolarHBondContact O-N 2.93Å
16	K	47.6	Very low	45.7	Very low	126 Å²	126	112.9 Å²	112.9	55%	0.548	60%	0.596	S	S	.	*	H	α-helix	trans	-63.1	-27.9	175.5	-72.4	167.1	-160.8	160.6	0	113	S12 N13 L18	S12-K16 WeakPolarHBondContact O-CG 3.34Å; S12-K16 PolarHBondContact O-N 3.39Å; N13-K16 PolarHBondContact O-N 3.2Å; N13-K16 PolarHBondContact OD1-NZ 2.92Å; K16-L18 PolarHBondContact O-N 2.93Å
17	N	42.2	Very low	44.6	Very low	117 Å²	117	113.4 Å²	113.4	63%	0.626	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-14.5	173.2	-71.2	-21.7	0	0	0	113.1	N13 N14 L15 R19	N13-N17 PolarHBondContact O-N 3.19Å; N14-N17 PolarHBondContact O-N 3.33Å; L15-N17 PolarHBondContact O-N 3.33Å; N17-R19 PolarHBondContact O-N 3.4Å
18	L	38.9	Very low	43.5	Very low	69 Å²	69	116.9 Å²	116.9	36%	0.361	63%	0.626	S	S	.	*			trans	-85.9	57.6	164.3	-60.1	173.5	0	0	0	110.8	L15 K16 F20 W870	L15-L18 HydrophobicContact CD2-CD1 4.22Å; L15-L18 WeakPolarHBondContact O-CA 3.22Å; L15-L18 WeakPolarHBondContact O-CB 3.11Å; L15-L18 PolarHBondContact O-N 2.93Å; K16-L18 PolarHBondContact O-N 2.93Å; L18-F20 WeakPolarHBondContact O-CD2 3.45Å; L18-F20 PolarHBondContact O-N 2.92Å; L18-W870 HydrophobicContact CD2-CH2 3.41Å; L18-W870 VanDerWaalsContact CD2-CH2 3.41Å; L18-W870 HydrophobicContact CD2-CZ2 4Å; L18-W870 HydrophobicContact CD2-CZ3 4Å
19	R	36.8	Very low	42	Very low	223 Å²	223	119.5 Å²	119.5	84%	0.842	65%	0.645	S	S	*	*			trans	-62.4	100.5	165.2	-83.3	-170.4	176.4	178.9	-0.3	109.2	N17 T21	N17-R19 PolarHBondContact O-N 3.4Å; R19-T21 PolarHBondContact O-N 2.98Å; R19-T21 VanDerWaalsContact O-N 3.15Å
20	F	32.5	Very low	40.2	Very low	196 Å²	196	120.4 Å²	120.4	86%	0.86	66%	0.66	S	S	*	*			trans	-56.7	115.9	164.6	-72.5	-91.7	0	0	0	108.9	L18 K22	L18-F20 WeakPolarHBondContact O-CD2 3.45Å; L18-F20 PolarHBondContact O-N 2.92Å; F20-K22 PolarHBondContact O-N 3.36Å
21	T	29.8	Very low	38.7	Very low	141 Å²	141	123.6 Å²	123.6	87%	0.865	68%	0.682	S	S	*	*			trans	-68.5	92.5	174.4	47.5	0	0	0	0	109	R19 S23	R19-T21 PolarHBondContact O-N 2.98Å; R19-T21 VanDerWaalsContact O-N 3.15Å; T21-S23 PolarHBondContact O-N 2.9Å
22	K	32.4	Very low	37.1	Very low	189 Å²	189	123.4 Å²	123.4	82%	0.822	69%	0.692	S	S	*	*			trans	-60.8	125.3	172.9	-154.2	175	-173.3	-178	0	107.7	F20 N24	F20-K22 PolarHBondContact O-N 3.36Å; K22-N24 PolarHBondContact O-N 2.74Å
23	S	30.6	Very low	35.5	Very low	112 Å²	112	127.1 Å²	127.1	78%	0.783	71%	0.713	S	S	*	*			trans	-64.6	114.3	-176	51.3	0	0	0	0	110.7	T21 A25	T21-S23 PolarHBondContact O-N 2.9Å; S23-A25 PolarHBondContact O-N 3.27Å; S23-A25 VanDerWaalsContact O-N 3.16Å
24	N	28.3	Very low	34.3	Very low	162 Å²	162	130.7 Å²	130.7	87%	0.866	74%	0.737	S	S	*	*			trans	-71.2	106.6	171.7	-78.4	-5.5	0	0	0	109.3	K22	K22-N24 PolarHBondContact O-N 2.74Å
25	A	31.9	Very low	33.1	Very low	95 Å²	95	134.8 Å²	134.8	79%	0.785	76%	0.759	S	S	*	*			trans	-72	140.1	162.1	0	0	0	0	0	109.3	S23	S23-A25 PolarHBondContact O-N 3.27Å; S23-A25 VanDerWaalsContact O-N 3.16Å
26	T	27.4	Very low	32.2	Very low	135 Å²	135	137.7 Å²	137.7	83%	0.828	78%	0.775	S	S	*	*			trans	-84.1	124.6	-175.7	48.1	0	0	0	0	112.4
27	T	33.7	Very low	31.3	Very low	144 Å²	144	136.2 Å²	136.2	88%	0.883	78%	0.78	S	S	*	*			trans	-135	149.3	158.4	47.1	0	0	0	0	109.7
28	T	31.5	Very low	30.7	Very low	126 Å²	126	136.9 Å²	136.9	77%	0.773	79%	0.789	S	S	*	*			trans	-109.1	156.9	-159.7	47.3	0	0	0	0	114.3
29	S	30.1	Very low	30.2	Very low	113 Å²	113	137.7 Å²	137.7	79%	0.79	81%	0.806	S	S	*	*			trans	65.3	151.3	166.8	62.8	0	0	0	0	116.7
30	S	31.5	Very low	29.8	Very low	117 Å²	117	134 Å²	134	82%	0.818	81%	0.808	S	S	*	*			cis	-150.4	169.9	2	6.5	0	0	0	0	112.1
31	T	27.2	Very low	29.4	Very low	132 Å²	132	132.8 Å²	132.8	81%	0.81	81%	0.807	S	S	*	*			trans	-75.5	139.6	-175.6	48.6	0	0	0	0	115.9
32	V	29.9	Very low	29.3	Very low	138 Å²	138	133.1 Å²	133.1	84%	0.836	81%	0.809	S	S	*	*			trans	-145	142.9	139.5	-179.6	0	0	0	0	108.6
33	T	24.6	Very low	28.9	Very low	127 Å²	127	134.1 Å²	134.1	78%	0.779	81%	0.813	S	S	*	*			trans	-124.6	130	179.1	49.8	0	0	0	0	112
34	V	30.7	Very low	28.8	Very low	138 Å²	138	134.5 Å²	134.5	84%	0.836	82%	0.816	S	S	*	*			trans	-144.7	139.3	160.6	-174.9	0	0	0	0	108.9
35	N	25.6	Very low	28.6	Very low	138 Å²	138	131.9 Å²	131.9	74%	0.738	81%	0.81	S	S	*	*			trans	-98.1	156.2	177.8	-62.7	-32.1	0	0	0	111.3
36	N	32.1	Very low	28.4	Very low	154 Å²	154	133.5 Å²	133.5	82%	0.824	81%	0.81	S	S	*	*				176.8	130.5	120	-89.9	-9.7	0	0	0	116.3
37	S	30.4	Very low	28.2	Very low	95 Å²	95	132.2 Å²	132.2	66%	0.664	80%	0.802	S	S	*	*			trans	37.7	111.3	139.8	66.3	0	0	0	0	123.9
38	T	29.1	Very low	27.8	Very low	130 Å²	130	132.4 Å²	132.4	80%	0.798	80%	0.797	S	S	*	*				59.6	106.9	124.3	62.1	0	0	0	0	123.8
39	A	27.4	Very low	27.5	Very low	87 Å²	87	133.1 Å²	133.1	72%	0.719	80%	0.796	S	S	*	*				85.3	148.1	109.5	0	0	0	0	0	124.7
40	T	28.3	Very low	27.1	Very low	145 Å²	145	137.9 Å²	137.9	89%	0.89	80%	0.803	S	S	*	*			trans	88.4	150.4	164.9	73.7	0	0	0	0	120.2
41	M	24.7	Very low	26.8	Very low	171 Å²	171	141.1 Å²	141.1	84%	0.842	81%	0.805	S	S	*	*			trans	-74.7	155.1	-153.1	-45.1	-179.7	81.2	0	0	114.5
42	T	28.8	Very low	26.6	Very low	147 Å²	147	139.5 Å²	139.5	90%	0.902	80%	0.799	S	S	*	*				-168.8	179.9	96.2	23.3	0	0	0	0	113.2
43	K	23.8	Very low	26.3	Very low	210 Å²	210	139.4 Å²	139.4	91%	0.913	79%	0.794	S	S	*	*			trans	-71.2	141.1	-170	-55.6	168.8	-176.7	172.4	0	113.4
44	S	28.3	Very low	26.5	Very low	120 Å²	120	139.8 Å²	139.8	84%	0.839	80%	0.796	S	S	*	*			trans	-141	154.5	148.9	67.7	0	0	0	0	110.5
45	S	23.1	Very low	26.1	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	79%	0.794	S	S	*	*			trans	-95.5	135	-172.3	51.5	0	0	0	0	112.4
46	V	27.9	Very low	26.1	Very low	129 Å²	129	143.8 Å²	143.8	78%	0.782	80%	0.801	S	S	*	*			trans	-110.4	111.4	161.1	179.4	0	0	0	0	108.5	L48	V46-L48 HydrophobicContact CG1-CG 4.5Å
47	V	24.3	Very low	25.6	Very low	109 Å²	109	144.4 Å²	144.4	66%	0.661	81%	0.805	S	S	*	*			trans	-79.3	132.5	169.7	176.6	0	0	0	0	108.3
48	L	24.6	Very low	25.5	Very low	147 Å²	147	144.9 Å²	144.9	77%	0.77	81%	0.808	S	S	*	*			trans	-117.2	107.5	165	-70.7	177.8	0	0	0	108.5	V46 F50	V46-L48 HydrophobicContact CG1-CG 4.5Å; L48-F50 PolarHBondContact O-N 2.96Å
49	N	25	Very low	25.4	Very low	142 Å²	142	144.8 Å²	144.8	76%	0.759	81%	0.807	S	S	*	*			trans	-66	127.5	172.5	-75.8	-9.1	0	0	0	109.5
50	F	22.1	Very low	25.2	Very low	212 Å²	212	147 Å²	147	93%	0.93	81%	0.812	S	S	*	*			trans	-87.8	124	156.8	-81.5	-90.3	0	0	0	108.4	L48	L48-F50 PolarHBondContact O-N 2.96Å
51	Q	24.6	Very low	25.1	Very low	185 Å²	185	146.7 Å²	146.7	86%	0.864	81%	0.805	S	S	*	*			trans	-127.1	128.9	170.5	-162.5	166.2	3.2	0	0	107
52	S	22.5	Very low	24.9	Very low	98 Å²	98	147.4 Å²	147.4	69%	0.685	81%	0.806	S	S	*	*			trans	-86.5	149.8	-173.5	58.6	0	0	0	0	111.7
53	D	24.6	Very low	24.8	Very low	137 Å²	137	150.3 Å²	150.3	73%	0.733	80%	0.802	S	S	*	*				172.5	174.6	113.6	-85.4	-2.1	0	0	0	112.5
54	T	28.3	Very low	24.8	Very low	134 Å²	134	147.8 Å²	147.8	82%	0.822	80%	0.797	S	S	*	*			trans	74.5	62.8	169.6	65.8	0	0	0	0	119.2
55	I	23.3	Very low	24.4	Very low	156 Å²	156	149.6 Å²	149.6	80%	0.8	80%	0.795	S	S	*	*				27.4	115.6	124.5	-53	170.2	0	0	0	117.7
56	K	24.6	Very low	24.4	Very low	204 Å²	204	150 Å²	150	89%	0.887	80%	0.798	S	S	*	*			trans	-159.5	121.5	130.8	-114.5	166.2	-172.9	173.5	0	112.2
57	N	21.5	Very low	24.1	Very low	168 Å²	168	149.8 Å²	149.8	90%	0.898	80%	0.797	S	S	*	*			trans	-93.6	119.6	177.9	-77	-29.9	0	0	0	111.3
58	S	27.9	Very low	24.1	Very low	105 Å²	105	151.5 Å²	151.5	73%	0.734	81%	0.808	S	S	*	*			trans	-149	98.6	161.1	57	0	0	0	0	108.4
59	V	27.9	Very low	24	Very low	128 Å²	128	152 Å²	152	78%	0.776	81%	0.811	S	S	*	*				74.9	124.7	97.9	170.5	0	0	0	0	112.8
60	T	23.2	Very low	24	Very low	134 Å²	134	157.1 Å²	157.1	82%	0.822	82%	0.82	S	S	*	*			trans	-65.2	126.1	179.5	46.6	0	0	0	0	112.3
61	N	25.7	Very low	24.1	Very low	138 Å²	138	154.5 Å²	154.5	74%	0.738	81%	0.814	S	S	*	*			trans	-103.4	93.9	169.2	-81.3	-19.9	0	0	0	110.8
62	E	20.9	Very low	24.2	Very low	185 Å²	185	152.4 Å²	152.4	86%	0.864	81%	0.814	S	S	*	*			trans	-79	129.6	138.9	-65.2	-176.1	129.7	0	0	106.6
63	Y	26.6	Very low	24.2	Very low	208 Å²	208	151.6 Å²	151.6	82%	0.816	81%	0.813	S	S	*	*			trans	-140.8	135.3	165.6	-104.3	-75.7	0	0	0	112.4
64	I	23.5	Very low	24.3	Very low	158 Å²	158	153 Å²	153	81%	0.81	82%	0.82	S	S	*	*			trans	-90.5	151.8	-174	-67.2	170.4	0	0	0	110	S66	I64-S66 PolarHBondContact O-N 3.4Å
65	I	20.5	Very low	24.1	Very low	157 Å²	157	154 Å²	154	81%	0.805	82%	0.821	S	S	*	*			trans	-53.5	133.6	175.2	-60.3	161.7	0	0	0	110.9	V67	I65-V67 HydrophobicContact CG2-CG2 4.41Å
66	S	22.7	Very low	24.5	Very low	116 Å²	116	151.3 Å²	151.3	81%	0.811	82%	0.816	S	S	*	*			trans	-138.4	146.2	156.4	65.4	0	0	0	0	110.9	I64	I64-S66 PolarHBondContact O-N 3.4Å
67	V	21	Very low	24.7	Very low	125 Å²	125	150.8 Å²	150.8	76%	0.758	81%	0.813	S	S	*	*			trans	-138.6	120.3	179.6	173.3	0	0	0	0	108.3	I65	I65-V67 HydrophobicContact CG2-CG2 4.41Å
68	T	24.7	Very low	25.2	Very low	145 Å²	145	147.8 Å²	147.8	89%	0.89	80%	0.801	S	S	*	*			trans	-161.3	142.2	148.3	9	0	0	0	0	111.4
69	N	22.5	Very low	25.3	Very low	156 Å²	156	149.1 Å²	149.1	83%	0.834	80%	0.8	S	S	*	*			trans	-79.6	148	175.3	-67.8	-35.8	0	0	0	111.8
70	R	25.6	Very low	25.4	Very low	250 Å²	250	148.6 Å²	148.6	94%	0.943	79%	0.793	S	S	*	*			trans	-154.8	148	132	-117	172.1	-170.4	-173	2.5	112.9
71	I	23.3	Very low	25.9	Very low	157 Å²	157	148.6 Å²	148.6	81%	0.805	78%	0.783	S	S	*	*			trans	-101.7	130.4	-179.5	-61	163	0	0	0	108.3
72	V	26.8	Very low	26.2	Very low	142 Å²	142	149.8 Å²	149.8	86%	0.861	78%	0.784	S	S	*	*			trans	-140.7	134.7	148.8	-179.2	0	0	0	0	106.9
73	A	23.4	Very low	26.6	Very low	80 Å²	80	145 Å²	145	66%	0.661	77%	0.772	S	S	*	*			trans	-114.1	147.3	170.2	0	0	0	0	0	109.4
74	N	26.9	Very low	26.6	Very low	166 Å²	166	142.4 Å²	142.4	89%	0.888	77%	0.772	S	S	*	*			trans	-158.4	143.4	148.5	-110.6	-23.6	0	0	0	111.1
75	N	24.7	Very low	26.9	Very low	157 Å²	157	140.3 Å²	140.3	84%	0.84	77%	0.766	S	S	*	*			trans	-97.3	153.6	178.4	-65.7	-50	0	0	0	110.2
76	S	30.7	Very low	27.3	Very low	99 Å²	99	140.5 Å²	140.5	69%	0.692	77%	0.769	S	S	*	*				174.7	126.9	114.6	59.9	0	0	0	0	115.5
77	K	29.5	Very low	27.4	Very low	192 Å²	192	140.1 Å²	140.1	84%	0.835	77%	0.766	S	S	*	*				71.8	150.2	127	-66.7	-176.7	180	179.8	0	119.1
78	T	31.4	Very low	27.9	Very low	105 Å²	105	139.8 Å²	139.8	64%	0.644	76%	0.764	S	S	*	*			cis	-160.8	156.7	4.2	3.4	0	0	0	0	113.3
79	N	29.5	Very low	28.1	Very low	134 Å²	134	140.9 Å²	140.9	72%	0.717	76%	0.759	S	S	*	*			trans	68.2	145.4	149.4	-64.6	-2.2	0	0	0	118.8
80	N	31.1	Very low	28.4	Very low	116 Å²	116	139.7 Å²	139.7	62%	0.62	75%	0.749	S	S	*	*			cis	-155.9	-157.6	-0.3	-129.8	5.1	0	0	0	109.7
81	H	32.6	Very low	28.6	Very low	134 Å²	134	134.5 Å²	134.5	62%	0.62	73%	0.733	S	S	*	*			cis	-158.7	147.7	6.5	-122.2	-66.9	0	0	0	109.1
82	H	31.3	Very low	28.9	Very low	164 Å²	164	134.6 Å²	134.6	76%	0.759	73%	0.73	S	S	*	*			trans	60.2	152	154.5	-67.7	-45.8	0	0	0	121.5
83	S	30	Very low	28.9	Very low	85 Å²	85	137.9 Å²	137.9	59%	0.594	73%	0.727	S	S	*	*			cis	-171.6	149.1	-16.3	50.8	0	0	0	0	113.3
84	N	27.8	Very low	29.2	Very low	153 Å²	153	141.6 Å²	141.6	82%	0.818	74%	0.736	S	S	*	*			trans	63.5	162.8	147.2	-70.2	14.2	0	0	0	120.7
85	V	29.4	Very low	29.2	Very low	113 Å²	113	140.5 Å²	140.5	69%	0.685	73%	0.725	S	S	*	*			cis	-176.1	138.1	-44.3	126.5	0	0	0	0	108.2
86	N	28.3	Very low	29.5	Very low	162 Å²	162	140.8 Å²	140.8	87%	0.866	72%	0.719	S	S	*	*			trans	163.3	162.5	142.9	-90.8	-24.2	0	0	0	114.2
87	S	25.5	Very low	29.5	Very low	108 Å²	108	142.1 Å²	142.1	76%	0.755	72%	0.718	S	S	*	*			trans	-163.6	133.1	-175.2	55.5	0	0	0	0	113.5
88	T	30.8	Very low	29.6	Very low	118 Å²	118	138.9 Å²	138.9	72%	0.724	71%	0.706	S	S	*	*			trans	-163.4	129.7	165.2	33.3	0	0	0	0	109.3
89	E	29.4	Very low	29.6	Very low	168 Å²	168	141.1 Å²	141.1	79%	0.785	71%	0.706	S	S	*	*				75.5	145.8	101.4	-59.7	178.5	161.9	0	0	115.6
90	E	28.2	Very low	29.6	Very low	131 Å²	131	140.7 Å²	140.7	61%	0.612	70%	0.704	S	S	*	*			cis	-162.1	152.5	-13.8	-115.3	-160.5	158.6	0	0	114.6
91	K	29.3	Very low	29.4	Very low	141 Å²	141	138.8 Å²	138.8	61%	0.613	70%	0.7	S	S	*	*			trans	61	155.8	143.1	-70.2	178.9	-176.9	133.5	0	125.7
92	H	30.9	Very low	29.2	Very low	158 Å²	158	140 Å²	140	73%	0.731	71%	0.706	S	S	*	*			trans	75.1	154.3	157	-65	-64	0	0	0	120.6
93	R	27.1	Very low	29.1	Very low	211 Å²	211	138.7 Å²	138.7	80%	0.796	70%	0.7	S	S	*	*			cis	179.2	134.3	-44.8	-133.3	-169.6	-176.4	172.3	0.4	107.7
94	N	28.8	Very low	29.1	Very low	159 Å²	159	142.5 Å²	142.5	85%	0.85	71%	0.706	S	S	*	*			trans	176.7	172.6	132.8	-94.4	-10.3	0	0	0	113.3
95	E	27.8	Very low	29.2	Very low	142 Å²	142	140 Å²	140	66%	0.664	70%	0.696	S	S	*	*			trans	-124.8	176.9	-159.4	-46.4	169.8	118.7	0	0	113.5
96	K	30.5	Very low	29	Very low	164 Å²	164	141.4 Å²	141.4	71%	0.713	70%	0.7	S	S	*	*			trans	72.8	140.2	163	-65.7	140.9	-178	156.6	0	113.7
97	N	30.1	Very low	29.1	Very low	127 Å²	127	139.1 Å²	139.1	68%	0.679	69%	0.688	S	S	*	*			cis	-158.6	171.4	11.3	-116	-12.4	0	0	0	108.9
98	H	32.5	Very low	29.3	Very low	123 Å²	123	142 Å²	142	57%	0.569	69%	0.687	S	S	*	*			cis	-157.6	-179.4	6.2	-142.5	25.5	0	0	0	111.9
99	K	30.6	Very low	28.9	Very low	152 Å²	152	141.9 Å²	141.9	66%	0.661	69%	0.69	S	S	*	*			trans	3.8	150.5	144.6	-66.1	-174.6	-174.6	144.8	0	120.8
100	N	29.1	Very low	29	Very low	126 Å²	126	140 Å²	140	67%	0.674	69%	0.69	S	S	*	*			cis	-162	150.8	13.4	-130.6	35.9	0	0	0	114.9
101	S	28.2	Very low	28.9	Very low	76 Å²	76	140.8 Å²	140.8	53%	0.531	70%	0.696	S	S	.	*			trans	33.7	144.7	134.9	66.6	0	0	0	0	123.3
102	E	27.9	Very low	28.7	Very low	159 Å²	159	139 Å²	139	74%	0.743	70%	0.701	S	S	*	*			cis	-174.1	156	0.3	-111.3	159.5	-131.7	0	0	112.2
103	H	29.5	Very low	28.5	Very low	137 Å²	137	137.6 Å²	137.6	63%	0.634	70%	0.699	S	S	*	*			trans	55.5	159.5	146.7	-71.2	-52.9	0	0	0	122.4
104	F	29.3	Very low	28.5	Very low	165 Å²	165	136.4 Å²	136.4	72%	0.724	70%	0.699	S	S	*	*			cis	-149.1	167.1	-4.3	-118.6	-51.8	0	0	0	111.5
105	T	29.7	Very low	28.3	Very low	100 Å²	100	135.2 Å²	135.2	61%	0.613	69%	0.692	S	S	*	*			trans	-33.1	163.9	163.2	48.9	0	0	0	0	118.8
106	D	26.5	Very low	28.2	Very low	143 Å²	143	137 Å²	137	77%	0.765	70%	0.698	S	S	*	*			cis	-165.7	179.1	-0.3	-119	-36.7	0	0	0	113.1
107	D	29.3	Very low	28.2	Very low	113 Å²	113	135.1 Å²	135.1	60%	0.604	70%	0.702	S	S	*	*			trans	86.5	114.9	143	-111.2	9.6	0	0	0	125.2
108	K	29.8	Very low	28	Very low	169 Å²	169	136.6 Å²	136.6	74%	0.735	71%	0.709	S	S	*	*			trans	71.3	136.4	137.8	-70.7	170.9	-177.5	79	0	124.4
109	C	23.4	Very low	28.2	Very low	116 Å²	116	136 Å²	136	78%	0.784	72%	0.716	S	S	*	*			trans	-14.3	154.8	162	-48.7	0	0	0	0	120.1
110	T	29.8	Very low	28.1	Very low	128 Å²	128	135.9 Å²	135.9	79%	0.785	72%	0.722	S	S	*	*			cis	-164.3	147.6	45.3	-43.9	0	0	0	0	115.4
111	I	27.2	Very low	28.1	Very low	147 Å²	147	136.1 Å²	136.1	75%	0.754	72%	0.724	S	S	*	*			trans	-22.2	143.2	169.5	-62.6	162.7	0	0	0	120.7
112	C	24.4	Very low	28	Very low	105 Å²	105	140.1 Å²	140.1	71%	0.709	74%	0.737	S	S	*	*			trans	74.6	151	160.7	-85.7	0	0	0	0	118.4
113	N	26.5	Very low	28.1	Very low	128 Å²	128	137.6 Å²	137.6	68%	0.684	74%	0.738	S	S	*	*			cis	-163.3	153	14.8	-128.4	-23.9	0	0	0	113.5
114	K	27.5	Very low	28.1	Very low	185 Å²	185	135.8 Å²	135.8	80%	0.804	75%	0.746	S	S	*	*			trans	64	168.9	160.8	-62.8	176.1	-178.4	178.5	0	118.4
115	L	24.2	Very low	28.2	Very low	135 Å²	135	132.4 Å²	132.4	71%	0.707	74%	0.743	S	S	*	*				-179.2	141.3	-53.1	-112.7	171.6	0	0	0	109.2
116	F	25.8	Very low	28	Very low	180 Å²	180	135.2 Å²	135.2	79%	0.789	75%	0.754	S	S	*	*			trans	67	149.9	175.5	-58.4	-71.2	0	0	0	118
117	P	31.4	Very low	28.2	Very low	123 Å²	123	133.3 Å²	133.3	80%	0.799	76%	0.759	S	S	*	*				-143.9	160.9	106	40.2	-27.7	0	0	0	115.8
118	I	25	Very low	28.1	Very low	158 Å²	158	133.4 Å²	133.4	81%	0.81	77%	0.768	S	S	*	*			trans	-142	171.9	151.6	-11.1	177.6	0	0	0	107.7
119	P	38	Very low	28.1	Very low	112 Å²	112	132.9 Å²	132.9	73%	0.727	77%	0.773	S	S	*	*				-114.1	-173.6	-113.2	41.7	-27	0	0	0	114.3
120	N	27.4	Very low	28.4	Very low	148 Å²	148	132 Å²	132	79%	0.791	77%	0.765	S	S	*	*			trans	-165.5	150.5	156.7	-105.3	-23.7	0	0	0	114.5
121	N	29	Very low	28.5	Very low	132 Å²	132	132.3 Å²	132.3	71%	0.706	76%	0.761	S	S	*	*			trans	60.3	132.4	163.1	-53.3	-9.7	0	0	0	117.9
122	I	27.2	Very low	28.7	Very low	159 Å²	159	131.8 Å²	131.8	82%	0.815	76%	0.76	S	S	*	*			cis	80.6	99.2	24.5	-50	170.8	0	0	0	115.1
123	S	28.9	Very low	29	Very low	107 Å²	107	132.8 Å²	132.8	75%	0.748	76%	0.758	S	S	*	*				168.3	129.8	114.9	61.9	0	0	0	0	114.5
124	A	29.5	Very low	29.1	Very low	98 Å²	98	132 Å²	132	81%	0.81	76%	0.759	S	S	*	*			trans	57.1	151.1	148.6	0	0	0	0	0	121.5
125	S	30.7	Very low	29.3	Very low	95 Å²	95	130.4 Å²	130.4	66%	0.664	76%	0.764	S	S	*	*			cis	-169.7	152.4	-18.5	50.1	0	0	0	0	112.5
126	D	27.5	Very low	29.4	Very low	158 Å²	158	129.2 Å²	129.2	85%	0.845	77%	0.767	S	S	*	*			trans	71.2	170.1	149.4	-57.8	-21.1	0	0	0	123.4
127	A	30	Very low	29.8	Very low	104 Å²	104	128.3 Å²	128.3	86%	0.86	77%	0.769	S	S	*	*			trans	80.5	88.3	175.6	0	0	0	0	0	118.5
128	S	26.2	Very low	29.8	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	77%	0.768	S	S	*	*			trans	-70.6	157.7	163.3	55.5	0	0	0	0	113.6
129	N	29.5	Very low	30	Very low	159 Å²	159	125.9 Å²	125.9	85%	0.85	76%	0.758	S	S	*	*			trans	-146	150.3	141.2	-146.4	-7.1	0	0	0	112.1
130	T	30.5	Very low	29.8	Very low	98 Å²	98	126.8 Å²	126.8	60%	0.601	76%	0.761	S	S	*	*			trans	-119.6	157.8	-172.1	57.6	0	0	0	0	111.8
131	N	31.1	Very low	29.9	Very low	134 Å²	134	126.8 Å²	126.8	72%	0.717	76%	0.761	S	S	*	*				156.3	159.8	114.7	-84	-29.8	0	0	0	115.1
132	N	32.6	Very low	30.2	Very low	136 Å²	136	129 Å²	129	73%	0.727	77%	0.772	S	S	*	*			trans	79.1	144.2	154.1	-62.6	-30.6	0	0	0	120.5
133	N	30.2	Very low	30.3	Very low	126 Å²	126	125 Å²	125	67%	0.674	77%	0.77	S	S	*	*			cis	-165	157.2	-43.5	-121.9	-32.8	0	0	0	112.1
134	T	28.6	Very low	30.5	Very low	112 Å²	112	123.8 Å²	123.8	69%	0.687	78%	0.775	S	S	*	*			trans	12	135.2	155.2	57.2	0	0	0	0	121.7
135	T	31.3	Very low	30.7	Very low	151 Å²	151	130.3 Å²	130.3	93%	0.926	78%	0.778	S	S	*	*				-169.4	165.4	110.8	17.5	0	0	0	0	112.5
136	S	26.6	Very low	30.9	Very low	110 Å²	110	132.6 Å²	132.6	77%	0.769	78%	0.781	S	S	*	*			trans	-143.2	143.9	-169	56.3	0	0	0	0	113.1
137	I	34.6	Very low	31.3	Very low	160 Å²	160	129.9 Å²	129.9	82%	0.821	78%	0.775	S	S	*	*			trans	-153.6	119.8	166.6	-93	140	0	0	0	105.3
138	N	30.9	Very low	31.5	Very low	145 Å²	145	131.4 Å²	131.4	78%	0.775	77%	0.769	S	S	*	*				65.4	138.5	75.4	-78.1	-11.9	0	0	0	114.4
139	S	30.2	Very low	31.8	Very low	86 Å²	86	133.3 Å²	133.3	60%	0.601	77%	0.765	S	S	*	*			cis	-175.4	177.3	-10.9	47.6	0	0	0	0	111.3
140	T	32.3	Very low	32	Very low	130 Å²	130	132.3 Å²	132.3	80%	0.798	75%	0.753	S	S	*	*			trans	76	164.5	159.6	69.3	0	0	0	0	121.3
141	N	30.9	Very low	32	Very low	149 Å²	149	134.3 Å²	134.3	80%	0.797	76%	0.756	S	S	*	*				-174.5	150.5	-55.6	-134.9	-7.3	0	0	0	110.7
142	L	34.9	Very low	31.9	Very low	177 Å²	177	134.5 Å²	134.5	93%	0.927	76%	0.757	S	S	*	*			trans	157.4	139.1	157.4	-92.5	157.2	0	0	0	111.1
143	G	29.9	Very low	31.9	Very low	76 Å²	76	133.2 Å²	133.2	78%	0.784	76%	0.758	S	S	*	*			cis	165.9	129.3	-14.5	0	0	0	0	0	115.5
144	G	32.5	Very low	31.7	Very low	81 Å²	81	132.6 Å²	132.6	84%	0.835	76%	0.764	S	S	*	*			trans	92.6	142.6	167.7	0	0	0	0	0	116.4
145	R	33.6	Very low	31.9	Very low	236 Å²	236	134.4 Å²	134.4	89%	0.891	78%	0.775	S	S	*	*			cis	-136.6	141.2	1.8	-85.5	177.5	166.3	170.7	-5.9	108.3
146	I	35.5	Very low	31.7	Very low	142 Å²	142	135.8 Å²	135.8	73%	0.728	78%	0.775	S	S	*	*				60.6	127.9	74.4	-57.1	169	0	0	0	111.4
147	S	36.1	Very low	31.8	Very low	102 Å²	102	133.6 Å²	133.6	71%	0.713	77%	0.77	S	S	*	*			cis	-125.4	158.3	20.6	5.5	0	0	0	0	113.2
148	D	33.3	Very low	31.6	Very low	136 Å²	136	136.5 Å²	136.5	73%	0.727	78%	0.777	S	S	*	*				68.9	130.5	62.7	-47	-51.3	0	0	0	113.6
149	E	32.2	Very low	31.5	Very low	154 Å²	154	134.9 Å²	134.9	72%	0.72	78%	0.777	S	S	*	*			cis	-129.6	-154.8	3.7	-57.9	-171.1	99.8	0	0	111.1
150	K	33.9	Very low	31.5	Very low	137 Å²	137	138.7 Å²	138.7	60%	0.596	79%	0.787	S	S	*	*			cis	-156.9	-152.8	2.9	-143.7	-178.7	-177.3	64.3	0	113.1
151	E	30.1	Very low	31.3	Very low	141 Å²	141	139.6 Å²	139.6	66%	0.659	79%	0.792	S	S	*	*			trans	-87.5	177.5	-171.6	-55.9	119.4	-179.7	0	0	114
152	D	30.7	Very low	31.4	Very low	137 Å²	137	137.2 Å²	137.2	73%	0.733	78%	0.783	S	S	*	*			cis	-142.4	134.4	11.7	-107.7	-49.2	0	0	0	108.3
153	S	31.9	Very low	31.1	Very low	109 Å²	109	137 Å²	137	76%	0.762	77%	0.774	S	S	*	*				86.2	157.3	68.1	94.9	0	0	0	0	115.5
154	S	26.3	Very low	31.2	Very low	113 Å²	113	140.2 Å²	140.2	79%	0.79	77%	0.769	S	S	*	*			trans	-132	144.7	-154.2	61.5	0	0	0	0	114.7
155	V	31.6	Very low	31.1	Very low	151 Å²	151	141 Å²	141	92%	0.915	76%	0.762	S	S	*	*			trans	-133.7	130.8	166.7	-178.5	0	0	0	0	111.3
156	L	26.8	Very low	30.6	Very low	179 Å²	179	138.6 Å²	138.6	94%	0.937	76%	0.761	S	S	*	*			trans	-141.3	118	172.2	-167.5	168	0	0	0	107.5
157	G	29.3	Very low	30.3	Very low	65 Å²	65	139 Å²	139	67%	0.67	76%	0.762	S	S	*	*			trans	162.2	105.4	175.2	0	0	0	0	0	117.2
158	K	31.7	Very low	29.9	Very low	221 Å²	221	141.7 Å²	141.7	96%	0.961	77%	0.769	S	S	*	*			trans	-136.7	142.8	140.9	-82.8	-168.4	175.6	-179.5	0	107.6
159	S	28.2	Very low	29.5	Very low	110 Å²	110	139.8 Å²	139.8	77%	0.769	77%	0.767	S	S	*	*			trans	-152	155.2	-170.2	-168.6	0	0	0	0	113.2
160	M	29.4	Very low	29.4	Very low	166 Å²	166	139.7 Å²	139.7	82%	0.818	77%	0.77	S	S	*	*			trans	61.2	118.8	160	-80.6	179.4	166.4	0	0	121.6
161	V	29.7	Very low	29.1	Very low	149 Å²	149	140.4 Å²	140.4	90%	0.903	78%	0.775	S	S	*	*				-171.2	154.7	126.1	139.2	0	0	0	0	108.8
162	V	32.3	Very low	28.9	Very low	100 Å²	100	140.4 Å²	140.4	61%	0.606	78%	0.78	S	S	*	*				-174.2	151.7	-58.6	136.7	0	0	0	0	109.1
163	K	28.5	Very low	29.2	Very low	172 Å²	172	139.4 Å²	139.4	75%	0.748	78%	0.781	S	S	*	*			trans	70	156.3	175.4	-77.7	166.5	167.4	-150.5	0	116.4
164	H	31.7	Very low	28.8	Very low	143 Å²	143	140 Å²	140	66%	0.662	78%	0.78	S	S	*	*			cis	-153.9	162.1	0.4	-116	-53.6	0	0	0	110.6
165	S	29.6	Very low	29	Very low	99 Å²	99	142.1 Å²	142.1	69%	0.692	78%	0.781	S	S	*	*			trans	57.9	135.9	163.3	45.7	0	0	0	0	118.7
166	E	23.9	Very low	28.8	Very low	185 Å²	185	140.4 Å²	140.4	86%	0.864	78%	0.776	S	S	*	*			cis	78.8	150.6	40.6	-67.4	-165.4	138.9	0	0	116.4
167	I	29.9	Very low	29.4	Very low	149 Å²	149	136.8 Å²	136.8	76%	0.764	76%	0.763	S	S	*	*			trans	75.7	90.6	175.7	-48.4	172.2	0	0	0	115.9
168	N	27.6	Very low	29.4	Very low	159 Å²	159	140.6 Å²	140.6	85%	0.85	77%	0.768	S	S	*	*				-172.9	142	99.1	-111.6	-31.6	0	0	0	114.1
169	S	24.7	Very low	29.4	Very low	97 Å²	97	135.5 Å²	135.5	68%	0.678	76%	0.756	S	S	*	*			trans	-139	138.3	168.2	55.6	0	0	0	0	108.9
170	L	30.3	Very low	29.5	Very low	152 Å²	152	136.6 Å²	136.6	80%	0.796	76%	0.758	S	S	*	*			trans	176.5	124.2	153.3	-113.4	72.5	0	0	0	106.1
171	E	27.6	Very low	29.6	Very low	151 Å²	151	132.8 Å²	132.8	71%	0.706	75%	0.752	S	S	*	*				76.8	102.8	78.6	-67.7	-163.6	137.7	0	0	117.1
172	N	24.5	Very low	29.6	Very low	142 Å²	142	134 Å²	134	76%	0.759	75%	0.751	S	S	*	*				64.5	-178.4	129.1	-57.3	-32.9	0	0	0	118.1
173	P	37.4	Very low	29.5	Very low	116 Å²	116	135.2 Å²	135.2	75%	0.753	76%	0.758	S	S	*	*				-134.5	-163.9	-85.6	43.2	-26	0	0	0	114.6
174	T	24.6	Very low	29.5	Very low	121 Å²	121	134.9 Å²	134.9	74%	0.742	76%	0.759	S	S	*	*			trans	-47.2	140.7	174.1	53.1	0	0	0	0	116
175	I	29.6	Very low	29.3	Very low	157 Å²	157	133.3 Å²	133.3	81%	0.805	76%	0.756	S	S	*	*				173.8	129.2	117.4	-88.5	154.2	0	0	0	111.6
176	S	28.4	Very low	29.1	Very low	115 Å²	115	138.7 Å²	138.7	80%	0.804	76%	0.761	S	S	*	*			trans	-165.9	151.2	137.4	42.1	0	0	0	0	110.1
177	P	38.2	Very low	29.2	Very low	103 Å²	103	138 Å²	138	67%	0.669	76%	0.755	S	S	*	*			trans	-135	-171.4	-147.1	40.3	-21.1	0	0	0	116.9
178	N	29.2	Very low	29.1	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	75%	0.752	S	S	*	*			trans	83.2	144.6	170.9	-51.6	-29.9	0	0	0	115.2
179	T	31.8	Very low	29.3	Very low	115 Å²	115	136.6 Å²	136.6	71%	0.706	75%	0.748	S	S	*	*			cis	-150.2	138.1	18.6	-33	0	0	0	0	112
180	T	31.8	Very low	29.5	Very low	133 Å²	133	139.1 Å²	139.1	82%	0.816	75%	0.752	S	S	*	*			trans	50.5	143.4	155.3	47.7	0	0	0	0	121.4
181	A	30.5	Very low	29.9	Very low	85 Å²	85	136.8 Å²	136.8	70%	0.702	75%	0.746	S	S	*	*			cis	-167.6	171.5	-10.9	0	0	0	0	0	111.3
182	M	29.3	Very low	29.8	Very low	175 Å²	175	137.8 Å²	137.8	86%	0.862	76%	0.756	S	S	*	*			trans	4.7	148	144	-65.1	-168.9	165.6	0	0	120.5
183	T	29.5	Very low	29.9	Very low	125 Å²	125	134.6 Å²	134.6	77%	0.767	76%	0.757	S	S	*	*			cis	-163.1	176.8	0.7	11.6	0	0	0	0	112.4
184	Q	29.8	Very low	29.4	Very low	165 Å²	165	134.7 Å²	134.7	77%	0.771	76%	0.76	S	S	*	*			trans	-53.6	168.2	173.2	-52.8	170.9	-7.7	0	0	117.3
185	N	26.7	Very low	29.8	Very low	111 Å²	111	135.6 Å²	135.6	59%	0.594	77%	0.765	S	S	*	*			trans	95.9	106.7	140.8	-82.2	-49.2	0	0	0	122.2
186	R	25.9	Very low	29.6	Very low	212 Å²	212	135.4 Å²	135.4	80%	0.8	77%	0.766	S	S	*	*				63.9	127	121	-78.3	178.9	168.5	172.7	-2.2	121.5
187	K	27	Very low	29.7	Very low	171 Å²	171	135 Å²	135	74%	0.743	76%	0.763	S	S	*	*			trans	96.2	128.2	133.8	-83.3	-176.9	175.7	-176.4	0	120.9
188	N	27	Very low	29	Very low	129 Å²	129	138.3 Å²	138.3	69%	0.69	78%	0.775	S	S	*	*			trans	88.5	149.1	135.4	-71	8	0	0	0	120.8
189	I	31.3	Very low	28.9	Very low	149 Å²	149	135.9 Å²	135.9	76%	0.764	77%	0.769	S	S	*	*			trans	68.2	133	158.5	-66.3	148.5	0	0	0	114.6
190	I	29.3	Very low	28.7	Very low	150 Å²	150	138.5 Å²	138.5	77%	0.769	78%	0.778	S	S	*	*			cis	177.7	156.4	-19	-116.3	162	0	0	0	103.6
191	P	38	Very low	28.6	Very low	103 Å²	103	140.9 Å²	140.9	67%	0.669	78%	0.777	S	S	*	*			trans	-93.8	159.4	-162.9	36.4	-37.5	0	0	0	115
192	N	25.6	Very low	28.3	Very low	172 Å²	172	144.9 Å²	144.9	92%	0.92	79%	0.787	S	S	*	*				-175.4	153.8	129.9	-94	-27.9	0	0	0	111.2
193	G	27.4	Very low	28.2	Very low	75 Å²	75	144.9 Å²	144.9	77%	0.773	79%	0.787	S	S	*	*			trans	176.4	40.7	-175.7	0	0	0	0	0	116
194	S	26.3	Very low	28.2	Very low	117 Å²	117	145.6 Å²	145.6	82%	0.818	78%	0.784	S	S	*	*			trans	-81.5	119.4	175.1	55.4	0	0	0	0	111.6
195	V	33.2	Very low	27.9	Very low	140 Å²	140	142.8 Å²	142.8	85%	0.848	78%	0.783	S	S	*	*			trans	-133.2	137.8	167.6	-178.3	0	0	0	0	108.9
196	N	25.4	Very low	27.8	Very low	154 Å²	154	144.1 Å²	144.1	82%	0.824	79%	0.79	S	S	*	*			trans	-83.1	148.3	-179.2	-57.4	-33.8	0	0	0	111.8
197	S	31	Very low	28	Very low	106 Å²	106	145.8 Å²	145.8	74%	0.741	80%	0.798	S	S	*	*			trans	-159.5	99.2	146.9	60.8	0	0	0	0	112.5	S199	S197-S199 PolarHBondContact O-N 3Å
198	D	24.1	Very low	28	Very low	173 Å²	173	142.3 Å²	142.3	93%	0.925	80%	0.796	S	S	*	*			trans	-74.7	97.1	161.9	-75.6	-65.7	0	0	0	110.1
199	S	26.9	Very low	28	Very low	93 Å²	93	143 Å²	143	65%	0.65	80%	0.799	S	S	*	*			trans	-164.9	92.5	168.1	58.8	0	0	0	0	115.3	S197	S197-S199 PolarHBondContact O-N 3Å
200	L	27.8	Very low	27.9	Very low	171 Å²	171	147.1 Å²	147.1	90%	0.895	81%	0.807	S	S	*	*			trans	-174	90.8	157.5	-101.2	161.2	0	0	0	105.6
201	K	29.5	Very low	27.7	Very low	182 Å²	182	150.9 Å²	150.9	79%	0.791	81%	0.811	S	S	*	*				47.3	91.1	58.3	-72.8	-171.8	175.9	-179.9	0	111.4
202	N	23.4	Very low	27.4	Very low	169 Å²	169	154.2 Å²	154.2	90%	0.904	82%	0.822	S	S	*	*				54.4	72.2	88.4	-78	4.6	0	0	0	114.7
203	M	26.2	Very low	27.5	Very low	176 Å²	176	150.7 Å²	150.7	87%	0.867	81%	0.811	S	S	*	*			trans	-157.1	143.2	151	-103	-173.5	169.9	0	0	106.3
204	I	29.7	Very low	27.6	Very low	139 Å²	139	154.2 Å²	154.2	71%	0.713	81%	0.812	S	S	*	*			cis	-123.5	138.1	1	-72.5	98	0	0	0	109.7
205	S	23.6	Very low	27.9	Very low	106 Å²	106	152.7 Å²	152.7	74%	0.741	80%	0.802	S	S	*	*			trans	-109.3	117.8	149.7	57	0	0	0	0	107.9
206	N	26.1	Very low	27.9	Very low	140 Å²	140	154.9 Å²	154.9	75%	0.749	80%	0.8	S	S	*	*			trans	161.4	110.9	155.6	-86.5	-7.2	0	0	0	109
207	Y	28.7	Very low	28.2	Very low	247 Å²	247	154.9 Å²	154.9	97%	0.969	80%	0.798	S	S	*	*			trans	-149.4	98.7	157.9	-112.2	-75.5	0	0	0	109
208	S	26.6	Very low	28.2	Very low	98 Å²	98	153.9 Å²	153.9	69%	0.685	79%	0.791	S	S	*	*			trans	-147.4	132.3	167.4	53.3	0	0	0	0	107.7
209	D	27.8	Very low	28.6	Very low	142 Å²	142	152.6 Å²	152.6	76%	0.759	79%	0.785	S	S	*	*			trans	55.3	93.8	164.5	-56.1	-39.1	0	0	0	118.9
210	Y	29.3	Very low	29	Very low	237 Å²	237	153.6 Å²	153.6	93%	0.929	79%	0.791	S	S	*	*			trans	-124.4	108.3	132	-101.7	-82.1	0	0	0	110.2
211	R	26	Very low	29.1	Very low	228 Å²	228	153.1 Å²	153.1	86%	0.86	79%	0.789	S	S	*	*			trans	-83.4	129.5	158.3	-76.8	-179.3	171.6	-175.7	-2.2	108.6
212	L	30.8	Very low	29.3	Very low	173 Å²	173	149.7 Å²	149.7	91%	0.906	79%	0.785	S	S	*	*			trans	-164.9	157.3	137.2	-107.5	162.3	0	0	0	109.7
213	S	27.6	Very low	29.7	Very low	98 Å²	98	147.7 Å²	147.7	69%	0.685	78%	0.784	S	S	*	*			trans	-140.6	139.8	-153.3	56.8	0	0	0	0	114.6
214	N	30.3	Very low	29.8	Very low	149 Å²	149	144.6 Å²	144.6	80%	0.797	78%	0.78	S	S	*	*			trans	-150.7	120.1	149.8	-89.2	-47.4	0	0	0	106.1
215	S	31.7	Very low	30.2	Very low	86 Å²	86	143.1 Å²	143.1	60%	0.601	78%	0.78	S	S	*	*				62.1	123.9	59.3	104.1	0	0	0	0	110.5
216	K	32.4	Very low	30.5	Very low	185 Å²	185	143.6 Å²	143.6	80%	0.804	78%	0.778	S	S	*	*			cis	-146.8	166.4	22.1	-72.8	155.1	179.4	170.3	0	108.5
217	I	32.8	Very low	30.7	Very low	154 Å²	154	142.6 Å²	142.6	79%	0.79	78%	0.779	S	S	*	*			cis	-163.2	156.9	47	-124.3	132.5	0	0	0	111.7
218	S	30.6	Very low	30.6	Very low	85 Å²	85	142.1 Å²	142.1	59%	0.594	78%	0.775	S	S	*	*			trans	-31	148	177.2	57.2	0	0	0	0	120.6
219	N	32.2	Very low	30.7	Very low	147 Å²	147	146.4 Å²	146.4	79%	0.786	78%	0.784	S	S	*	*				-170.3	170.4	76.5	-105	-33	0	0	0	116.7
220	S	35.8	Very low	30.5	Very low	113 Å²	113	144.8 Å²	144.8	79%	0.79	78%	0.784	S	S	*	*			trans	59.9	99.4	162.7	50.2	0	0	0	0	121.2
221	L	30.3	Very low	30.3	Very low	162 Å²	162	143 Å²	143	85%	0.848	78%	0.781	S	S	*	*			trans	-65.5	179.8	142.7	-96.3	73.3	0	0	0	111.4
222	P	34.1	Very low	30.4	Very low	109 Å²	109	138 Å²	138	71%	0.708	78%	0.776	S	S	*	*			cis	-137.7	161.7	-32.5	35.4	-19.1	0	0	0	114.1
223	S	30.9	Very low	30.2	Very low	127 Å²	127	138.5 Å²	138.5	89%	0.888	78%	0.776	S	S	*	*				-175.6	136	128.8	33.3	0	0	0	0	113.3
224	S	29	Very low	30.2	Very low	111 Å²	111	143.7 Å²	143.7	78%	0.776	79%	0.787	S	S	*	*			trans	-150.8	178.2	168	72.2	0	0	0	0	105.8
225	P	37.9	Very low	30	Very low	109 Å²	109	144.5 Å²	144.5	71%	0.708	79%	0.791	S	S	*	*			cis	-138.6	-179.7	5.1	40.3	-21.4	0	0	0	116.3
226	V	29.2	Very low	29.9	Very low	115 Å²	115	150 Å²	150	70%	0.697	80%	0.804	S	S	*	*			trans	-28.4	135.5	151.3	-175.2	0	0	0	0	115.1	R228	V226-R228 HydrophobicContact CG1-CB 4.49Å; V226-R228 PolarHBondContact O-N 2.88Å
227	P	31	Very low	29.8	Very low	120 Å²	120	147.2 Å²	147.2	78%	0.779	81%	0.805	S	S	*	*			trans	-86.6	92.2	162.9	33.9	-31.5	0	0	0	111.7
228	R	26.5	Very low	29.6	Very low	236 Å²	236	145.3 Å²	145.3	89%	0.891	81%	0.805	S	S	*	*			trans	-137	87.3	156	-84.5	-162.4	174.9	-177.7	0	110.3	V226	V226-R228 HydrophobicContact CG1-CB 4.49Å; V226-R228 PolarHBondContact O-N 2.88Å
229	H	29.4	Very low	29.7	Very low	189 Å²	189	146.2 Å²	146.2	88%	0.875	81%	0.811	S	S	*	*			trans	-67.4	133.5	167.7	-80.6	-85.9	0	0	0	111
230	S	23.6	Very low	29.6	Very low	107 Å²	107	147.7 Å²	147.7	75%	0.748	81%	0.813	S	S	*	*				-172.4	122.9	120.4	37.2	0	0	0	0	110.3
231	F	24.1	Very low	29.4	Very low	200 Å²	200	149.4 Å²	149.4	88%	0.877	81%	0.812	S	S	*	*			trans	-166.5	161.3	152.4	-107.3	-65	0	0	0	110.5
232	T	29	Very low	29.5	Very low	122 Å²	122	152.3 Å²	152.3	75%	0.748	81%	0.812	S	S	*	*			trans	64	97.1	173.9	58.7	0	0	0	0	118.7
233	M	25.9	Very low	29.5	Very low	184 Å²	184	154.4 Å²	154.4	91%	0.906	81%	0.812	S	S	*	*				36.4	110	119.4	-72.2	-73.2	-172.9	0	0	119
234	K	28	Very low	29.5	Very low	208 Å²	208	154.7 Å²	154.7	90%	0.904	80%	0.804	S	S	*	*			trans	-160.5	113.5	138.6	-115.3	166.6	-172.5	172.9	0	112.3
235	N	24.9	Very low	29.8	Very low	165 Å²	165	153.6 Å²	153.6	88%	0.882	80%	0.796	S	S	*	*			trans	-78.4	123.1	157.3	-79.3	-11.4	0	0	0	108.6
236	K	30.6	Very low	29.6	Very low	203 Å²	203	155.2 Å²	155.2	88%	0.883	80%	0.799	S	S	*	*			trans	-171.5	115.9	147.6	-116	180	-178.9	-172.8	0	112.3
237	P	29.5	Very low	29.8	Very low	126 Å²	126	155.6 Å²	155.6	82%	0.818	80%	0.802	S	S	*	*			trans	-85.8	161.3	152.7	35.3	-31.8	0	0	0	111.1
238	S	30.1	Very low	30	Very low	114 Å²	114	153.7 Å²	153.7	80%	0.797	80%	0.796	S	S	*	*			trans	-139	142.3	159.7	49.2	0	0	0	0	106
239	S	31.2	Very low	30.2	Very low	104 Å²	104	149.4 Å²	149.4	73%	0.727	79%	0.791	S	S	*	*			cis	-159.7	-166.2	3.4	34.5	0	0	0	0	108.8
240	E	30.3	Very low	30.5	Very low	177 Å²	177	147.2 Å²	147.2	83%	0.827	79%	0.786	S	S	*	*			trans	78	114.3	-176	-52	-175.2	172.1	0	0	113.1
241	I	32.1	Very low	30.7	Very low	150 Å²	150	152.8 Å²	152.8	77%	0.769	79%	0.791	S	S	*	*			cis	102.3	85.4	30.3	-61.9	162.7	0	0	0	112.5
242	R	33.4	Very low	31	Very low	222 Å²	222	154.8 Å²	154.8	84%	0.838	79%	0.792	S	S	*	*			trans	162.7	108.5	143.5	-90.3	159.6	-175.5	-167.1	1.6	107.5
243	Q	33	Very low	31.1	Very low	153 Å²	153	152.2 Å²	152.2	72%	0.715	78%	0.784	S	S	*	*				81.7	116.5	80.2	-85.2	-167.8	-90.7	0	0	113.7
244	D	31.4	Very low	31.4	Very low	133 Å²	133	151.7 Å²	151.7	71%	0.711	78%	0.778	S	S	*	*			trans	62.8	136.5	141.8	-45.3	-31.7	0	0	0	119.2
245	S	34.7	Very low	31.5	Very low	89 Å²	89	145.9 Å²	145.9	62%	0.622	76%	0.764	S	S	*	*			cis	-168	164.6	-11.8	55.4	0	0	0	0	110.3
246	N	33.2	Very low	31.8	Very low	142 Å²	142	144.3 Å²	144.3	76%	0.759	76%	0.756	S	S	*	*			trans	67.8	148.4	155	-61.1	-21.6	0	0	0	118.3
247	T	34.4	Very low	31.9	Very low	123 Å²	123	141 Å²	141	76%	0.755	75%	0.746	S	S	*	*			cis	-163.5	160.1	-7	11.7	0	0	0	0	110.7
248	A	34.4	Very low	32.1	Very low	81 Å²	81	141.3 Å²	141.3	67%	0.669	74%	0.741	S	S	*	*			trans	56.3	117.3	153.4	0	0	0	0	0	118.9
249	D	32.1	Very low	32.1	Very low	146 Å²	146	140.4 Å²	140.4	78%	0.781	74%	0.735	S	S	*	*				80.5	145.4	63.8	-72.4	-47.6	0	0	0	114
250	N	34.6	Very low	31.8	Very low	143 Å²	143	143.2 Å²	143.2	77%	0.765	74%	0.741	S	S	*	*			cis	-141.2	170.6	18.8	-139.2	-43	0	0	0	114.3
251	R	27.7	Very low	31.7	Very low	224 Å²	224	140.1 Å²	140.1	85%	0.845	73%	0.734	S	S	*	*			trans	-117.6	179.2	178.5	-74.1	178.1	168	178	-3.4	111.4
252	R	30.7	Very low	31.4	Very low	241 Å²	241	139.6 Å²	139.6	91%	0.909	73%	0.733	S	S	*	*			trans	96.6	146	156.2	-62.3	179.5	176	173.4	-0	116.2
253	A	30.4	Very low	30.9	Very low	69 Å²	69	134.3 Å²	134.3	57%	0.57	73%	0.73	S	S	*	*			cis	-166.5	-176.3	-15.1	0	0	0	0	0	111.1
254	H	32.5	Very low	30.7	Very low	172 Å²	172	132.1 Å²	132.1	80%	0.796	73%	0.729	S	S	*	*			trans	80.8	104.5	169.1	-58.1	-72.1	0	0	0	115.1
255	S	31.1	Very low	30.6	Very low	87 Å²	87	135.4 Å²	135.4	61%	0.608	74%	0.737	S	S	*	*				89.7	129.8	55.2	71.8	0	0	0	0	111.7
256	N	30.9	Very low	30	Very low	132 Å²	132	137 Å²	137	71%	0.706	74%	0.744	S	S	*	*				-165	153.9	55.9	-108.9	-27.1	0	0	0	113.7
257	I	32.9	Very low	29.8	Very low	133 Å²	133	139.2 Å²	139.2	68%	0.682	75%	0.747	S	S	*	*			trans	57.5	132	135.4	-63.6	167.9	0	0	0	118.8
258	N	32.7	Very low	29.4	Very low	133 Å²	133	142.9 Å²	142.9	71%	0.711	75%	0.752	S	S	*	*			cis	-159.5	125.4	-5	-108.7	10.8	0	0	0	107.4
259	S	30	Very low	29.1	Very low	95 Å²	95	143 Å²	143	66%	0.664	75%	0.753	S	S	*	*				76.8	121.7	87.5	78.4	0	0	0	0	117.1
260	L	25.1	Very low	28.9	Very low	163 Å²	163	142.4 Å²	142.4	85%	0.853	76%	0.755	S	S	*	*			trans	-73.1	173.7	156.3	-54.5	75.6	0	0	0	109.1
261	T	27.8	Very low	28.7	Very low	111 Å²	111	142.7 Å²	142.7	68%	0.681	76%	0.756	S	S	*	*			cis	-147.4	169.9	16.1	49.6	0	0	0	0	111.5
262	D	25.4	Very low	28.8	Very low	139 Å²	139	134.8 Å²	134.8	74%	0.743	74%	0.735	S	S	*	*			trans	140	119.3	130.1	-76.5	-7.2	0	0	0	117.9
263	S	24.4	Very low	29.3	Very low	111 Å²	111	128.2 Å²	128.2	78%	0.776	72%	0.723	S	S	*	*			trans	67.7	171.4	151.1	79.9	0	0	0	0	119.1
264	P	28.8	Very low	29.7	Very low	107 Å²	107	129.7 Å²	129.7	70%	0.695	73%	0.725	S	S	*	*				-130.1	126.8	-60.5	34.1	-18.7	0	0	0	112.7	T266	P264-T266 PolarHBondContact O-N 3.48Å
265	F	28.6	Very low	29.9	Very low	203 Å²	203	125.8 Å²	125.8	89%	0.89	71%	0.708	S	S	*	*			trans	-79.6	93.1	-179.4	-85.4	-70.8	0	0	0	114.1	F267	F265-F267 HydrophobicContact CD1-CD2 4.3Å; F265-F267 HydrophobicContact CD1-CE2 4.32Å; F265-F267 HydrophobicContact CE1-CE2 4.46Å
266	T	23.2	Very low	30.5	Very low	123 Å²	123	126 Å²	126	76%	0.755	71%	0.706	S	S	*	*			trans	-80.9	143	152.2	57.2	0	0	0	0	110	P264	P264-T266 PolarHBondContact O-N 3.48Å
267	F	27.6	Very low	30.9	Very low	188 Å²	188	125.8 Å²	125.8	83%	0.825	70%	0.701	S	S	*	*			trans	-147	127.9	158.9	-108.2	-77.8	0	0	0	109.6	F265	F265-F267 HydrophobicContact CD1-CD2 4.3Å; F265-F267 HydrophobicContact CD1-CE2 4.32Å; F265-F267 HydrophobicContact CE1-CE2 4.46Å
268	K	26.7	Very low	31.1	Very low	199 Å²	199	127.6 Å²	127.6	87%	0.865	70%	0.699	S	S	*	*			trans	-100.2	137.1	169.5	-93	-177.8	174	177.5	0	109.9
269	A	28.5	Very low	31.7	Very low	84 Å²	84	126.8 Å²	126.8	69%	0.694	69%	0.694	S	S	*	*			trans	18.1	142.3	133.6	0	0	0	0	0	119.8
270	T	27.4	Very low	32.5	Very low	134 Å²	134	124 Å²	124	82%	0.822	68%	0.677	S	S	*	*			cis	-175.4	151.3	-4.9	22.5	0	0	0	0	108
271	L	30.4	Very low	33.7	Very low	149 Å²	149	120.2 Å²	120.2	78%	0.78	66%	0.657	S	S	*	*			trans	-155.6	139.4	149.6	-125.6	155.7	0	0	0	110.9	M275	L271-M275 HydrophobicContact CD2-CB 4Å; L271-M275 HydrophobicContact CD2-CG 4.45Å
272	S	31	Very low	34.3	Very low	57 Å²	57	120.8 Å²	120.8	40%	0.399	66%	0.655	S	S	.	*			trans	-92.2	137.3	-173.5	55.3	0	0	0	0	112.7	T274 M275	S272-T274 PolarHBondContact O-N 2.88Å; S272-T274 PolarHBondContact OG-OG1 3.42Å; S272-M275 PolarHBondContact O-N 3.23Å
273	P	39.4	Very low	35.1	Very low	103 Å²	103	117.7 Å²	117.7	67%	0.669	65%	0.649	S	S	*	*	H	α-helix	trans	-60.5	-16.7	177.3	-27.5	36.2	0	0	0	115.1	M275 T276 H277	P273-M275 PolarHBondContact O-N 3.16Å; P273-T276 WeakPolarHBondContact O-CB 3.5Å; P273-T276 PolarHBondContact O-N 3.48Å; P273-H277 WeakPolarHBondContact O-CB 3.47Å; P273-H277 PolarHBondContact O-N 2.96Å
274	T	39.1	Very low	35.9	Very low	101 Å²	101	121.9 Å²	121.9	62%	0.62	65%	0.647	S	S	*	*	H	α-helix	trans	-65.6	-18.6	171.3	38.6	0	0	0	0	113.4	S272 R278	S272-T274 PolarHBondContact O-N 2.88Å; S272-T274 PolarHBondContact OG-OG1 3.42Å; T274-R278 WeakPolarHBondContact O-CG 3.46Å
275	M	38.1	Very low	36.2	Very low	89 Å²	89	123.2 Å²	123.2	44%	0.438	65%	0.649	S	S	.	*	H	α-helix	trans	-83.7	-42.3	166	-80.3	-93.2	49.6	0	0	112.2	L271 S272 P273 H277 R278 L279	L271-M275 HydrophobicContact CD2-CB 4Å; L271-M275 HydrophobicContact CD2-CG 4.45Å; S272-M275 PolarHBondContact O-N 3.23Å; P273-M275 PolarHBondContact O-N 3.16Å; M275-H277 VanDerWaalsContact C-N 3.25Å; M275-H277 PolarHBondContact O-N 3.35Å; M275-R278 HydrophobicContact CE-CB 3.91Å; M275-R278 PolarHBondContact O-N 3.26Å; M275-L279 PolarHBondContact O-N 3.47Å
276	T	43.3	Very low	36.7	Very low	92 Å²	92	119 Å²	119	56%	0.564	64%	0.643	S	S	*	*	H	α-helix	trans	-55.7	-41.2	174.1	-43.7	0	0	0	0	111.6	P273 R278 L279 A280	P273-T276 WeakPolarHBondContact O-CB 3.5Å; P273-T276 PolarHBondContact O-N 3.48Å; T276-R278 VanDerWaalsContact C-N 3.33Å; T276-R278 PolarHBondContact O-N 2.81Å; T276-L279 PolarHBondContact O-N 3.31Å; T276-A280 WeakPolarHBondContact O-CB 3.39Å; T276-A280 PolarHBondContact O-N 2.72Å
277	H	38.2	Very low	37.1	Very low	127 Å²	127	121.6 Å²	121.6	59%	0.588	64%	0.644	S	S	*	*	H	α-helix	trans	-68.1	-27.9	176.5	-162	-45.1	0	0	0	113.1	P273 M275 I281	P273-H277 WeakPolarHBondContact O-CB 3.47Å; P273-H277 PolarHBondContact O-N 2.96Å; M275-H277 VanDerWaalsContact C-N 3.25Å; M275-H277 PolarHBondContact O-N 3.35Å; H277-I281 WeakPolarHBondContact O-CD1 3.2Å; H277-I281 VanDerWaalsContact O-CG1 3.32Å; H277-I281 WeakPolarHBondContact O-CG1 3.3Å; H277-I281 PolarHBondContact O-N 3.26Å
278	R	38.6	Very low	37.2	Very low	171 Å²	171	121 Å²	121	65%	0.645	65%	0.649	S	S	*	*	H	α-helix	trans	-78.9	-38.6	175.9	-74.3	177.2	176.9	-157.3	-0.4	111.9	T274 M275 T276 A280 I281 L282	T274-R278 WeakPolarHBondContact O-CG 3.46Å; M275-R278 HydrophobicContact CE-CB 3.91Å; M275-R278 PolarHBondContact O-N 3.26Å; T276-R278 VanDerWaalsContact C-N 3.33Å; T276-R278 PolarHBondContact O-N 2.81Å; R278-A280 VanDerWaalsContact C-N 3.33Å; R278-I281 PolarHBondContact O-N 2.92Å; R278-L282 PolarHBondContact O-N 3.43Å
279	L	44.6	Very low	37.4	Very low	117 Å²	117	115.8 Å²	115.8	61%	0.613	64%	0.638	S	S	*	*	H	α-helix	trans	-60	-42.2	167.9	-83.9	159.5	0	0	0	111.6	M275 T276 I281 L282 A283	M275-L279 PolarHBondContact O-N 3.47Å; T276-L279 PolarHBondContact O-N 3.31Å; L279-I281 PolarHBondContact O-N 2.86Å; L279-L282 PolarHBondContact O-N 3.38Å; L279-A283 VanDerWaalsContact O-CB 3.29Å; L279-A283 WeakPolarHBondContact O-CB 3.2Å; L279-A283 PolarHBondContact O-N 3.34Å
280	A	47.3	Very low	37.6	Very low	36 Å²	36	119.3 Å²	119.3	30%	0.298	64%	0.643	S	S	.	*	H	α-helix	trans	-68.8	-12.7	176.5	0	0	0	0	0	115.1	T276 R278 R284	T276-A280 WeakPolarHBondContact O-CB 3.39Å; T276-A280 PolarHBondContact O-N 2.72Å; R278-A280 VanDerWaalsContact C-N 3.33Å; A280-R284 WeakPolarHBondContact O-CG 3.28Å
281	I	48.9	Very low	37.8	Very low	84 Å²	84	118.9 Å²	118.9	43%	0.431	64%	0.64	S	S	.	*	H	α-helix	trans	-90.4	-45.6	171.4	-74	166.9	0	0	0	110.2	H277 R278 L279 A283 R284 N285	H277-I281 WeakPolarHBondContact O-CD1 3.2Å; H277-I281 VanDerWaalsContact O-CG1 3.32Å; H277-I281 WeakPolarHBondContact O-CG1 3.3Å; H277-I281 PolarHBondContact O-N 3.26Å; R278-I281 PolarHBondContact O-N 2.92Å; L279-I281 PolarHBondContact O-N 2.86Å; I281-A283 VanDerWaalsContact C-N 3.33Å; I281-A283 PolarHBondContact O-N 3.1Å; I281-R284 PolarHBondContact O-N 2.72Å; I281-R284 VanDerWaalsContact O-N 3.09Å; I281-N285 PolarHBondContact O-N 3.43Å
282	L	41.8	Very low	37.7	Very low	123 Å²	123	116.2 Å²	116.2	64%	0.644	63%	0.634	S	S	*	*	H	α-helix	trans	-60.2	-42.8	174.6	-76.8	165.1	0	0	0	111.7	R278 L279 R284 N285	R278-L282 PolarHBondContact O-N 3.43Å; L279-L282 PolarHBondContact O-N 3.38Å; L282-R284 PolarHBondContact O-N 2.7Å; L282-R284 VanDerWaalsContact O-N 3.17Å; L282-N285 PolarHBondContact O-N 3.45Å
283	A	42.2	Very low	37.6	Very low	74 Å²	74	121.6 Å²	121.6	61%	0.612	66%	0.658	S	S	*	*	H	α-helix	trans	-66.4	-12.6	176.3	0	0	0	0	0	114.6	L279 I281	L279-A283 VanDerWaalsContact O-CB 3.29Å; L279-A283 WeakPolarHBondContact O-CB 3.2Å; L279-A283 PolarHBondContact O-N 3.34Å; I281-A283 VanDerWaalsContact C-N 3.33Å; I281-A283 PolarHBondContact O-N 3.1Å
284	R	40	Very low	37	Very low	199 Å²	199	120.2 Å²	120.2	75%	0.751	66%	0.662	S	S	*	*	H	α-helix	trans	-100.7	-19.6	177.5	-80.4	-173.7	168.8	107.5	-5.5	114.4	A280 I281 L282 C286	A280-R284 WeakPolarHBondContact O-CG 3.28Å; I281-R284 PolarHBondContact O-N 2.72Å; I281-R284 VanDerWaalsContact O-N 3.09Å; L282-R284 PolarHBondContact O-N 2.7Å; L282-R284 VanDerWaalsContact O-N 3.17Å; R284-C286 VanDerWaalsContact C-N 3.34Å
285	N	36	Very low	36.8	Very low	135 Å²	135	123.2 Å²	123.2	72%	0.722	68%	0.675	S	S	*	*	H	α-helix	trans	-82	-13.5	173.3	-74.7	-6.9	0	0	0	113.2	I281 L282	I281-N285 PolarHBondContact O-N 3.43Å; L282-N285 PolarHBondContact O-N 3.45Å
286	C	38	Very low	36.5	Very low	113 Å²	113	125 Å²	125	76%	0.764	70%	0.696	S	S	*	*	S	Bend	trans	-102.2	48	177.6	-64.3	0	0	0	0	113.2	R284	R284-C286 VanDerWaalsContact C-N 3.34Å
287	K	31.9	Very low	35.9	Very low	178 Å²	178	127.7 Å²	127.7	77%	0.774	71%	0.705	S	S	*	*			trans	-149.9	45.3	171.2	-133.9	168.9	-170.7	176.6	0	115.9
288	N	30.1	Very low	35.5	Very low	176 Å²	176	127.2 Å²	127.2	94%	0.941	72%	0.716	S	S	*	*			trans	-104.5	55.5	166.5	-109.8	-2.1	0	0	0	111.7
289	S	30.6	Very low	35.1	Very low	89 Å²	89	122.2 Å²	122.2	62%	0.622	72%	0.718	S	S	*	*	S	Bend	trans	-148.4	111.3	163.3	58.4	0	0	0	0	109.7
290	I	32.6	Very low	34.6	Very low	159 Å²	159	121.4 Å²	121.4	82%	0.815	72%	0.722	S	S	*	*				29.8	98.4	128.3	-53.5	168.4	0	0	0	113.5
291	V	30.9	Very low	34	Very low	125 Å²	125	127 Å²	127	76%	0.758	75%	0.747	S	S	*	*				85.3	129.3	61.2	174.3	0	0	0	0	113.5
292	S	29.5	Very low	33.3	Very low	93 Å²	93	127.4 Å²	127.4	65%	0.65	76%	0.757	S	S	*	*			trans	62.3	114.4	163.4	64.5	0	0	0	0	121.2
293	N	28.5	Very low	33	Very low	170 Å²	170	128.5 Å²	128.5	91%	0.909	77%	0.769	S	S	*	*				69.3	138.3	128.6	-59.2	4.8	0	0	0	120.7
294	G	27.3	Very low	32.5	Very low	73 Å²	73	128 Å²	128	75%	0.753	77%	0.772	S	S	*	*			trans	175.8	72.3	173.8	0	0	0	0	0	111.8	S296	G294-S296 PolarHBondContact O-N 3.02Å
295	N	34.7	Very low	32	Very low	165 Å²	165	127.9 Å²	127.9	88%	0.882	78%	0.777	S	S	*	*			trans	-61.3	130.5	158.7	-87.8	-5.5	0	0	0	107.5	I297	N295-I297 VanDerWaalsContact C-N 3.3Å; N295-I297 PolarHBondContact O-N 3.37Å
296	S	30.7	Very low	31.6	Very low	125 Å²	125	126.5 Å²	126.5	87%	0.874	77%	0.773	S	S	*	*	S	Bend	trans	-78	78.1	177.6	57.8	0	0	0	0	111.7	G294	G294-S296 PolarHBondContact O-N 3.02Å
297	I	31.3	Very low	31.2	Very low	150 Å²	150	131.1 Å²	131.1	77%	0.769	78%	0.776	S	S	*	*	S	Bend	trans	-142.2	111.6	150.1	-90.8	157.4	0	0	0	107.2	N295	N295-I297 VanDerWaalsContact C-N 3.3Å; N295-I297 PolarHBondContact O-N 3.37Å
298	S	29.9	Very low	31	Very low	116 Å²	116	128.3 Å²	128.3	81%	0.811	77%	0.769	S	S	*	*			trans	38.4	132.2	159	63.2	0	0	0	0	123.1
299	G	29.5	Very low	30.8	Very low	66 Å²	66	128.3 Å²	128.3	68%	0.68	76%	0.756	S	S	*	*				130.1	101.3	127.4	0	0	0	0	0	119.7
300	S	34.7	Very low	30.8	Very low	100 Å²	100	132.8 Å²	132.8	70%	0.699	76%	0.761	S	S	*	*			trans	34.7	123.1	140.8	59.8	0	0	0	0	122.9
301	D	34.2	Very low	30.6	Very low	155 Å²	155	128.8 Å²	128.8	83%	0.829	75%	0.747	S	S	*	*				49.4	151.1	116.6	-46	-32.5	0	0	0	122.7
302	S	34	Very low	30.6	Very low	91 Å²	91	129.2 Å²	129.2	64%	0.636	75%	0.745	S	S	*	*			cis	-172.1	153.5	-25.5	62.8	0	0	0	0	110.8
303	T	36	Very low	30.7	Very low	147 Å²	147	131 Å²	131	90%	0.902	75%	0.747	S	S	*	*			trans	62.7	161.9	167.5	73.1	0	0	0	0	118.2
304	G	32.6	Very low	30.8	Very low	64 Å²	64	126.6 Å²	126.6	66%	0.66	73%	0.73	S	S	*	*			cis	176.8	144.1	-12.1	0	0	0	0	0	115.3
305	F	29.2	Very low	31.1	Very low	196 Å²	196	130.5 Å²	130.5	86%	0.86	73%	0.732	S	S	*	*			trans	57.5	107	152.3	-76.1	-88.3	0	0	0	124.4
306	T	28	Very low	30.9	Very low	105 Å²	105	127.1 Å²	127.1	64%	0.644	72%	0.721	S	S	*	*				43.8	129	127.5	60.8	0	0	0	0	122.9
307	Y	28.5	Very low	30.8	Very low	211 Å²	211	126.6 Å²	126.6	83%	0.827	72%	0.717	S	S	*	*				-173.1	138.8	106.7	-108.4	-60.8	0	0	0	116
308	N	28.3	Very low	30.7	Very low	118 Å²	118	125.1 Å²	125.1	63%	0.631	72%	0.72	S	S	*	*			trans	48.5	134.3	137	-101.7	-25.9	0	0	0	125.8
309	R	25.2	Very low	30.9	Very low	176 Å²	176	125 Å²	125	66%	0.664	72%	0.719	S	S	*	*			trans	78.1	158.4	140	-65.4	-178.4	-165.2	169.9	7.2	121.9
310	Y	31.2	Very low	31.4	Very low	184 Å²	184	127.1 Å²	127.1	72%	0.722	72%	0.721	S	S	*	*			trans	76.7	145	157.7	-58.9	-65.2	0	0	0	118.6
311	S	28.2	Very low	31.1	Very low	75 Å²	75	130.1 Å²	130.1	52%	0.524	73%	0.728	S	S	.	*			cis	177.8	161	-38.5	49.9	0	0	0	0	110.4
312	N	31.6	Very low	30.9	Very low	133 Å²	133	127.2 Å²	127.2	71%	0.711	72%	0.72	S	S	*	*			trans	69	159	149.3	-65.9	-4.3	0	0	0	116.1
313	N	31.4	Very low	30.8	Very low	132 Å²	132	128 Å²	128	71%	0.706	73%	0.726	S	S	*	*			cis	-169.1	168.3	-14.7	-104.7	-4.9	0	0	0	107.9
314	S	30.9	Very low	30.8	Very low	77 Å²	77	128.2 Å²	128.2	54%	0.538	72%	0.716	S	S	.	*			cis	179.4	-178.2	-14.5	53.3	0	0	0	0	110.2
315	I	32.6	Very low	30.8	Very low	155 Å²	155	135.4 Å²	135.4	80%	0.795	72%	0.724	S	S	*	*			trans	73.9	139.7	156.1	-66.9	162.6	0	0	0	116.1
316	S	31.3	Very low	31	Very low	93 Å²	93	129.5 Å²	129.5	65%	0.65	72%	0.718	S	S	*	*			cis	-167	149.6	-23.6	57.5	0	0	0	0	108.9
317	S	27.5	Very low	31.9	Very low	115 Å²	115	130.9 Å²	130.9	80%	0.804	73%	0.726	S	S	*	*			cis	102.5	68.6	10.1	83.1	0	0	0	0	118.2
318	S	29.8	Very low	33.1	Very low	118 Å²	118	126.2 Å²	126.2	83%	0.825	72%	0.72	S	S	*	*			trans	-150.2	143.5	169.3	55.9	0	0	0	0	115.4
319	S	33.7	Very low	34.1	Very low	113 Å²	113	126 Å²	126	79%	0.79	72%	0.723	S	S	*	*			trans	-95.9	-173.9	167.9	-35.6	0	0	0	0	110.5
320	P	40.2	Very low	35.6	Very low	111 Å²	111	120.6 Å²	120.6	72%	0.721	72%	0.716	S	S	*	*				-159.4	175.2	50.9	43	-19.2	0	0	0	120.7
321	L	27.9	Very low	37	Very low	163 Å²	163	114.2 Å²	114.2	85%	0.853	70%	0.701	S	S	*	*			trans	36.1	158.6	140.4	-80.6	80.6	0	0	0	124.1
322	S	30.3	Very low	38.6	Very low	94 Å²	94	115.6 Å²	115.6	66%	0.657	70%	0.701	S	S	*	*			cis	-176.2	179.4	-16.2	62.4	0	0	0	0	114.7
323	S	32.2	Very low	39.7	Very low	108 Å²	108	116.4 Å²	116.4	76%	0.755	70%	0.698	S	S	*	*			trans	78.1	150.5	169.7	82.5	0	0	0	0	116.2
324	H	36.4	Very low	41.4	Very low	151 Å²	151	116.4 Å²	116.4	70%	0.699	69%	0.694	S	S	*	*			cis	-160.2	167.7	13.7	-135.8	42.9	0	0	0	107
325	R	31.7	Very low	42.8	Very low	216 Å²	216	122.1 Å²	122.1	82%	0.815	70%	0.704	S	S	*	*			cis	-177.6	120.5	-18.6	153.9	178.2	162.2	-168.1	-5.6	110.3
326	G	35.3	Very low	44.2	Very low	72 Å²	72	118.8 Å²	118.8	74%	0.742	69%	0.688	S	S	*	*			trans	137.2	150.1	166.2	0	0	0	0	0	115.3
327	T	45.8	Very low	45.9	Very low	134 Å²	134	118.9 Å²	118.9	82%	0.822	68%	0.684	S	S	*	*			cis	-136.4	137.3	-11.3	49.8	0	0	0	0	110.2
328	T	54.5	Low	47.9	Very low	112 Å²	112	119.7 Å²	119.7	69%	0.687	68%	0.679	S	S	*	*			trans	-87.7	155.5	-171.3	46.4	0	0	0	0	114.4	A330 A331	T328-A330 PolarHBondContact O-N 3.46Å; T328-A331 WeakPolarHBondContact O-CB 3.48Å; T328-A331 PolarHBondContact O-N 3.34Å
329	V	47.6	Very low	49.7	Very low	114 Å²	114	120.5 Å²	120.5	69%	0.691	67%	0.67	S	S	*	*	H	α-helix	trans	-46.2	-29.4	179.7	178.2	0	0	0	0	115.1	A331 I332 K333	V329-A331 VanDerWaalsContact C-N 3.26Å; V329-A331 PolarHBondContact O-N 3.42Å; V329-I332 WeakPolarHBondContact O-CB 3.48Å; V329-I332 PolarHBondContact O-N 3.42Å; V329-I332 VanDerWaalsContact O-N 3.1Å; V329-K333 PolarHBondContact O-N 3.31Å
330	A	57.5	Low	50.3	Low	63 Å²	63	118 Å²	118	52%	0.521	66%	0.662	S	S	.	*	H	α-helix	trans	-54.1	-39	172.9	0	0	0	0	0	113.4	T328 I332 K333 Q334	T328-A330 PolarHBondContact O-N 3.46Å; A330-I332 PolarHBondContact O-N 2.88Å; A330-K333 PolarHBondContact O-N 2.91Å; A330-Q334 WeakPolarHBondContact O-CB 3.5Å; A330-Q334 PolarHBondContact O-N 2.92Å
331	A	60	Low	50.5	Low	50 Å²	50	118.2 Å²	118.2	41%	0.413	66%	0.657	S	S	.	*	H	α-helix	trans	-68	-34.4	177.7	0	0	0	0	0	112.5	T328 V329 R335	T328-A331 WeakPolarHBondContact O-CB 3.48Å; T328-A331 PolarHBondContact O-N 3.34Å; V329-A331 VanDerWaalsContact C-N 3.26Å; V329-A331 PolarHBondContact O-N 3.42Å; A331-R335 PolarHBondContact O-N 2.96Å
332	I	62.6	Low	51.2	Low	104 Å²	104	122.1 Å²	122.1	53%	0.533	66%	0.66	S	S	.	*	H	α-helix	trans	-68.7	-45.7	174.2	-57.1	175.6	0	0	0	109.7	V329 A330 Q334 R335 L336	V329-I332 WeakPolarHBondContact O-CB 3.48Å; V329-I332 PolarHBondContact O-N 3.42Å; V329-I332 VanDerWaalsContact O-N 3.1Å; A330-I332 PolarHBondContact O-N 2.88Å; I332-Q334 VanDerWaalsContact C-N 3.29Å; I332-Q334 PolarHBondContact O-N 2.93Å; I332-R335 PolarHBondContact O-N 3.08Å; I332-L336 HydrophobicContact CG2-CD1 4.23Å; I332-L336 WeakPolarHBondContact O-CG 3.47Å; I332-L336 PolarHBondContact O-N 3.08Å
333	K	55.7	Low	51.9	Low	149 Å²	149	124.5 Å²	124.5	65%	0.648	66%	0.664	S	S	*	*	H	α-helix	trans	-57.1	-41.8	175.2	-171.7	-179.7	-179.4	-176.9	0	111.7	V329 A330 L336 V337	V329-K333 PolarHBondContact O-N 3.31Å; A330-K333 PolarHBondContact O-N 2.91Å; K333-L336 PolarHBondContact O-N 2.95Å; K333-V337 WeakPolarHBondContact O-CG2 3.24Å; K333-V337 PolarHBondContact O-N 3.2Å; K333-V337 VanDerWaalsContact O-N 3.11Å
334	Q	65.2	Low	52.3	Low	133 Å²	133	126.1 Å²	126.1	62%	0.621	66%	0.664	S	S	*	*	H	α-helix	trans	-72.5	-34.8	179.1	-161.6	162.6	0.5	0	0	112.5	A330 I332 V337 N338	A330-Q334 WeakPolarHBondContact O-CB 3.5Å; A330-Q334 PolarHBondContact O-N 2.92Å; I332-Q334 VanDerWaalsContact C-N 3.29Å; I332-Q334 PolarHBondContact O-N 2.93Å; Q334-V337 PolarHBondContact O-N 3.1Å; Q334-N338 WeakPolarHBondContact O-CB 3.42Å; Q334-N338 VanDerWaalsContact O-CG 3.29Å; Q334-N338 PolarHBondContact O-N 3Å; Q334-N338 PolarHBondContact O-OD1 3.18Å
335	R	61.8	Low	52.4	Low	197 Å²	197	126 Å²	126	74%	0.743	67%	0.668	S	S	*	*	H	α-helix	trans	-60.3	-44.8	170.2	-112.7	178.1	174.1	159.6	-1.8	112.5	A331 I332 N338 Q339	A331-R335 PolarHBondContact O-N 2.96Å; I332-R335 PolarHBondContact O-N 3.08Å; R335-N338 PolarHBondContact O-N 3.36Å; R335-Q339 WeakPolarHBondContact O-CG 3.41Å; R335-Q339 PolarHBondContact O-N 3.28Å
336	L	60.9	Low	52.6	Low	85 Å²	85	122.8 Å²	122.8	45%	0.445	67%	0.667	S	S	.	*	H	α-helix	trans	-67.4	-37.7	179.5	-69.3	167.6	0	0	0	112.6	I332 K333 Q339	I332-L336 HydrophobicContact CG2-CD1 4.23Å; I332-L336 WeakPolarHBondContact O-CG 3.47Å; I332-L336 PolarHBondContact O-N 3.08Å; K333-L336 PolarHBondContact O-N 2.95Å; L336-Q339 PolarHBondContact O-N 2.91Å
337	V	66.6	Low	52.8	Low	95 Å²	95	127 Å²	127	58%	0.576	67%	0.671	S	S	*	*	H	α-helix	trans	-65	-39.7	173.2	169.8	0	0	0	0	111.3	K333 Q334 Q339 G340	K333-V337 WeakPolarHBondContact O-CG2 3.24Å; K333-V337 PolarHBondContact O-N 3.2Å; K333-V337 VanDerWaalsContact O-N 3.11Å; Q334-V337 PolarHBondContact O-N 3.1Å; V337-Q339 PolarHBondContact O-N 3.37Å; V337-G340 PolarHBondContact O-N 2.96Å
338	N	70.3	Confident	52.4	Low	132 Å²	132	126.6 Å²	126.6	71%	0.706	67%	0.67	S	S	*	*	H	α-helix	trans	-69.9	-11.1	175.3	-71.2	11.2	0	0	0	113.7	Q334 R335	Q334-N338 WeakPolarHBondContact O-CB 3.42Å; Q334-N338 VanDerWaalsContact O-CG 3.29Å; Q334-N338 PolarHBondContact O-N 3Å; Q334-N338 PolarHBondContact O-OD1 3.18Å; R335-N338 PolarHBondContact O-N 3.36Å
339	Q	67.2	Low	51.7	Low	134 Å²	134	127.9 Å²	127.9	63%	0.626	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	14.5	173.2	-72.6	175.5	-36.6	0	0	113	R335 L336 V337 L341	R335-Q339 WeakPolarHBondContact O-CG 3.41Å; R335-Q339 PolarHBondContact O-N 3.28Å; L336-Q339 PolarHBondContact O-N 2.91Å; V337-Q339 PolarHBondContact O-N 3.37Å; Q339-L341 PolarHBondContact O-N 3.04Å
340	G	47.1	Very low	51.4	Low	61 Å²	61	131.7 Å²	131.7	63%	0.629	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.8	-5.7	172.5	0	0	0	0	0	115.9	V337 R342	V337-G340 PolarHBondContact O-N 2.96Å; G340-R342 PolarHBondContact O-N 3.06Å
341	L	43.4	Very low	50.3	Low	116 Å²	116	138.4 Å²	138.4	61%	0.607	70%	0.703	S	S	*	*			trans	-77.5	79.4	-175.4	-71.2	168.3	0	0	0	112.5	Q339 I343	Q339-L341 PolarHBondContact O-N 3.04Å; L341-I343 PolarHBondContact O-N 3.05Å; L341-I343 VanDerWaalsContact O-N 3.17Å
342	R	43.4	Very low	49.2	Very low	245 Å²	245	143.5 Å²	143.5	93%	0.925	72%	0.722	S	S	*	*			trans	-76.5	92	171.9	-72.8	-174.6	173.7	-174.7	-0.8	111.8	G340	G340-R342 PolarHBondContact O-N 3.06Å
343	I	44.8	Very low	48.1	Very low	144 Å²	144	142.9 Å²	142.9	74%	0.738	73%	0.727	S	S	*	*			trans	-85.1	116.4	169.1	-52	178.6	0	0	0	109.2	L341 L345	L341-I343 PolarHBondContact O-N 3.05Å; L341-I343 VanDerWaalsContact O-N 3.17Å; I343-L345 HydrophobicContact CG2-CD2 4.18Å; I343-L345 HydrophobicContact CG2-CG 4.09Å
344	N	39.6	Very low	47.7	Very low	141 Å²	141	141.3 Å²	141.3	75%	0.754	73%	0.733	S	S	*	*			trans	-102.9	116.6	-177.5	-161.3	3.8	0	0	0	110.4
345	L	38.4	Very low	47.3	Very low	150 Å²	150	139.3 Å²	139.3	79%	0.785	73%	0.73	S	S	*	*			trans	-118.1	81.9	-170.1	-69.4	175.7	0	0	0	112.2	I343	I343-L345 HydrophobicContact CG2-CD2 4.18Å; I343-L345 HydrophobicContact CG2-CG 4.09Å
346	N	36.1	Very low	47.1	Very low	148 Å²	148	140.5 Å²	140.5	79%	0.791	74%	0.735	S	S	*	*			trans	-125.4	75.8	177.9	-89.6	-17.8	0	0	0	112.4
347	I	39.2	Very low	46.9	Very low	160 Å²	160	144.7 Å²	144.7	82%	0.821	75%	0.746	S	S	*	*			trans	-136.2	118.1	157.2	-56.3	-178.4	0	0	0	108.3
348	P	37.7	Very low	46.5	Very low	125 Å²	125	148.2 Å²	148.2	81%	0.812	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-89	126.7	-173.5	32.8	-33.4	0	0	0	113.2
349	V	40.5	Very low	45.9	Very low	140 Å²	140	144.3 Å²	144.3	85%	0.848	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-89.8	123.5	171.1	179.7	0	0	0	0	110.1
350	K	40.4	Very low	45.7	Very low	194 Å²	194	143.9 Å²	143.9	84%	0.843	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-63.9	137.7	176	-77.1	-177	175.5	177.8	0	111.3
351	K	34.3	Very low	46.1	Very low	204 Å²	204	143.8 Å²	143.8	89%	0.887	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-74.4	134.7	176.4	-63.6	174.3	179.6	173.2	0	111.2
352	L	37.7	Very low	46.6	Very low	157 Å²	157	145 Å²	145	82%	0.822	71%	0.705	S	S	*	*			trans	-130.5	123.1	151.8	-88.8	97.2	0	0	0	111.7	C354	L352-C354 PolarHBondContact O-N 3.24Å
353	S	40.2	Very low	47.3	Very low	90 Å²	90	141.6 Å²	141.6	63%	0.629	69%	0.692	S	S	*	*			trans	28.8	73	149	58.9	0	0	0	0	120.1	T355	S353-T355 PolarHBondContact O-N 3.42Å
354	C	47.7	Very low	47.6	Very low	117 Å²	117	138.7 Å²	138.7	79%	0.791	68%	0.675	S	S	*	*				40.3	38.2	116.8	-154.8	0	0	0	0	121.1	L352	L352-C354 PolarHBondContact O-N 3.24Å
355	T	56.7	Low	47.9	Very low	91 Å²	91	140.7 Å²	140.7	56%	0.558	68%	0.677	S	S	*	*			trans	-98.5	-53.9	169.4	52.1	0	0	0	0	112.8	S353 Y357 R358 D359	S353-T355 PolarHBondContact O-N 3.42Å; T355-Y357 VanDerWaalsContact C-N 3.32Å; T355-Y357 PolarHBondContact O-N 3.19Å; T355-Y357 VanDerWaalsContact O-N 3.1Å; T355-R358 WeakPolarHBondContact O-CA 3.42Å; T355-R358 WeakPolarHBondContact O-CB 3.35Å; T355-R358 PolarHBondContact O-N 3Å; T355-D359 PolarHBondContact O-N 2.78Å
356	R	56.7	Low	48.1	Very low	222 Å²	222	144.1 Å²	144.1	84%	0.838	68%	0.68	S	S	*	*	H	α-helix	trans	-50.7	-40.7	-171.5	-104	-177.5	-179.2	173.2	1.1	115.3	D359 Y360	R356-D359 PolarHBondContact O-N 3.1Å; R356-Y360 PolarHBondContact O-N 2.96Å
357	Y	56.9	Low	48.1	Very low	172 Å²	172	140 Å²	140	68%	0.675	67%	0.672	S	S	*	*	H	α-helix	trans	-70.7	-36.4	178.2	-171.7	-100.9	0	0	0	112.4	T355 D359 Y360 V361	T355-Y357 VanDerWaalsContact C-N 3.32Å; T355-Y357 PolarHBondContact O-N 3.19Å; T355-Y357 VanDerWaalsContact O-N 3.1Å; Y357-D359 VanDerWaalsContact C-N 3.29Å; Y357-D359 PolarHBondContact O-N 3.09Å; Y357-Y360 HydrophobicContact CE2-CD1 4.49Å; Y357-Y360 WeakPolarHBondContact O-CB 3.49Å; Y357-Y360 PolarHBondContact O-N 3.34Å; Y357-V361 HydrophobicContact CD1-CG2 4.3Å; Y357-V361 HydrophobicContact CE1-CG2 3.95Å; Y357-V361 WeakPolarHBondContact O-CG2 3.46Å; Y357-V361 PolarHBondContact O-N 3.1Å
358	R	58.6	Low	48.5	Very low	170 Å²	170	137 Å²	137	64%	0.642	66%	0.664	S	S	*	*	H	α-helix	trans	-68.4	-31.3	174.3	-161.4	170.8	-177.6	178.5	-0.5	111.3	T355 V361 R362	T355-R358 WeakPolarHBondContact O-CA 3.42Å; T355-R358 WeakPolarHBondContact O-CB 3.35Å; T355-R358 PolarHBondContact O-N 3Å; R358-V361 PolarHBondContact O-N 3.23Å; R358-R362 WeakPolarHBondContact O-CB 3.42Å; R358-R362 VanDerWaalsContact O-CG 3.28Å; R358-R362 WeakPolarHBondContact O-CG 3.39Å; R358-R362 PolarHBondContact O-N 2.9Å
359	D	57.2	Low	48.7	Very low	50 Å²	50	135.5 Å²	135.5	27%	0.267	66%	0.655	S	S	.	*	H	α-helix	trans	-78.3	-19.5	172.2	-64.7	-37.1	0	0	0	114.3	T355 R356 Y357 R362 R363	T355-D359 PolarHBondContact O-N 2.78Å; R356-D359 PolarHBondContact O-N 3.1Å; Y357-D359 VanDerWaalsContact C-N 3.29Å; Y357-D359 PolarHBondContact O-N 3.09Å; D359-R362 VanDerWaalsContact OD1-CD 3.24Å; D359-R362 WeakPolarHBondContact OD1-CD 3.46Å; D359-R362 IonicContact OD1-CZ 3.88Å; D359-R362 IonicContact OD1-NE 2.7Å; D359-R362 IonicContact OD1-NH1 2.82Å; D359-R362 PolarHBondContact OD1-NH1 2.82Å; D359-R363 WeakPolarHBondContact O-CG 3.43Å; D359-R363 PolarHBondContact O-N 3.47Å; D359-R363 PolarHBondContact O-NE 3.22Å; D359-R363 VanDerWaalsContact O-NE 3.08Å
360	Y	62.5	Low	49.1	Very low	125 Å²	125	133.1 Å²	133.1	49%	0.49	63%	0.634	S	S	.	*	H	α-helix	trans	-73	-45.5	164.8	176.8	-94.7	0	0	0	110.6	R356 Y357 R362 R363 Q364	R356-Y360 PolarHBondContact O-N 2.96Å; Y357-Y360 HydrophobicContact CE2-CD1 4.49Å; Y357-Y360 WeakPolarHBondContact O-CB 3.49Å; Y357-Y360 PolarHBondContact O-N 3.34Å; Y360-R362 VanDerWaalsContact C-N 3.33Å; Y360-R362 PolarHBondContact O-N 2.89Å; Y360-R363 WeakPolarHBondContact O-CB 3.1Å; Y360-R363 PolarHBondContact O-N 3.14Å; Y360-R363 VanDerWaalsContact O-N 3.08Å; Y360-Q364 HydrophobicContact CD1-CG 4.35Å; Y360-Q364 HydrophobicContact CE1-CG 3.88Å; Y360-Q364 PolarHBondContact O-N 3.31Å; Y360-Q364 PolarHBondContact OH-NE2 3.05Å
361	V	56.6	Low	50	Low	58 Å²	58	127.7 Å²	127.7	35%	0.352	62%	0.618	S	S	.	*	H	α-helix	trans	-64.6	-34.5	175	175.1	0	0	0	0	112	Y357 R358 R363 Q364 K365	Y357-V361 HydrophobicContact CD1-CG2 4.3Å; Y357-V361 HydrophobicContact CE1-CG2 3.95Å; Y357-V361 WeakPolarHBondContact O-CG2 3.46Å; Y357-V361 PolarHBondContact O-N 3.1Å; R358-V361 PolarHBondContact O-N 3.23Å; V361-R363 VanDerWaalsContact C-N 3.34Å; V361-Q364 PolarHBondContact O-N 3.08Å; V361-K365 PolarHBondContact O-N 3.21Å
362	R	54.4	Low	51.3	Low	142 Å²	142	123.9 Å²	123.9	54%	0.536	61%	0.606	S	S	.	*	H	α-helix	trans	-64.8	-32.9	170.7	-77	163.2	169.1	161.8	-5.5	113.1	R358 D359 Y360 R366	R358-R362 WeakPolarHBondContact O-CB 3.42Å; R358-R362 VanDerWaalsContact O-CG 3.28Å; R358-R362 WeakPolarHBondContact O-CG 3.39Å; R358-R362 PolarHBondContact O-N 2.9Å; D359-R362 VanDerWaalsContact OD1-CD 3.24Å; D359-R362 WeakPolarHBondContact OD1-CD 3.46Å; D359-R362 IonicContact OD1-CZ 3.88Å; D359-R362 IonicContact OD1-NE 2.7Å; D359-R362 IonicContact OD1-NH1 2.82Å; D359-R362 PolarHBondContact OD1-NH1 2.82Å; Y360-R362 VanDerWaalsContact C-N 3.33Å; Y360-R362 PolarHBondContact O-N 2.89Å; R362-R366 WeakPolarHBondContact O-CB 3.34Å; R362-R366 PolarHBondContact O-N 3.35Å
363	R	56.4	Low	52.3	Low	174 Å²	174	123.2 Å²	123.2	66%	0.657	60%	0.598	S	S	*	*	H	α-helix	trans	-70.2	-44.9	171.5	-78	174.5	-114.1	-148.1	-7.7	111.3	D359 Y360 V361 K365 R366	D359-R363 WeakPolarHBondContact O-CG 3.43Å; D359-R363 PolarHBondContact O-N 3.47Å; D359-R363 PolarHBondContact O-NE 3.22Å; D359-R363 VanDerWaalsContact O-NE 3.08Å; Y360-R363 WeakPolarHBondContact O-CB 3.1Å; Y360-R363 PolarHBondContact O-N 3.14Å; Y360-R363 VanDerWaalsContact O-N 3.08Å; V361-R363 VanDerWaalsContact C-N 3.34Å; R363-K365 VanDerWaalsContact C-N 3.28Å; R363-K365 PolarHBondContact O-N 3.47Å; R363-R366 CarbonylContact O-C 3.6Å; R363-R366 PolarHBondContact O-N 2.88Å
364	Q	52.6	Low	53.4	Low	83 Å²	83	120.7 Å²	120.7	39%	0.388	58%	0.58	S	S	.	*	H	α-helix	trans	-60.5	-35.3	174.4	-70.9	-70.9	9.8	0	0	112.8	Y360 V361 R366	Y360-Q364 HydrophobicContact CD1-CG 4.35Å; Y360-Q364 HydrophobicContact CE1-CG 3.88Å; Y360-Q364 PolarHBondContact O-N 3.31Å; Y360-Q364 PolarHBondContact OH-NE2 3.05Å; V361-Q364 PolarHBondContact O-N 3.08Å; Q364-R366 VanDerWaalsContact C-N 3.29Å; Q364-R366 PolarHBondContact O-N 3.28Å
365	K	46.1	Very low	54.2	Low	183 Å²	183	117.9 Å²	117.9	80%	0.796	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	12.9	172.2	-72	-161.2	171.8	-167.8	0	114.9	V361 R363	V361-K365 PolarHBondContact O-N 3.21Å; R363-K365 VanDerWaalsContact C-N 3.28Å; R363-K365 PolarHBondContact O-N 3.47Å
366	R	40.9	Very low	54.7	Low	221 Å²	221	118.9 Å²	118.9	83%	0.834	55%	0.551	S	S	*	*	S	Bend	trans	-140.3	71.5	173.5	-74.9	-171.1	171.6	-175.3	-2.9	112	R362 R363 Q364	R362-R366 WeakPolarHBondContact O-CB 3.34Å; R362-R366 PolarHBondContact O-N 3.35Å; R363-R366 CarbonylContact O-C 3.6Å; R363-R366 PolarHBondContact O-N 2.88Å; Q364-R366 VanDerWaalsContact C-N 3.29Å; Q364-R366 PolarHBondContact O-N 3.28Å
367	G	36.8	Very low	55.3	Low	61 Å²	61	114.3 Å²	114.3	63%	0.629	54%	0.543	S	S	*	.	S	Bend	trans	77	89.1	159.1	0	0	0	0	0	116.4
368	C	48.5	Very low	56	Low	97 Å²	97	108.6 Å²	108.6	66%	0.655	52%	0.524	S	S	*	.			trans	57.8	106.7	156.9	-59.2	0	0	0	0	118.1	H370	C368-H370 PolarHBondContact O-N 3.1Å; C368-H370 VanDerWaalsContact O-N 3.1Å; C368-H370 PolarHBondContact O-ND1 2.71Å
369	P	41.4	Very low	56.6	Low	95 Å²	95	106.2 Å²	106.2	62%	0.617	52%	0.518	S	S	*	.			trans	-63.6	114.7	162.1	29.3	-32.7	0	0	0	108.9	T371	P369-T371 PolarHBondContact O-N 2.84Å
370	H	48.7	Very low	57.3	Low	90 Å²	90	109.4 Å²	109.4	42%	0.417	54%	0.535	S	S	.	.			trans	-74.8	120.2	179.1	-74.3	46.3	0	0	0	109.8	C368 S374 L375 N378	C368-H370 PolarHBondContact O-N 3.1Å; C368-H370 VanDerWaalsContact O-N 3.1Å; C368-H370 PolarHBondContact O-ND1 2.71Å; H370-S374 VanDerWaalsContact C-OG 3.27Å; H370-S374 WeakPolarHBondContact CA-OG 3.41Å; H370-S374 VanDerWaalsContact CB-OG 3.22Å; H370-S374 WeakPolarHBondContact CB-OG 3.06Å; H370-L375 HydrophobicContact CB-CD2 3.79Å; H370-L375 HydrophobicContact CB-CG 4Å; H370-N378 PolarHBondContact NE2-ND2 3.42Å
371	T	60	Low	58.1	Low	80 Å²	80	107.8 Å²	107.8	49%	0.491	53%	0.531	S	S	.	.			trans	-62.3	158.8	160.4	61.7	0	0	0	0	109.5	P369 E373 S374 L375	P369-T371 PolarHBondContact O-N 2.84Å; T371-E373 PolarHBondContact O-N 3.18Å; T371-S374 PolarHBondContact N-OG 3.3Å; T371-S374 WeakPolarHBondContact O-CA 3.49Å; T371-S374 PolarHBondContact O-N 3.42Å; T371-S374 PolarHBondContact O-OG 3.01Å; T371-S374 PolarHBondContact OG1-N 3.19Å; T371-S374 PolarHBondContact OG1-OG 2.86Å; T371-L375 PolarHBondContact O-N 3.22Å
372	I	61	Low	59	Low	124 Å²	124	105.1 Å²	105.1	64%	0.636	52%	0.515	S	S	*	.	H	α-helix	trans	-54.6	-41.5	177.2	-69	172.6	0	0	0	110.7	S374 L375 W376	I372-S374 VanDerWaalsContact C-N 3.34Å; I372-S374 PolarHBondContact O-N 3.03Å; I372-L375 WeakPolarHBondContact O-CB 3.17Å; I372-L375 PolarHBondContact O-N 3.4Å; I372-W376 VanDerWaalsContact CG2-NE1 3.3Å; I372-W376 PolarHBondContact O-N 3.04Å; I372-W376 VanDerWaalsContact O-N 3.1Å
373	E	59.5	Low	60	Low	142 Å²	142	100.1 Å²	100.1	66%	0.664	50%	0.498	S	S	*	.	H	α-helix	trans	-57.2	-43.5	174.2	-60.8	157.8	150.9	0	0	112.4	T371 L375 W376 L377	T371-E373 PolarHBondContact O-N 3.18Å; E373-L375 VanDerWaalsContact C-N 3.3Å; E373-L375 PolarHBondContact O-N 2.98Å; E373-W376 PolarHBondContact O-N 3.22Å; E373-L377 WeakPolarHBondContact O-CG 3.19Å; E373-L377 PolarHBondContact O-N 3.21Å; E373-L377 VanDerWaalsContact O-N 3.09Å
374	S	61.9	Low	61	Low	37 Å²	37	96.9 Å²	96.9	26%	0.259	49%	0.494	S	S	.	.	H	α-helix	trans	-73.2	-16.9	176.5	70.5	0	0	0	0	114.3	H370 T371 I372 N378	H370-S374 VanDerWaalsContact C-OG 3.27Å; H370-S374 WeakPolarHBondContact CA-OG 3.41Å; H370-S374 VanDerWaalsContact CB-OG 3.22Å; H370-S374 WeakPolarHBondContact CB-OG 3.06Å; T371-S374 PolarHBondContact N-OG 3.3Å; T371-S374 WeakPolarHBondContact O-CA 3.49Å; T371-S374 PolarHBondContact O-N 3.42Å; T371-S374 PolarHBondContact O-OG 3.01Å; T371-S374 PolarHBondContact OG1-N 3.19Å; T371-S374 PolarHBondContact OG1-OG 2.86Å; I372-S374 VanDerWaalsContact C-N 3.34Å; I372-S374 PolarHBondContact O-N 3.03Å; S374-N378 PolarHBondContact O-N 3.43Å
375	L	66	Low	62.4	Low	59 Å²	59	95.7 Å²	95.7	31%	0.309	49%	0.49	S	S	.	.	H	α-helix	trans	-74.4	-41	166.5	-66.5	173.7	0	0	0	111	H370 T371 I372 E373 L377 N378 F381	H370-L375 HydrophobicContact CB-CD2 3.79Å; H370-L375 HydrophobicContact CB-CG 4Å; T371-L375 PolarHBondContact O-N 3.22Å; I372-L375 WeakPolarHBondContact O-CB 3.17Å; I372-L375 PolarHBondContact O-N 3.4Å; E373-L375 VanDerWaalsContact C-N 3.3Å; E373-L375 PolarHBondContact O-N 2.98Å; L375-L377 PolarHBondContact O-N 3.15Å; L375-N378 WeakPolarHBondContact O-CB 3.48Å; L375-N378 PolarHBondContact O-N 3.38Å; L375-F381 HydrophobicContact CB-CD1 4.19Å; L375-F381 HydrophobicContact CB-CE1 4.31Å
376	W	67	Low	64	Low	111 Å²	111	87.1 Å²	87.1	42%	0.42	45%	0.452	S	S	.	.	H	α-helix	trans	-65.3	-21.4	172.9	-62.2	116.4	0	0	0	113.3	I372 E373 M382 I385 W404	I372-W376 VanDerWaalsContact CG2-NE1 3.3Å; I372-W376 PolarHBondContact O-N 3.04Å; I372-W376 VanDerWaalsContact O-N 3.1Å; E373-W376 PolarHBondContact O-N 3.22Å; W376-M382 HydrophobicContact CD2-SD 4.45Å; W376-M382 HydrophobicContact CE3-CE 3.76Å; W376-M382 HydrophobicContact CE3-SD 3.45Å; W376-M382 HydrophobicContact CZ3-CE 4.07Å; W376-M382 HydrophobicContact CZ3-SD 4.01Å; W376-M382 WeakPolarHBondContact O-CG 3.17Å; W376-I385 HydrophobicContact CZ3-CD1 4.32Å; W376-W404 AromaticContact CD2-CZ2 3.99Å; W376-W404 HydrophobicContact CD2-CZ2 3.99Å; W376-W404 HydrophobicContact CE3-CH2 4.04Å; W376-W404 AromaticContact CE3-CZ2 3.31Å; W376-W404 HydrophobicContact CE3-CZ2 3.31Å; W376-W404 HydrophobicContact CH2-CH2 4.26Å; W376-W404 HydrophobicContact CH2-CZ2 4.28Å; W376-W404 AromaticContact CZ3-CH2 3.71Å; W376-W404 HydrophobicContact CZ3-CH2 3.71Å; W376-W404 AromaticContact CZ3-CZ2 3.49Å; W376-W404 HydrophobicContact CZ3-CZ2 3.49Å; W376-W404 VanDerWaalsContact CZ3-CZ2 3.49Å
377	L	68.2	Low	65.6	Low	127 Å²	127	78.9 Å²	78.9	67%	0.665	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-10.2	170.7	-67	167.7	0	0	0	113.6	E373 L375 K379	E373-L377 WeakPolarHBondContact O-CG 3.19Å; E373-L377 PolarHBondContact O-N 3.21Å; E373-L377 VanDerWaalsContact O-N 3.09Å; L375-L377 PolarHBondContact O-N 3.15Å; L377-K379 PolarHBondContact O-N 3.27Å
378	N	72.2	Confident	67.5	Low	51 Å²	51	85.9 Å²	85.9	27%	0.273	44%	0.441	S	S	.	.			trans	-80.3	105.8	-178.3	-171.8	-47.4	0	0	0	110.4	H370 S374 L375 N380 F381 M382	H370-N378 PolarHBondContact NE2-ND2 3.42Å; S374-N378 PolarHBondContact O-N 3.43Å; L375-N378 WeakPolarHBondContact O-CB 3.48Å; L375-N378 PolarHBondContact O-N 3.38Å; N378-N380 VanDerWaalsContact C-N 3.29Å; N378-N380 PolarHBondContact O-N 2.98Å; N378-N380 PolarHBondContact OD1-N 3.29Å; N378-F381 HydrophobicContact CB-CB 4.09Å; N378-F381 WeakPolarHBondContact O-CB 3.36Å; N378-F381 PolarHBondContact O-N 3.25Å; N378-F381 PolarHBondContact OD1-N 3.19Å; N378-M382 PolarHBondContact O-N 2.88Å
379	K	70.4	Confident	68.8	Low	120 Å²	120	82.6 Å²	82.6	52%	0.522	42%	0.417	S	S	.	.	H	α-helix	trans	-49.7	-45.4	-177	-61.3	-154.8	172.2	-171.4	0	113.5	L377 F381 M382 N383 F407	L377-K379 PolarHBondContact O-N 3.27Å; K379-F381 VanDerWaalsContact C-N 3.31Å; K379-F381 PolarHBondContact O-N 3.34Å; K379-M382 PolarHBondContact O-N 2.78Å; K379-N383 WeakPolarHBondContact O-CB 3.43Å; K379-N383 PolarHBondContact O-N 3.48Å; K379-F407 HydrophobicContact CB-CE2 3.63Å; K379-F407 HydrophobicContact CB-CZ 4.11Å; K379-F407 HydrophobicContact CD-CE2 4.05Å; K379-F407 HydrophobicContact CG-CD2 4.42Å; K379-F407 HydrophobicContact CG-CE2 3.68Å; K379-F407 WeakPolarHBondContact O-CZ 3.47Å
380	N	73	Confident	69.9	Low	117 Å²	117	81.6 Å²	81.6	63%	0.626	41%	0.409	S	S	*	.	H	α-helix	trans	-70.3	-30.8	-175.9	-65.7	-4	0	0	0	112	N378 N384	N378-N380 VanDerWaalsContact C-N 3.29Å; N378-N380 PolarHBondContact O-N 2.98Å; N378-N380 PolarHBondContact OD1-N 3.29Å; N380-N384 VanDerWaalsContact O-CG 3.28Å; N380-N384 PolarHBondContact O-N 3.11Å; N380-N384 PolarHBondContact O-ND2 3.17Å
381	F	77.9	Confident	70.6	Confident	91 Å²	91	78.4 Å²	78.4	40%	0.399	40%	0.4	S	S	.	.	H	α-helix	trans	-72.1	-46.7	175.6	-170.2	-110.2	0	0	0	111.4	L375 N378 K379 N383 N384 I385	L375-F381 HydrophobicContact CB-CD1 4.19Å; L375-F381 HydrophobicContact CB-CE1 4.31Å; N378-F381 HydrophobicContact CB-CB 4.09Å; N378-F381 WeakPolarHBondContact O-CB 3.36Å; N378-F381 PolarHBondContact O-N 3.25Å; N378-F381 PolarHBondContact OD1-N 3.19Å; K379-F381 VanDerWaalsContact C-N 3.31Å; K379-F381 PolarHBondContact O-N 3.34Å; F381-N383 PolarHBondContact O-N 3.31Å; F381-N384 PolarHBondContact O-N 3.35Å; F381-I385 HydrophobicContact CD1-CD1 3.96Å; F381-I385 HydrophobicContact CE1-CD1 3.62Å; F381-I385 HydrophobicContact CZ-CD1 4.13Å; F381-I385 PolarHBondContact O-N 3.41Å
382	M	75.8	Confident	70.8	Confident	3 Å²	3	79.1 Å²	79.1	2%	0.015	41%	0.405	C	S	.	.	H	α-helix	trans	-64.3	-38.8	177.7	-65.5	-52.4	-63.9	0	0	113	W376 N378 K379 N384 I385 F386 W404 F407	W376-M382 HydrophobicContact CD2-SD 4.45Å; W376-M382 HydrophobicContact CE3-CE 3.76Å; W376-M382 HydrophobicContact CE3-SD 3.45Å; W376-M382 HydrophobicContact CZ3-CE 4.07Å; W376-M382 HydrophobicContact CZ3-SD 4.01Å; W376-M382 WeakPolarHBondContact O-CG 3.17Å; N378-M382 PolarHBondContact O-N 2.88Å; K379-M382 PolarHBondContact O-N 2.78Å; M382-N384 VanDerWaalsContact C-N 3.32Å; M382-N384 PolarHBondContact O-N 3.25Å; M382-I385 PolarHBondContact O-N 3.09Å; M382-I385 HydrophobicContact SD-CD1 4.37Å; M382-F386 HydrophobicContact CB-CD2 4.44Å; M382-F386 HydrophobicContact CB-CE2 4.26Å; M382-F386 HydrophobicContact CE-CD2 4.42Å; M382-F386 HydrophobicContact CE-CE1 4.25Å; M382-F386 HydrophobicContact CE-CE2 3.52Å; M382-F386 HydrophobicContact CE-CZ 3.42Å; M382-F386 VanDerWaalsContact CE-CZ 3.42Å; M382-F386 WeakPolarHBondContact O-CD2 3.2Å; M382-F386 PolarHBondContact O-N 3.23Å; M382-W404 HydrophobicContact CE-CD2 4.15Å; M382-W404 HydrophobicContact CE-CG 4.45Å; M382-W404 HydrophobicContact CE-CZ2 4.14Å; M382-F407 HydrophobicContact CB-CD1 3.93Å; M382-F407 HydrophobicContact CB-CE1 3.47Å; M382-F407 VanDerWaalsContact CB-CE1 3.47Å; M382-F407 HydrophobicContact CB-CE2 4.47Å; M382-F407 HydrophobicContact CB-CZ 3.79Å
383	N	76.4	Confident	71.4	Confident	37 Å²	37	76.6 Å²	76.6	20%	0.198	39%	0.39	C	S	.	.	H	α-helix	trans	-57.6	-45.3	173.1	-86.9	-15.3	0	0	0	111.8	K379 F381 I385 F386 A387 F407 N411 F413	K379-N383 WeakPolarHBondContact O-CB 3.43Å; K379-N383 PolarHBondContact O-N 3.48Å; F381-N383 PolarHBondContact O-N 3.31Å; N383-I385 VanDerWaalsContact C-N 3.31Å; N383-I385 PolarHBondContact O-N 3.31Å; N383-F386 PolarHBondContact O-N 3.37Å; N383-A387 WeakPolarHBondContact O-CB 3.26Å; N383-A387 PolarHBondContact O-N 2.93Å; N383-F407 HydrophobicContact CB-CZ 4.36Å; N383-F407 WeakPolarHBondContact OD1-CE1 3.44Å; N383-F407 WeakPolarHBondContact OD1-CZ 3.37Å; N383-N411 PolarHBondContact ND2-OD1 3.06Å; N383-N411 WeakPolarHBondContact OD1-CB 3.48Å; N383-N411 PolarHBondContact OD1-OD1 3.47Å; N383-N411 VanDerWaalsContact OD1-OD1 3.12Å; N383-F413 HydrophobicContact CB-CZ 4.37Å; N383-F413 WeakPolarHBondContact O-CZ 3.38Å; N383-F413 VanDerWaalsContact OD1-CE2 3.3Å; N383-F413 WeakPolarHBondContact OD1-CE2 3.31Å
384	N	77.3	Confident	72	Confident	106 Å²	106	69.9 Å²	69.9	57%	0.567	36%	0.359	S	S	*	.	H	α-helix	trans	-65.4	-33.8	179.8	-69.7	-15.9	0	0	0	112.3	N380 F381 M382 Y388	N380-N384 VanDerWaalsContact O-CG 3.28Å; N380-N384 PolarHBondContact O-N 3.11Å; N380-N384 PolarHBondContact O-ND2 3.17Å; F381-N384 PolarHBondContact O-N 3.35Å; M382-N384 VanDerWaalsContact C-N 3.32Å; M382-N384 PolarHBondContact O-N 3.25Å; N384-Y388 WeakPolarHBondContact O-CD2 3.46Å
385	I	82.2	Confident	72.4	Confident	58 Å²	58	72.2 Å²	72.2	30%	0.297	37%	0.368	S	S	.	.	H	α-helix	trans	-68.4	-55.4	175	-66	171.3	0	0	0	110.6	W376 F381 M382 N383 A387 Y388	W376-I385 HydrophobicContact CZ3-CD1 4.32Å; F381-I385 HydrophobicContact CD1-CD1 3.96Å; F381-I385 HydrophobicContact CE1-CD1 3.62Å; F381-I385 HydrophobicContact CZ-CD1 4.13Å; F381-I385 PolarHBondContact O-N 3.41Å; M382-I385 PolarHBondContact O-N 3.09Å; M382-I385 HydrophobicContact SD-CD1 4.37Å; N383-I385 VanDerWaalsContact C-N 3.31Å; N383-I385 PolarHBondContact O-N 3.31Å; I385-A387 PolarHBondContact O-N 3.19Å; I385-Y388 PolarHBondContact O-N 3.12Å; I385-Y388 VanDerWaalsContact O-N 3.07Å
386	F	78.9	Confident	72.7	Confident	2 Å²	2	75.4 Å²	75.4	1%	0.009	38%	0.38	C	S	.	.	H	α-helix	trans	-66.2	-21.2	-178.4	-62.2	-42.5	0	0	0	113.3	M382 N383 Y388 L389 L394 W404 F407 M408 F413 K416	M382-F386 HydrophobicContact CB-CD2 4.44Å; M382-F386 HydrophobicContact CB-CE2 4.26Å; M382-F386 HydrophobicContact CE-CD2 4.42Å; M382-F386 HydrophobicContact CE-CE1 4.25Å; M382-F386 HydrophobicContact CE-CE2 3.52Å; M382-F386 HydrophobicContact CE-CZ 3.42Å; M382-F386 VanDerWaalsContact CE-CZ 3.42Å; M382-F386 WeakPolarHBondContact O-CD2 3.2Å; M382-F386 PolarHBondContact O-N 3.23Å; N383-F386 PolarHBondContact O-N 3.37Å; F386-Y388 VanDerWaalsContact C-N 3.3Å; F386-Y388 PolarHBondContact O-N 2.87Å; F386-L389 HydrophobicContact CD1-CD1 3.83Å; F386-L389 HydrophobicContact CE1-CD1 4.41Å; F386-L389 PolarHBondContact O-N 3.43Å; F386-L394 HydrophobicContact CB-CD2 4.08Å; F386-L394 HydrophobicContact CD1-CD2 4.16Å; F386-L394 HydrophobicContact CG-CD2 4.39Å; F386-W404 HydrophobicContact CE1-CE3 4.18Å; F386-W404 HydrophobicContact CZ-CB 4.14Å; F386-W404 AromaticContact CZ-CD2 3.93Å; F386-W404 HydrophobicContact CZ-CD2 3.93Å; F386-W404 AromaticContact CZ-CE3 3.86Å; F386-W404 HydrophobicContact CZ-CE3 3.86Å; F386-W404 HydrophobicContact CZ-CG 4.05Å; F386-F407 AromaticContact CD2-CD1 3.72Å; F386-F407 HydrophobicContact CD2-CD1 3.72Å; F386-F407 AromaticContact CD2-CE1 3.95Å; F386-F407 HydrophobicContact CD2-CE1 3.95Å; F386-F407 AromaticContact CE2-CD1 3.65Å; F386-F407 HydrophobicContact CE2-CD1 3.65Å; F386-F407 HydrophobicContact CE2-CE1 4.24Å; F386-M408 HydrophobicContact CD1-CG 4.41Å; F386-M408 HydrophobicContact CD1-SD 3.99Å; F386-M408 HydrophobicContact CD2-CG 3.67Å; F386-M408 HydrophobicContact CD2-SD 4.3Å; F386-M408 HydrophobicContact CE1-SD 4.04Å; F386-M408 HydrophobicContact CE2-CG 3.78Å; F386-M408 HydrophobicContact CE2-SD 4.35Å; F386-M408 HydrophobicContact CG-CG 4.01Å; F386-M408 HydrophobicContact CG-SD 4.13Å; F386-M408 HydrophobicContact CZ-CG 4.21Å; F386-M408 HydrophobicContact CZ-SD 4.22Å; F386-F413 HydrophobicContact CB-CD1 4.25Å; F386-F413 HydrophobicContact CB-CD2 3.95Å; F386-F413 HydrophobicContact CB-CE1 4.07Å; F386-F413 HydrophobicContact CB-CE2 3.72Å; F386-F413 HydrophobicContact CB-CG 4.2Å; F386-F413 HydrophobicContact CB-CZ 3.79Å; F386-F413 HydrophobicContact CD2-CE2 4.39Å; F386-K416 PolarHBondContact O-NZ 3.48Å
387	A	74.8	Confident	73	Confident	49 Å²	49	74.7 Å²	74.7	41%	0.405	38%	0.378	S	S	.	.	H	α-helix	trans	-62.6	-31.2	170.9	0	0	0	0	0	113.6	N383 I385 F413 K416	N383-A387 WeakPolarHBondContact O-CB 3.26Å; N383-A387 PolarHBondContact O-N 2.93Å; I385-A387 PolarHBondContact O-N 3.19Å; A387-F413 HydrophobicContact CB-CE1 4.21Å; A387-K416 PolarHBondContact O-NZ 3.4Å
388	Y	77	Confident	73.2	Confident	208 Å²	208	70.1 Å²	70.1	82%	0.816	36%	0.357	S	S	*	.	H	α-helix	trans	-86.1	-17.8	178	-70.4	-67	0	0	0	114.6	N384 I385 F386	N384-Y388 WeakPolarHBondContact O-CD2 3.46Å; I385-Y388 PolarHBondContact O-N 3.12Å; I385-Y388 VanDerWaalsContact O-N 3.07Å; F386-Y388 VanDerWaalsContact C-N 3.3Å; F386-Y388 PolarHBondContact O-N 2.87Å
389	L	74.7	Confident	73.3	Confident	28 Å²	28	74.1 Å²	74.1	15%	0.147	38%	0.377	C	S	.	.			trans	-76.2	149.3	-176	-58.1	-169.9	0	0	0	113.6	F386 E393 L394 Y397 K416	F386-L389 HydrophobicContact CD1-CD1 3.83Å; F386-L389 HydrophobicContact CE1-CD1 4.41Å; F386-L389 PolarHBondContact O-N 3.43Å; L389-E393 HydrophobicContact CB-CB 4.19Å; L389-E393 HydrophobicContact CD1-CB 4.47Å; L389-L394 HydrophobicContact CB-CD2 4.01Å; L389-L394 HydrophobicContact CB-CG 3.94Å; L389-L394 HydrophobicContact CD1-CD2 4.2Å; L389-Y397 HydrophobicContact CD1-CD2 3.36Å; L389-Y397 HydrophobicContact CD1-CE2 3.62Å; L389-Y397 HydrophobicContact CD1-CG 4.28Å; L389-Y397 HydrophobicContact CD2-CE2 4.41Å; L389-K416 PolarHBondContact O-NZ 2.77Å
390	T	65	Low	73.8	Confident	73 Å²	73	72.7 Å²	72.7	45%	0.448	38%	0.378	S	S	.	.			trans	-79.3	164.9	172	63.7	0	0	0	0	112.1	T392 E393 L394	T390-T392 VanDerWaalsContact C-N 3.32Å; T390-T392 PolarHBondContact O-N 2.99Å; T390-T392 PolarHBondContact OG1-OG1 3.13Å; T390-E393 WeakPolarHBondContact CB-OE2 3.39Å; T390-E393 WeakPolarHBondContact CG2-OE2 3.49Å; T390-E393 PolarHBondContact N-OE2 3.36Å; T390-E393 PolarHBondContact O-N 3.48Å; T390-E393 VanDerWaalsContact OG1-CD 3.29Å; T390-E393 WeakPolarHBondContact OG1-CG 3.17Å; T390-E393 PolarHBondContact OG1-OE2 3.4Å; T390-L394 VanDerWaalsContact O-CG 3.27Å; T390-L394 WeakPolarHBondContact O-CG 3.46Å; T390-L394 PolarHBondContact O-N 3.43Å
391	G	63.4	Low	74	Confident	23 Å²	23	69.3 Å²	69.3	24%	0.237	36%	0.363	C	S	.	.	H	α-helix	trans	-60.5	-36.5	-179.3	0	0	0	0	0	114.1	I395 L417	G391-I395 WeakPolarHBondContact O-CG1 3.3Å; G391-I395 PolarHBondContact O-N 3.35Å; G391-L417 WeakPolarHBondContact O-CD2 3.1Å
392	T	63.6	Low	73.8	Confident	96 Å²	96	71.4 Å²	71.4	59%	0.589	37%	0.368	S	S	*	.	H	α-helix	trans	-69.5	-42.4	177	44.4	0	0	0	0	112.1	T390 I395 H396	T390-T392 VanDerWaalsContact C-N 3.32Å; T390-T392 PolarHBondContact O-N 2.99Å; T390-T392 PolarHBondContact OG1-OG1 3.13Å; T392-I395 PolarHBondContact O-N 2.98Å; T392-H396 PolarHBondContact O-N 2.94Å
393	E	74.5	Confident	73.6	Confident	71 Å²	71	75 Å²	75	33%	0.332	39%	0.391	S	S	.	.	H	α-helix	trans	-61.8	-45.1	174.2	-70.4	168.7	125	0	0	111.6	L389 T390 I395 H396 Y397	L389-E393 HydrophobicContact CB-CB 4.19Å; L389-E393 HydrophobicContact CD1-CB 4.47Å; T390-E393 WeakPolarHBondContact CB-OE2 3.39Å; T390-E393 WeakPolarHBondContact CG2-OE2 3.49Å; T390-E393 PolarHBondContact N-OE2 3.36Å; T390-E393 PolarHBondContact O-N 3.48Å; T390-E393 VanDerWaalsContact OG1-CD 3.29Å; T390-E393 WeakPolarHBondContact OG1-CG 3.17Å; T390-E393 PolarHBondContact OG1-OE2 3.4Å; E393-I395 PolarHBondContact O-N 3.28Å; E393-H396 PolarHBondContact O-N 3.23Å; E393-Y397 HydrophobicContact CB-CD2 4.23Å; E393-Y397 HydrophobicContact CB-CE2 4.08Å; E393-Y397 WeakPolarHBondContact O-CD2 3.46Å; E393-Y397 PolarHBondContact O-N 2.72Å
394	L	72.2	Confident	73.6	Confident	1 Å²	1	75.4 Å²	75.4	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-57.7	-33.8	177.5	-71.8	165.5	0	0	0	112.3	F386 L389 T390 S398 M408 K416 L417	F386-L394 HydrophobicContact CB-CD2 4.08Å; F386-L394 HydrophobicContact CD1-CD2 4.16Å; F386-L394 HydrophobicContact CG-CD2 4.39Å; L389-L394 HydrophobicContact CB-CD2 4.01Å; L389-L394 HydrophobicContact CB-CG 3.94Å; L389-L394 HydrophobicContact CD1-CD2 4.2Å; T390-L394 VanDerWaalsContact O-CG 3.27Å; T390-L394 WeakPolarHBondContact O-CG 3.46Å; T390-L394 PolarHBondContact O-N 3.43Å; L394-S398 WeakPolarHBondContact O-CB 3.32Å; L394-S398 PolarHBondContact O-N 3Å; L394-M408 HydrophobicContact CB-SD 4.48Å; L394-M408 HydrophobicContact CD2-SD 3.46Å; L394-M408 WeakPolarHBondContact CD2-SD 3.33Å; L394-K416 HydrophobicContact CD1-CB 4.05Å; L394-K416 HydrophobicContact CD1-CD 3.57Å; L394-K416 HydrophobicContact CD1-CG 4.49Å; L394-L417 HydrophobicContact CB-CD2 4.01Å
395	I	69.9	Low	73.3	Confident	86 Å²	86	73.8 Å²	73.8	44%	0.441	38%	0.376	S	S	.	.	H	α-helix	trans	-64.3	-48.1	172.5	-66.4	166.7	0	0	0	110.8	G391 T392 E393 Y397 S398 L417	G391-I395 WeakPolarHBondContact O-CG1 3.3Å; G391-I395 PolarHBondContact O-N 3.35Å; T392-I395 PolarHBondContact O-N 2.98Å; E393-I395 PolarHBondContact O-N 3.28Å; I395-Y397 PolarHBondContact O-N 3.17Å; I395-S398 WeakPolarHBondContact O-CB 3.34Å; I395-S398 PolarHBondContact O-N 3.17Å; I395-S398 PolarHBondContact O-OG 3.41Å; I395-L417 HydrophobicContact CD1-CD2 4.34Å; I395-L417 HydrophobicContact CG1-CD2 3.81Å
396	H	72.9	Confident	72.8	Confident	125 Å²	125	73.4 Å²	73.4	58%	0.579	37%	0.373	S	S	*	.	H	α-helix	trans	-62	-45.4	178.4	-62	144.5	0	0	0	112.1	T392 E393 S398 I399	T392-H396 PolarHBondContact O-N 2.94Å; E393-H396 PolarHBondContact O-N 3.23Å; H396-S398 PolarHBondContact O-N 3.19Å; H396-I399 PolarHBondContact O-N 2.98Å
397	Y	73.7	Confident	72.4	Confident	96 Å²	96	74.4 Å²	74.4	38%	0.376	38%	0.377	S	S	.	.	H	α-helix	trans	-69.9	-17.6	177.7	-64.9	-65.3	0	0	0	113.8	L389 E393 I395 I399 V400 W404	L389-Y397 HydrophobicContact CD1-CD2 3.36Å; L389-Y397 HydrophobicContact CD1-CE2 3.62Å; L389-Y397 HydrophobicContact CD1-CG 4.28Å; L389-Y397 HydrophobicContact CD2-CE2 4.41Å; E393-Y397 HydrophobicContact CB-CD2 4.23Å; E393-Y397 HydrophobicContact CB-CE2 4.08Å; E393-Y397 WeakPolarHBondContact O-CD2 3.46Å; E393-Y397 PolarHBondContact O-N 2.72Å; I395-Y397 PolarHBondContact O-N 3.17Å; Y397-I399 PolarHBondContact O-N 2.95Å; Y397-V400 HydrophobicContact CD1-CG2 4.25Å; Y397-V400 PolarHBondContact O-N 3.11Å; Y397-W404 AromaticContact CD1-CZ3 3.88Å; Y397-W404 HydrophobicContact CD1-CZ3 3.88Å
398	S	71.1	Confident	72.2	Confident	32 Å²	32	72.6 Å²	72.6	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-68.3	-22.2	174.1	80	0	0	0	0	113.7	L394 I395 H396 M408	L394-S398 WeakPolarHBondContact O-CB 3.32Å; L394-S398 PolarHBondContact O-N 3Å; I395-S398 WeakPolarHBondContact O-CB 3.34Å; I395-S398 PolarHBondContact O-N 3.17Å; I395-S398 PolarHBondContact O-OG 3.41Å; H396-S398 PolarHBondContact O-N 3.19Å; S398-M408 VanDerWaalsContact CA-CE 3.42Å
399	I	75.6	Confident	71.7	Confident	135 Å²	135	64 Å²	64	69%	0.692	33%	0.331	S	S	*	.	H	α-helix	trans	-88.4	-21.3	-177.9	-56.2	168.1	0	0	0	111	H396 Y397 C401	H396-I399 PolarHBondContact O-N 2.98Å; Y397-I399 PolarHBondContact O-N 2.95Å; I399-C401 PolarHBondContact O-N 3.49Å
400	V	80.9	Confident	71.3	Confident	90 Å²	90	68.4 Å²	68.4	55%	0.545	35%	0.354	S	S	.	.	H	α-helix	trans	-61.3	-47.6	-172.4	173.4	0	0	0	0	112.9	Y397 W404	Y397-V400 HydrophobicContact CD1-CG2 4.25Å; Y397-V400 PolarHBondContact O-N 3.11Å; V400-W404 HydrophobicContact CB-CE3 4.18Å; V400-W404 HydrophobicContact CB-CZ3 4.41Å; V400-W404 HydrophobicContact CG1-CE3 4.17Å; V400-W404 HydrophobicContact CG1-CZ3 4.13Å
401	C	76	Confident	71.4	Confident	45 Å²	45	67.5 Å²	67.5	30%	0.304	35%	0.346	S	S	.	.			trans	-157.6	153.8	169.7	78.4	0	0	0	0	112.9	I399 T403 W404 Y405	I399-C401 PolarHBondContact O-N 3.49Å; C401-T403 PolarHBondContact O-N 2.95Å; C401-W404 PolarHBondContact O-N 3.08Å; C401-W404 VanDerWaalsContact O-N 3.1Å; C401-W404 VanDerWaalsContact SG-CG 3.54Å; C401-W404 PolarHBondContact SG-N 3.35Å; C401-Y405 PolarHBondContact O-N 2.62Å; C401-Y405 VanDerWaalsContact O-N 3.08Å
402	R	73.7	Confident	71.2	Confident	135 Å²	135	68.1 Å²	68.1	51%	0.509	35%	0.352	S	S	.	.	H	α-helix	trans	-53.7	-38.2	176.9	-178.6	176.3	176.5	132.1	20	112.8	Y405 E406 F579	R402-Y405 PolarHBondContact O-N 3.24Å; R402-E406 HydrophobicContact CG-CG 4.32Å; R402-E406 IonicContact CZ-OE1 3.22Å; R402-E406 VanDerWaalsContact CZ-OE1 3.22Å; R402-E406 IonicContact NE-OE1 2.72Å; R402-E406 PolarHBondContact NE-OE1 3.29Å; R402-E406 IonicContact NH2-OE1 2.69Å; R402-E406 PolarHBondContact NH2-OE1 3.02Å; R402-E406 WeakPolarHBondContact O-CB 3.15Å; R402-E406 WeakPolarHBondContact O-CG 3.37Å; R402-E406 PolarHBondContact O-N 3.27Å; R402-F579 VanDerWaalsContact NH2-CE1 3.34Å
403	T	71.6	Confident	71.2	Confident	80 Å²	80	64.7 Å²	64.7	49%	0.491	33%	0.329	S	S	.	.	H	α-helix	trans	-66.5	-37.3	-179.5	-41.7	0	0	0	0	112	C401 F407	C401-T403 PolarHBondContact O-N 2.95Å; T403-F407 WeakPolarHBondContact O-CB 3.08Å; T403-F407 PolarHBondContact O-N 3.02Å
404	W	77.1	Confident	70.5	Confident	45 Å²	45	62.3 Å²	62.3	17%	0.17	32%	0.318	C	S	.	.	H	α-helix	trans	-73.1	-37.3	175.1	-72.2	15.6	0	0	0	111.6	W376 M382 F386 Y397 V400 C401 F407 M408	W376-W404 AromaticContact CD2-CZ2 3.99Å; W376-W404 HydrophobicContact CD2-CZ2 3.99Å; W376-W404 HydrophobicContact CE3-CH2 4.04Å; W376-W404 AromaticContact CE3-CZ2 3.31Å; W376-W404 HydrophobicContact CE3-CZ2 3.31Å; W376-W404 HydrophobicContact CH2-CH2 4.26Å; W376-W404 HydrophobicContact CH2-CZ2 4.28Å; W376-W404 AromaticContact CZ3-CH2 3.71Å; W376-W404 HydrophobicContact CZ3-CH2 3.71Å; W376-W404 AromaticContact CZ3-CZ2 3.49Å; W376-W404 HydrophobicContact CZ3-CZ2 3.49Å; W376-W404 VanDerWaalsContact CZ3-CZ2 3.49Å; M382-W404 HydrophobicContact CE-CD2 4.15Å; M382-W404 HydrophobicContact CE-CG 4.45Å; M382-W404 HydrophobicContact CE-CZ2 4.14Å; F386-W404 HydrophobicContact CE1-CE3 4.18Å; F386-W404 HydrophobicContact CZ-CB 4.14Å; F386-W404 AromaticContact CZ-CD2 3.93Å; F386-W404 HydrophobicContact CZ-CD2 3.93Å; F386-W404 AromaticContact CZ-CE3 3.86Å; F386-W404 HydrophobicContact CZ-CE3 3.86Å; F386-W404 HydrophobicContact CZ-CG 4.05Å; Y397-W404 AromaticContact CD1-CZ3 3.88Å; Y397-W404 HydrophobicContact CD1-CZ3 3.88Å; V400-W404 HydrophobicContact CB-CE3 4.18Å; V400-W404 HydrophobicContact CB-CZ3 4.41Å; V400-W404 HydrophobicContact CG1-CE3 4.17Å; V400-W404 HydrophobicContact CG1-CZ3 4.13Å; C401-W404 PolarHBondContact O-N 3.08Å; C401-W404 VanDerWaalsContact O-N 3.1Å; C401-W404 VanDerWaalsContact SG-CG 3.54Å; C401-W404 PolarHBondContact SG-N 3.35Å; W404-F407 PolarHBondContact O-N 3.44Å; W404-M408 WeakPolarHBondContact O-CG 3.39Å; W404-M408 PolarHBondContact O-N 3.31Å
405	Y	71.6	Confident	69.9	Low	71 Å²	71	65.9 Å²	65.9	28%	0.278	34%	0.337	S	S	.	.	H	α-helix	trans	-59.6	-57.3	171.9	178.1	-106.4	0	0	0	111.7	C401 R402 F407 M408 C409 N482 R483	C401-Y405 PolarHBondContact O-N 2.62Å; C401-Y405 VanDerWaalsContact O-N 3.08Å; R402-Y405 PolarHBondContact O-N 3.24Å; Y405-F407 PolarHBondContact O-N 2.96Å; Y405-M408 PolarHBondContact O-N 3.34Å; Y405-C409 PolarHBondContact O-N 3.36Å; Y405-C409 PolarHBondContact O-SG 2.93Å; Y405-N482 PolarHBondContact OH-O 3.43Å; Y405-R483 HydrophobicContact CE2-CG 4.47Å; Y405-R483 WeakPolarHBondContact OH-CA 3.33Å; Y405-R483 WeakPolarHBondContact OH-CG 3.24Å
406	E	70.7	Confident	69.6	Low	50 Å²	50	66 Å²	66	23%	0.234	33%	0.334	C	S	.	.	H	α-helix	trans	-57.7	-35.9	177.5	-72.4	176	174.2	0	0	111.5	R402 L410	R402-E406 HydrophobicContact CG-CG 4.32Å; R402-E406 IonicContact CZ-OE1 3.22Å; R402-E406 VanDerWaalsContact CZ-OE1 3.22Å; R402-E406 IonicContact NE-OE1 2.72Å; R402-E406 PolarHBondContact NE-OE1 3.29Å; R402-E406 IonicContact NH2-OE1 2.69Å; R402-E406 PolarHBondContact NH2-OE1 3.02Å; R402-E406 WeakPolarHBondContact O-CB 3.15Å; R402-E406 WeakPolarHBondContact O-CG 3.37Å; R402-E406 PolarHBondContact O-N 3.27Å; E406-L410 WeakPolarHBondContact O-CB 3.46Å; E406-L410 WeakPolarHBondContact O-CD1 3.29Å; E406-L410 WeakPolarHBondContact O-CG 3.3Å; E406-L410 PolarHBondContact O-N 2.91Å
407	F	71.7	Confident	69.4	Low	23 Å²	23	61.5 Å²	61.5	10%	0.101	32%	0.315	C	S	.	.	H	α-helix	trans	-66	-42.8	173.8	-172	-91.6	0	0	0	113	K379 M382 N383 F386 T403 W404 Y405 C409 L410 N411 F413	K379-F407 HydrophobicContact CB-CE2 3.63Å; K379-F407 HydrophobicContact CB-CZ 4.11Å; K379-F407 HydrophobicContact CD-CE2 4.05Å; K379-F407 HydrophobicContact CG-CD2 4.42Å; K379-F407 HydrophobicContact CG-CE2 3.68Å; K379-F407 WeakPolarHBondContact O-CZ 3.47Å; M382-F407 HydrophobicContact CB-CD1 3.93Å; M382-F407 HydrophobicContact CB-CE1 3.47Å; M382-F407 VanDerWaalsContact CB-CE1 3.47Å; M382-F407 HydrophobicContact CB-CE2 4.47Å; M382-F407 HydrophobicContact CB-CZ 3.79Å; N383-F407 HydrophobicContact CB-CZ 4.36Å; N383-F407 WeakPolarHBondContact OD1-CE1 3.44Å; N383-F407 WeakPolarHBondContact OD1-CZ 3.37Å; F386-F407 AromaticContact CD2-CD1 3.72Å; F386-F407 HydrophobicContact CD2-CD1 3.72Å; F386-F407 AromaticContact CD2-CE1 3.95Å; F386-F407 HydrophobicContact CD2-CE1 3.95Å; F386-F407 AromaticContact CE2-CD1 3.65Å; F386-F407 HydrophobicContact CE2-CD1 3.65Å; F386-F407 HydrophobicContact CE2-CE1 4.24Å; T403-F407 WeakPolarHBondContact O-CB 3.08Å; T403-F407 PolarHBondContact O-N 3.02Å; W404-F407 PolarHBondContact O-N 3.44Å; Y405-F407 PolarHBondContact O-N 2.96Å; F407-C409 VanDerWaalsContact C-N 3.34Å; F407-L410 PolarHBondContact O-N 2.88Å; F407-N411 WeakPolarHBondContact CE1-ND2 3.3Å; F407-N411 WeakPolarHBondContact CE2-ND2 3.46Å; F407-N411 WeakPolarHBondContact CZ-ND2 3.22Å; F407-N411 PolarHBondContact O-N 3.38Å; F407-N411 PolarHBondContact O-ND2 2.87Å; F407-F413 HydrophobicContact CE1-CE2 4.45Å
408	M	70.5	Confident	69.6	Low	12 Å²	12	59.4 Å²	59.4	6%	0.059	31%	0.313	C	S	.	.	H	α-helix	trans	-68	-34.5	178.2	-74.4	-172.6	-66.8	0	0	112.5	F386 L394 S398 W404 Y405 F413	F386-M408 HydrophobicContact CD1-CG 4.41Å; F386-M408 HydrophobicContact CD1-SD 3.99Å; F386-M408 HydrophobicContact CD2-CG 3.67Å; F386-M408 HydrophobicContact CD2-SD 4.3Å; F386-M408 HydrophobicContact CE1-SD 4.04Å; F386-M408 HydrophobicContact CE2-CG 3.78Å; F386-M408 HydrophobicContact CE2-SD 4.35Å; F386-M408 HydrophobicContact CG-CG 4.01Å; F386-M408 HydrophobicContact CG-SD 4.13Å; F386-M408 HydrophobicContact CZ-CG 4.21Å; F386-M408 HydrophobicContact CZ-SD 4.22Å; L394-M408 HydrophobicContact CB-SD 4.48Å; L394-M408 HydrophobicContact CD2-SD 3.46Å; L394-M408 WeakPolarHBondContact CD2-SD 3.33Å; S398-M408 VanDerWaalsContact CA-CE 3.42Å; W404-M408 WeakPolarHBondContact O-CG 3.39Å; W404-M408 PolarHBondContact O-N 3.31Å; Y405-M408 PolarHBondContact O-N 3.34Å; M408-F413 HydrophobicContact CB-CB 4.41Å; M408-F413 HydrophobicContact CB-CD2 4.45Å; M408-F413 HydrophobicContact CG-CD2 4.28Å; M408-F413 PolarHBondContact O-N 2.75Å
409	C	65.5	Low	70.2	Confident	28 Å²	28	59.1 Å²	59.1	19%	0.189	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-50	170.3	-59	0	0	0	0	111.9	Y405 F407 N411 G412 Q414	Y405-C409 PolarHBondContact O-N 3.36Å; Y405-C409 PolarHBondContact O-SG 2.93Å; F407-C409 VanDerWaalsContact C-N 3.34Å; C409-N411 PolarHBondContact O-N 3.18Å; C409-N411 VanDerWaalsContact O-N 3.13Å; C409-G412 PolarHBondContact O-N 3.37Å; C409-Q414 PolarHBondContact O-OE1 2.84Å; C409-Q414 PolarHBondContact SG-NE2 3Å
410	L	65.6	Low	70.7	Confident	119 Å²	119	56.7 Å²	56.7	62%	0.623	30%	0.3	S	S	*	.	H	α-helix	trans	-68.2	-11.9	-174.2	-75.1	169.9	0	0	0	115.1	E406 F407	E406-L410 WeakPolarHBondContact O-CB 3.46Å; E406-L410 WeakPolarHBondContact O-CD1 3.29Å; E406-L410 WeakPolarHBondContact O-CG 3.3Å; E406-L410 PolarHBondContact O-N 2.91Å; F407-L410 PolarHBondContact O-N 2.88Å
411	N	67.1	Low	71	Confident	55 Å²	55	52.6 Å²	52.6	29%	0.294	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	12.8	-177.5	-62.1	-90.5	0	0	0	113.8	N383 F407 C409 F413	N383-N411 PolarHBondContact ND2-OD1 3.06Å; N383-N411 WeakPolarHBondContact OD1-CB 3.48Å; N383-N411 PolarHBondContact OD1-OD1 3.47Å; N383-N411 VanDerWaalsContact OD1-OD1 3.12Å; F407-N411 WeakPolarHBondContact CE1-ND2 3.3Å; F407-N411 WeakPolarHBondContact CE2-ND2 3.46Å; F407-N411 WeakPolarHBondContact CZ-ND2 3.22Å; F407-N411 PolarHBondContact O-N 3.38Å; F407-N411 PolarHBondContact O-ND2 2.87Å; C409-N411 PolarHBondContact O-N 3.18Å; C409-N411 VanDerWaalsContact O-N 3.13Å; N411-F413 HydrophobicContact CB-CD2 4.05Å; N411-F413 HydrophobicContact CB-CE2 3.73Å; N411-F413 PolarHBondContact O-N 3.36Å
412	G	59.7	Low	71.6	Confident	35 Å²	35	52.7 Å²	52.7	36%	0.361	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	23.1	171.4	0	0	0	0	0	115.6	C409 Q414 N415	C409-G412 PolarHBondContact O-N 3.37Å; G412-Q414 PolarHBondContact O-N 2.9Å; G412-N415 PolarHBondContact O-N 3.36Å; G412-N415 PolarHBondContact O-OD1 2.82Å
413	F	64	Low	72.3	Confident	25 Å²	25	46.3 Å²	46.3	11%	0.11	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-72.3	-11.9	172.7	-64.8	-67.7	0	0	0	112.7	N383 F386 A387 F407 M408 N411 N415 K416	N383-F413 HydrophobicContact CB-CZ 4.37Å; N383-F413 WeakPolarHBondContact O-CZ 3.38Å; N383-F413 VanDerWaalsContact OD1-CE2 3.3Å; N383-F413 WeakPolarHBondContact OD1-CE2 3.31Å; F386-F413 HydrophobicContact CB-CD1 4.25Å; F386-F413 HydrophobicContact CB-CD2 3.95Å; F386-F413 HydrophobicContact CB-CE1 4.07Å; F386-F413 HydrophobicContact CB-CE2 3.72Å; F386-F413 HydrophobicContact CB-CG 4.2Å; F386-F413 HydrophobicContact CB-CZ 3.79Å; F386-F413 HydrophobicContact CD2-CE2 4.39Å; A387-F413 HydrophobicContact CB-CE1 4.21Å; F407-F413 HydrophobicContact CE1-CE2 4.45Å; M408-F413 HydrophobicContact CB-CB 4.41Å; M408-F413 HydrophobicContact CB-CD2 4.45Å; M408-F413 HydrophobicContact CG-CD2 4.28Å; M408-F413 PolarHBondContact O-N 2.75Å; N411-F413 HydrophobicContact CB-CD2 4.05Å; N411-F413 HydrophobicContact CB-CE2 3.73Å; N411-F413 PolarHBondContact O-N 3.36Å; F413-N415 PolarHBondContact O-N 3.4Å; F413-K416 WeakPolarHBondContact O-CB 3.4Å; F413-K416 PolarHBondContact O-N 3.02Å; F413-K416 VanDerWaalsContact O-N 3.09Å
414	Q	59.5	Low	72.9	Confident	20 Å²	20	48.3 Å²	48.3	9%	0.093	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-58.6	-26.4	171.3	-72.4	155.3	-37.1	0	0	113.1	C409 G412 K416 L417 R483	C409-Q414 PolarHBondContact O-OE1 2.84Å; C409-Q414 PolarHBondContact SG-NE2 3Å; G412-Q414 PolarHBondContact O-N 2.9Å; Q414-K416 PolarHBondContact O-N 3.43Å; Q414-L417 WeakPolarHBondContact O-CB 3.28Å; Q414-L417 PolarHBondContact O-N 3.35Å; Q414-R483 PolarHBondContact NE2-O 2.75Å
415	N	59.8	Low	73.3	Confident	76 Å²	76	52 Å²	52	41%	0.406	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-68.2	-14.9	177.3	-54.8	57.1	0	0	0	112.5	G412 F413 E486	G412-N415 PolarHBondContact O-N 3.36Å; G412-N415 PolarHBondContact O-OD1 2.82Å; F413-N415 PolarHBondContact O-N 3.4Å; N415-E486 PolarHBondContact ND2-OE1 3.35Å; N415-E486 PolarHBondContact ND2-OE2 3.06Å; N415-E486 VanDerWaalsContact ND2-OE2 3.1Å
416	K	64.7	Low	73.9	Confident	88 Å²	88	49 Å²	49	38%	0.383	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-88.6	-9.9	168.4	-66.4	177.6	167.1	-173.4	0	113.7	F386 A387 L389 L394 F413 Q414	F386-K416 PolarHBondContact O-NZ 3.48Å; A387-K416 PolarHBondContact O-NZ 3.4Å; L389-K416 PolarHBondContact O-NZ 2.77Å; L394-K416 HydrophobicContact CD1-CB 4.05Å; L394-K416 HydrophobicContact CD1-CD 3.57Å; L394-K416 HydrophobicContact CD1-CG 4.49Å; F413-K416 WeakPolarHBondContact O-CB 3.4Å; F413-K416 PolarHBondContact O-N 3.02Å; F413-K416 VanDerWaalsContact O-N 3.09Å; Q414-K416 PolarHBondContact O-N 3.43Å
417	L	68.5	Low	74.5	Confident	31 Å²	31	47.3 Å²	47.3	16%	0.162	25%	0.249	C	C	.	.			trans	-100.7	135.3	-174.7	-66	178.1	0	0	0	109.9	G391 L394 I395 Q414 L485 T487	G391-L417 WeakPolarHBondContact O-CD2 3.1Å; L394-L417 HydrophobicContact CB-CD2 4.01Å; I395-L417 HydrophobicContact CD1-CD2 4.34Å; I395-L417 HydrophobicContact CG1-CD2 3.81Å; Q414-L417 WeakPolarHBondContact O-CB 3.28Å; Q414-L417 PolarHBondContact O-N 3.35Å; L417-L485 HydrophobicContact CB-CD2 3.54Å; L417-L485 HydrophobicContact CD1-CD2 3.97Å; L417-L485 HydrophobicContact CG-CD2 4.41Å; L417-T487 PolarHBondContact O-OG1 3.31Å
418	C	76.8	Confident	75.2	Confident	52 Å²	52	52.1 Å²	52.1	35%	0.351	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.3	-177.5	-167.1	0	0	0	0	111.9	V420 T487	C418-V420 PolarHBondContact O-N 3.1Å; C418-T487 VanDerWaalsContact CA-OG1 3.23Å; C418-T487 WeakPolarHBondContact CA-OG1 3.07Å; C418-T487 WeakPolarHBondContact CB-OG1 3.38Å; C418-T487 PolarHBondContact SG-OG1 3.4Å; C418-T487 VanDerWaalsContact SG-OG1 3.4Å
419	F	83.4	Confident	75.8	Confident	26 Å²	26	54.9 Å²	54.9	11%	0.114	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	96.6	172.4	177	-116	0	0	0	110.1	L421 R476 I477 A480 L485 T487 I488 K489	F419-L421 HydrophobicContact CE1-CB 4.14Å; F419-L421 HydrophobicContact CE1-CD1 4.23Å; F419-L421 HydrophobicContact CZ-CB 4.44Å; F419-L421 HydrophobicContact CZ-CD1 3.9Å; F419-R476 HydrophobicContact CE2-CB 3.91Å; F419-R476 VanDerWaalsContact CE2-O 3.29Å; F419-R476 WeakPolarHBondContact CE2-O 3.43Å; F419-R476 HydrophobicContact CZ-CB 3.85Å; F419-I477 HydrophobicContact CE1-CG1 3.75Å; F419-I477 HydrophobicContact CZ-CG1 3.94Å; F419-A480 HydrophobicContact CB-CB 4Å; F419-A480 HydrophobicContact CD1-CB 3.99Å; F419-A480 HydrophobicContact CD2-CB 3.58Å; F419-A480 HydrophobicContact CE1-CB 4.41Å; F419-A480 HydrophobicContact CE2-CB 4.03Å; F419-A480 HydrophobicContact CG-CB 3.55Å; F419-A480 HydrophobicContact CZ-CB 4.42Å; F419-L485 HydrophobicContact CB-CD1 4.01Å; F419-T487 PolarHBondContact N-O 3.19Å; F419-I488 HydrophobicContact CD1-CG1 4.36Å; F419-I488 HydrophobicContact CD1-CG2 4.23Å; F419-K489 PolarHBondContact O-N 2.94Å
420	V	85.8	Confident	76.6	Confident	85 Å²	85	54 Å²	54	52%	0.515	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	113.4	179.7	-173	0	0	0	0	110.9	C418 K489 V491	C418-V420 PolarHBondContact O-N 3.1Å; V420-K489 CarbonylContact C-O 3.58Å; V420-K489 WeakPolarHBondContact CA-O 3.17Å; V420-K489 HydrophobicContact CG2-CB 4.36Å; V420-V491 HydrophobicContact CG1-CG2 3.94Å
421	L	88.6	Confident	77.2	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	86.9	174.3	-167.8	77.4	0	0	0	110	F419 I423 L426 I473 K489 V491 L501	F419-L421 HydrophobicContact CE1-CB 4.14Å; F419-L421 HydrophobicContact CE1-CD1 4.23Å; F419-L421 HydrophobicContact CZ-CB 4.44Å; F419-L421 HydrophobicContact CZ-CD1 3.9Å; L421-I423 HydrophobicContact CD2-CD1 4.29Å; L421-I423 HydrophobicContact CD2-CG1 4.31Å; L421-I423 HydrophobicContact CG-CG1 4.26Å; L421-I423 PolarHBondContact O-N 2.73Å; L421-L426 HydrophobicContact CD1-CD1 3.83Å; L421-L426 HydrophobicContact CG-CD1 4.39Å; L421-I473 HydrophobicContact CD1-CG1 4.31Å; L421-I473 HydrophobicContact CD1-CG2 4.5Å; L421-I473 HydrophobicContact CD2-CG2 4.28Å; L421-K489 PolarHBondContact N-O 2.94Å; L421-V491 PolarHBondContact O-N 3.28Å; L421-L501 HydrophobicContact CD2-CD1 3.62Å; L421-L501 HydrophobicContact CD2-CD2 4.35Å
422	N	88.4	Confident	77.8	Confident	47 Å²	47	54.1 Å²	54.1	25%	0.251	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	97.9	176.4	-175.3	-34.1	0	0	0	111.1	K424 K425 L426 V491	N422-K424 PolarHBondContact O-N 3.43Å; N422-K424 PolarHBondContact OD1-N 3.12Å; N422-K425 HydrophobicContact CB-CB 3.99Å; N422-K425 WeakPolarHBondContact O-CB 3.38Å; N422-K425 PolarHBondContact O-N 3.2Å; N422-K425 VanDerWaalsContact O-N 3.12Å; N422-K425 PolarHBondContact OD1-N 3.25Å; N422-L426 WeakPolarHBondContact O-CG 3.29Å; N422-L426 PolarHBondContact O-N 3.05Å; N422-V491 WeakPolarHBondContact CA-O 3.38Å; N422-V491 HydrophobicContact CB-CB 4.04Å
423	I	87.6	Confident	78.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-68.4	-36	-171.4	-69.7	171.4	0	0	0	111.6	L421 K425 L426 I427 V491 L493 F497 L501	L421-I423 HydrophobicContact CD2-CD1 4.29Å; L421-I423 HydrophobicContact CD2-CG1 4.31Å; L421-I423 HydrophobicContact CG-CG1 4.26Å; L421-I423 PolarHBondContact O-N 2.73Å; I423-K425 VanDerWaalsContact C-N 3.27Å; I423-K425 PolarHBondContact O-N 3.22Å; I423-L426 PolarHBondContact O-N 3.07Å; I423-I427 HydrophobicContact CG2-CD1 3.86Å; I423-I427 HydrophobicContact CG2-CG1 4.48Å; I423-I427 WeakPolarHBondContact O-CD1 3.05Å; I423-I427 VanDerWaalsContact O-CG1 3.29Å; I423-I427 WeakPolarHBondContact O-CG1 3.22Å; I423-I427 PolarHBondContact O-N 3.14Å; I423-V491 PolarHBondContact N-O 2.95Å; I423-L493 HydrophobicContact CD1-CB 4.01Å; I423-L493 HydrophobicContact CD1-CD1 3.38Å; I423-L493 HydrophobicContact CD1-CG 4.26Å; I423-F497 HydrophobicContact CG2-CD2 3.93Å; I423-F497 HydrophobicContact CG2-CE2 4.39Å; I423-F497 HydrophobicContact CG2-CG 4.34Å; I423-L501 HydrophobicContact CD1-CD2 4.4Å
424	K	84.6	Confident	78.5	Confident	122 Å²	122	56.3 Å²	56.3	53%	0.53	28%	0.282	S	S	.	.	H	α-helix	trans	-63.6	-31.9	173.6	-164.6	175.8	-169.4	170.4	0	112.7	N422 K428 Q492	N422-K424 PolarHBondContact O-N 3.43Å; N422-K424 PolarHBondContact OD1-N 3.12Å; K424-K428 PolarHBondContact O-N 3.47Å; K424-Q492 HydrophobicContact CB-CB 4.02Å
425	K	85.2	Confident	78.4	Confident	122 Å²	122	60.4 Å²	60.4	53%	0.53	30%	0.301	S	S	.	.	H	α-helix	trans	-74.5	-40.5	173	-167.7	176.1	-175.2	-81.8	0	111.7	N422 I423 I427 K428 E429	N422-K425 HydrophobicContact CB-CB 3.99Å; N422-K425 WeakPolarHBondContact O-CB 3.38Å; N422-K425 PolarHBondContact O-N 3.2Å; N422-K425 VanDerWaalsContact O-N 3.12Å; N422-K425 PolarHBondContact OD1-N 3.25Å; I423-K425 VanDerWaalsContact C-N 3.27Å; I423-K425 PolarHBondContact O-N 3.22Å; K425-I427 VanDerWaalsContact C-N 3.35Å; K425-I427 PolarHBondContact O-N 3.42Å; K425-K428 PolarHBondContact O-N 3.4Å; K425-E429 IonicContact NZ-OE1 3.76Å; K425-E429 PolarHBondContact NZ-OE1 3.05Å; K425-E429 WeakPolarHBondContact O-CG 3.19Å; K425-E429 PolarHBondContact O-N 3.2Å
426	L	84.2	Confident	78.3	Confident	8 Å²	8	61.7 Å²	61.7	4%	0.042	31%	0.308	C	S	.	.	H	α-helix	trans	-59.9	-43.5	175.8	-65.6	179.5	0	0	0	112.3	L421 N422 I423 K428 E429 I430 L469 I473 R476	L421-L426 HydrophobicContact CD1-CD1 3.83Å; L421-L426 HydrophobicContact CG-CD1 4.39Å; N422-L426 WeakPolarHBondContact O-CG 3.29Å; N422-L426 PolarHBondContact O-N 3.05Å; I423-L426 PolarHBondContact O-N 3.07Å; L426-K428 VanDerWaalsContact C-N 3.34Å; L426-K428 PolarHBondContact O-N 3.08Å; L426-E429 WeakPolarHBondContact O-CB 3.11Å; L426-E429 PolarHBondContact O-N 3.05Å; L426-I430 WeakPolarHBondContact O-CD1 3.49Å; L426-I430 WeakPolarHBondContact O-CG1 3.44Å; L426-I430 PolarHBondContact O-N 3.39Å; L426-L469 HydrophobicContact CB-CD1 3.86Å; L426-L469 HydrophobicContact CD1-CD1 4.21Å; L426-I473 HydrophobicContact CD1-CG1 3.83Å; L426-R476 VanDerWaalsContact CD2-NE 3.27Å
427	I	84.5	Confident	77.9	Confident	16 Å²	16	60 Å²	60	8%	0.082	31%	0.307	C	S	.	.	H	α-helix	trans	-58.7	-47.2	177.1	-68.9	158.9	0	0	0	110.3	I423 K425 E429 I430 E431 L469 F497	I423-I427 HydrophobicContact CG2-CD1 3.86Å; I423-I427 HydrophobicContact CG2-CG1 4.48Å; I423-I427 WeakPolarHBondContact O-CD1 3.05Å; I423-I427 VanDerWaalsContact O-CG1 3.29Å; I423-I427 WeakPolarHBondContact O-CG1 3.22Å; I423-I427 PolarHBondContact O-N 3.14Å; K425-I427 VanDerWaalsContact C-N 3.35Å; K425-I427 PolarHBondContact O-N 3.42Å; I427-E429 PolarHBondContact O-N 2.9Å; I427-I430 PolarHBondContact O-N 3.25Å; I427-E431 HydrophobicContact CG2-CG 4.26Å; I427-E431 VanDerWaalsContact CG2-OE1 3.28Å; I427-E431 WeakPolarHBondContact CG2-OE1 3.48Å; I427-E431 WeakPolarHBondContact O-CB 3.32Å; I427-E431 VanDerWaalsContact O-CG 3.27Å; I427-E431 WeakPolarHBondContact O-CG 3.36Å; I427-E431 PolarHBondContact O-N 3.28Å; I427-L469 HydrophobicContact CG1-CD1 4.46Å; I427-F497 HydrophobicContact CD1-CD2 4.19Å; I427-F497 HydrophobicContact CD1-CE1 4.41Å; I427-F497 HydrophobicContact CD1-CE2 3.3Å; I427-F497 HydrophobicContact CD1-CZ 3.43Å; I427-F497 VanDerWaalsContact CD1-CZ 3.43Å; I427-F497 HydrophobicContact CG1-CE2 4.44Å; I427-F497 HydrophobicContact CG1-CZ 4.16Å
428	K	84.9	Confident	77.1	Confident	124 Å²	124	63.1 Å²	63.1	54%	0.539	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-36.6	174.7	-71.7	-172.1	170.3	-153	0	114.2	K424 K425 L426 I430 N432	K424-K428 PolarHBondContact O-N 3.47Å; K425-K428 PolarHBondContact O-N 3.4Å; L426-K428 VanDerWaalsContact C-N 3.34Å; L426-K428 PolarHBondContact O-N 3.08Å; K428-I430 VanDerWaalsContact C-N 3.29Å; K428-I430 PolarHBondContact O-N 3.19Å; K428-N432 WeakPolarHBondContact O-CB 3.09Å; K428-N432 PolarHBondContact O-N 2.97Å; K428-N432 PolarHBondContact O-OD1 3.44Å
429	E	83	Confident	75.7	Confident	69 Å²	69	64 Å²	64	32%	0.322	33%	0.326	S	S	.	.	H	α-helix	trans	-61.9	-39.4	174.2	-76.1	170	-166.6	0	0	110.9	K425 L426 I427 S433 R476	K425-E429 IonicContact NZ-OE1 3.76Å; K425-E429 PolarHBondContact NZ-OE1 3.05Å; K425-E429 WeakPolarHBondContact O-CG 3.19Å; K425-E429 PolarHBondContact O-N 3.2Å; L426-E429 WeakPolarHBondContact O-CB 3.11Å; L426-E429 PolarHBondContact O-N 3.05Å; I427-E429 PolarHBondContact O-N 2.9Å; E429-S433 WeakPolarHBondContact O-CB 3.42Å; E429-S433 PolarHBondContact O-N 3.33Å; E429-S433 PolarHBondContact O-OG 3.32Å; E429-R476 IonicContact OE2-CZ 3.67Å; E429-R476 IonicContact OE2-NH2 2.71Å; E429-R476 PolarHBondContact OE2-NH2 2.84Å
430	I	82.2	Confident	73.7	Confident	9 Å²	9	67.7 Å²	67.7	5%	0.046	35%	0.347	C	S	.	.	H	α-helix	trans	-72.4	-49.5	177.1	-64	160.1	0	0	0	111.1	L426 I427 K428 N432 S433 H434 L465 Y468 L469	L426-I430 WeakPolarHBondContact O-CD1 3.49Å; L426-I430 WeakPolarHBondContact O-CG1 3.44Å; L426-I430 PolarHBondContact O-N 3.39Å; I427-I430 PolarHBondContact O-N 3.25Å; K428-I430 VanDerWaalsContact C-N 3.29Å; K428-I430 PolarHBondContact O-N 3.19Å; I430-N432 PolarHBondContact O-N 3.07Å; I430-S433 PolarHBondContact O-N 2.89Å; I430-S433 PolarHBondContact O-OG 3.4Å; I430-H434 PolarHBondContact O-N 2.93Å; I430-L465 HydrophobicContact CB-CD1 4.33Å; I430-L465 HydrophobicContact CG2-CD1 3.87Å; I430-Y468 HydrophobicContact CG2-CD2 4.29Å; I430-Y468 HydrophobicContact CG2-CG 4.32Å; I430-L469 HydrophobicContact CD1-CB 3.97Å; I430-L469 HydrophobicContact CD1-CD1 4.09Å
431	E	79.7	Confident	71.7	Confident	81 Å²	81	71.3 Å²	71.3	38%	0.379	36%	0.358	S	S	.	.	H	α-helix	trans	-52.7	-53.8	177.9	-73.3	165.6	162.6	0	0	111.1	I427 S433 H434 E435	I427-E431 HydrophobicContact CG2-CG 4.26Å; I427-E431 VanDerWaalsContact CG2-OE1 3.28Å; I427-E431 WeakPolarHBondContact CG2-OE1 3.48Å; I427-E431 WeakPolarHBondContact O-CB 3.32Å; I427-E431 VanDerWaalsContact O-CG 3.27Å; I427-E431 WeakPolarHBondContact O-CG 3.36Å; I427-E431 PolarHBondContact O-N 3.28Å; E431-S433 PolarHBondContact O-N 3.07Å; E431-H434 PolarHBondContact O-N 2.8Å; E431-E435 PolarHBondContact O-N 3.44Å
432	N	78.1	Confident	69.4	Low	97 Å²	97	79.4 Å²	79.4	52%	0.519	40%	0.396	S	S	.	.	H	α-helix	trans	-59	-44.4	178.2	-69.4	11.3	0	0	0	112.2	K428 I430 H434 E435 D436	K428-N432 WeakPolarHBondContact O-CB 3.09Å; K428-N432 PolarHBondContact O-N 2.97Å; K428-N432 PolarHBondContact O-OD1 3.44Å; I430-N432 PolarHBondContact O-N 3.07Å; N432-H434 PolarHBondContact O-N 3.48Å; N432-H434 VanDerWaalsContact O-N 3.12Å; N432-E435 PolarHBondContact O-N 3.41Å; N432-E435 VanDerWaalsContact O-N 3.07Å; N432-D436 PolarHBondContact O-N 3.22Å
433	S	72	Confident	66.8	Low	62 Å²	62	82.3 Å²	82.3	43%	0.434	42%	0.415	S	S	.	.	H	α-helix	trans	-62.3	-22.4	-178.1	73.5	0	0	0	0	113.7	E429 I430 E431 S437	E429-S433 WeakPolarHBondContact O-CB 3.42Å; E429-S433 PolarHBondContact O-N 3.33Å; E429-S433 PolarHBondContact O-OG 3.32Å; I430-S433 PolarHBondContact O-N 2.89Å; I430-S433 PolarHBondContact O-OG 3.4Å; E431-S433 PolarHBondContact O-N 3.07Å; S433-S437 PolarHBondContact O-N 3.4Å
434	H	67	Low	64.2	Low	43 Å²	43	86.8 Å²	86.8	20%	0.199	44%	0.439	C	S	.	.	H	α-helix	trans	-88.2	-25.5	177	-168.9	-93	0	0	0	113	I430 E431 N432 S437 K438 L460	I430-H434 PolarHBondContact O-N 2.93Å; E431-H434 PolarHBondContact O-N 2.8Å; N432-H434 PolarHBondContact O-N 3.48Å; N432-H434 VanDerWaalsContact O-N 3.12Å; H434-S437 WeakPolarHBondContact CA-OG 3.27Å; H434-S437 PolarHBondContact O-N 2.9Å; H434-S437 PolarHBondContact O-OG 3.27Å; H434-K438 PolarHBondContact O-N 3.25Å; H434-K438 VanDerWaalsContact O-N 3.14Å; H434-L460 HydrophobicContact CB-CD1 3.5Å; H434-L460 VanDerWaalsContact CB-CD1 3.5Å
435	E	58.5	Low	61.9	Low	107 Å²	107	92 Å²	92	50%	0.5	46%	0.458	S	S	.	.	H	α-helix	trans	-72.1	-38.6	168.5	-63.5	-167.5	153.5	0	0	110.9	E431 N432 S437 K438 S439 H457	E431-E435 PolarHBondContact O-N 3.44Å; N432-E435 PolarHBondContact O-N 3.41Å; N432-E435 VanDerWaalsContact O-N 3.07Å; E435-S437 VanDerWaalsContact C-N 3.3Å; E435-S437 PolarHBondContact O-N 3.09Å; E435-K438 PolarHBondContact O-N 3.21Å; E435-S439 PolarHBondContact O-N 3.26Å; E435-S439 PolarHBondContact O-OG 3.25Å; E435-S439 VanDerWaalsContact O-OG 3.08Å; E435-H457 IonicContact OE1-CE1 2.69Å; E435-H457 PolarHBondContact OE1-CE1 2.8Å; E435-H457 IonicContact OE1-ND1 3.71Å
436	D	56.6	Low	59.4	Low	102 Å²	102	94.6 Å²	94.6	55%	0.545	47%	0.468	S	S	.	.	H	α-helix	trans	-59.7	-37.9	169	-78.3	-26.7	0	0	0	111.9	N432 S439 N440	N432-D436 PolarHBondContact O-N 3.22Å; D436-S439 PolarHBondContact O-OG 2.76Å; D436-S439 VanDerWaalsContact O-OG 3.06Å; D436-N440 PolarHBondContact O-N 3.14Å; D436-N440 PolarHBondContact O-ND2 3.16Å
437	S	56.7	Low	56.8	Low	53 Å²	53	100.3 Å²	100.3	37%	0.371	50%	0.499	S	S	.	.	H	α-helix	trans	-72.2	-37.4	178.8	77.1	0	0	0	0	113.1	S433 H434 E435	S433-S437 PolarHBondContact O-N 3.4Å; H434-S437 WeakPolarHBondContact CA-OG 3.27Å; H434-S437 PolarHBondContact O-N 2.9Å; H434-S437 PolarHBondContact O-OG 3.27Å; E435-S437 VanDerWaalsContact C-N 3.3Å; E435-S437 PolarHBondContact O-N 3.09Å
438	K	51.9	Low	54.6	Low	96 Å²	96	104.9 Å²	104.9	42%	0.417	53%	0.53	S	S	.	.	H	α-helix	trans	-66.5	-45.3	175.2	-79	-177.9	173.1	179.3	0	112.8	H434 E435 N440 Q441	H434-K438 PolarHBondContact O-N 3.25Å; H434-K438 VanDerWaalsContact O-N 3.14Å; E435-K438 PolarHBondContact O-N 3.21Å; K438-N440 VanDerWaalsContact C-N 3.26Å; K438-N440 PolarHBondContact O-N 3.24Å; K438-Q441 PolarHBondContact O-N 3.01Å; K438-Q441 VanDerWaalsContact O-N 3.11Å
439	S	45.9	Very low	51.8	Low	70 Å²	70	106.3 Å²	106.3	49%	0.49	54%	0.542	S	S	.	.	H	α-helix	trans	-62.3	-33.1	-177.8	54	0	0	0	0	112.9	E435 D436 Q441	E435-S439 PolarHBondContact O-N 3.26Å; E435-S439 PolarHBondContact O-OG 3.25Å; E435-S439 VanDerWaalsContact O-OG 3.08Å; D436-S439 PolarHBondContact O-OG 2.76Å; D436-S439 VanDerWaalsContact O-OG 3.06Å; S439-Q441 VanDerWaalsContact C-N 3.33Å; S439-Q441 PolarHBondContact O-N 2.64Å
440	N	42.3	Very low	49.3	Very low	104 Å²	104	109.7 Å²	109.7	56%	0.556	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-7.9	176.8	-74.8	-80.1	0	0	0	114.7	D436 K438	D436-N440 PolarHBondContact O-N 3.14Å; D436-N440 PolarHBondContact O-ND2 3.16Å; K438-N440 VanDerWaalsContact C-N 3.26Å; K438-N440 PolarHBondContact O-N 3.24Å
441	Q	44.8	Very low	46.7	Very low	161 Å²	161	116.9 Å²	116.9	75%	0.752	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-10.2	176.7	-74.7	-177.9	-6.9	0	0	114	K438 S439	K438-Q441 PolarHBondContact O-N 3.01Å; K438-Q441 VanDerWaalsContact O-N 3.11Å; S439-Q441 VanDerWaalsContact C-N 3.33Å; S439-Q441 PolarHBondContact O-N 2.64Å
442	H	38.3	Very low	44.2	Very low	175 Å²	175	117.8 Å²	117.8	81%	0.81	61%	0.613	S	S	*	*	S	Bend	trans	-98.2	15.2	-170.8	-108.1	-57.5	0	0	0	115.6
443	T	35.6	Very low	41.8	Very low	107 Å²	107	119.8 Å²	119.8	66%	0.656	62%	0.624	S	S	*	*	S	Bend	trans	-117.7	14.9	-167.5	59.8	0	0	0	0	116.8
444	D	32.3	Very low	39.8	Very low	95 Å²	95	124.9 Å²	124.9	51%	0.508	64%	0.64	S	S	.	*	S	Bend	trans	-135.8	147.9	160.9	-91.2	-57.1	0	0	0	110	K545	D444-K545 IonicContact OD1-NZ 2.72Å; D444-K545 PolarHBondContact OD1-NZ 2.95Å; D444-K545 WeakPolarHBondContact OD2-CD 3.48Å; D444-K545 IonicContact OD2-NZ 3.71Å; D444-K545 PolarHBondContact OD2-NZ 2.98Å
445	Y	37.2	Very low	38	Very low	232 Å²	232	128.3 Å²	128.3	91%	0.91	67%	0.669	S	S	*	*			trans	79	106.2	-171.5	-65.1	-82.5	0	0	0	118.6
446	K	32.4	Very low	36.6	Very low	175 Å²	175	129.2 Å²	129.2	76%	0.761	68%	0.677	S	S	*	*			trans	-74.8	160.2	155.1	-79.6	-171.3	162.7	-151.2	0	111.3
447	D	28.7	Very low	35.6	Very low	129 Å²	129	131.9 Å²	131.9	69%	0.69	69%	0.686	S	S	*	*			cis	-135.3	-141.2	-9.6	-81.5	-45.5	0	0	0	107.6
448	P	38.7	Very low	35.1	Very low	111 Å²	111	135.4 Å²	135.4	72%	0.721	70%	0.699	S	S	*	*				-120	-170	-102.6	37.8	-20.9	0	0	0	115.7
449	I	26.9	Very low	35.2	Very low	154 Å²	154	135.8 Å²	135.8	79%	0.79	71%	0.712	S	S	*	*			trans	88.6	86.5	166.1	-51.3	155.1	0	0	0	116.5
450	I	29.3	Very low	35.8	Very low	141 Å²	141	133.7 Å²	133.7	72%	0.723	70%	0.695	S	S	*	*				-167.3	140.1	105.6	-95.3	165.3	0	0	0	108.4
451	I	27.4	Very low	37	Very low	160 Å²	160	132.1 Å²	132.1	82%	0.821	69%	0.69	S	S	*	*			trans	-95.7	107.7	168.9	-60.8	172.6	0	0	0	107.7
452	S	28.3	Very low	38.2	Very low	99 Å²	99	128.8 Å²	128.8	69%	0.692	68%	0.678	S	S	*	*			trans	-132.1	98.9	169.6	58	0	0	0	0	109.5	H454	S452-H454 PolarHBondContact O-N 3.31Å
453	N	26.2	Very low	39.8	Very low	140 Å²	140	126.7 Å²	126.7	75%	0.749	67%	0.672	S	S	*	*			trans	-67.9	112.8	172.7	-59.4	-45.3	0	0	0	109.2
454	H	30.3	Very low	41.5	Very low	168 Å²	168	125.2 Å²	125.2	78%	0.778	66%	0.66	S	S	*	*			trans	-156.4	130.2	145.8	-97.5	-68.2	0	0	0	109.7	S452 D456	S452-H454 PolarHBondContact O-N 3.31Å; H454-D456 VanDerWaalsContact C-N 3.28Å; H454-D456 PolarHBondContact O-N 3.36Å; H454-D456 VanDerWaalsContact O-N 3.14Å
455	S	29	Very low	43.7	Very low	116 Å²	116	121.1 Å²	121.1	81%	0.811	64%	0.638	S	S	*	*			trans	-89	60.1	-174.7	59	0	0	0	0	111.5	H457	S455-H457 PolarHBondContact O-N 2.84Å
456	D	29.3	Very low	45.7	Very low	125 Å²	125	113.4 Å²	113.4	67%	0.668	61%	0.608	S	S	*	*			trans	-80.9	102.4	-178.5	-68.6	-22.2	0	0	0	110.4	H454 I458	H454-D456 VanDerWaalsContact C-N 3.28Å; H454-D456 PolarHBondContact O-N 3.36Å; H454-D456 VanDerWaalsContact O-N 3.14Å; D456-I458 VanDerWaalsContact C-N 3.25Å; D456-I458 PolarHBondContact O-N 3.25Å
457	H	36	Very low	48	Very low	158 Å²	158	108 Å²	108	73%	0.731	59%	0.592	S	S	*	*			trans	-61.4	91.1	161	-92.2	-80	0	0	0	108.3	E435 S455 P459	E435-H457 IonicContact OE1-CE1 2.69Å; E435-H457 PolarHBondContact OE1-CE1 2.8Å; E435-H457 IonicContact OE1-ND1 3.71Å; S455-H457 PolarHBondContact O-N 2.84Å; H457-P459 WeakPolarHBondContact O-CD 3.43Å; H457-P459 VanDerWaalsContact O-N 3.15Å
458	I	47.1	Very low	50.4	Low	127 Å²	127	107.6 Å²	107.6	65%	0.651	58%	0.582	S	S	*	*			trans	-66.5	108.5	165.5	-57.8	174.6	0	0	0	106.5	D456	D456-I458 VanDerWaalsContact C-N 3.25Å; D456-I458 PolarHBondContact O-N 3.25Å
459	P	52.7	Low	52.6	Low	104 Å²	104	102.3 Å²	102.3	68%	0.675	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-66	160.3	-177.8	30.5	-35.8	0	0	0	110.2	H457	H457-P459 WeakPolarHBondContact O-CD 3.43Å; H457-P459 VanDerWaalsContact O-N 3.15Å
460	L	58.7	Low	55.3	Low	27 Å²	27	98.8 Å²	98.8	14%	0.141	53%	0.528	C	S	.	.	P	Polyproline II helix	trans	-56.6	131.6	172.5	-132	106.4	0	0	0	109.3	H434 N462 L464 L465 Y468	H434-L460 HydrophobicContact CB-CD1 3.5Å; H434-L460 VanDerWaalsContact CB-CD1 3.5Å; L460-N462 PolarHBondContact O-N 3.01Å; L460-L464 HydrophobicContact CD2-CB 4.02Å; L460-L465 HydrophobicContact CB-CB 4.47Å; L460-L465 HydrophobicContact CD2-CB 3.74Å; L460-L465 HydrophobicContact CD2-CD1 4.26Å; L460-Y468 HydrophobicContact CD2-CD2 4.43Å
461	P	68.5	Low	57.8	Low	71 Å²	71	95.8 Å²	95.8	46%	0.461	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-54.1	127.2	168.5	-26	35.2	0	0	0	109.6	D463 L464 L465	P461-D463 PolarHBondContact O-N 3.5Å; P461-D463 VanDerWaalsContact O-N 3.09Å; P461-L464 HydrophobicContact CB-CD1 4.32Å; P461-L464 HydrophobicContact CG-CD1 4.13Å; P461-L464 PolarHBondContact O-N 2.67Å; P461-L465 PolarHBondContact O-N 2.91Å; P461-L465 VanDerWaalsContact O-N 3.14Å
462	N	69.3	Low	60.4	Low	90 Å²	90	89.3 Å²	89.3	48%	0.481	48%	0.482	S	S	.	.	H	α-helix	trans	-54	-37.2	-170.9	-74.7	-49.1	0	0	0	112.3	L460 L464 L465 Y466	L460-N462 PolarHBondContact O-N 3.01Å; N462-L464 PolarHBondContact O-N 3.47Å; N462-L465 WeakPolarHBondContact O-CB 3.38Å; N462-L465 PolarHBondContact O-N 2.78Å; N462-L465 VanDerWaalsContact O-N 3.14Å; N462-Y466 HydrophobicContact CB-CD2 4.29Å; N462-Y466 HydrophobicContact CB-CE2 3.94Å; N462-Y466 WeakPolarHBondContact O-CD2 3.42Å; N462-Y466 PolarHBondContact O-N 2.86Å
463	D	72	Confident	63.2	Low	131 Å²	131	84.7 Å²	84.7	70%	0.701	45%	0.45	S	S	*	.	H	α-helix	trans	-64.6	-37.9	-178.8	-48.7	-41.9	0	0	0	112.6	P461 S467	P461-D463 PolarHBondContact O-N 3.5Å; P461-D463 VanDerWaalsContact O-N 3.09Å; D463-S467 WeakPolarHBondContact O-CB 3.12Å; D463-S467 PolarHBondContact O-N 3Å
464	L	71.2	Confident	66	Low	77 Å²	77	80.8 Å²	80.8	40%	0.403	43%	0.425	S	S	.	.	H	α-helix	trans	-68.5	-40.9	172.2	-70.3	174.6	0	0	0	110.9	L460 P461 N462 Y466 S467 Y468	L460-L464 HydrophobicContact CD2-CB 4.02Å; P461-L464 HydrophobicContact CB-CD1 4.32Å; P461-L464 HydrophobicContact CG-CD1 4.13Å; P461-L464 PolarHBondContact O-N 2.67Å; N462-L464 PolarHBondContact O-N 3.47Å; L464-Y466 VanDerWaalsContact C-N 3.34Å; L464-Y466 PolarHBondContact O-N 3.47Å; L464-S467 PolarHBondContact O-N 3.22Å; L464-Y468 HydrophobicContact CB-CD2 4.42Å; L464-Y468 HydrophobicContact CB-CE2 4.31Å; L464-Y468 WeakPolarHBondContact O-CD2 3.21Å; L464-Y468 PolarHBondContact O-N 2.85Å
465	L	78.9	Confident	68.3	Low	9 Å²	9	77.7 Å²	77.7	5%	0.047	41%	0.413	C	S	.	.	H	α-helix	trans	-62.5	-43	177.9	-179	63.4	0	0	0	111	I430 L460 P461 N462 L469	I430-L465 HydrophobicContact CB-CD1 4.33Å; I430-L465 HydrophobicContact CG2-CD1 3.87Å; L460-L465 HydrophobicContact CB-CB 4.47Å; L460-L465 HydrophobicContact CD2-CB 3.74Å; L460-L465 HydrophobicContact CD2-CD1 4.26Å; P461-L465 PolarHBondContact O-N 2.91Å; P461-L465 VanDerWaalsContact O-N 3.14Å; N462-L465 WeakPolarHBondContact O-CB 3.38Å; N462-L465 PolarHBondContact O-N 2.78Å; N462-L465 VanDerWaalsContact O-N 3.14Å; L465-L469 WeakPolarHBondContact O-CB 3.47Å; L465-L469 PolarHBondContact O-N 3.24Å
466	Y	79	Confident	70.9	Confident	69 Å²	69	76 Å²	76	27%	0.271	39%	0.388	S	S	.	.	H	α-helix	trans	-64.4	-43.4	176.3	-68.4	-49.8	0	0	0	112	N462 L464 L469 E470 F497 I500	N462-Y466 HydrophobicContact CB-CD2 4.29Å; N462-Y466 HydrophobicContact CB-CE2 3.94Å; N462-Y466 WeakPolarHBondContact O-CD2 3.42Å; N462-Y466 PolarHBondContact O-N 2.86Å; L464-Y466 VanDerWaalsContact C-N 3.34Å; L464-Y466 PolarHBondContact O-N 3.47Å; Y466-L469 PolarHBondContact O-N 3.4Å; Y466-E470 WeakPolarHBondContact O-CB 3.29Å; Y466-E470 PolarHBondContact O-N 2.63Å; Y466-F497 HydrophobicContact CD1-CD1 4.08Å; Y466-F497 AromaticContact CD1-CE1 3.91Å; Y466-F497 HydrophobicContact CD1-CE1 3.91Å; Y466-F497 AromaticContact CE1-CD1 3.75Å; Y466-F497 HydrophobicContact CE1-CD1 3.75Å; Y466-F497 AromaticContact CE1-CE1 3.54Å; Y466-F497 HydrophobicContact CE1-CE1 3.54Å; Y466-I500 HydrophobicContact CD1-CD1 3.24Å; Y466-I500 HydrophobicContact CE1-CD1 3.84Å; Y466-I500 HydrophobicContact CG-CD1 3.84Å
467	S	80	Confident	73.5	Confident	62 Å²	62	70.2 Å²	70.2	43%	0.434	36%	0.357	S	S	.	.	H	α-helix	trans	-61.6	-51.7	176.6	-178.5	0	0	0	0	112.6	D463 L464 L469 E470 D471	D463-S467 WeakPolarHBondContact O-CB 3.12Å; D463-S467 PolarHBondContact O-N 3Å; L464-S467 PolarHBondContact O-N 3.22Å; S467-L469 PolarHBondContact O-N 3.35Å; S467-E470 PolarHBondContact O-N 3.05Å; S467-D471 PolarHBondContact O-N 3.46Å; S467-D471 VanDerWaalsContact O-N 3.1Å
468	Y	80.4	Confident	75.7	Confident	120 Å²	120	64 Å²	64	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-63.5	-30.4	176.8	-72.1	-56.4	0	0	0	113	I430 L460 L464 S472	I430-Y468 HydrophobicContact CG2-CD2 4.29Å; I430-Y468 HydrophobicContact CG2-CG 4.32Å; L460-Y468 HydrophobicContact CD2-CD2 4.43Å; L464-Y468 HydrophobicContact CB-CD2 4.42Å; L464-Y468 HydrophobicContact CB-CE2 4.31Å; L464-Y468 WeakPolarHBondContact O-CD2 3.21Å; L464-Y468 PolarHBondContact O-N 2.85Å; Y468-S472 WeakPolarHBondContact O-CB 3Å; Y468-S472 PolarHBondContact O-N 3.19Å; Y468-S472 PolarHBondContact O-OG 3.32Å
469	L	83.7	Confident	77	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-73.3	-40.7	174.9	-176.1	65.1	0	0	0	111.7	L426 I427 I430 L465 Y466 S467 S472 I473 F497	L426-L469 HydrophobicContact CB-CD1 3.86Å; L426-L469 HydrophobicContact CD1-CD1 4.21Å; I427-L469 HydrophobicContact CG1-CD1 4.46Å; I430-L469 HydrophobicContact CD1-CB 3.97Å; I430-L469 HydrophobicContact CD1-CD1 4.09Å; L465-L469 WeakPolarHBondContact O-CB 3.47Å; L465-L469 PolarHBondContact O-N 3.24Å; Y466-L469 PolarHBondContact O-N 3.4Å; S467-L469 PolarHBondContact O-N 3.35Å; L469-S472 WeakPolarHBondContact O-CB 3.12Å; L469-S472 PolarHBondContact O-N 2.83Å; L469-I473 HydrophobicContact CD1-CD1 3.92Å; L469-I473 HydrophobicContact CD1-CG1 4.16Å; L469-I473 HydrophobicContact CD2-CD1 4.43Å; L469-I473 HydrophobicContact CG-CD1 3.77Å; L469-I473 HydrophobicContact CG-CG1 4.37Å; L469-I473 WeakPolarHBondContact O-CB 3.22Å; L469-I473 WeakPolarHBondContact O-CG1 3.06Å; L469-I473 PolarHBondContact O-N 2.97Å; L469-F497 HydrophobicContact CD2-CD1 3.36Å; L469-F497 HydrophobicContact CD2-CE1 3.5Å; L469-F497 VanDerWaalsContact CD2-CE1 3.5Å; L469-F497 HydrophobicContact CD2-CG 4.04Å; L469-F497 HydrophobicContact CD2-CZ 4.27Å
470	E	84.7	Confident	78.3	Confident	81 Å²	81	54.8 Å²	54.8	38%	0.379	28%	0.28	S	S	.	.	H	α-helix	trans	-60.5	-53.3	176.5	170.4	160.4	-170.3	0	0	111.3	Y466 S467 S472 I473 R474 I500 I504	Y466-E470 WeakPolarHBondContact O-CB 3.29Å; Y466-E470 PolarHBondContact O-N 2.63Å; S467-E470 PolarHBondContact O-N 3.05Å; E470-S472 VanDerWaalsContact C-N 3.32Å; E470-S472 PolarHBondContact O-N 2.77Å; E470-I473 PolarHBondContact O-N 3.34Å; E470-R474 WeakPolarHBondContact O-CB 3.44Å; E470-R474 PolarHBondContact O-N 2.84Å; E470-I500 HydrophobicContact CB-CG2 4.25Å; E470-I504 HydrophobicContact CB-CD1 4.14Å; E470-I504 HydrophobicContact CG-CD1 3.82Å; E470-I504 HydrophobicContact CG-CG1 4.03Å
471	D	80.5	Confident	79.4	Confident	77 Å²	77	54.4 Å²	54.4	41%	0.412	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-40.2	175.7	-87	-30.4	0	0	0	111.7	S467 I473 R474 I475	S467-D471 PolarHBondContact O-N 3.46Å; S467-D471 VanDerWaalsContact O-N 3.1Å; D471-I473 VanDerWaalsContact C-N 3.34Å; D471-I473 PolarHBondContact O-N 2.99Å; D471-R474 PolarHBondContact O-N 3.49Å; D471-I475 WeakPolarHBondContact O-CB 3.34Å; D471-I475 VanDerWaalsContact O-CG1 3.26Å; D471-I475 WeakPolarHBondContact O-CG1 3.33Å; D471-I475 PolarHBondContact O-N 3.26Å
472	S	83.5	Confident	79.7	Confident	25 Å²	25	56 Å²	56	18%	0.175	28%	0.282	C	S	.	.	H	α-helix	trans	-59.9	-40.3	175.9	-82.1	0	0	0	0	113.5	Y468 L469 E470 R476	Y468-S472 WeakPolarHBondContact O-CB 3Å; Y468-S472 PolarHBondContact O-N 3.19Å; Y468-S472 PolarHBondContact O-OG 3.32Å; L469-S472 WeakPolarHBondContact O-CB 3.12Å; L469-S472 PolarHBondContact O-N 2.83Å; E470-S472 VanDerWaalsContact C-N 3.32Å; E470-S472 PolarHBondContact O-N 2.77Å; S472-R476 VanDerWaalsContact CA-NH1 3.34Å; S472-R476 WeakPolarHBondContact O-CB 3.14Å; S472-R476 VanDerWaalsContact O-CD 3.28Å; S472-R476 WeakPolarHBondContact O-CD 3.28Å; S472-R476 WeakPolarHBondContact O-CG 3.27Å; S472-R476 PolarHBondContact O-NH1 3.21Å; S472-R476 PolarHBondContact OG-NH1 3.48Å
473	I	86.6	Confident	79.7	Confident	1 Å²	1	58 Å²	58	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-73.3	-48.1	176.9	-70.7	171.4	0	0	0	109.4	L421 L426 L469 E470 D471 I475 R476 I477 L501 I504	L421-I473 HydrophobicContact CD1-CG1 4.31Å; L421-I473 HydrophobicContact CD1-CG2 4.5Å; L421-I473 HydrophobicContact CD2-CG2 4.28Å; L426-I473 HydrophobicContact CD1-CG1 3.83Å; L469-I473 HydrophobicContact CD1-CD1 3.92Å; L469-I473 HydrophobicContact CD1-CG1 4.16Å; L469-I473 HydrophobicContact CD2-CD1 4.43Å; L469-I473 HydrophobicContact CG-CD1 3.77Å; L469-I473 HydrophobicContact CG-CG1 4.37Å; L469-I473 WeakPolarHBondContact O-CB 3.22Å; L469-I473 WeakPolarHBondContact O-CG1 3.06Å; L469-I473 PolarHBondContact O-N 2.97Å; E470-I473 PolarHBondContact O-N 3.34Å; D471-I473 VanDerWaalsContact C-N 3.34Å; D471-I473 PolarHBondContact O-N 2.99Å; I473-I475 PolarHBondContact O-N 3.05Å; I473-R476 PolarHBondContact O-N 3.46Å; I473-I477 HydrophobicContact CG2-CD1 3.46Å; I473-I477 VanDerWaalsContact CG2-CD1 3.46Å; I473-I477 HydrophobicContact CG2-CG1 4.2Å; I473-I477 WeakPolarHBondContact O-CG1 3.44Å; I473-I477 PolarHBondContact O-N 3.14Å; I473-L501 HydrophobicContact CG2-CD1 3.9Å; I473-I504 HydrophobicContact CB-CD1 3.88Å; I473-I504 HydrophobicContact CG2-CD1 3.72Å; I473-I504 HydrophobicContact CG2-CG2 4.21Å
474	R	85.3	Confident	79.9	Confident	59 Å²	59	56.7 Å²	56.7	22%	0.223	27%	0.273	C	S	.	.	H	α-helix	trans	-57.1	-50.3	-179.1	-175.9	-176.6	178.4	-166.5	1.3	112.3	E470 D471 R476 I477 V478 I504 M507 L508	E470-R474 WeakPolarHBondContact O-CB 3.44Å; E470-R474 PolarHBondContact O-N 2.84Å; D471-R474 PolarHBondContact O-N 3.49Å; R474-R476 VanDerWaalsContact C-N 3.29Å; R474-R476 PolarHBondContact O-N 3.03Å; R474-I477 PolarHBondContact O-N 3.18Å; R474-V478 WeakPolarHBondContact O-CB 3.28Å; R474-V478 VanDerWaalsContact O-CG2 3.3Å; R474-V478 WeakPolarHBondContact O-CG2 3.4Å; R474-V478 PolarHBondContact O-N 3.44Å; R474-I504 HydrophobicContact CB-CG2 4.11Å; R474-M507 HydrophobicContact CG-CE 4.34Å; R474-L508 HydrophobicContact CG-CD1 4.45Å
475	I	78.1	Confident	80.3	Confident	103 Å²	103	53.7 Å²	53.7	53%	0.528	26%	0.257	S	S	.	.	H	α-helix	trans	-61.1	-39.9	178.6	-67.9	166.2	0	0	0	111	D471 I473 S479	D471-I475 WeakPolarHBondContact O-CB 3.34Å; D471-I475 VanDerWaalsContact O-CG1 3.26Å; D471-I475 WeakPolarHBondContact O-CG1 3.33Å; D471-I475 PolarHBondContact O-N 3.26Å; I473-I475 PolarHBondContact O-N 3.05Å; I475-S479 VanDerWaalsContact O-CB 3.3Å; I475-S479 WeakPolarHBondContact O-CB 3.22Å; I475-S479 PolarHBondContact O-N 3.02Å; I475-S479 PolarHBondContact O-OG 3.45Å
476	R	84	Confident	80.5	Confident	79 Å²	79	56 Å²	56	30%	0.298	27%	0.268	S	S	.	.	H	α-helix	trans	-70.3	-42.2	179.5	-72.8	175.3	-179.7	82.7	-15.7	111.7	F419 L426 E429 S472 I473 R474 S479 A480	F419-R476 HydrophobicContact CE2-CB 3.91Å; F419-R476 VanDerWaalsContact CE2-O 3.29Å; F419-R476 WeakPolarHBondContact CE2-O 3.43Å; F419-R476 HydrophobicContact CZ-CB 3.85Å; L426-R476 VanDerWaalsContact CD2-NE 3.27Å; E429-R476 IonicContact OE2-CZ 3.67Å; E429-R476 IonicContact OE2-NH2 2.71Å; E429-R476 PolarHBondContact OE2-NH2 2.84Å; S472-R476 VanDerWaalsContact CA-NH1 3.34Å; S472-R476 WeakPolarHBondContact O-CB 3.14Å; S472-R476 VanDerWaalsContact O-CD 3.28Å; S472-R476 WeakPolarHBondContact O-CD 3.28Å; S472-R476 WeakPolarHBondContact O-CG 3.27Å; S472-R476 PolarHBondContact O-NH1 3.21Å; S472-R476 PolarHBondContact OG-NH1 3.48Å; I473-R476 PolarHBondContact O-N 3.46Å; R474-R476 VanDerWaalsContact C-N 3.29Å; R474-R476 PolarHBondContact O-N 3.03Å; R476-S479 WeakPolarHBondContact O-CB 3.37Å; R476-S479 PolarHBondContact O-N 3.09Å; R476-A480 PolarHBondContact O-N 3.32Å
477	I	84	Confident	80.7	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-67.9	-45.2	175.9	-65.4	171.2	0	0	0	111.4	F419 I473 R474 S479 A480 I481 L501 I504 L505 L508	F419-I477 HydrophobicContact CE1-CG1 3.75Å; F419-I477 HydrophobicContact CZ-CG1 3.94Å; I473-I477 HydrophobicContact CG2-CD1 3.46Å; I473-I477 VanDerWaalsContact CG2-CD1 3.46Å; I473-I477 HydrophobicContact CG2-CG1 4.2Å; I473-I477 WeakPolarHBondContact O-CG1 3.44Å; I473-I477 PolarHBondContact O-N 3.14Å; R474-I477 PolarHBondContact O-N 3.18Å; I477-S479 PolarHBondContact O-N 3.14Å; I477-A480 WeakPolarHBondContact O-CA 3.38Å; I477-A480 WeakPolarHBondContact O-CB 3.39Å; I477-A480 PolarHBondContact O-N 3.4Å; I477-I481 HydrophobicContact CG2-CD1 3.87Å; I477-I481 HydrophobicContact CG2-CG1 4.36Å; I477-I481 WeakPolarHBondContact O-CG1 3.23Å; I477-I481 PolarHBondContact O-N 2.98Å; I477-L501 HydrophobicContact CD1-CD1 4.13Å; I477-I504 HydrophobicContact CD1-CG2 4.06Å; I477-L505 HydrophobicContact CD1-CD2 3.87Å; I477-L505 HydrophobicContact CD1-CG 4.29Å; I477-L505 HydrophobicContact CG2-CD2 4.4Å; I477-L508 HydrophobicContact CB-CD1 3.91Å; I477-L508 HydrophobicContact CG2-CD1 3.59Å
478	V	81.7	Confident	81.2	Confident	27 Å²	27	50.8 Å²	50.8	16%	0.164	24%	0.24	C	C	.	.	H	α-helix	trans	-58.5	-39.1	174.4	170.4	0	0	0	0	110.6	R474 A480 I481 N482 L508 M517	R474-V478 WeakPolarHBondContact O-CB 3.28Å; R474-V478 VanDerWaalsContact O-CG2 3.3Å; R474-V478 WeakPolarHBondContact O-CG2 3.4Å; R474-V478 PolarHBondContact O-N 3.44Å; V478-A480 VanDerWaalsContact C-N 3.32Å; V478-A480 PolarHBondContact O-N 3.24Å; V478-I481 PolarHBondContact O-N 3.46Å; V478-N482 VanDerWaalsContact O-CB 3.31Å; V478-N482 WeakPolarHBondContact O-CB 3.4Å; V478-N482 PolarHBondContact O-N 3.44Å; V478-N482 PolarHBondContact O-ND2 3.29Å; V478-L508 HydrophobicContact CG2-CD1 3.93Å; V478-L508 HydrophobicContact CG2-CD2 3.66Å; V478-L508 HydrophobicContact CG2-CG 4.48Å; V478-M517 HydrophobicContact CG1-CE 4.39Å; V478-M517 HydrophobicContact CG2-CE 4.43Å
479	S	75	Confident	81.7	Confident	38 Å²	38	47 Å²	47	27%	0.266	23%	0.226	S	C	.	.	H	α-helix	trans	-65.9	-29.9	173.4	-61.4	0	0	0	0	113.7	I475 R476 I477 R483	I475-S479 VanDerWaalsContact O-CB 3.3Å; I475-S479 WeakPolarHBondContact O-CB 3.22Å; I475-S479 PolarHBondContact O-N 3.02Å; I475-S479 PolarHBondContact O-OG 3.45Å; R476-S479 WeakPolarHBondContact O-CB 3.37Å; R476-S479 PolarHBondContact O-N 3.09Å; I477-S479 PolarHBondContact O-N 3.14Å; S479-R483 WeakPolarHBondContact O-CB 3.48Å; S479-R483 VanDerWaalsContact O-CD 3.24Å; S479-R483 WeakPolarHBondContact O-CD 3.49Å; S479-R483 WeakPolarHBondContact O-CG 3.33Å; S479-R483 PolarHBondContact O-N 2.94Å
480	A	80.2	Confident	82.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-74.2	-43.2	174.7	0	0	0	0	0	112	F419 R476 I477 V478 R483 H484 L485	F419-A480 HydrophobicContact CB-CB 4Å; F419-A480 HydrophobicContact CD1-CB 3.99Å; F419-A480 HydrophobicContact CD2-CB 3.58Å; F419-A480 HydrophobicContact CE1-CB 4.41Å; F419-A480 HydrophobicContact CE2-CB 4.03Å; F419-A480 HydrophobicContact CG-CB 3.55Å; F419-A480 HydrophobicContact CZ-CB 4.42Å; R476-A480 PolarHBondContact O-N 3.32Å; I477-A480 WeakPolarHBondContact O-CA 3.38Å; I477-A480 WeakPolarHBondContact O-CB 3.39Å; I477-A480 PolarHBondContact O-N 3.4Å; V478-A480 VanDerWaalsContact C-N 3.32Å; V478-A480 PolarHBondContact O-N 3.24Å; A480-R483 CarbonylContact O-C 3.53Å; A480-R483 WeakPolarHBondContact O-CA 3.43Å; A480-R483 PolarHBondContact O-N 2.87Å; A480-R483 VanDerWaalsContact O-N 3.08Å; A480-H484 PolarHBondContact O-N 2.73Å; A480-H484 VanDerWaalsContact O-N 3.17Å; A480-L485 HydrophobicContact CB-CD1 4.09Å; A480-L485 PolarHBondContact O-N 2.88Å
481	I	80.6	Confident	82.4	Confident	19 Å²	19	43.9 Å²	43.9	10%	0.097	21%	0.212	C	C	.	.	H	α-helix	trans	-61.9	-45.8	176.1	-69.8	171.8	0	0	0	110.6	I477 V478 R483 H484 L508 L509 H657 F659	I477-I481 HydrophobicContact CG2-CD1 3.87Å; I477-I481 HydrophobicContact CG2-CG1 4.36Å; I477-I481 WeakPolarHBondContact O-CG1 3.23Å; I477-I481 PolarHBondContact O-N 2.98Å; V478-I481 PolarHBondContact O-N 3.46Å; I481-R483 PolarHBondContact O-N 2.97Å; I481-H484 PolarHBondContact O-N 2.77Å; I481-L508 HydrophobicContact CD1-CB 4.32Å; I481-L509 HydrophobicContact CD1-CD2 4.42Å; I481-H657 HydrophobicContact CG1-CB 4.07Å; I481-H657 HydrophobicContact CG2-CB 4.13Å; I481-F659 HydrophobicContact CG1-CE2 4.12Å; I481-F659 HydrophobicContact CG1-CZ 3.95Å
482	N	74.3	Confident	82.7	Confident	104 Å²	104	43.4 Å²	43.4	56%	0.556	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-12.2	175.7	-69.3	-16.4	0	0	0	113.7	Y405 V478	Y405-N482 PolarHBondContact OH-O 3.43Å; V478-N482 VanDerWaalsContact O-CB 3.31Å; V478-N482 WeakPolarHBondContact O-CB 3.4Å; V478-N482 PolarHBondContact O-N 3.44Å; V478-N482 PolarHBondContact O-ND2 3.29Å
483	R	70.3	Confident	83	Confident	132 Å²	132	42.2 Å²	42.2	50%	0.498	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	6.7	172.7	-73.1	171.6	-175.1	140.9	2	112.9	Y405 Q414 S479 A480 I481 L485	Y405-R483 HydrophobicContact CE2-CG 4.47Å; Y405-R483 WeakPolarHBondContact OH-CA 3.33Å; Y405-R483 WeakPolarHBondContact OH-CG 3.24Å; Q414-R483 PolarHBondContact NE2-O 2.75Å; S479-R483 WeakPolarHBondContact O-CB 3.48Å; S479-R483 VanDerWaalsContact O-CD 3.24Å; S479-R483 WeakPolarHBondContact O-CD 3.49Å; S479-R483 WeakPolarHBondContact O-CG 3.33Å; S479-R483 PolarHBondContact O-N 2.94Å; A480-R483 CarbonylContact O-C 3.53Å; A480-R483 WeakPolarHBondContact O-CA 3.43Å; A480-R483 PolarHBondContact O-N 2.87Å; A480-R483 VanDerWaalsContact O-N 3.08Å; I481-R483 PolarHBondContact O-N 2.97Å; R483-L485 HydrophobicContact CB-CD1 4.26Å; R483-L485 HydrophobicContact CB-CD2 4.17Å; R483-L485 HydrophobicContact CB-CG 3.79Å; R483-L485 PolarHBondContact O-N 3.1Å
484	H	75	Confident	82.9	Confident	105 Å²	105	45.1 Å²	45.1	49%	0.486	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.3	41.7	-176.8	-53.1	-69	0	0	0	114.1	A480 I481 E486 H657	A480-H484 PolarHBondContact O-N 2.73Å; A480-H484 VanDerWaalsContact O-N 3.17Å; I481-H484 PolarHBondContact O-N 2.77Å; H484-E486 PolarHBondContact O-N 3.32Å; H484-H657 VanDerWaalsContact CA-NE2 3.34Å; H484-H657 WeakPolarHBondContact CA-NE2 3.5Å
485	L	80.3	Confident	82.9	Confident	13 Å²	13	48 Å²	48	7%	0.068	23%	0.233	C	C	.	.			trans	-76.2	107.2	-175.6	-63.6	-178	0	0	0	110.8	L417 F419 A480 R483 T487 H657 F659	L417-L485 HydrophobicContact CB-CD2 3.54Å; L417-L485 HydrophobicContact CD1-CD2 3.97Å; L417-L485 HydrophobicContact CG-CD2 4.41Å; F419-L485 HydrophobicContact CB-CD1 4.01Å; A480-L485 HydrophobicContact CB-CD1 4.09Å; A480-L485 PolarHBondContact O-N 2.88Å; R483-L485 HydrophobicContact CB-CD1 4.26Å; R483-L485 HydrophobicContact CB-CD2 4.17Å; R483-L485 HydrophobicContact CB-CG 3.79Å; R483-L485 PolarHBondContact O-N 3.1Å; L485-T487 PolarHBondContact O-N 2.93Å; L485-T487 VanDerWaalsContact O-N 3.14Å; L485-H657 PolarHBondContact O-CE1 3.41Å; L485-H657 VanDerWaalsContact O-CE1 3.26Å; L485-F659 WeakPolarHBondContact O-CD1 3.41Å; L485-F659 WeakPolarHBondContact O-CE1 3.11Å
486	E	82.7	Confident	83.1	Confident	59 Å²	59	49 Å²	49	28%	0.276	23%	0.23	S	C	.	.			trans	-63.2	-20.1	-177.6	-79.7	-163.5	-147.9	0	0	115.1	N415 H484 F659 T660 H661	N415-E486 PolarHBondContact ND2-OE1 3.35Å; N415-E486 PolarHBondContact ND2-OE2 3.06Å; N415-E486 VanDerWaalsContact ND2-OE2 3.1Å; H484-E486 PolarHBondContact O-N 3.32Å; E486-F659 WeakPolarHBondContact O-CA 3.33Å; E486-T660 HydrophobicContact CG-CG2 4.48Å; E486-T660 PolarHBondContact O-N 3.39Å; E486-T660 WeakPolarHBondContact OE2-CG2 3.33Å; E486-T660 PolarHBondContact OE2-OG1 2.64Å; E486-H661 PolarHBondContact O-N 3.01Å
487	T	84.6	Confident	83.1	Confident	13 Å²	13	45.4 Å²	45.4	8%	0.08	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	131.5	-170.2	86.2	0	0	0	0	113.3	L417 C418 F419 L485 H661	L417-T487 PolarHBondContact O-OG1 3.31Å; C418-T487 VanDerWaalsContact CA-OG1 3.23Å; C418-T487 WeakPolarHBondContact CA-OG1 3.07Å; C418-T487 WeakPolarHBondContact CB-OG1 3.38Å; C418-T487 PolarHBondContact SG-OG1 3.4Å; C418-T487 VanDerWaalsContact SG-OG1 3.4Å; F419-T487 PolarHBondContact N-O 3.19Å; L485-T487 PolarHBondContact O-N 2.93Å; L485-T487 VanDerWaalsContact O-N 3.14Å; T487-H661 WeakPolarHBondContact CA-O 3.44Å; T487-H661 HydrophobicContact CG2-CB 3.74Å
488	I	90.3	Very high	83.1	Confident	7 Å²	7	45.6 Å²	45.6	4%	0.036	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.9	175.5	-59.3	178.9	0	0	0	109.5	F419 I490 F659 H661 I662 I663 F681	F419-I488 HydrophobicContact CD1-CG1 4.36Å; F419-I488 HydrophobicContact CD1-CG2 4.23Å; I488-I490 HydrophobicContact CG2-CD1 4.43Å; I488-I490 HydrophobicContact CG2-CG1 3.91Å; I488-F659 HydrophobicContact CD1-CB 4.36Å; I488-F659 HydrophobicContact CD1-CD1 3.56Å; I488-F659 HydrophobicContact CD1-CD2 3.88Å; I488-F659 HydrophobicContact CD1-CE1 3.64Å; I488-F659 HydrophobicContact CD1-CE2 3.96Å; I488-F659 HydrophobicContact CD1-CG 3.66Å; I488-F659 HydrophobicContact CD1-CZ 3.85Å; I488-F659 HydrophobicContact CG1-CD1 3.4Å; I488-F659 HydrophobicContact CG1-CE1 3.49Å; I488-F659 VanDerWaalsContact CG1-CE1 3.49Å; I488-F659 HydrophobicContact CG1-CG 4Å; I488-F659 HydrophobicContact CG1-CZ 4.18Å; I488-H661 PolarHBondContact N-O 3.48Å; I488-I662 CarbonylContact O-C 3.57Å; I488-I662 WeakPolarHBondContact O-CA 3.34Å; I488-I663 PolarHBondContact O-N 3.23Å; I488-F681 HydrophobicContact CD1-CE1 3.72Å; I488-F681 HydrophobicContact CD1-CZ 3.89Å
489	K	90.9	Very high	83.2	Confident	40 Å²	40	47.3 Å²	47.3	17%	0.174	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	104.5	165.5	-175.8	151.8	-170.9	150.7	0	111.5	F419 V420 L421 V491 I663 E690	F419-K489 PolarHBondContact O-N 2.94Å; V420-K489 CarbonylContact C-O 3.58Å; V420-K489 WeakPolarHBondContact CA-O 3.17Å; V420-K489 HydrophobicContact CG2-CB 4.36Å; L421-K489 PolarHBondContact N-O 2.94Å; K489-V491 HydrophobicContact CG-CG2 3.8Å; K489-I663 CarbonylContact C-O 3.38Å; K489-I663 VanDerWaalsContact CA-O 3.32Å; K489-I663 WeakPolarHBondContact CA-O 3.43Å; K489-I663 HydrophobicContact CB-CB 3.99Å; K489-I663 HydrophobicContact CB-CD1 4.32Å; K489-I663 HydrophobicContact CD-CB 3.96Å; K489-I663 HydrophobicContact CD-CD1 4.01Å; K489-I663 HydrophobicContact CD-CG2 3.57Å; K489-I663 VanDerWaalsContact CE-CG2 3.47Å; K489-I663 HydrophobicContact CG-CB 3.85Å; K489-I663 HydrophobicContact CG-CG2 3.83Å; K489-E690 IonicContact NZ-OE2 2.7Å; K489-E690 PolarHBondContact NZ-OE2 3.02Å
490	I	91.9	Very high	83.7	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	128.1	172.8	-63.5	162.5	0	0	0	107.9	I488 L493 L501 I663 F664 K665	I488-I490 HydrophobicContact CG2-CD1 4.43Å; I488-I490 HydrophobicContact CG2-CG1 3.91Å; I490-L493 HydrophobicContact CG2-CB 3.71Å; I490-L493 HydrophobicContact CG2-CD2 4.2Å; I490-L501 HydrophobicContact CD1-CD2 3.95Å; I490-L501 HydrophobicContact CG1-CD2 4.38Å; I490-L501 HydrophobicContact CG2-CD2 4.36Å; I490-I663 PolarHBondContact N-O 3.16Å; I490-F664 HydrophobicContact CB-CD1 4.15Å; I490-F664 HydrophobicContact CB-CE1 4.43Å; I490-F664 HydrophobicContact CD1-CD1 4.16Å; I490-F664 HydrophobicContact CD1-CE1 3.58Å; I490-F664 HydrophobicContact CD1-CZ 4.01Å; I490-F664 HydrophobicContact CG2-CD1 4.34Å; I490-K665 PolarHBondContact O-N 3.25Å
491	V	90.7	Very high	84	Confident	12 Å²	12	46.6 Å²	46.6	7%	0.073	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	127.1	-177.1	-172.4	0	0	0	0	110.4	V420 L421 N422 I423 K489 L493 K665	V420-V491 HydrophobicContact CG1-CG2 3.94Å; L421-V491 PolarHBondContact O-N 3.28Å; N422-V491 WeakPolarHBondContact CA-O 3.38Å; N422-V491 HydrophobicContact CB-CB 4.04Å; I423-V491 PolarHBondContact N-O 2.95Å; K489-V491 HydrophobicContact CG-CG2 3.8Å; V491-L493 VanDerWaalsContact C-N 3.3Å; V491-L493 PolarHBondContact O-N 2.84Å; V491-K665 WeakPolarHBondContact CA-O 3.46Å; V491-K665 HydrophobicContact CG1-CB 4.27Å; V491-K665 HydrophobicContact CG1-CD 4.41Å; V491-K665 HydrophobicContact CG1-CG 4.39Å; V491-K665 HydrophobicContact CG2-CB 4.25Å
492	Q	87.5	Confident	84.3	Confident	67 Å²	67	47.1 Å²	47.1	31%	0.313	23%	0.225	S	C	.	.	S	Bend	trans	54.8	43.1	176.2	-66.7	171.8	-5.3	0	0	113.2	K424 K665 S666	K424-Q492 HydrophobicContact CB-CB 4.02Å; Q492-K665 PolarHBondContact N-O 2.57Å; Q492-S666 WeakPolarHBondContact CA-O 3.49Å
493	L	88.3	Confident	84.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.221	C	C	.	.			trans	-67.5	134.3	163	177	64.1	0	0	0	109.1	I423 I490 V491 F497 L501 C667 S668 I669 L677	I423-L493 HydrophobicContact CD1-CB 4.01Å; I423-L493 HydrophobicContact CD1-CD1 3.38Å; I423-L493 HydrophobicContact CD1-CG 4.26Å; I490-L493 HydrophobicContact CG2-CB 3.71Å; I490-L493 HydrophobicContact CG2-CD2 4.2Å; V491-L493 VanDerWaalsContact C-N 3.3Å; V491-L493 PolarHBondContact O-N 2.84Å; L493-F497 HydrophobicContact CD1-CB 3.98Å; L493-L501 HydrophobicContact CD1-CD2 4.24Å; L493-L501 HydrophobicContact CD2-CD2 3.91Å; L493-C667 HydrophobicContact CB-CB 4.3Å; L493-C667 WeakPolarHBondContact O-CA 3.48Å; L493-S668 PolarHBondContact O-N 3.19Å; L493-I669 HydrophobicContact CB-CG2 4.48Å; L493-I669 HydrophobicContact CD2-CD1 4.11Å; L493-I669 HydrophobicContact CD2-CG2 3.74Å; L493-I669 HydrophobicContact CG-CG2 3.63Å; L493-L677 HydrophobicContact CD2-CD1 3.88Å
494	V	86.4	Confident	85.5	Confident	63 Å²	63	40.1 Å²	40.1	38%	0.382	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-118.4	145.5	175.9	-176	0	0	0	0	108	R496 F497 S498 S668	V494-R496 VanDerWaalsContact C-N 3.25Å; V494-R496 HydrophobicContact CG1-CG 4.4Å; V494-R496 PolarHBondContact O-N 2.88Å; V494-F497 HydrophobicContact CB-CD2 4.25Å; V494-F497 PolarHBondContact O-N 3.43Å; V494-S498 PolarHBondContact O-N 3.21Å; V494-S668 CarbonylContact C-O 3.56Å; V494-S668 VanDerWaalsContact CA-O 3.28Å; V494-S668 WeakPolarHBondContact CA-O 3.32Å
495	E	83.9	Confident	86	Confident	118 Å²	118	35.3 Å²	35.3	55%	0.551	18%	0.175	S	C	*	.	H	α-helix	trans	-40.5	-47.7	-176.9	-178.2	175.9	-156.3	0	0	114.1	F497 S498 S668 P670	E495-F497 PolarHBondContact O-N 3.5Å; E495-S498 WeakPolarHBondContact O-CB 3.36Å; E495-S498 PolarHBondContact O-N 2.87Å; E495-S498 PolarHBondContact O-OG 2.81Å; E495-S668 PolarHBondContact N-O 3.43Å; E495-P670 HydrophobicContact CG-CG 4.23Å; E495-P670 WeakPolarHBondContact OE1-CG 3.28Å
496	R	82.6	Confident	86.2	Confident	126 Å²	126	38.2 Å²	38.2	48%	0.475	19%	0.189	S	C	.	.	H	α-helix	trans	-57.2	-14.2	179.3	72	174.8	-178.7	160.6	1.6	115.7	V494	V494-R496 VanDerWaalsContact C-N 3.25Å; V494-R496 HydrophobicContact CG1-CG 4.4Å; V494-R496 PolarHBondContact O-N 2.88Å
497	F	84.3	Confident	86.2	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-113.9	-3.9	176.6	-54.4	-62.4	0	0	0	113.4	I423 I427 Y466 L469 L493 V494 E495 I500 L501	I423-F497 HydrophobicContact CG2-CD2 3.93Å; I423-F497 HydrophobicContact CG2-CE2 4.39Å; I423-F497 HydrophobicContact CG2-CG 4.34Å; I427-F497 HydrophobicContact CD1-CD2 4.19Å; I427-F497 HydrophobicContact CD1-CE1 4.41Å; I427-F497 HydrophobicContact CD1-CE2 3.3Å; I427-F497 HydrophobicContact CD1-CZ 3.43Å; I427-F497 VanDerWaalsContact CD1-CZ 3.43Å; I427-F497 HydrophobicContact CG1-CE2 4.44Å; I427-F497 HydrophobicContact CG1-CZ 4.16Å; Y466-F497 HydrophobicContact CD1-CD1 4.08Å; Y466-F497 AromaticContact CD1-CE1 3.91Å; Y466-F497 HydrophobicContact CD1-CE1 3.91Å; Y466-F497 AromaticContact CE1-CD1 3.75Å; Y466-F497 HydrophobicContact CE1-CD1 3.75Å; Y466-F497 AromaticContact CE1-CE1 3.54Å; Y466-F497 HydrophobicContact CE1-CE1 3.54Å; L469-F497 HydrophobicContact CD2-CD1 3.36Å; L469-F497 HydrophobicContact CD2-CE1 3.5Å; L469-F497 VanDerWaalsContact CD2-CE1 3.5Å; L469-F497 HydrophobicContact CD2-CG 4.04Å; L469-F497 HydrophobicContact CD2-CZ 4.27Å; L493-F497 HydrophobicContact CD1-CB 3.98Å; V494-F497 HydrophobicContact CB-CD2 4.25Å; V494-F497 PolarHBondContact O-N 3.43Å; E495-F497 PolarHBondContact O-N 3.5Å; F497-I500 PolarHBondContact O-N 3.36Å; F497-L501 PolarHBondContact O-N 3.46Å
498	S	84.1	Confident	86	Confident	8 Å²	8	39.2 Å²	39.2	6%	0.056	19%	0.194	C	C	.	.	H	α-helix	trans	-65.3	-40	-176.8	65.6	0	0	0	0	112.4	V494 E495 L501 Y502 S673	V494-S498 PolarHBondContact O-N 3.21Å; E495-S498 WeakPolarHBondContact O-CB 3.36Å; E495-S498 PolarHBondContact O-N 2.87Å; E495-S498 PolarHBondContact O-OG 2.81Å; S498-L501 PolarHBondContact O-N 3.06Å; S498-Y502 VanDerWaalsContact O-CB 3.29Å; S498-Y502 WeakPolarHBondContact O-CB 3.38Å; S498-Y502 PolarHBondContact O-N 2.91Å; S498-S673 PolarHBondContact OG-OG 3.35Å
499	S	84.1	Confident	85.3	Confident	63 Å²	63	40 Å²	40	44%	0.441	20%	0.198	S	C	.	.	H	α-helix	trans	-62.4	-43.2	174.2	51.7	0	0	0	0	112.5	Y502 N503	S499-Y502 PolarHBondContact O-N 3.03Å; S499-N503 WeakPolarHBondContact O-CB 3.44Å; S499-N503 PolarHBondContact O-N 3.47Å; S499-N503 PolarHBondContact O-OD1 3.21Å
500	I	85.3	Confident	84.2	Confident	22 Å²	22	40 Å²	40	11%	0.113	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-47.7	178.1	-64.9	170.7	0	0	0	110.1	Y466 E470 F497 Y502 N503 I504	Y466-I500 HydrophobicContact CD1-CD1 3.24Å; Y466-I500 HydrophobicContact CE1-CD1 3.84Å; Y466-I500 HydrophobicContact CG-CD1 3.84Å; E470-I500 HydrophobicContact CB-CG2 4.25Å; F497-I500 PolarHBondContact O-N 3.36Å; I500-Y502 VanDerWaalsContact C-N 3.33Å; I500-Y502 PolarHBondContact O-N 3.48Å; I500-N503 PolarHBondContact O-N 2.98Å; I500-I504 HydrophobicContact CG2-CD1 3.72Å; I500-I504 WeakPolarHBondContact O-CD1 3.23Å; I500-I504 VanDerWaalsContact O-CG1 3.23Å; I500-I504 WeakPolarHBondContact O-CG1 3.43Å; I500-I504 PolarHBondContact O-N 2.99Å
501	L	86.4	Confident	82.3	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-41	176.1	-177.8	61.3	0	0	0	111.9	L421 I423 I473 I477 I490 L493 F497 S498 L505 L677	L421-L501 HydrophobicContact CD2-CD1 3.62Å; L421-L501 HydrophobicContact CD2-CD2 4.35Å; I423-L501 HydrophobicContact CD1-CD2 4.4Å; I473-L501 HydrophobicContact CG2-CD1 3.9Å; I477-L501 HydrophobicContact CD1-CD1 4.13Å; I490-L501 HydrophobicContact CD1-CD2 3.95Å; I490-L501 HydrophobicContact CG1-CD2 4.38Å; I490-L501 HydrophobicContact CG2-CD2 4.36Å; L493-L501 HydrophobicContact CD1-CD2 4.24Å; L493-L501 HydrophobicContact CD2-CD2 3.91Å; F497-L501 PolarHBondContact O-N 3.46Å; S498-L501 PolarHBondContact O-N 3.06Å; L501-L505 HydrophobicContact CD1-CD1 3.99Å; L501-L505 HydrophobicContact CD1-CG 4.19Å; L501-L505 HydrophobicContact CG-CD1 3.87Å; L501-L505 HydrophobicContact CG-CG 4.48Å; L501-L505 WeakPolarHBondContact O-CB 3.26Å; L501-L505 VanDerWaalsContact O-CG 3.29Å; L501-L505 WeakPolarHBondContact O-CG 3.18Å; L501-L505 PolarHBondContact O-N 2.9Å; L501-L677 HydrophobicContact CD2-CD2 4.37Å; L501-L677 HydrophobicContact CG-CD2 4.18Å
502	Y	87.4	Confident	79.7	Confident	31 Å²	31	49.8 Å²	49.8	12%	0.122	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-52	175	175.6	-85.6	0	0	0	111.3	S498 S499 I500 I504 L505 E506 R676 L677 L680	S498-Y502 VanDerWaalsContact O-CB 3.29Å; S498-Y502 WeakPolarHBondContact O-CB 3.38Å; S498-Y502 PolarHBondContact O-N 2.91Å; S499-Y502 PolarHBondContact O-N 3.03Å; I500-Y502 VanDerWaalsContact C-N 3.33Å; I500-Y502 PolarHBondContact O-N 3.48Å; Y502-I504 VanDerWaalsContact C-N 3.32Å; Y502-I504 PolarHBondContact O-N 3.28Å; Y502-L505 PolarHBondContact O-N 3.35Å; Y502-E506 HydrophobicContact CE1-CB 4.18Å; Y502-E506 VanDerWaalsContact CE1-CD 3.43Å; Y502-E506 HydrophobicContact CE1-CG 4.38Å; Y502-E506 VanDerWaalsContact CE1-OE1 3.3Å; Y502-E506 WeakPolarHBondContact CE1-OE1 3.38Å; Y502-E506 WeakPolarHBondContact CE1-OE2 3.47Å; Y502-E506 VanDerWaalsContact O-CB 3.28Å; Y502-E506 WeakPolarHBondContact O-CB 3.47Å; Y502-E506 PolarHBondContact O-N 2.94Å; Y502-E506 PolarHBondContact OH-OE1 3.45Å; Y502-R676 HydrophobicContact CD2-CB 3.88Å; Y502-R676 VanDerWaalsContact CE1-NH2 3.33Å; Y502-R676 HydrophobicContact CE2-CB 3.72Å; Y502-R676 WeakPolarHBondContact CE2-O 3.36Å; Y502-R676 PolarHBondContact OH-NH2 3.35Å; Y502-L677 HydrophobicContact CD2-CD2 4.47Å; Y502-L680 HydrophobicContact CD2-CD1 3.84Å; Y502-L680 HydrophobicContact CD2-CG 4.38Å; Y502-L680 HydrophobicContact CE2-CD1 3.98Å; Y502-L680 HydrophobicContact CE2-CD2 4.02Å; Y502-L680 HydrophobicContact CE2-CG 4.08Å; Y502-L680 HydrophobicContact CG-CD1 4.49Å
503	N	85.5	Confident	77.5	Confident	88 Å²	88	51.7 Å²	51.7	47%	0.471	27%	0.268	S	S	.	.	H	α-helix	trans	-59.4	-41.9	-178.7	-67.9	-5.8	0	0	0	111.8	S499 I500 M507	S499-N503 WeakPolarHBondContact O-CB 3.44Å; S499-N503 PolarHBondContact O-N 3.47Å; S499-N503 PolarHBondContact O-OD1 3.21Å; I500-N503 PolarHBondContact O-N 2.98Å; N503-M507 VanDerWaalsContact O-CB 3.28Å; N503-M507 WeakPolarHBondContact O-CB 3.41Å; N503-M507 PolarHBondContact O-N 3.46Å
504	I	84.4	Confident	74.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-43	178.8	-62.5	161.7	0	0	0	110.9	E470 I473 R474 I477 I500 Y502 L508	E470-I504 HydrophobicContact CB-CD1 4.14Å; E470-I504 HydrophobicContact CG-CD1 3.82Å; E470-I504 HydrophobicContact CG-CG1 4.03Å; I473-I504 HydrophobicContact CB-CD1 3.88Å; I473-I504 HydrophobicContact CG2-CD1 3.72Å; I473-I504 HydrophobicContact CG2-CG2 4.21Å; R474-I504 HydrophobicContact CB-CG2 4.11Å; I477-I504 HydrophobicContact CD1-CG2 4.06Å; I500-I504 HydrophobicContact CG2-CD1 3.72Å; I500-I504 WeakPolarHBondContact O-CD1 3.23Å; I500-I504 VanDerWaalsContact O-CG1 3.23Å; I500-I504 WeakPolarHBondContact O-CG1 3.43Å; I500-I504 PolarHBondContact O-N 2.99Å; Y502-I504 VanDerWaalsContact C-N 3.32Å; Y502-I504 PolarHBondContact O-N 3.28Å; I504-L508 HydrophobicContact CG2-CD1 3.76Å; I504-L508 HydrophobicContact CG2-CG 4.41Å; I504-L508 WeakPolarHBondContact O-CB 3.3Å; I504-L508 WeakPolarHBondContact O-CG 3.38Å; I504-L508 PolarHBondContact O-N 3.23Å
505	L	84.4	Confident	72.4	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-43.2	176.4	-73.8	170.1	0	0	0	111.6	I477 L501 Y502 M507 L508 L509 L677 L680 F681	I477-L505 HydrophobicContact CD1-CD2 3.87Å; I477-L505 HydrophobicContact CD1-CG 4.29Å; I477-L505 HydrophobicContact CG2-CD2 4.4Å; L501-L505 HydrophobicContact CD1-CD1 3.99Å; L501-L505 HydrophobicContact CD1-CG 4.19Å; L501-L505 HydrophobicContact CG-CD1 3.87Å; L501-L505 HydrophobicContact CG-CG 4.48Å; L501-L505 WeakPolarHBondContact O-CB 3.26Å; L501-L505 VanDerWaalsContact O-CG 3.29Å; L501-L505 WeakPolarHBondContact O-CG 3.18Å; L501-L505 PolarHBondContact O-N 2.9Å; Y502-L505 PolarHBondContact O-N 3.35Å; L505-M507 PolarHBondContact O-N 3.12Å; L505-L508 PolarHBondContact O-N 2.84Å; L505-L509 HydrophobicContact CB-CD1 4.27Å; L505-L509 HydrophobicContact CD2-CD1 4.12Å; L505-L509 WeakPolarHBondContact O-CB 3.29Å; L505-L509 VanDerWaalsContact O-CG 3.27Å; L505-L509 WeakPolarHBondContact O-CG 3.29Å; L505-L509 PolarHBondContact O-N 3.14Å; L505-L677 HydrophobicContact CD1-CD2 3.88Å; L505-L680 HydrophobicContact CB-CD1 3.54Å; L505-L680 HydrophobicContact CD1-CD1 4.5Å; L505-F681 HydrophobicContact CD1-CE2 4.16Å; L505-F681 HydrophobicContact CD1-CZ 3.88Å; L505-F681 HydrophobicContact CD2-CE1 4.4Å; L505-F681 HydrophobicContact CD2-CZ 3.86Å; L505-F681 HydrophobicContact CG-CZ 4.43Å
506	E	84.9	Confident	70.1	Confident	74 Å²	74	56.9 Å²	56.9	35%	0.346	30%	0.301	S	S	.	.	H	α-helix	trans	-60.4	-45.5	176.3	-173.8	175.9	-114.3	0	0	110.8	Y502 L508 S510 L680	Y502-E506 HydrophobicContact CE1-CB 4.18Å; Y502-E506 VanDerWaalsContact CE1-CD 3.43Å; Y502-E506 HydrophobicContact CE1-CG 4.38Å; Y502-E506 VanDerWaalsContact CE1-OE1 3.3Å; Y502-E506 WeakPolarHBondContact CE1-OE1 3.38Å; Y502-E506 WeakPolarHBondContact CE1-OE2 3.47Å; Y502-E506 VanDerWaalsContact O-CB 3.28Å; Y502-E506 WeakPolarHBondContact O-CB 3.47Å; Y502-E506 PolarHBondContact O-N 2.94Å; Y502-E506 PolarHBondContact OH-OE1 3.45Å; E506-L508 PolarHBondContact O-N 3.22Å; E506-S510 WeakPolarHBondContact O-CB 3.48Å; E506-S510 PolarHBondContact O-N 3.19Å; E506-S510 PolarHBondContact O-OG 3.32Å; E506-L680 HydrophobicContact CB-CD1 4.42Å; E506-L680 HydrophobicContact CB-CD2 4.12Å; E506-L680 HydrophobicContact CG-CD2 4.33Å
507	M	81.9	Confident	67.5	Low	64 Å²	64	55.4 Å²	55.4	32%	0.315	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-41.4	174.5	176.4	-178.2	56	0	0	113	R474 N503 L505	R474-M507 HydrophobicContact CG-CE 4.34Å; N503-M507 VanDerWaalsContact O-CB 3.28Å; N503-M507 WeakPolarHBondContact O-CB 3.41Å; N503-M507 PolarHBondContact O-N 3.46Å; L505-M507 PolarHBondContact O-N 3.12Å
508	L	80.5	Confident	64.9	Low	30 Å²	30	59.7 Å²	59.7	16%	0.157	33%	0.327	C	S	.	.	H	α-helix	trans	-86.2	-22.2	-173.9	-68.6	177.1	0	0	0	114.4	R474 I477 V478 I481 I504 L505 E506	R474-L508 HydrophobicContact CG-CD1 4.45Å; I477-L508 HydrophobicContact CB-CD1 3.91Å; I477-L508 HydrophobicContact CG2-CD1 3.59Å; V478-L508 HydrophobicContact CG2-CD1 3.93Å; V478-L508 HydrophobicContact CG2-CD2 3.66Å; V478-L508 HydrophobicContact CG2-CG 4.48Å; I481-L508 HydrophobicContact CD1-CB 4.32Å; I504-L508 HydrophobicContact CG2-CD1 3.76Å; I504-L508 HydrophobicContact CG2-CG 4.41Å; I504-L508 WeakPolarHBondContact O-CB 3.3Å; I504-L508 WeakPolarHBondContact O-CG 3.38Å; I504-L508 PolarHBondContact O-N 3.23Å; L505-L508 PolarHBondContact O-N 2.84Å; E506-L508 PolarHBondContact O-N 3.22Å
509	L	75.4	Confident	62.2	Low	23 Å²	23	62.8 Å²	62.8	12%	0.12	35%	0.349	C	S	.	.	H	α-helix	trans	-104.3	-21.2	-178.2	-61.1	172.9	0	0	0	113.2	I481 L505 H657 F659 L680 F681	I481-L509 HydrophobicContact CD1-CD2 4.42Å; L505-L509 HydrophobicContact CB-CD1 4.27Å; L505-L509 HydrophobicContact CD2-CD1 4.12Å; L505-L509 WeakPolarHBondContact O-CB 3.29Å; L505-L509 VanDerWaalsContact O-CG 3.27Å; L505-L509 WeakPolarHBondContact O-CG 3.29Å; L505-L509 PolarHBondContact O-N 3.14Å; L509-H657 HydrophobicContact CD2-CB 4.35Å; L509-F659 HydrophobicContact CD2-CD2 4.3Å; L509-F659 HydrophobicContact CD2-CE2 4.06Å; L509-L680 HydrophobicContact CD1-CB 4.26Å; L509-F681 HydrophobicContact CD1-CD1 3.84Å; L509-F681 HydrophobicContact CD1-CE1 3.48Å; L509-F681 VanDerWaalsContact CD1-CE1 3.48Å; L509-F681 HydrophobicContact CD1-CZ 3.96Å
510	S	67.4	Low	59.6	Low	40 Å²	40	66.6 Å²	66.6	28%	0.28	36%	0.363	S	S	.	.			trans	-64.9	132.2	177.7	-71.5	0	0	0	0	111.8	E506 N512	E506-S510 WeakPolarHBondContact O-CB 3.48Å; E506-S510 PolarHBondContact O-N 3.19Å; E506-S510 PolarHBondContact O-OG 3.32Å; S510-N512 PolarHBondContact O-N 2.95Å; S510-N512 VanDerWaalsContact O-N 3.11Å
511	P	52.3	Low	56.9	Low	79 Å²	79	69.2 Å²	69.2	51%	0.513	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-61.7	-26	-179.9	24.2	-33.5	0	0	0	113.1	N514	P511-N514 PolarHBondContact O-ND2 3.33Å
512	N	37.3	Very low	53.9	Low	142 Å²	142	77.4 Å²	77.4	76%	0.759	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-82.6	-13.2	-167	-64.2	-8.6	0	0	0	115.4	S510	S510-N512 PolarHBondContact O-N 2.95Å; S510-N512 VanDerWaalsContact O-N 3.11Å
513	H	40	Very low	50.9	Low	107 Å²	107	81.6 Å²	81.6	50%	0.495	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-100	10.1	-174.3	-95.7	-43.9	0	0	0	116.1	V515 I516	H513-V515 PolarHBondContact O-N 3.04Å; H513-I516 PolarHBondContact O-N 2.6Å
514	N	32.7	Very low	47.9	Very low	75 Å²	75	82.3 Å²	82.3	40%	0.401	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	0.9	178.8	-76.7	-74.8	0	0	0	115.9	P511	P511-N514 PolarHBondContact O-ND2 3.33Å
515	V	35.4	Very low	44.9	Very low	119 Å²	119	88.9 Å²	88.9	72%	0.721	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-24.8	179.5	-177.9	0	0	0	0	113.1	H513 T518	H513-V515 PolarHBondContact O-N 3.04Å; V515-T518 PolarHBondContact O-OG1 2.76Å; V515-T518 VanDerWaalsContact O-OG1 3.14Å
516	I	35.8	Very low	42.1	Very low	97 Å²	97	95.1 Å²	95.1	50%	0.497	55%	0.546	S	S	.	.	S	Bend	trans	-95.9	-23.6	-167.7	-61.4	177.6	0	0	0	113.2	H513 T518 S519	H513-I516 PolarHBondContact O-N 2.6Å; I516-T518 VanDerWaalsContact C-N 3.26Å; I516-T518 PolarHBondContact O-N 2.89Å; I516-S519 PolarHBondContact O-OG 3.34Å; I516-S519 VanDerWaalsContact O-OG 3.05Å
517	M	28.6	Very low	39.1	Very low	94 Å²	94	100.5 Å²	100.5	46%	0.463	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.4	-11.9	179.8	-73	-66.5	-71.9	0	0	114.2	V478	V478-M517 HydrophobicContact CG1-CE 4.39Å; V478-M517 HydrophobicContact CG2-CE 4.43Å
518	T	29.9	Very low	36.2	Very low	93 Å²	93	101.8 Å²	101.8	57%	0.571	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-29.6	177.7	33.4	0	0	0	0	114.2	V515 I516 L520 S521	V515-T518 PolarHBondContact O-OG1 2.76Å; V515-T518 VanDerWaalsContact O-OG1 3.14Å; I516-T518 VanDerWaalsContact C-N 3.26Å; I516-T518 PolarHBondContact O-N 2.89Å; T518-L520 PolarHBondContact O-N 2.91Å; T518-S521 PolarHBondContact O-N 2.83Å; T518-S521 PolarHBondContact O-OG 3.07Å
519	S	27.1	Very low	33.5	Very low	73 Å²	73	110.5 Å²	110.5	51%	0.51	62%	0.619	S	S	.	*	G	3₁₀ helix	trans	-71.3	-26.5	-174.8	55.3	0	0	0	0	113.9	I516 S521 Q522	I516-S519 PolarHBondContact O-OG 3.34Å; I516-S519 VanDerWaalsContact O-OG 3.05Å; S519-S521 PolarHBondContact O-N 3.27Å; S519-S521 VanDerWaalsContact O-N 3.1Å; S519-Q522 PolarHBondContact O-N 3Å
520	L	29.6	Very low	30.9	Very low	142 Å²	142	119.1 Å²	119.1	74%	0.743	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-73.9	6.9	177.1	-73.9	164.9	0	0	0	114.3	T518	T518-L520 PolarHBondContact O-N 2.91Å
521	S	27.3	Very low	29	Very low	78 Å²	78	123 Å²	123	55%	0.545	68%	0.68	S	S	.	*	G	3₁₀ helix	trans	-115.5	-1.4	175.5	70.3	0	0	0	0	114.4	T518 S519	T518-S521 PolarHBondContact O-N 2.83Å; T518-S521 PolarHBondContact O-OG 3.07Å; S519-S521 PolarHBondContact O-N 3.27Å; S519-S521 VanDerWaalsContact O-N 3.1Å
522	Q	24.6	Very low	27.6	Very low	173 Å²	173	127.4 Å²	127.4	81%	0.808	69%	0.693	S	S	*	*			trans	-140.2	71.1	-178.1	-68.6	-172.3	-15.7	0	0	111.1	S519	S519-Q522 PolarHBondContact O-N 3Å
523	S	23.3	Very low	27.1	Very low	119 Å²	119	128.6 Å²	128.6	83%	0.832	70%	0.698	S	S	*	*			trans	-145.6	78.9	165.3	-167.4	0	0	0	0	110.7
524	S	22.2	Very low	26.3	Very low	103 Å²	103	129.2 Å²	129.2	72%	0.72	71%	0.705	S	S	*	*			trans	-118.1	124	160.1	57.1	0	0	0	0	106.9
525	T	22.4	Very low	25.9	Very low	138 Å²	138	131.4 Å²	131.4	85%	0.847	72%	0.721	S	S	*	*			trans	55.1	108.7	-178.3	62	0	0	0	0	116.3
526	V	25.9	Very low	25.5	Very low	134 Å²	134	131.9 Å²	131.9	81%	0.812	73%	0.725	S	S	*	*				-158.6	130.8	108.8	150.2	0	0	0	0	107.3
527	E	21	Very low	25.1	Very low	187 Å²	187	134 Å²	134	87%	0.874	74%	0.742	S	S	*	*			trans	-86.8	137.5	169.2	-61.2	162.5	107.6	0	0	109.7
528	S	22.2	Very low	24.8	Very low	92 Å²	92	133.2 Å²	133.2	64%	0.643	75%	0.75	S	S	*	*			trans	170.4	165.1	144.8	42.3	0	0	0	0	112.5
529	Y	22.7	Very low	24.5	Very low	213 Å²	213	135.8 Å²	135.8	84%	0.835	76%	0.76	S	S	*	*			trans	70.8	61.8	169.5	-60.2	-73.5	0	0	0	118.8
530	F	22.3	Very low	24.4	Very low	204 Å²	204	139.4 Å²	139.4	90%	0.895	78%	0.78	S	S	*	*	P	Polyproline II helix		-92.4	130.9	129.8	-91.3	-86.9	0	0	0	109.4
531	P	26.6	Very low	24	Very low	121 Å²	121	139.9 Å²	139.9	79%	0.786	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-86.8	144.8	155.4	32.9	-29	0	0	0	110.6
532	Q	22.7	Very low	23.9	Very low	171 Å²	171	141.8 Å²	141.8	80%	0.799	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-103.6	143.9	-167.7	-55	154.5	-71.4	0	0	113.5
533	I	26.3	Very low	23.8	Very low	167 Å²	167	142.5 Å²	142.5	86%	0.856	79%	0.791	S	S	*	*			trans	-151.4	129.7	141.4	-58.2	-175.5	0	0	0	105.1
534	N	24.6	Very low	23.8	Very low	120 Å²	120	142.8 Å²	142.8	64%	0.642	79%	0.788	S	S	*	*			cis	-169.6	135.6	-22.2	-108.9	-10.7	0	0	0	105
535	T	23.6	Very low	23.8	Very low	121 Å²	121	144.1 Å²	144.1	74%	0.742	78%	0.781	S	S	*	*			trans	35.8	129.9	137.6	63.3	0	0	0	0	119.5
536	T	26.8	Very low	23.9	Very low	130 Å²	130	143.4 Å²	143.4	80%	0.798	78%	0.776	S	S	*	*			cis	-137.3	-173.5	35.6	48.3	0	0	0	0	110
537	V	26.6	Very low	23.7	Very low	142 Å²	142	146.3 Å²	146.3	86%	0.861	78%	0.778	S	S	*	*			cis	-134.8	173.4	16.7	-173	0	0	0	0	109.8
538	A	24	Very low	24	Very low	76 Å²	76	144.6 Å²	144.6	63%	0.628	78%	0.775	S	S	*	*			trans	-102.8	153.4	-170.1	0	0	0	0	0	115.9
539	N	22.3	Very low	24.1	Very low	147 Å²	147	147.8 Å²	147.8	79%	0.786	79%	0.785	S	S	*	*			trans	53	120.4	143.7	-58.6	-12.8	0	0	0	121.5
540	T	26.3	Very low	24.1	Very low	150 Å²	150	148.7 Å²	148.7	92%	0.92	79%	0.787	S	S	*	*				-159.7	160.3	110.7	7.4	0	0	0	0	112.1
541	L	21.1	Very low	24.4	Very low	151 Å²	151	146.4 Å²	146.4	79%	0.791	78%	0.782	S	S	*	*			trans	-93.5	152.4	-175.4	-98.5	74.1	0	0	0	113.3
542	T	23.8	Very low	24.3	Very low	119 Å²	119	147.3 Å²	147.3	73%	0.73	78%	0.78	S	S	*	*			trans	57.8	110	152	55.2	0	0	0	0	119.4
543	K	23.1	Very low	24.4	Very low	188 Å²	188	147.3 Å²	147.3	82%	0.817	79%	0.785	S	S	*	*				-176.6	130.9	112	-99.2	159.1	-175.2	173.6	0	114.5
544	T	22.8	Very low	24.3	Very low	124 Å²	124	145.5 Å²	145.5	76%	0.761	78%	0.781	S	S	*	*			trans	67.1	155.7	146.1	58.4	0	0	0	0	122
545	K	23.7	Very low	24.4	Very low	131 Å²	131	144.9 Å²	144.9	57%	0.57	79%	0.787	S	S	*	*			trans	75.8	96.6	164.2	-62.5	-178.8	-170.5	175	0	120.1	D444	D444-K545 IonicContact OD1-NZ 2.72Å; D444-K545 PolarHBondContact OD1-NZ 2.95Å; D444-K545 WeakPolarHBondContact OD2-CD 3.48Å; D444-K545 IonicContact OD2-NZ 3.71Å; D444-K545 PolarHBondContact OD2-NZ 2.98Å
546	T	23.6	Very low	24.4	Very low	123 Å²	123	146.8 Å²	146.8	76%	0.755	79%	0.792	S	S	*	*				39	110.7	126.6	55.6	0	0	0	0	120.6
547	F	22.8	Very low	24.3	Very low	196 Å²	196	149 Å²	149	86%	0.86	79%	0.793	S	S	*	*			trans	-137	104.9	135.6	-119.3	-88.3	0	0	0	109.3
548	N	26.1	Very low	24.1	Very low	151 Å²	151	147.5 Å²	147.5	81%	0.807	79%	0.789	S	S	*	*			trans	-92.7	136.5	175.2	-103	-20	0	0	0	109.5	R550	N548-R550 PolarHBondContact O-N 3.13Å
549	N	25.3	Very low	24.1	Very low	159 Å²	159	150.7 Å²	150.7	85%	0.85	81%	0.805	S	S	*	*			trans	-64	93.8	-178.7	-76.4	-31	0	0	0	112.6	I551	N549-I551 PolarHBondContact O-N 3.36Å
550	R	21.8	Very low	24.1	Very low	232 Å²	232	149 Å²	149	88%	0.875	81%	0.805	S	S	*	*			trans	-89.1	84.9	159.7	-80.6	-175.6	169.2	175.7	-2.4	109.6	N548	N548-R550 PolarHBondContact O-N 3.13Å
551	I	29.4	Very low	23.9	Very low	155 Å²	155	147.9 Å²	147.9	80%	0.795	80%	0.798	S	S	*	*			trans	-82.8	116.7	161.4	-66.4	-178.7	0	0	0	107.4	N549	N549-I551 PolarHBondContact O-N 3.36Å
552	L	23.4	Very low	24.1	Very low	140 Å²	140	152.7 Å²	152.7	73%	0.733	81%	0.806	S	S	*	*			trans	-70.2	136.2	-179.4	-56.8	91.5	0	0	0	110.4
553	L	25.1	Very low	24	Very low	172 Å²	172	154 Å²	154	90%	0.901	81%	0.807	S	S	*	*			trans	-172.3	68.4	149.9	-107.2	169.2	0	0	0	111.1
554	T	24.7	Very low	24	Very low	128 Å²	128	151.8 Å²	151.8	79%	0.785	80%	0.804	S	S	*	*			trans	-127.2	139.2	168.4	49.1	0	0	0	0	110.4	N556	T554-N556 PolarHBondContact O-N 3.01Å
555	S	25.7	Very low	24.2	Very low	108 Å²	108	153.5 Å²	153.5	76%	0.755	81%	0.809	S	S	*	*			trans	-58.9	126.2	172.2	44.8	0	0	0	0	111.4	E557	S555-E557 PolarHBondContact O-N 2.83Å
556	N	23.8	Very low	24.1	Very low	160 Å²	160	152.9 Å²	152.9	86%	0.856	82%	0.816	S	S	*	*	S	Bend	trans	-73	90.9	166.7	-88.5	-1.7	0	0	0	109.9	T554	T554-N556 PolarHBondContact O-N 3.01Å
557	E	24.6	Very low	24.2	Very low	177 Å²	177	152.9 Å²	152.9	83%	0.827	81%	0.811	S	S	*	*	S	Bend	trans	-160	117.3	144.8	-113.4	161.1	-139.8	0	0	111.1	S555	S555-E557 PolarHBondContact O-N 2.83Å
558	S	23	Very low	24.2	Very low	111 Å²	111	151.2 Å²	151.2	78%	0.776	80%	0.804	S	S	*	*			trans	31.5	94.3	164.1	58.5	0	0	0	0	120.2
559	C	23.9	Very low	24.2	Very low	142 Å²	142	151.3 Å²	151.3	96%	0.959	80%	0.804	S	S	*	*			trans	-160.4	99.9	134.1	-105.2	0	0	0	0	112.6
560	S	21.4	Very low	24.1	Very low	111 Å²	111	150.1 Å²	150.1	78%	0.776	80%	0.798	S	S	*	*			trans	-114.8	92.6	169.5	44.7	0	0	0	0	110.4
561	T	22.7	Very low	24.2	Very low	128 Å²	128	148.7 Å²	148.7	79%	0.785	80%	0.798	S	S	*	*			trans	-179.6	102.6	152.5	14.9	0	0	0	0	111.4
562	W	25.1	Very low	24	Very low	252 Å²	252	146.8 Å²	146.8	96%	0.955	80%	0.798	S	S	*	*				-178.4	155.4	114.6	-84.1	-12.7	0	0	0	110.1
563	I	22.9	Very low	24.1	Very low	147 Å²	147	146.7 Å²	146.7	75%	0.754	80%	0.804	S	S	*	*			trans	-139.9	139.5	-169.8	-79.1	177.4	0	0	0	107.7
564	N	22.9	Very low	24.1	Very low	140 Å²	140	148.4 Å²	148.4	75%	0.749	80%	0.804	S	S	*	*			trans	63.9	134.3	179.5	-56.7	-13	0	0	0	113.5
565	D	25.3	Very low	24.3	Very low	161 Å²	161	150.8 Å²	150.8	86%	0.861	80%	0.803	S	S	*	*				-132.6	169.8	58.1	-92.3	-34.1	0	0	0	115.6
566	T	22.8	Very low	24.6	Very low	118 Å²	118	150.6 Å²	150.6	72%	0.724	80%	0.798	S	S	*	*			trans	-100.8	138.3	-179.5	54.9	0	0	0	0	111.6
567	D	25.5	Very low	24.9	Very low	123 Å²	123	147.7 Å²	147.7	66%	0.658	78%	0.782	S	S	*	*				-168.9	176.2	99.4	-133.6	-20.6	0	0	0	115
568	K	23.3	Very low	25.2	Very low	160 Å²	160	145 Å²	145	70%	0.696	77%	0.774	S	S	*	*			trans	-55.7	145.6	-176.8	-41.9	113	-171.2	134.6	0	114.2
569	D	26	Very low	25.7	Very low	153 Å²	153	144 Å²	144	82%	0.818	76%	0.756	S	S	*	*				-166.1	175.4	91.5	-132	-34.2	0	0	0	114.7
570	N	22.9	Very low	26.3	Very low	135 Å²	135	141.6 Å²	141.6	72%	0.722	73%	0.732	S	S	*	*			trans	-99	167.3	-161.8	-71.5	-88.8	0	0	0	116.7
571	K	23.9	Very low	26.9	Very low	202 Å²	202	141.1 Å²	141.1	88%	0.878	72%	0.721	S	S	*	*			trans	86	90.7	158.1	-52.3	171.4	-174.3	169.5	0	119.1
572	S	25.5	Very low	27.4	Very low	114 Å²	114	138.2 Å²	138.2	80%	0.797	71%	0.706	S	S	*	*				-175.7	93.2	124.6	58.4	0	0	0	0	114
573	V	25.5	Very low	27.9	Very low	139 Å²	139	129.8 Å²	129.8	84%	0.842	68%	0.676	S	S	*	*			trans	-129.8	52.1	170.2	-165.9	0	0	0	0	111.2
574	F	25.5	Very low	28.6	Very low	207 Å²	207	125.6 Å²	125.6	91%	0.908	65%	0.653	S	S	*	*			trans	-155.3	86.5	167.8	-85.3	-69.2	0	0	0	109.1
575	K	27.8	Very low	29.4	Very low	178 Å²	178	126.5 Å²	126.5	77%	0.774	65%	0.651	S	S	*	*			trans	-165.8	7.2	174.6	-119.9	165.8	-171.6	175.5	0	116.8
576	T	32.3	Very low	30	Very low	104 Å²	104	123.8 Å²	123.8	64%	0.638	63%	0.633	S	S	*	*	H	α-helix	trans	-79.8	-39.2	-174.3	43.5	0	0	0	0	113.8
577	N	29.6	Very low	30.9	Very low	99 Å²	99	121 Å²	121	53%	0.529	62%	0.615	S	S	.	*	H	α-helix	trans	-77.7	-37.9	-167.5	-64.8	8.6	0	0	0	112.6	F579 I580	N577-F579 VanDerWaalsContact C-N 3.26Å; N577-F579 PolarHBondContact O-N 3.19Å; N577-I580 PolarHBondContact O-N 3.01Å
578	D	31.7	Very low	31.4	Very low	121 Å²	121	118.6 Å²	118.6	65%	0.647	60%	0.599	S	S	*	*	H	α-helix	trans	-62.4	-33.2	178.6	-62.5	-48.4	0	0	0	112.9	I580 N581 S582	D578-I580 VanDerWaalsContact C-N 3.34Å; D578-I580 PolarHBondContact O-N 2.93Å; D578-N581 PolarHBondContact O-N 2.94Å; D578-S582 WeakPolarHBondContact O-CB 3.29Å; D578-S582 PolarHBondContact O-N 3.44Å
579	F	34	Very low	32	Very low	91 Å²	91	117.6 Å²	117.6	40%	0.399	59%	0.594	S	S	.	*	H	α-helix	trans	-66	-36.3	-179.8	-167.4	-85.9	0	0	0	112	R402 N577 S582 F583	R402-F579 VanDerWaalsContact NH2-CE1 3.34Å; N577-F579 VanDerWaalsContact C-N 3.26Å; N577-F579 PolarHBondContact O-N 3.19Å; F579-S582 PolarHBondContact O-N 2.82Å; F579-F583 HydrophobicContact CD1-CB 4.48Å; F579-F583 HydrophobicContact CE1-CB 4.36Å; F579-F583 HydrophobicContact CE1-CD2 4.01Å; F579-F583 VanDerWaalsContact O-CB 3.3Å; F579-F583 WeakPolarHBondContact O-CB 3.46Å; F579-F583 PolarHBondContact O-N 2.92Å
580	I	35.7	Very low	32.3	Very low	91 Å²	91	116.5 Å²	116.5	47%	0.467	59%	0.585	S	S	.	*	H	α-helix	trans	-65.6	-44.3	179	-61.8	177	0	0	0	110.2	N577 D578 S582 F583 Q584	N577-I580 PolarHBondContact O-N 3.01Å; D578-I580 VanDerWaalsContact C-N 3.34Å; D578-I580 PolarHBondContact O-N 2.93Å; I580-S582 VanDerWaalsContact C-N 3.34Å; I580-S582 PolarHBondContact O-N 2.88Å; I580-F583 PolarHBondContact O-N 3.35Å; I580-Q584 PolarHBondContact O-N 2.94Å
581	N	33.6	Very low	32.9	Very low	101 Å²	101	117 Å²	117	54%	0.54	58%	0.582	S	S	.	*	H	α-helix	trans	-65	-37	175.5	-70.8	-27.2	0	0	0	112.3	D578 K585	D578-N581 PolarHBondContact O-N 2.94Å; N581-K585 PolarHBondContact O-N 2.71Å; N581-K585 VanDerWaalsContact O-N 3.16Å
582	S	33.7	Very low	33.3	Very low	66 Å²	66	114.7 Å²	114.7	46%	0.462	58%	0.575	S	S	.	*	H	α-helix	trans	-65.9	-42.4	172.8	-170.6	0	0	0	0	112	D578 F579 I580 K585 Q586	D578-S582 WeakPolarHBondContact O-CB 3.29Å; D578-S582 PolarHBondContact O-N 3.44Å; F579-S582 PolarHBondContact O-N 2.82Å; I580-S582 VanDerWaalsContact C-N 3.34Å; I580-S582 PolarHBondContact O-N 2.88Å; S582-K585 CarbonylContact O-C 3.58Å; S582-K585 WeakPolarHBondContact O-CB 3.39Å; S582-K585 PolarHBondContact O-N 3.5Å; S582-Q586 WeakPolarHBondContact O-CB 3.15Å; S582-Q586 PolarHBondContact O-N 3.37Å
583	F	36.1	Very low	33.6	Very low	75 Å²	75	116.6 Å²	116.6	33%	0.329	57%	0.571	S	S	.	*	H	α-helix	trans	-65.6	-42.8	179.5	-167	-93.2	0	0	0	111.7	F579 I580 K585 Q586 V587	F579-F583 HydrophobicContact CD1-CB 4.48Å; F579-F583 HydrophobicContact CE1-CB 4.36Å; F579-F583 HydrophobicContact CE1-CD2 4.01Å; F579-F583 VanDerWaalsContact O-CB 3.3Å; F579-F583 WeakPolarHBondContact O-CB 3.46Å; F579-F583 PolarHBondContact O-N 2.92Å; I580-F583 PolarHBondContact O-N 3.35Å; F583-K585 VanDerWaalsContact C-N 3.33Å; F583-K585 PolarHBondContact O-N 2.9Å; F583-Q586 WeakPolarHBondContact O-CA 3.28Å; F583-Q586 WeakPolarHBondContact O-CB 3.46Å; F583-Q586 PolarHBondContact O-N 3.31Å; F583-V587 HydrophobicContact CD1-CG2 4.08Å; F583-V587 HydrophobicContact CE1-CG2 3.88Å; F583-V587 PolarHBondContact O-N 3.47Å
584	Q	37.5	Very low	33.7	Very low	60 Å²	60	117.4 Å²	117.4	28%	0.28	57%	0.571	S	S	.	*	H	α-helix	trans	-60.9	-39.4	172.3	-72.1	-173.2	0.2	0	0	112.4	I580 Q586 K588	I580-Q584 PolarHBondContact O-N 2.94Å; Q584-Q586 VanDerWaalsContact C-N 3.3Å; Q584-Q586 PolarHBondContact O-N 2.86Å; Q584-K588 WeakPolarHBondContact O-CB 3.45Å; Q584-K588 WeakPolarHBondContact O-CG 3.27Å; Q584-K588 PolarHBondContact O-N 2.69Å
585	K	38.8	Very low	33.7	Very low	159 Å²	159	110.1 Å²	110.1	69%	0.691	55%	0.554	S	S	*	*	H	α-helix	trans	-64.3	-32.7	170.5	-83.7	-179.5	175	175	0	112.5	N581 S582 F583 K589	N581-K585 PolarHBondContact O-N 2.71Å; N581-K585 VanDerWaalsContact O-N 3.16Å; S582-K585 CarbonylContact O-C 3.58Å; S582-K585 WeakPolarHBondContact O-CB 3.39Å; S582-K585 PolarHBondContact O-N 3.5Å; F583-K585 VanDerWaalsContact C-N 3.33Å; F583-K585 PolarHBondContact O-N 2.9Å; K585-K589 WeakPolarHBondContact O-CB 3.37Å; K585-K589 WeakPolarHBondContact O-CG 3.29Å; K585-K589 PolarHBondContact O-N 2.94Å
586	Q	39.1	Very low	33.6	Very low	104 Å²	104	112 Å²	112	49%	0.486	56%	0.562	S	S	.	*	H	α-helix	trans	-75	-40	179.9	-146.5	169.2	13.4	0	0	112.3	S582 F583 Q584 K589 Q590	S582-Q586 WeakPolarHBondContact O-CB 3.15Å; S582-Q586 PolarHBondContact O-N 3.37Å; F583-Q586 WeakPolarHBondContact O-CA 3.28Å; F583-Q586 WeakPolarHBondContact O-CB 3.46Å; F583-Q586 PolarHBondContact O-N 3.31Å; Q584-Q586 VanDerWaalsContact C-N 3.3Å; Q584-Q586 PolarHBondContact O-N 2.86Å; Q586-K589 PolarHBondContact O-N 3.21Å; Q586-Q590 PolarHBondContact O-N 3.05Å
587	V	41.4	Very low	33.3	Very low	58 Å²	58	113.5 Å²	113.5	35%	0.352	57%	0.565	S	S	.	*	H	α-helix	trans	-64.3	-46.5	172	175	0	0	0	0	110.8	F583 K589 Q590 Q591	F583-V587 HydrophobicContact CD1-CG2 4.08Å; F583-V587 HydrophobicContact CE1-CG2 3.88Å; F583-V587 PolarHBondContact O-N 3.47Å; V587-K589 VanDerWaalsContact C-N 3.31Å; V587-K589 PolarHBondContact O-N 3.3Å; V587-Q590 PolarHBondContact O-N 3.03Å; V587-Q591 PolarHBondContact O-N 2.93Å
588	K	36	Very low	33.3	Very low	74 Å²	74	117 Å²	117	32%	0.322	58%	0.578	S	S	.	*	H	α-helix	trans	-59.4	-40.4	173.7	-74.2	173.8	178.6	171.1	0	111.6	Q584 Q591 Q592 S651	Q584-K588 WeakPolarHBondContact O-CB 3.45Å; Q584-K588 WeakPolarHBondContact O-CG 3.27Å; Q584-K588 PolarHBondContact O-N 2.69Å; K588-Q591 PolarHBondContact O-N 2.94Å; K588-Q592 WeakPolarHBondContact O-CB 3.39Å; K588-Q592 WeakPolarHBondContact O-CG 3.49Å; K588-Q592 PolarHBondContact O-N 2.85Å; K588-S651 PolarHBondContact NZ-O 2.8Å; K588-S651 PolarHBondContact NZ-OG 2.94Å
589	K	35.3	Very low	32.9	Very low	138 Å²	138	116.5 Å²	116.5	60%	0.6	58%	0.576	S	S	*	*	H	α-helix	trans	-64.1	-39.7	173.5	-83.4	-174.4	173.7	-170.8	0	113.6	K585 Q586 V587 Q591 Q592 Q593	K585-K589 WeakPolarHBondContact O-CB 3.37Å; K585-K589 WeakPolarHBondContact O-CG 3.29Å; K585-K589 PolarHBondContact O-N 2.94Å; Q586-K589 PolarHBondContact O-N 3.21Å; V587-K589 VanDerWaalsContact C-N 3.31Å; V587-K589 PolarHBondContact O-N 3.3Å; K589-Q591 VanDerWaalsContact C-N 3.34Å; K589-Q592 CarbonylContact O-C 3.59Å; K589-Q592 PolarHBondContact O-N 3.28Å; K589-Q593 WeakPolarHBondContact O-CB 3.32Å; K589-Q593 VanDerWaalsContact O-CG 3.31Å; K589-Q593 WeakPolarHBondContact O-CG 3.37Å; K589-Q593 PolarHBondContact O-N 2.92Å
590	Q	33.2	Very low	32.5	Very low	131 Å²	131	118.4 Å²	118.4	61%	0.612	59%	0.59	S	S	*	*	H	α-helix	trans	-69.2	-32.2	176.4	-74.3	-176.2	-0.4	0	0	112.5	Q586 V587	Q586-Q590 PolarHBondContact O-N 3.05Å; V587-Q590 PolarHBondContact O-N 3.03Å
591	Q	33.9	Very low	32	Very low	144 Å²	144	119.6 Å²	119.6	67%	0.673	61%	0.607	S	S	*	*	H	α-helix	trans	-73.4	-31.6	172.3	-70.1	176.4	-14.8	0	0	112.5	V587 K588 K589	V587-Q591 PolarHBondContact O-N 2.93Å; K588-Q591 PolarHBondContact O-N 2.94Å; K589-Q591 VanDerWaalsContact C-N 3.34Å
592	Q	32.5	Very low	31.5	Very low	155 Å²	155	120.1 Å²	120.1	72%	0.724	61%	0.613	S	S	*	*	H	α-helix	trans	-86.5	-12.6	176.7	-71.1	177.2	-29.8	0	0	114.6	K588 K589 N594	K588-Q592 WeakPolarHBondContact O-CB 3.39Å; K588-Q592 WeakPolarHBondContact O-CG 3.49Å; K588-Q592 PolarHBondContact O-N 2.85Å; K589-Q592 CarbonylContact O-C 3.59Å; K589-Q592 PolarHBondContact O-N 3.28Å; Q592-N594 VanDerWaalsContact C-N 3.35Å
593	Q	31.5	Very low	31.1	Very low	154 Å²	154	124.8 Å²	124.8	72%	0.72	63%	0.631	S	S	*	*	S	Bend	trans	-83.5	-7.5	173.8	-81.5	-177.7	-38.1	0	0	113.9	K589 G595	K589-Q593 WeakPolarHBondContact O-CB 3.32Å; K589-Q593 VanDerWaalsContact O-CG 3.31Å; K589-Q593 WeakPolarHBondContact O-CG 3.37Å; K589-Q593 PolarHBondContact O-N 2.92Å; Q593-G595 PolarHBondContact O-N 3.06Å
594	N	28.2	Very low	30.4	Very low	155 Å²	155	125.9 Å²	125.9	83%	0.829	64%	0.644	S	S	*	*	S	Bend	trans	-89.7	43.2	165.3	-76.1	-12.7	0	0	0	111.6	Q592	Q592-N594 VanDerWaalsContact C-N 3.35Å
595	G	25.6	Very low	29.8	Very low	54 Å²	54	129.1 Å²	129.1	56%	0.557	67%	0.668	S	S	*	*			trans	-102.5	107.3	173.3	0	0	0	0	0	111.4	Q593	Q593-G595 PolarHBondContact O-N 3.06Å
596	F	25.6	Very low	29	Very low	217 Å²	217	128 Å²	128	95%	0.952	67%	0.669	S	S	*	*			trans	-108.7	116.8	153.2	-110	-77.5	0	0	0	108.1
597	I	26.2	Very low	28.4	Very low	136 Å²	136	131.7 Å²	131.7	70%	0.697	69%	0.686	S	S	*	*			trans	-98.5	134.7	-177.9	-62.3	165.8	0	0	0	107.9
598	Q	29.4	Very low	27.4	Very low	172 Å²	172	134.1 Å²	134.1	80%	0.804	71%	0.706	S	S	*	*			trans	-179.9	118	134.1	-97.6	171.1	-19.2	0	0	107.3
599	D	24.4	Very low	27	Very low	112 Å²	112	138.2 Å²	138.2	60%	0.599	73%	0.73	S	S	*	*				79.3	142.5	73.4	-71.7	15.6	0	0	0	111.3
600	N	24.1	Very low	26.4	Very low	131 Å²	131	139.5 Å²	139.5	70%	0.701	74%	0.738	S	S	*	*			cis	-163.3	145.5	-13	-115.8	-42.3	0	0	0	108
601	S	26.4	Very low	26.1	Very low	116 Å²	116	139.3 Å²	139.3	81%	0.811	74%	0.741	S	S	*	*			trans	-159	107.4	157.3	63.9	0	0	0	0	112
602	V	22.7	Very low	25.7	Very low	112 Å²	112	141.3 Å²	141.3	68%	0.679	75%	0.747	S	S	*	*			trans	-74.6	138	173.2	172.8	0	0	0	0	110.2	T604	V602-T604 WeakPolarHBondContact CG1-OG1 3.41Å
603	I	25.2	Very low	25.2	Very low	163 Å²	163	141.7 Å²	141.7	84%	0.836	75%	0.753	S	S	*	*			trans	-124.3	111.3	148.3	-63.7	-177	0	0	0	107.5
604	T	22.1	Very low	25.1	Very low	98 Å²	98	139.3 Å²	139.3	60%	0.601	75%	0.752	S	S	*	*			trans	-90	128.8	174.4	-55.2	0	0	0	0	109.4	V602	V602-T604 WeakPolarHBondContact CG1-OG1 3.41Å
605	V	24.6	Very low	24.9	Very low	128 Å²	128	136.4 Å²	136.4	78%	0.776	74%	0.743	S	S	*	*			trans	-131.5	93.5	155.8	-175.1	0	0	0	0	108.1
606	N	21.7	Very low	24.7	Very low	135 Å²	135	140.5 Å²	140.5	72%	0.722	75%	0.752	S	S	*	*			trans	-80.5	135.5	160	-78.2	-21.1	0	0	0	108
607	H	26.7	Very low	24.9	Very low	182 Å²	182	136.9 Å²	136.9	84%	0.843	75%	0.748	S	S	*	*			trans	-150.5	104.9	141.4	-108.9	-68	0	0	0	110.9
608	S	20.8	Very low	24.7	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	75%	0.751	S	S	*	*			trans	-86	128.8	169.3	52.8	0	0	0	0	110.2
609	I	27.5	Very low	24.6	Very low	161 Å²	161	134.3 Å²	134.3	83%	0.826	75%	0.75	S	S	*	*			trans	-130.8	128.3	158.7	-64.7	-176	0	0	0	108.3
610	Q	22.9	Very low	24.8	Very low	164 Å²	164	134.6 Å²	134.6	77%	0.766	76%	0.758	S	S	*	*			trans	-86.6	149.1	173	-59.7	162.8	-35.3	0	0	109.4
611	N	25.8	Very low	24.7	Very low	127 Å²	127	133.6 Å²	133.6	68%	0.679	76%	0.762	S	S	*	*				172.4	138.6	114.2	-95.6	-70.3	0	0	0	114.3
612	K	25.7	Very low	24.7	Very low	187 Å²	187	134.5 Å²	134.5	81%	0.813	76%	0.762	S	S	*	*			trans	55.6	108.1	138.3	-65.5	174.6	-176.5	-178.3	0	121.6
613	L	23	Very low	25	Very low	162 Å²	162	135 Å²	135	85%	0.848	77%	0.768	S	S	*	*				-65.2	168.7	127.4	-119.3	77.4	0	0	0	109.8
614	P	29.2	Very low	24.9	Very low	105 Å²	105	132 Å²	132	68%	0.682	76%	0.762	S	S	*	*			cis	-150.5	176.9	46.1	40	-18.4	0	0	0	118.7
615	S	23.3	Very low	25	Very low	94 Å²	94	133.8 Å²	133.8	66%	0.657	77%	0.767	S	S	*	*			trans	62.2	154	145.1	59	0	0	0	0	120.5
616	N	22.1	Very low	25	Very low	140 Å²	140	132.8 Å²	132.8	75%	0.749	76%	0.761	S	S	*	*			cis	-164.5	152.5	-12.7	-107.7	17	0	0	0	107.9
617	T	28.3	Very low	25.1	Very low	140 Å²	140	138 Å²	138	86%	0.859	77%	0.771	S	S	*	*			trans	-161.3	132.4	142.4	40.6	0	0	0	0	110.6
618	D	23.5	Very low	24.9	Very low	143 Å²	143	135 Å²	135	77%	0.765	77%	0.766	S	S	*	*			trans	-69.7	175.4	169.2	-50.4	-91.3	0	0	0	110.8
619	S	27.3	Very low	25	Very low	112 Å²	112	139.7 Å²	139.7	78%	0.783	77%	0.773	S	S	*	*			cis	-165.6	173.6	39.8	53.9	0	0	0	0	113.2
620	P	28.2	Very low	24.8	Very low	117 Å²	117	140.8 Å²	140.8	76%	0.76	77%	0.772	S	S	*	*			trans	-112.8	-165.2	-161.2	43.3	-35.7	0	0	0	116.6
621	S	22.6	Very low	24.7	Very low	111 Å²	111	144.7 Å²	144.7	78%	0.776	78%	0.78	S	S	*	*			trans	87.2	145.3	177.3	76	0	0	0	0	116.2
622	T	26	Very low	24.8	Very low	135 Å²	135	144.4 Å²	144.4	83%	0.828	78%	0.783	S	S	*	*			cis	-153.2	168.6	-0.9	-0.1	0	0	0	0	110.3
623	P	29	Very low	24.7	Very low	122 Å²	122	141.3 Å²	141.3	79%	0.792	78%	0.784	S	S	*	*			trans	-111.8	164.1	-161	41.7	-35.3	0	0	0	117.9
624	S	22.5	Very low	24.9	Very low	101 Å²	101	137.2 Å²	137.2	71%	0.706	78%	0.781	S	S	*	*			trans	-174.7	144.4	166.3	172.4	0	0	0	0	107.8
625	D	25.4	Very low	24.8	Very low	135 Å²	135	138.2 Å²	138.2	72%	0.722	79%	0.79	S	S	*	*			cis	-163.3	146.9	-14.1	-105.8	-48.6	0	0	0	111.2
626	T	23.3	Very low	24.9	Very low	106 Å²	106	142.7 Å²	142.7	65%	0.65	80%	0.798	S	S	*	*			trans	53.1	144.3	156.2	-14	0	0	0	0	118.5
627	W	24.4	Very low	25.1	Very low	244 Å²	244	143.6 Å²	143.6	92%	0.924	80%	0.803	S	S	*	*			cis	-131.6	166	23.1	-77	63	0	0	0	113.1
628	T	21.1	Very low	24.8	Very low	120 Å²	120	142.5 Å²	142.5	74%	0.736	80%	0.801	S	S	*	*			trans	-108.3	158.5	-170.6	64.2	0	0	0	0	113.3
629	F	23.2	Very low	24.9	Very low	207 Å²	207	143.4 Å²	143.4	91%	0.908	80%	0.804	S	S	*	*				-139.7	145.4	129.5	-124.2	-84.1	0	0	0	111.2
630	K	23.6	Very low	24.6	Very low	184 Å²	184	143.5 Å²	143.5	80%	0.8	81%	0.805	S	S	*	*			trans	-70	135.7	-167.2	-66.9	173	178.4	172.9	0	112.8
631	R	22	Very low	24.3	Very low	247 Å²	247	142.6 Å²	142.6	93%	0.932	80%	0.801	S	S	*	*			trans	-129	114.5	141.9	-163.4	176.9	-67.3	-163.4	0.7	107.6
632	T	27.1	Very low	24.3	Very low	121 Å²	121	144.6 Å²	144.6	74%	0.742	80%	0.803	S	S	*	*			trans	-72.5	140.2	-172.3	41.1	0	0	0	0	112.1
633	S	23.9	Very low	24.3	Very low	122 Å²	122	145.3 Å²	145.3	85%	0.853	80%	0.801	S	S	*	*			trans	-63	152.3	167	40.4	0	0	0	0	111.4
634	G	26.3	Very low	23.9	Very low	75 Å²	75	145.5 Å²	145.5	77%	0.773	81%	0.806	S	S	*	*			cis	146.1	-174.7	-5.5	0	0	0	0	0	111.7
635	S	27.6	Very low	23.9	Very low	126 Å²	126	144.7 Å²	144.7	88%	0.881	80%	0.8	S	S	*	*			trans	-150.9	155	155.6	-167.2	0	0	0	0	110.2
636	K	25	Very low	23.8	Very low	189 Å²	189	145.9 Å²	145.9	82%	0.822	81%	0.806	S	S	*	*			trans	-94.1	137	178.2	-60.6	173.1	-177.1	175.5	0	108.9
637	N	26.2	Very low	23.7	Very low	158 Å²	158	150 Å²	150	85%	0.845	82%	0.817	S	S	*	*				-172.2	110	129.7	-94.9	-13.6	0	0	0	110.4
638	S	21.9	Very low	23.7	Very low	117 Å²	117	145.1 Å²	145.1	82%	0.818	81%	0.809	S	S	*	*			trans	-91.2	108.3	174.2	50.2	0	0	0	0	110
639	I	26.1	Very low	24	Very low	162 Å²	162	145 Å²	145	83%	0.831	81%	0.808	S	S	*	*			trans	-130	85	163.8	-53.5	-179	0	0	0	108.9
640	S	20.9	Very low	24.1	Very low	115 Å²	115	142.8 Å²	142.8	80%	0.804	81%	0.806	S	S	*	*			trans	-97.5	142.3	140.7	51.9	0	0	0	0	106.2
641	S	22.1	Very low	24.2	Very low	97 Å²	97	136.8 Å²	136.8	68%	0.678	79%	0.787	S	S	*	*			cis	-152.4	156.7	17	48.1	0	0	0	0	110.5
642	N	22.3	Very low	24.5	Very low	154 Å²	154	131.7 Å²	131.7	82%	0.824	78%	0.778	S	S	*	*			trans	157	92	148.8	-84.6	-26	0	0	0	111.6
643	L	25.3	Very low	24.7	Very low	149 Å²	149	129.1 Å²	129.1	78%	0.78	77%	0.765	S	S	*	*			trans	-156.5	72.1	148.9	-153.5	72.9	0	0	0	112.2	S645	L643-S645 PolarHBondContact O-N 3.15Å
644	S	20.9	Very low	25.2	Very low	127 Å²	127	127.7 Å²	127.7	89%	0.888	76%	0.755	S	S	*	*			trans	-77.9	60.2	173.9	59.7	0	0	0	0	112.1
645	S	23	Very low	25.9	Very low	84 Å²	84	130.1 Å²	130.1	59%	0.587	74%	0.742	S	S	*	*			trans	-167.3	74.6	176.2	46.1	0	0	0	0	113.6	L643	L643-S645 PolarHBondContact O-N 3.15Å
646	L	23.2	Very low	27	Very low	160 Å²	160	128 Å²	128	84%	0.838	72%	0.723	S	S	*	*			trans	-150.2	56.2	162.5	-146.4	75.4	0	0	0	113.6	N648	L646-N648 VanDerWaalsContact C-N 3.26Å; L646-N648 PolarHBondContact O-N 2.89Å
647	E	21.9	Very low	28.7	Very low	191 Å²	191	120.1 Å²	120.1	89%	0.893	69%	0.69	S	S	*	*			trans	-70	79	165.5	-68.3	-169.9	130.2	0	0	111.1
648	N	23.6	Very low	30.8	Very low	142 Å²	142	119.6 Å²	119.6	76%	0.759	68%	0.68	S	S	*	*			trans	-165.5	156.8	152.7	-120.3	-72.2	0	0	0	116.2	L646 N650	L646-N648 VanDerWaalsContact C-N 3.26Å; L646-N648 PolarHBondContact O-N 2.89Å; N648-N650 PolarHBondContact O-N 2.84Å
649	V	27.4	Very low	33.8	Very low	117 Å²	117	114 Å²	114	71%	0.709	64%	0.641	S	S	*	*			trans	55.4	42.9	169.6	-148.6	0	0	0	0	118	S651	V649-S651 PolarHBondContact O-N 3.3Å
650	N	25.6	Very low	36.7	Very low	162 Å²	162	107.3 Å²	107.3	87%	0.866	61%	0.608	S	S	*	*			trans	-88.1	88.4	155.9	-153.5	-2.5	0	0	0	109.8	N648	N648-N650 PolarHBondContact O-N 2.84Å
651	S	25.8	Very low	40.1	Very low	57 Å²	57	103.1 Å²	103.1	40%	0.399	58%	0.575	S	S	.	*			trans	-141.7	30.4	-177.2	74.9	0	0	0	0	114.7	K588 V649	K588-S651 PolarHBondContact NZ-O 2.8Å; K588-S651 PolarHBondContact NZ-OG 2.94Å; V649-S651 PolarHBondContact O-N 3.3Å
652	N	28.7	Very low	43.5	Very low	140 Å²	140	98.5 Å²	98.5	75%	0.749	54%	0.543	S	S	*	.			trans	-80.6	128.5	165.8	-72.2	-10	0	0	0	109.1
653	S	31.6	Very low	46.8	Very low	67 Å²	67	91.8 Å²	91.8	47%	0.469	51%	0.507	S	S	.	.			trans	-71.9	133.1	-175.9	48.7	0	0	0	0	112.4	Y655	S653-Y655 WeakPolarHBondContact O-CD2 3.46Å; S653-Y655 PolarHBondContact O-N 2.82Å; S653-Y655 VanDerWaalsContact O-N 3.15Å
654	S	33.3	Very low	50.1	Low	92 Å²	92	84.8 Å²	84.8	64%	0.643	47%	0.47	S	S	*	.			trans	-61.1	113.2	165.1	-50.6	0	0	0	0	109.9	T656	S654-T656 PolarHBondContact O-N 2.87Å
655	Y	41.4	Very low	53.5	Low	127 Å²	127	82.1 Å²	82.1	50%	0.498	44%	0.442	S	S	.	.			trans	-78.6	53.2	176.6	-69.7	-78	0	0	0	112.2	S653 H657	S653-Y655 WeakPolarHBondContact O-CD2 3.46Å; S653-Y655 PolarHBondContact O-N 2.82Å; S653-Y655 VanDerWaalsContact O-N 3.15Å; Y655-H657 VanDerWaalsContact C-N 3.33Å; Y655-H657 PolarHBondContact O-N 2.88Å
656	T	50	Low	56.7	Low	80 Å²	80	80 Å²	80	49%	0.491	43%	0.427	S	S	.	.			trans	-75.9	87.2	170.9	45.1	0	0	0	0	109.5	S654 K658	S654-T656 PolarHBondContact O-N 2.87Å; T656-K658 PolarHBondContact O-N 3.26Å
657	H	60.7	Low	60	Low	25 Å²	25	72.4 Å²	72.4	12%	0.116	39%	0.388	C	S	.	.			trans	-65.1	120.5	-179.9	-172	-77.7	0	0	0	111.1	I481 H484 L485 L509 Y655 F659	I481-H657 HydrophobicContact CG1-CB 4.07Å; I481-H657 HydrophobicContact CG2-CB 4.13Å; H484-H657 VanDerWaalsContact CA-NE2 3.34Å; H484-H657 WeakPolarHBondContact CA-NE2 3.5Å; L485-H657 PolarHBondContact O-CE1 3.41Å; L485-H657 VanDerWaalsContact O-CE1 3.26Å; L509-H657 HydrophobicContact CD2-CB 4.35Å; Y655-H657 VanDerWaalsContact C-N 3.33Å; Y655-H657 PolarHBondContact O-N 2.88Å; H657-F659 HydrophobicContact CB-CD2 4.5Å; H657-F659 HydrophobicContact CB-CE2 4.16Å; H657-F659 AromaticContact CE1-CD1 3.54Å; H657-F659 AromaticContact CE1-CE1 3.38Å; H657-F659 WeakPolarHBondContact CE1-CE1 3.24Å; H657-F659 AromaticContact CE1-CE2 3.88Å; H657-F659 AromaticContact CE1-CG 3.89Å; H657-F659 AromaticContact CE1-CZ 3.57Å; H657-F659 AromaticContact CG-CE2 3.78Å; H657-F659 AromaticContact ND1-CD1 3.58Å; H657-F659 AromaticContact ND1-CD2 3.21Å; H657-F659 WeakPolarHBondContact ND1-CD2 3.32Å; H657-F659 AromaticContact ND1-CE1 3.51Å; H657-F659 AromaticContact ND1-CE2 3.12Å; H657-F659 WeakPolarHBondContact ND1-CE2 3.45Å; H657-F659 AromaticContact ND1-CG 3.47Å; H657-F659 WeakPolarHBondContact ND1-CG 3.45Å; H657-F659 AromaticContact ND1-CZ 3.29Å; H657-F659 VanDerWaalsContact ND1-CZ 3.29Å; H657-F659 WeakPolarHBondContact ND1-CZ 3.47Å; H657-F659 PolarHBondContact O-N 2.92Å; H657-F659 VanDerWaalsContact O-N 3.16Å
658	K	71.2	Confident	63.2	Low	146 Å²	146	65.8 Å²	65.8	64%	0.635	36%	0.363	S	S	*	.			trans	-88.4	81.9	-177.4	-62.9	-176.6	-177.7	-179.3	0	110.6	T656 T660	T656-K658 PolarHBondContact O-N 3.26Å; K658-T660 PolarHBondContact O-N 3.46Å
659	F	84	Confident	66.3	Low	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.328	C	S	.	.			trans	-67.9	128.9	162	-64.1	-75.2	0	0	0	108.6	I481 L485 E486 I488 L509 H657 F681 S683	I481-F659 HydrophobicContact CG1-CE2 4.12Å; I481-F659 HydrophobicContact CG1-CZ 3.95Å; L485-F659 WeakPolarHBondContact O-CD1 3.41Å; L485-F659 WeakPolarHBondContact O-CE1 3.11Å; E486-F659 WeakPolarHBondContact O-CA 3.33Å; I488-F659 HydrophobicContact CD1-CB 4.36Å; I488-F659 HydrophobicContact CD1-CD1 3.56Å; I488-F659 HydrophobicContact CD1-CD2 3.88Å; I488-F659 HydrophobicContact CD1-CE1 3.64Å; I488-F659 HydrophobicContact CD1-CE2 3.96Å; I488-F659 HydrophobicContact CD1-CG 3.66Å; I488-F659 HydrophobicContact CD1-CZ 3.85Å; I488-F659 HydrophobicContact CG1-CD1 3.4Å; I488-F659 HydrophobicContact CG1-CE1 3.49Å; I488-F659 VanDerWaalsContact CG1-CE1 3.49Å; I488-F659 HydrophobicContact CG1-CG 4Å; I488-F659 HydrophobicContact CG1-CZ 4.18Å; L509-F659 HydrophobicContact CD2-CD2 4.3Å; L509-F659 HydrophobicContact CD2-CE2 4.06Å; H657-F659 HydrophobicContact CB-CD2 4.5Å; H657-F659 HydrophobicContact CB-CE2 4.16Å; H657-F659 AromaticContact CE1-CD1 3.54Å; H657-F659 AromaticContact CE1-CE1 3.38Å; H657-F659 WeakPolarHBondContact CE1-CE1 3.24Å; H657-F659 AromaticContact CE1-CE2 3.88Å; H657-F659 AromaticContact CE1-CG 3.89Å; H657-F659 AromaticContact CE1-CZ 3.57Å; H657-F659 AromaticContact CG-CE2 3.78Å; H657-F659 AromaticContact ND1-CD1 3.58Å; H657-F659 AromaticContact ND1-CD2 3.21Å; H657-F659 WeakPolarHBondContact ND1-CD2 3.32Å; H657-F659 AromaticContact ND1-CE1 3.51Å; H657-F659 AromaticContact ND1-CE2 3.12Å; H657-F659 WeakPolarHBondContact ND1-CE2 3.45Å; H657-F659 AromaticContact ND1-CG 3.47Å; H657-F659 WeakPolarHBondContact ND1-CG 3.45Å; H657-F659 AromaticContact ND1-CZ 3.29Å; H657-F659 VanDerWaalsContact ND1-CZ 3.29Å; H657-F659 WeakPolarHBondContact ND1-CZ 3.47Å; H657-F659 PolarHBondContact O-N 2.92Å; H657-F659 VanDerWaalsContact O-N 3.16Å; F659-F681 HydrophobicContact CB-CD1 3.89Å; F659-F681 HydrophobicContact CB-CE1 4.21Å; F659-F681 AromaticContact CD2-CD1 3.84Å; F659-F681 HydrophobicContact CD2-CD1 3.84Å; F659-F681 AromaticContact CD2-CE1 3.58Å; F659-F681 HydrophobicContact CD2-CE1 3.58Å; F659-F681 HydrophobicContact CE2-CE1 4.26Å; F659-F681 HydrophobicContact CG-CD1 4.23Å; F659-F681 HydrophobicContact CG-CE1 4.11Å; F659-S683 CarbonylContact O-C 3.58Å; F659-S683 PolarHBondContact O-OG 2.88Å
660	T	88	Confident	69.1	Low	22 Å²	22	55.9 Å²	55.9	14%	0.135	31%	0.308	C	S	.	.			trans	-112.2	-19.7	-176.4	60.7	0	0	0	0	111.9	E486 K658 K685 Q686	E486-T660 HydrophobicContact CG-CG2 4.48Å; E486-T660 PolarHBondContact O-N 3.39Å; E486-T660 WeakPolarHBondContact OE2-CG2 3.33Å; E486-T660 PolarHBondContact OE2-OG1 2.64Å; K658-T660 PolarHBondContact O-N 3.46Å; T660-K685 PolarHBondContact O-N 2.69Å; T660-Q686 PolarHBondContact O-N 2.99Å
661	H	91.7	Very high	72.1	Confident	27 Å²	27	49.2 Å²	49.2	13%	0.125	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	124.1	-176.6	-171.3	163.4	0	0	0	110.4	E486 T487 I488 I663 Q686 E688	E486-H661 PolarHBondContact O-N 3.01Å; T487-H661 WeakPolarHBondContact CA-O 3.44Å; T487-H661 HydrophobicContact CG2-CB 3.74Å; I488-H661 PolarHBondContact N-O 3.48Å; H661-I663 WeakPolarHBondContact NE2-CG1 3.47Å; H661-Q686 VanDerWaalsContact CA-O 3.29Å; H661-Q686 WeakPolarHBondContact CA-O 3.33Å; H661-Q686 HydrophobicContact CB-CB 3.9Å; H661-Q686 HydrophobicContact CB-CG 4.39Å; H661-Q686 PolarHBondContact ND1-OE1 2.88Å; H661-E688 WeakPolarHBondContact NE2-CG 3.41Å; H661-E688 IonicContact NE2-OE2 3.87Å
662	I	93	Very high	75	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	133	173.5	-52.1	-174.8	0	0	0	110.5	I488 F664 F681 I684 Q686 L687 E688	I488-I662 CarbonylContact O-C 3.57Å; I488-I662 WeakPolarHBondContact O-CA 3.34Å; I662-F664 HydrophobicContact CB-CE2 4.46Å; I662-F664 HydrophobicContact CG2-CD2 3.98Å; I662-F664 HydrophobicContact CG2-CE2 3.44Å; I662-F664 VanDerWaalsContact CG2-CE2 3.44Å; I662-F664 HydrophobicContact CG2-CZ 3.96Å; I662-F681 HydrophobicContact CD1-CB 3.93Å; I662-F681 HydrophobicContact CD1-CD1 3.99Å; I662-F681 HydrophobicContact CD1-CD2 3.31Å; I662-F681 HydrophobicContact CD1-CE1 4.23Å; I662-F681 HydrophobicContact CD1-CE2 3.62Å; I662-F681 HydrophobicContact CD1-CG 3.5Å; I662-F681 HydrophobicContact CD1-CZ 4.05Å; I662-I684 HydrophobicContact CD1-CD1 3.7Å; I662-I684 HydrophobicContact CD1-CG1 3.89Å; I662-I684 HydrophobicContact CG1-CD1 4.36Å; I662-I684 HydrophobicContact CG1-CG1 4.18Å; I662-Q686 PolarHBondContact N-O 2.7Å; I662-L687 HydrophobicContact CB-CD1 4.45Å; I662-L687 WeakPolarHBondContact O-CA 3.22Å; I662-E688 PolarHBondContact O-N 2.89Å
663	I	92.8	Very high	77.7	Confident	13 Å²	13	47.4 Å²	47.4	7%	0.067	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.6	179.3	-50.2	170.2	0	0	0	108.9	I488 K489 I490 H661 E688	I488-I663 PolarHBondContact O-N 3.23Å; K489-I663 CarbonylContact C-O 3.38Å; K489-I663 VanDerWaalsContact CA-O 3.32Å; K489-I663 WeakPolarHBondContact CA-O 3.43Å; K489-I663 HydrophobicContact CB-CB 3.99Å; K489-I663 HydrophobicContact CB-CD1 4.32Å; K489-I663 HydrophobicContact CD-CB 3.96Å; K489-I663 HydrophobicContact CD-CD1 4.01Å; K489-I663 HydrophobicContact CD-CG2 3.57Å; K489-I663 VanDerWaalsContact CE-CG2 3.47Å; K489-I663 HydrophobicContact CG-CB 3.85Å; K489-I663 HydrophobicContact CG-CG2 3.83Å; I490-I663 PolarHBondContact N-O 3.16Å; H661-I663 WeakPolarHBondContact NE2-CG1 3.47Å; I663-E688 WeakPolarHBondContact CA-O 3.29Å; I663-E688 HydrophobicContact CB-CB 4.13Å; I663-E688 WeakPolarHBondContact CD1-OE2 3.49Å; I663-E688 HydrophobicContact CG1-CB 3.95Å; I663-E688 HydrophobicContact CG1-CG 4Å; I663-E688 WeakPolarHBondContact CG1-OE2 3.33Å; I663-E688 HydrophobicContact CG2-CB 3.85Å
664	F	94.1	Very high	80.5	Confident	1 Å²	1	44.2 Å²	44.2	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.7	170.6	-66.3	-96	0	0	0	109.3	I490 I662 C667 L674 I678 L687 E688 F689 E690	I490-F664 HydrophobicContact CB-CD1 4.15Å; I490-F664 HydrophobicContact CB-CE1 4.43Å; I490-F664 HydrophobicContact CD1-CD1 4.16Å; I490-F664 HydrophobicContact CD1-CE1 3.58Å; I490-F664 HydrophobicContact CD1-CZ 4.01Å; I490-F664 HydrophobicContact CG2-CD1 4.34Å; I662-F664 HydrophobicContact CB-CE2 4.46Å; I662-F664 HydrophobicContact CG2-CD2 3.98Å; I662-F664 HydrophobicContact CG2-CE2 3.44Å; I662-F664 VanDerWaalsContact CG2-CE2 3.44Å; I662-F664 HydrophobicContact CG2-CZ 3.96Å; F664-C667 HydrophobicContact CB-CB 4.49Å; F664-C667 HydrophobicContact CD1-CB 4.48Å; F664-L674 HydrophobicContact CD1-CD1 4.26Å; F664-L674 HydrophobicContact CD2-CD1 4.25Å; F664-L674 HydrophobicContact CE1-CD1 3.92Å; F664-L674 HydrophobicContact CE2-CD1 3.92Å; F664-L674 HydrophobicContact CG-CD1 4.42Å; F664-L674 HydrophobicContact CZ-CD1 3.74Å; F664-I678 HydrophobicContact CE2-CD1 3.82Å; F664-I678 HydrophobicContact CE2-CG1 3.97Å; F664-I678 HydrophobicContact CZ-CD1 4.3Å; F664-I678 HydrophobicContact CZ-CG1 4.12Å; F664-L687 HydrophobicContact CD2-CD1 4.4Å; F664-L687 HydrophobicContact CE2-CD1 4.28Å; F664-E688 PolarHBondContact N-O 3.24Å; F664-F689 HydrophobicContact CB-CD1 4.02Å; F664-F689 HydrophobicContact CB-CE1 4.36Å; F664-F689 HydrophobicContact CD2-CD1 4.1Å; F664-F689 AromaticContact CD2-CE1 3.66Å; F664-F689 HydrophobicContact CD2-CE1 3.66Å; F664-F689 HydrophobicContact CE2-CE1 4.28Å; F664-F689 HydrophobicContact CG-CD1 4.39Å; F664-F689 HydrophobicContact CG-CE1 4.23Å; F664-E690 PolarHBondContact O-N 3.08Å
665	K	92.7	Very high	83.1	Confident	71 Å²	71	40.1 Å²	40.1	31%	0.309	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.5	176	-178.6	177.7	-171.2	140.2	0	112	I490 V491 Q492 C667 E690	I490-K665 PolarHBondContact O-N 3.25Å; V491-K665 WeakPolarHBondContact CA-O 3.46Å; V491-K665 HydrophobicContact CG1-CB 4.27Å; V491-K665 HydrophobicContact CG1-CD 4.41Å; V491-K665 HydrophobicContact CG1-CG 4.39Å; V491-K665 HydrophobicContact CG2-CB 4.25Å; Q492-K665 PolarHBondContact N-O 2.57Å; K665-C667 PolarHBondContact O-N 3.39Å; K665-C667 PolarHBondContact O-SG 2.82Å; K665-E690 CarbonylContact C-O 3.59Å; K665-E690 WeakPolarHBondContact CA-O 3.22Å; K665-E690 HydrophobicContact CB-CB 4.25Å; K665-E690 HydrophobicContact CD-CG 4.47Å; K665-E690 VanDerWaalsContact CD-OE2 3.22Å; K665-E690 WeakPolarHBondContact CD-OE2 3.19Å; K665-E690 VanDerWaalsContact CE-OE1 3.25Å; K665-E690 WeakPolarHBondContact CE-OE1 3.39Å; K665-E690 HydrophobicContact CG-CB 4.23Å; K665-E690 HydrophobicContact CG-CG 4.09Å; K665-E690 WeakPolarHBondContact CG-OE2 3.46Å; K665-E690 IonicContact NZ-OE1 3.53Å; K665-E690 PolarHBondContact NZ-OE1 3.35Å; K665-E690 IonicContact NZ-OE2 2.65Å
666	S	90.8	Very high	85.3	Confident	39 Å²	39	39.9 Å²	39.9	27%	0.273	20%	0.204	S	C	.	.	S	Bend	trans	50.4	39.7	176.9	-47	0	0	0	0	112.6	Q492 E690	Q492-S666 WeakPolarHBondContact CA-O 3.49Å; S666-E690 PolarHBondContact N-O 3.14Å
667	C	91.1	Very high	87.1	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.014	18%	0.181	C	C	.	.			trans	-86.6	136.2	179.9	-64.4	0	0	0	0	110.3	L493 F664 K665 C692 F695	L493-C667 HydrophobicContact CB-CB 4.3Å; L493-C667 WeakPolarHBondContact O-CA 3.48Å; F664-C667 HydrophobicContact CB-CB 4.49Å; F664-C667 HydrophobicContact CD1-CB 4.48Å; K665-C667 PolarHBondContact O-N 3.39Å; K665-C667 PolarHBondContact O-SG 2.82Å; C667-C692 PolarHBondContact N-SG 2.65Å; C667-F695 HydrophobicContact CB-CZ 4.35Å
668	S	89.4	Confident	88.4	Confident	52 Å²	52	35 Å²	35	36%	0.364	18%	0.175	S	C	.	.	B	Isolated β-bridge	trans	-120.8	82.3	-178.2	-178.2	0	0	0	0	107.9	L493 V494 E495 D694	L493-S668 PolarHBondContact O-N 3.19Å; V494-S668 CarbonylContact C-O 3.56Å; V494-S668 VanDerWaalsContact CA-O 3.28Å; V494-S668 WeakPolarHBondContact CA-O 3.32Å; E495-S668 PolarHBondContact N-O 3.43Å; S668-D694 WeakPolarHBondContact CA-OD2 3.44Å; S668-D694 WeakPolarHBondContact CB-OD2 3.28Å; S668-D694 PolarHBondContact OG-OD2 2.93Å
669	I	88.4	Confident	89.1	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.015	17%	0.169	C	C	.	.			trans	-136.9	147.8	179.9	61.9	171.5	0	0	0	108.9	L493 L674 L677 F695	L493-I669 HydrophobicContact CB-CG2 4.48Å; L493-I669 HydrophobicContact CD2-CD1 4.11Å; L493-I669 HydrophobicContact CD2-CG2 3.74Å; L493-I669 HydrophobicContact CG-CG2 3.63Å; I669-L674 HydrophobicContact CD1-CB 3.91Å; I669-L674 HydrophobicContact CD1-CD1 4.17Å; I669-L674 HydrophobicContact CG1-CB 4.45Å; I669-L677 HydrophobicContact CD1-CD1 3.95Å; I669-F695 HydrophobicContact CD1-CE1 4.44Å; I669-F695 HydrophobicContact CD1-CZ 4.4Å; I669-F695 HydrophobicContact CG1-CE1 3.58Å; I669-F695 HydrophobicContact CG1-CZ 3.96Å; I669-F695 WeakPolarHBondContact O-CE1 3.39Å
670	P	87	Confident	89.2	Confident	47 Å²	47	34 Å²	34	31%	0.305	18%	0.177	S	C	.	.			trans	-68.9	151	173.9	30.1	-36.7	0	0	0	111	E495 Q672 S673 L674	E495-P670 HydrophobicContact CG-CG 4.23Å; E495-P670 WeakPolarHBondContact OE1-CG 3.28Å; P670-Q672 PolarHBondContact O-N 2.84Å; P670-Q672 VanDerWaalsContact O-N 3.08Å; P670-S673 WeakPolarHBondContact O-CA 3.28Å; P670-S673 WeakPolarHBondContact O-CB 3.38Å; P670-S673 PolarHBondContact O-N 2.84Å; P670-L674 PolarHBondContact O-N 3.45Å
671	D	89.1	Confident	89.2	Confident	23 Å²	23	33.2 Å²	33.2	12%	0.123	17%	0.172	C	C	.	.	H	α-helix	trans	-51.4	-36.6	-176.9	-59.5	-12.8	0	0	0	113.1	S673 L674 S675 F695 T696 A699	D671-S673 VanDerWaalsContact C-N 3.31Å; D671-S673 PolarHBondContact O-N 3.34Å; D671-L674 WeakPolarHBondContact O-CB 3.5Å; D671-L674 PolarHBondContact O-N 2.74Å; D671-L674 VanDerWaalsContact O-N 3.16Å; D671-S675 PolarHBondContact O-N 2.89Å; D671-S675 PolarHBondContact O-OG 3.3Å; D671-F695 WeakPolarHBondContact OD1-CA 3.49Å; D671-T696 PolarHBondContact OD1-N 2.8Å; D671-T696 PolarHBondContact OD2-N 2.89Å; D671-T696 PolarHBondContact OD2-OG1 3.23Å; D671-A699 HydrophobicContact CB-CB 4.16Å; D671-A699 PolarHBondContact OD2-N 2.86Å
672	Q	85.8	Confident	88.6	Confident	131 Å²	131	37.3 Å²	37.3	61%	0.612	20%	0.201	S	C	*	.	H	α-helix	trans	-70.9	-21.3	177.6	-171.2	58.6	14.5	0	0	114.2	P670 S675 R676	P670-Q672 PolarHBondContact O-N 2.84Å; P670-Q672 VanDerWaalsContact O-N 3.08Å; Q672-S675 PolarHBondContact O-OG 3.33Å; Q672-S675 PolarHBondContact OE1-OG 3.05Å; Q672-R676 VanDerWaalsContact O-CG 3.24Å; Q672-R676 WeakPolarHBondContact O-CG 3.19Å
673	S	85.7	Confident	88.1	Confident	28 Å²	28	39 Å²	39	20%	0.196	21%	0.213	C	C	.	.	H	α-helix	trans	-80.4	-35.5	168.4	-69.7	0	0	0	0	111.3	S498 P670 D671 L677	S498-S673 PolarHBondContact OG-OG 3.35Å; P670-S673 WeakPolarHBondContact O-CA 3.28Å; P670-S673 WeakPolarHBondContact O-CB 3.38Å; P670-S673 PolarHBondContact O-N 2.84Å; D671-S673 VanDerWaalsContact C-N 3.31Å; D671-S673 PolarHBondContact O-N 3.34Å; S673-L677 WeakPolarHBondContact O-CB 3.35Å; S673-L677 WeakPolarHBondContact O-CG 3.44Å; S673-L677 PolarHBondContact O-N 3.43Å
674	L	89.8	Confident	88	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-49.6	176.1	-179.8	70.6	0	0	0	111.5	F664 I669 P670 D671 R676 L677 I678 F689 F695 A699 C703	F664-L674 HydrophobicContact CD1-CD1 4.26Å; F664-L674 HydrophobicContact CD2-CD1 4.25Å; F664-L674 HydrophobicContact CE1-CD1 3.92Å; F664-L674 HydrophobicContact CE2-CD1 3.92Å; F664-L674 HydrophobicContact CG-CD1 4.42Å; F664-L674 HydrophobicContact CZ-CD1 3.74Å; I669-L674 HydrophobicContact CD1-CB 3.91Å; I669-L674 HydrophobicContact CD1-CD1 4.17Å; I669-L674 HydrophobicContact CG1-CB 4.45Å; P670-L674 PolarHBondContact O-N 3.45Å; D671-L674 WeakPolarHBondContact O-CB 3.5Å; D671-L674 PolarHBondContact O-N 2.74Å; D671-L674 VanDerWaalsContact O-N 3.16Å; L674-R676 VanDerWaalsContact C-N 3.32Å; L674-R676 PolarHBondContact O-N 3.37Å; L674-L677 PolarHBondContact O-N 3.32Å; L674-I678 HydrophobicContact CD1-CD1 3.76Å; L674-I678 HydrophobicContact CD1-CG1 4.47Å; L674-I678 HydrophobicContact CG-CD1 3.99Å; L674-I678 PolarHBondContact O-N 3.48Å; L674-F689 HydrophobicContact CD1-CE1 3.99Å; L674-F689 HydrophobicContact CD1-CZ 4.48Å; L674-F689 HydrophobicContact CD2-CE1 4.07Å; L674-F689 HydrophobicContact CD2-CZ 4.04Å; L674-F695 HydrophobicContact CD1-CE2 3.96Å; L674-F695 HydrophobicContact CD1-CZ 3.9Å; L674-F695 HydrophobicContact CD2-CD2 3.8Å; L674-F695 HydrophobicContact CD2-CE1 4.48Å; L674-F695 HydrophobicContact CD2-CE2 3.65Å; L674-F695 HydrophobicContact CD2-CG 4.29Å; L674-F695 HydrophobicContact CD2-CZ 4.03Å; L674-F695 HydrophobicContact CG-CE2 4.38Å; L674-F695 HydrophobicContact CG-CZ 4.39Å; L674-A699 HydrophobicContact CD2-CB 3.91Å; L674-C703 HydrophobicContact CD2-CB 4.18Å; L674-C703 HydrophobicContact CG-CB 4.27Å
675	S	87.8	Confident	87.9	Confident	6 Å²	6	42.7 Å²	42.7	4%	0.042	23%	0.228	C	C	.	.	H	α-helix	trans	-58.9	-44	179.1	66.6	0	0	0	0	111.4	D671 Q672 I678 N679 S702	D671-S675 PolarHBondContact O-N 2.89Å; D671-S675 PolarHBondContact O-OG 3.3Å; Q672-S675 PolarHBondContact O-OG 3.33Å; Q672-S675 PolarHBondContact OE1-OG 3.05Å; S675-I678 PolarHBondContact O-N 3.27Å; S675-N679 WeakPolarHBondContact O-CB 3.24Å; S675-N679 PolarHBondContact O-N 2.82Å; S675-N679 PolarHBondContact O-ND2 3.44Å; S675-S702 VanDerWaalsContact CB-O 3.31Å; S675-S702 WeakPolarHBondContact CB-O 3.43Å
676	R	87.2	Confident	88	Confident	121 Å²	121	42.1 Å²	42.1	46%	0.457	23%	0.227	S	C	.	.	H	α-helix	trans	-61	-44.6	174.7	-75.7	-175.3	72.2	166.5	4.6	112.7	Y502 Q672 L674	Y502-R676 HydrophobicContact CD2-CB 3.88Å; Y502-R676 VanDerWaalsContact CE1-NH2 3.33Å; Y502-R676 HydrophobicContact CE2-CB 3.72Å; Y502-R676 WeakPolarHBondContact CE2-O 3.36Å; Y502-R676 PolarHBondContact OH-NH2 3.35Å; Q672-R676 VanDerWaalsContact O-CG 3.24Å; Q672-R676 WeakPolarHBondContact O-CG 3.19Å; L674-R676 VanDerWaalsContact C-N 3.32Å; L674-R676 PolarHBondContact O-N 3.37Å
677	L	88.7	Confident	88.2	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-44.3	177.4	-77.1	167.1	0	0	0	112.3	L493 L501 Y502 L505 I669 S673 L674 L680 F681	L493-L677 HydrophobicContact CD2-CD1 3.88Å; L501-L677 HydrophobicContact CD2-CD2 4.37Å; L501-L677 HydrophobicContact CG-CD2 4.18Å; Y502-L677 HydrophobicContact CD2-CD2 4.47Å; L505-L677 HydrophobicContact CD1-CD2 3.88Å; I669-L677 HydrophobicContact CD1-CD1 3.95Å; S673-L677 WeakPolarHBondContact O-CB 3.35Å; S673-L677 WeakPolarHBondContact O-CG 3.44Å; S673-L677 PolarHBondContact O-N 3.43Å; L674-L677 PolarHBondContact O-N 3.32Å; L677-L680 WeakPolarHBondContact O-CB 3.07Å; L677-L680 PolarHBondContact O-N 2.86Å; L677-F681 WeakPolarHBondContact O-CD2 3.4Å; L677-F681 VanDerWaalsContact O-CE2 3.26Å; L677-F681 WeakPolarHBondContact O-CE2 3.43Å
678	I	88.1	Confident	88.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-70.6	-34.7	-177.8	-79.3	169.5	0	0	0	112.2	F664 L674 S675 L680 F681 I684 L687 F689 C703 L705	F664-I678 HydrophobicContact CE2-CD1 3.82Å; F664-I678 HydrophobicContact CE2-CG1 3.97Å; F664-I678 HydrophobicContact CZ-CD1 4.3Å; F664-I678 HydrophobicContact CZ-CG1 4.12Å; L674-I678 HydrophobicContact CD1-CD1 3.76Å; L674-I678 HydrophobicContact CD1-CG1 4.47Å; L674-I678 HydrophobicContact CG-CD1 3.99Å; L674-I678 PolarHBondContact O-N 3.48Å; S675-I678 PolarHBondContact O-N 3.27Å; I678-L680 PolarHBondContact O-N 3.05Å; I678-L680 VanDerWaalsContact O-N 3.13Å; I678-F681 PolarHBondContact O-N 2.87Å; I678-I684 HydrophobicContact CG2-CD1 3.78Å; I678-L687 HydrophobicContact CD1-CD1 3.86Å; I678-L687 HydrophobicContact CD1-CD2 4.19Å; I678-F689 HydrophobicContact CD1-CE1 4.47Å; I678-F689 HydrophobicContact CD1-CZ 4.09Å; I678-C703 HydrophobicContact CB-CB 4.38Å; I678-C703 HydrophobicContact CD1-CB 3.68Å; I678-C703 HydrophobicContact CG2-CB 4.33Å; I678-C703 WeakPolarHBondContact CG2-O 3.46Å; I678-L705 HydrophobicContact CG2-CD1 4.07Å; I678-L705 HydrophobicContact CG2-CG 4.37Å
679	N	86.5	Confident	88.6	Confident	95 Å²	95	40.3 Å²	40.3	51%	0.508	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.9	176	-79.2	-51.5	0	0	0	114.4	S675 F681	S675-N679 WeakPolarHBondContact O-CB 3.24Å; S675-N679 PolarHBondContact O-N 2.82Å; S675-N679 PolarHBondContact O-ND2 3.44Å; N679-F681 PolarHBondContact O-N 3.06Å
680	L	86	Confident	88.9	Confident	31 Å²	31	42.2 Å²	42.2	16%	0.162	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-10.3	170.8	-61.1	177.3	0	0	0	113.4	Y502 L505 E506 L509 L677 I678 P682	Y502-L680 HydrophobicContact CD2-CD1 3.84Å; Y502-L680 HydrophobicContact CD2-CG 4.38Å; Y502-L680 HydrophobicContact CE2-CD1 3.98Å; Y502-L680 HydrophobicContact CE2-CD2 4.02Å; Y502-L680 HydrophobicContact CE2-CG 4.08Å; Y502-L680 HydrophobicContact CG-CD1 4.49Å; L505-L680 HydrophobicContact CB-CD1 3.54Å; L505-L680 HydrophobicContact CD1-CD1 4.5Å; E506-L680 HydrophobicContact CB-CD1 4.42Å; E506-L680 HydrophobicContact CB-CD2 4.12Å; E506-L680 HydrophobicContact CG-CD2 4.33Å; L509-L680 HydrophobicContact CD1-CB 4.26Å; L677-L680 WeakPolarHBondContact O-CB 3.07Å; L677-L680 PolarHBondContact O-N 2.86Å; I678-L680 PolarHBondContact O-N 3.05Å; I678-L680 VanDerWaalsContact O-N 3.13Å; L680-P682 WeakPolarHBondContact O-CD 3.35Å
681	F	86.4	Confident	89	Confident	6 Å²	6	41.5 Å²	41.5	3%	0.026	21%	0.213	C	C	.	.			trans	-124.4	73	-172.9	-53.7	-87.8	0	0	0	112.3	I488 L505 L509 F659 I662 L677 I678 N679 S683 I684	I488-F681 HydrophobicContact CD1-CE1 3.72Å; I488-F681 HydrophobicContact CD1-CZ 3.89Å; L505-F681 HydrophobicContact CD1-CE2 4.16Å; L505-F681 HydrophobicContact CD1-CZ 3.88Å; L505-F681 HydrophobicContact CD2-CE1 4.4Å; L505-F681 HydrophobicContact CD2-CZ 3.86Å; L505-F681 HydrophobicContact CG-CZ 4.43Å; L509-F681 HydrophobicContact CD1-CD1 3.84Å; L509-F681 HydrophobicContact CD1-CE1 3.48Å; L509-F681 VanDerWaalsContact CD1-CE1 3.48Å; L509-F681 HydrophobicContact CD1-CZ 3.96Å; F659-F681 HydrophobicContact CB-CD1 3.89Å; F659-F681 HydrophobicContact CB-CE1 4.21Å; F659-F681 AromaticContact CD2-CD1 3.84Å; F659-F681 HydrophobicContact CD2-CD1 3.84Å; F659-F681 AromaticContact CD2-CE1 3.58Å; F659-F681 HydrophobicContact CD2-CE1 3.58Å; F659-F681 HydrophobicContact CE2-CE1 4.26Å; F659-F681 HydrophobicContact CG-CD1 4.23Å; F659-F681 HydrophobicContact CG-CE1 4.11Å; I662-F681 HydrophobicContact CD1-CB 3.93Å; I662-F681 HydrophobicContact CD1-CD1 3.99Å; I662-F681 HydrophobicContact CD1-CD2 3.31Å; I662-F681 HydrophobicContact CD1-CE1 4.23Å; I662-F681 HydrophobicContact CD1-CE2 3.62Å; I662-F681 HydrophobicContact CD1-CG 3.5Å; I662-F681 HydrophobicContact CD1-CZ 4.05Å; L677-F681 WeakPolarHBondContact O-CD2 3.4Å; L677-F681 VanDerWaalsContact O-CE2 3.26Å; L677-F681 WeakPolarHBondContact O-CE2 3.43Å; I678-F681 PolarHBondContact O-N 2.87Å; N679-F681 PolarHBondContact O-N 3.06Å; F681-S683 PolarHBondContact O-N 2.77Å; F681-I684 HydrophobicContact CB-CD1 3.72Å; F681-I684 HydrophobicContact CB-CG1 3.74Å; F681-I684 WeakPolarHBondContact O-CD1 3.32Å; F681-I684 WeakPolarHBondContact O-CG1 3.31Å; F681-I684 PolarHBondContact O-N 2.85Å
682	P	79.5	Confident	89.1	Confident	113 Å²	113	40.4 Å²	40.4	73%	0.734	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	4.4	-177.1	29	-37.2	0	0	0	115.1	L680	L680-P682 WeakPolarHBondContact O-CD 3.35Å
683	S	83.3	Confident	89.1	Confident	35 Å²	35	36.7 Å²	36.7	25%	0.245	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	9.7	178.6	56.6	0	0	0	0	114.7	F659 F681 K685	F659-S683 CarbonylContact O-C 3.58Å; F659-S683 PolarHBondContact O-OG 2.88Å; F681-S683 PolarHBondContact O-N 2.77Å; S683-K685 PolarHBondContact O-N 2.95Å
684	I	90.4	Very high	89.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.202	C	C	.	.			trans	-60	130.3	178.1	-63.9	159.2	0	0	0	110.6	I662 I678 F681 Q686 L687 L705 S707 I708	I662-I684 HydrophobicContact CD1-CD1 3.7Å; I662-I684 HydrophobicContact CD1-CG1 3.89Å; I662-I684 HydrophobicContact CG1-CD1 4.36Å; I662-I684 HydrophobicContact CG1-CG1 4.18Å; I678-I684 HydrophobicContact CG2-CD1 3.78Å; F681-I684 HydrophobicContact CB-CD1 3.72Å; F681-I684 HydrophobicContact CB-CG1 3.74Å; F681-I684 WeakPolarHBondContact O-CD1 3.32Å; F681-I684 WeakPolarHBondContact O-CG1 3.31Å; F681-I684 PolarHBondContact O-N 2.85Å; I684-Q686 WeakPolarHBondContact CG2-O 3.42Å; I684-L687 HydrophobicContact CG2-CB 4.38Å; I684-L705 HydrophobicContact CB-CD1 4.48Å; I684-L705 HydrophobicContact CD1-CD1 4.03Å; I684-S707 CarbonylContact O-C 3.59Å; I684-S707 WeakPolarHBondContact O-CB 3.48Å; I684-S707 PolarHBondContact O-OG 3.22Å; I684-I708 HydrophobicContact CG2-CG1 4.02Å
685	K	92.7	Very high	89	Confident	92 Å²	92	39.3 Å²	39.3	40%	0.4	20%	0.203	S	C	.	.			trans	-116.2	-25.5	168	-70.5	178.7	171.8	-65.6	0	112.4	T660 S683 E709 Y710	T660-K685 PolarHBondContact O-N 2.69Å; S683-K685 PolarHBondContact O-N 2.95Å; K685-E709 IonicContact NZ-OE1 2.64Å; K685-E709 PolarHBondContact NZ-OE1 3.24Å; K685-E709 PolarHBondContact O-N 3.4Å; K685-Y710 PolarHBondContact O-N 2.77Å
686	Q	94.5	Very high	89	Confident	58 Å²	58	40.8 Å²	40.8	27%	0.271	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.4	-177.5	-43.9	-162.6	-64.9	0	0	110.2	T660 H661 I662 I684 Y710	T660-Q686 PolarHBondContact O-N 2.99Å; H661-Q686 VanDerWaalsContact CA-O 3.29Å; H661-Q686 WeakPolarHBondContact CA-O 3.33Å; H661-Q686 HydrophobicContact CB-CB 3.9Å; H661-Q686 HydrophobicContact CB-CG 4.39Å; H661-Q686 PolarHBondContact ND1-OE1 2.88Å; I662-Q686 PolarHBondContact N-O 2.7Å; I684-Q686 WeakPolarHBondContact CG2-O 3.42Å; Q686-Y710 CarbonylContact C-O 3.4Å; Q686-Y710 VanDerWaalsContact CA-O 3.32Å; Q686-Y710 WeakPolarHBondContact CA-O 3.32Å; Q686-Y710 HydrophobicContact CG-CD2 3.77Å; Q686-Y710 HydrophobicContact CG-CG 4.02Å; Q686-Y710 VanDerWaalsContact NE2-CD2 3.34Å; Q686-Y710 VanDerWaalsContact NE2-CG 3.27Å
687	L	95.1	Very high	89.1	Confident	1 Å²	1	38 Å²	38	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	127.9	180	-178.3	60.2	0	0	0	109.5	I662 F664 I678 I684 F689 L704 I708 Y710 L711 T712	I662-L687 HydrophobicContact CB-CD1 4.45Å; I662-L687 WeakPolarHBondContact O-CA 3.22Å; F664-L687 HydrophobicContact CD2-CD1 4.4Å; F664-L687 HydrophobicContact CE2-CD1 4.28Å; I678-L687 HydrophobicContact CD1-CD1 3.86Å; I678-L687 HydrophobicContact CD1-CD2 4.19Å; I684-L687 HydrophobicContact CG2-CB 4.38Å; L687-F689 HydrophobicContact CD1-CE1 4.21Å; L687-F689 HydrophobicContact CD1-CE2 4.35Å; L687-F689 HydrophobicContact CD1-CZ 3.87Å; L687-F689 HydrophobicContact CD2-CE2 3.69Å; L687-F689 HydrophobicContact CD2-CZ 3.71Å; L687-F689 HydrophobicContact CG-CE2 3.82Å; L687-F689 HydrophobicContact CG-CZ 3.84Å; L687-L704 HydrophobicContact CD2-CD2 4.03Å; L687-I708 HydrophobicContact CB-CD1 4.16Å; L687-I708 HydrophobicContact CB-CG2 4.47Å; L687-I708 HydrophobicContact CD2-CD1 3.74Å; L687-Y710 PolarHBondContact N-O 3.39Å; L687-L711 HydrophobicContact CB-CD1 4.23Å; L687-L711 HydrophobicContact CD2-CD1 4.35Å; L687-L711 HydrophobicContact CG-CD1 4.28Å; L687-L711 WeakPolarHBondContact O-CA 3.4Å; L687-T712 PolarHBondContact O-N 3Å
688	E	95	Very high	89.2	Confident	53 Å²	53	43.1 Å²	43.1	25%	0.248	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.7	-179	-54.1	-153.6	121.7	0	0	112.1	H661 I662 I663 F664 T712	H661-E688 WeakPolarHBondContact NE2-CG 3.41Å; H661-E688 IonicContact NE2-OE2 3.87Å; I662-E688 PolarHBondContact O-N 2.89Å; I663-E688 WeakPolarHBondContact CA-O 3.29Å; I663-E688 HydrophobicContact CB-CB 4.13Å; I663-E688 WeakPolarHBondContact CD1-OE2 3.49Å; I663-E688 HydrophobicContact CG1-CB 3.95Å; I663-E688 HydrophobicContact CG1-CG 4Å; I663-E688 WeakPolarHBondContact CG1-OE2 3.33Å; I663-E688 HydrophobicContact CG2-CB 3.85Å; F664-E688 PolarHBondContact N-O 3.24Å; E688-T712 CarbonylContact C-O 3.53Å; E688-T712 WeakPolarHBondContact CA-O 3.25Å; E688-T712 VanDerWaalsContact CB-OG1 3.23Å; E688-T712 WeakPolarHBondContact CB-OG1 3.3Å; E688-T712 HydrophobicContact CG-CG2 4.22Å; E688-T712 WeakPolarHBondContact CG-OG1 3.35Å; E688-T712 VanDerWaalsContact OE1-CG2 3.24Å; E688-T712 WeakPolarHBondContact OE1-CG2 3.42Å; E688-T712 PolarHBondContact OE1-OG1 2.93Å
689	F	94.4	Very high	89.3	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.009	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	123	175.1	-64.2	-58.6	0	0	0	110.3	F664 L674 I678 L687 F695 F700 L711 T712 V713 F714	F664-F689 HydrophobicContact CB-CD1 4.02Å; F664-F689 HydrophobicContact CB-CE1 4.36Å; F664-F689 HydrophobicContact CD2-CD1 4.1Å; F664-F689 AromaticContact CD2-CE1 3.66Å; F664-F689 HydrophobicContact CD2-CE1 3.66Å; F664-F689 HydrophobicContact CE2-CE1 4.28Å; F664-F689 HydrophobicContact CG-CD1 4.39Å; F664-F689 HydrophobicContact CG-CE1 4.23Å; L674-F689 HydrophobicContact CD1-CE1 3.99Å; L674-F689 HydrophobicContact CD1-CZ 4.48Å; L674-F689 HydrophobicContact CD2-CE1 4.07Å; L674-F689 HydrophobicContact CD2-CZ 4.04Å; I678-F689 HydrophobicContact CD1-CE1 4.47Å; I678-F689 HydrophobicContact CD1-CZ 4.09Å; L687-F689 HydrophobicContact CD1-CE1 4.21Å; L687-F689 HydrophobicContact CD1-CE2 4.35Å; L687-F689 HydrophobicContact CD1-CZ 3.87Å; L687-F689 HydrophobicContact CD2-CE2 3.69Å; L687-F689 HydrophobicContact CD2-CZ 3.71Å; L687-F689 HydrophobicContact CG-CE2 3.82Å; L687-F689 HydrophobicContact CG-CZ 3.84Å; F689-F695 HydrophobicContact CD1-CD2 4.06Å; F689-F695 AromaticContact CD1-CE2 3.63Å; F689-F695 HydrophobicContact CD1-CE2 3.63Å; F689-F695 HydrophobicContact CE1-CD2 4.21Å; F689-F695 AromaticContact CE1-CE2 3.69Å; F689-F695 HydrophobicContact CE1-CE2 3.69Å; F689-F700 HydrophobicContact CD2-CE1 4.07Å; F689-F700 HydrophobicContact CD2-CZ 4.39Å; F689-F700 HydrophobicContact CE2-CE1 4.18Å; F689-L711 HydrophobicContact CD2-CD1 4.41Å; F689-L711 HydrophobicContact CE2-CD1 4.45Å; F689-T712 PolarHBondContact N-O 3.09Å; F689-V713 HydrophobicContact CB-CG1 4.35Å; F689-V713 HydrophobicContact CD2-CG2 4.19Å; F689-V713 CarbonylContact O-C 3.59Å; F689-V713 WeakPolarHBondContact O-CA 3.5Å; F689-F714 PolarHBondContact O-N 3.32Å
690	E	93	Very high	89.6	Confident	42 Å²	42	38.8 Å²	38.8	20%	0.196	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	112	-174.9	-174.4	-173.6	178	0	0	110.2	K489 F664 K665 S666 C692 F714	K489-E690 IonicContact NZ-OE2 2.7Å; K489-E690 PolarHBondContact NZ-OE2 3.02Å; F664-E690 PolarHBondContact O-N 3.08Å; K665-E690 CarbonylContact C-O 3.59Å; K665-E690 WeakPolarHBondContact CA-O 3.22Å; K665-E690 HydrophobicContact CB-CB 4.25Å; K665-E690 HydrophobicContact CD-CG 4.47Å; K665-E690 VanDerWaalsContact CD-OE2 3.22Å; K665-E690 WeakPolarHBondContact CD-OE2 3.19Å; K665-E690 VanDerWaalsContact CE-OE1 3.25Å; K665-E690 WeakPolarHBondContact CE-OE1 3.39Å; K665-E690 HydrophobicContact CG-CB 4.23Å; K665-E690 HydrophobicContact CG-CG 4.09Å; K665-E690 WeakPolarHBondContact CG-OE2 3.46Å; K665-E690 IonicContact NZ-OE1 3.53Å; K665-E690 PolarHBondContact NZ-OE1 3.35Å; K665-E690 IonicContact NZ-OE2 2.65Å; S666-E690 PolarHBondContact N-O 3.14Å; E690-C692 PolarHBondContact O-N 3Å; E690-F714 CarbonylContact C-O 3.59Å; E690-F714 WeakPolarHBondContact CA-O 3.42Å; E690-F714 HydrophobicContact CG-CD1 4.42Å
691	C	90.2	Very high	89.8	Confident	33 Å²	33	41.6 Å²	41.6	22%	0.223	22%	0.216	C	C	.	.	S	Bend	trans	54.3	32.5	-177.9	-53.3	0	0	0	0	114.5	N693 F714 D715	C691-N693 VanDerWaalsContact C-N 3.33Å; C691-N693 PolarHBondContact O-N 3.26Å; C691-N693 VanDerWaalsContact O-N 3.13Å; C691-F714 PolarHBondContact N-O 3.42Å; C691-D715 WeakPolarHBondContact CA-O 3.44Å; C691-D715 PolarHBondContact SG-OD2 2.81Å
692	C	90.3	Very high	89.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.229	C	C	.	.			trans	-85.6	73.1	177.4	-76.7	0	0	0	0	110.5	C667 E690 D694 F695 C716	C667-C692 PolarHBondContact N-SG 2.65Å; E690-C692 PolarHBondContact O-N 3Å; C692-D694 VanDerWaalsContact C-N 3.31Å; C692-D694 PolarHBondContact O-N 2.75Å; C692-F695 HydrophobicContact CB-CD1 4.43Å; C692-F695 HydrophobicContact CB-CD2 3.52Å; C692-F695 HydrophobicContact CB-CE1 4.34Å; C692-F695 HydrophobicContact CB-CE2 3.44Å; C692-F695 VanDerWaalsContact CB-CE2 3.44Å; C692-F695 HydrophobicContact CB-CG 4.03Å; C692-F695 HydrophobicContact CB-CZ 3.87Å; C692-F695 PolarHBondContact O-N 3.39Å; C692-C716 PolarHBondContact N-SG 3.02Å; C692-C716 VanDerWaalsContact N-SG 3.4Å
693	N	86.6	Confident	90.4	Very high	52 Å²	52	38.1 Å²	38.1	28%	0.278	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-18.1	-167.4	-72	-32.8	0	0	0	115.7	C691 F695 D715 I717 N718	C691-N693 VanDerWaalsContact C-N 3.33Å; C691-N693 PolarHBondContact O-N 3.26Å; C691-N693 VanDerWaalsContact O-N 3.13Å; N693-F695 VanDerWaalsContact C-N 3.33Å; N693-D715 PolarHBondContact OD1-O 3.13Å; N693-D715 VanDerWaalsContact OD1-O 3.08Å; N693-I717 WeakPolarHBondContact OD1-CG1 3.35Å; N693-I717 PolarHBondContact OD1-N 2.8Å; N693-N718 VanDerWaalsContact O-CG 3.3Å; N693-N718 PolarHBondContact O-ND2 2.85Å
694	D	86.1	Confident	90.8	Very high	81 Å²	81	36.9 Å²	36.9	43%	0.433	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-8.8	-179.7	-57.6	-41.2	0	0	0	112.9	S668 C692	S668-D694 WeakPolarHBondContact CA-OD2 3.44Å; S668-D694 WeakPolarHBondContact CB-OD2 3.28Å; S668-D694 PolarHBondContact OG-OD2 2.93Å; C692-D694 VanDerWaalsContact C-N 3.31Å; C692-D694 PolarHBondContact O-N 2.75Å
695	F	87.7	Confident	90.7	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.009	19%	0.194	C	C	.	.			trans	-78.9	127.5	-177.6	-62.8	-3.3	0	0	0	111	C667 I669 D671 L674 F689 C692 N693 A699 N718	C667-F695 HydrophobicContact CB-CZ 4.35Å; I669-F695 HydrophobicContact CD1-CE1 4.44Å; I669-F695 HydrophobicContact CD1-CZ 4.4Å; I669-F695 HydrophobicContact CG1-CE1 3.58Å; I669-F695 HydrophobicContact CG1-CZ 3.96Å; I669-F695 WeakPolarHBondContact O-CE1 3.39Å; D671-F695 WeakPolarHBondContact OD1-CA 3.49Å; L674-F695 HydrophobicContact CD1-CE2 3.96Å; L674-F695 HydrophobicContact CD1-CZ 3.9Å; L674-F695 HydrophobicContact CD2-CD2 3.8Å; L674-F695 HydrophobicContact CD2-CE1 4.48Å; L674-F695 HydrophobicContact CD2-CE2 3.65Å; L674-F695 HydrophobicContact CD2-CG 4.29Å; L674-F695 HydrophobicContact CD2-CZ 4.03Å; L674-F695 HydrophobicContact CG-CE2 4.38Å; L674-F695 HydrophobicContact CG-CZ 4.39Å; F689-F695 HydrophobicContact CD1-CD2 4.06Å; F689-F695 AromaticContact CD1-CE2 3.63Å; F689-F695 HydrophobicContact CD1-CE2 3.63Å; F689-F695 HydrophobicContact CE1-CD2 4.21Å; F689-F695 AromaticContact CE1-CE2 3.69Å; F689-F695 HydrophobicContact CE1-CE2 3.69Å; C692-F695 HydrophobicContact CB-CD1 4.43Å; C692-F695 HydrophobicContact CB-CD2 3.52Å; C692-F695 HydrophobicContact CB-CE1 4.34Å; C692-F695 HydrophobicContact CB-CE2 3.44Å; C692-F695 VanDerWaalsContact CB-CE2 3.44Å; C692-F695 HydrophobicContact CB-CG 4.03Å; C692-F695 HydrophobicContact CB-CZ 3.87Å; C692-F695 PolarHBondContact O-N 3.39Å; N693-F695 VanDerWaalsContact C-N 3.33Å; F695-A699 HydrophobicContact CB-CB 3.88Å; F695-A699 HydrophobicContact CG-CB 4.33Å; F695-N718 WeakPolarHBondContact O-CB 3.46Å
696	T	88.2	Confident	90.6	Very high	38 Å²	38	37.8 Å²	37.8	23%	0.233	20%	0.199	C	C	.	.			trans	-96.4	177.9	176.3	78.5	0	0	0	0	111.7	D671 L698 A699	D671-T696 PolarHBondContact OD1-N 2.8Å; D671-T696 PolarHBondContact OD2-N 2.89Å; D671-T696 PolarHBondContact OD2-OG1 3.23Å; T696-L698 PolarHBondContact O-N 3.22Å; T696-L698 VanDerWaalsContact O-N 3.11Å; T696-L698 WeakPolarHBondContact OG1-CB 3.33Å; T696-L698 PolarHBondContact OG1-N 3.15Å; T696-A699 WeakPolarHBondContact O-CB 3.23Å; T696-A699 PolarHBondContact O-N 3.24Å
697	E	88.6	Confident	90.3	Very high	62 Å²	62	37.3 Å²	37.3	29%	0.29	20%	0.202	S	C	.	.	H	α-helix	trans	-50.8	-28.9	165.9	48.6	-79.2	158.1	0	0	114	A699 F700 W701 S720 E722	E697-A699 VanDerWaalsContact C-N 3.26Å; E697-A699 PolarHBondContact O-N 3.04Å; E697-F700 PolarHBondContact O-N 3.43Å; E697-F700 VanDerWaalsContact O-N 3.13Å; E697-W701 PolarHBondContact O-N 2.98Å; E697-W701 VanDerWaalsContact O-N 3.1Å; E697-S720 PolarHBondContact OE2-OG 2.82Å; E697-E722 HydrophobicContact CB-CB 3.96Å; E697-E722 HydrophobicContact CB-CG 4Å; E697-E722 HydrophobicContact CG-CB 4.02Å; E697-E722 HydrophobicContact CG-CG 3.91Å
698	L	90.3	Very high	90.3	Very high	110 Å²	110	37.2 Å²	37.2	58%	0.576	20%	0.202	S	C	*	.	H	α-helix	trans	-67.4	-25.6	177.4	-54.3	177.5	0	0	0	112.6	T696 S702	T696-L698 PolarHBondContact O-N 3.22Å; T696-L698 VanDerWaalsContact O-N 3.11Å; T696-L698 WeakPolarHBondContact OG1-CB 3.33Å; T696-L698 PolarHBondContact OG1-N 3.15Å; L698-S702 WeakPolarHBondContact O-CB 3.47Å; L698-S702 PolarHBondContact O-N 2.8Å; L698-S702 PolarHBondContact O-OG 3.13Å
699	A	90.8	Very high	90.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-60	-49.5	168.9	0	0	0	0	0	110.7	D671 L674 F695 T696 E697 W701 S702 C703	D671-A699 HydrophobicContact CB-CB 4.16Å; D671-A699 PolarHBondContact OD2-N 2.86Å; L674-A699 HydrophobicContact CD2-CB 3.91Å; F695-A699 HydrophobicContact CB-CB 3.88Å; F695-A699 HydrophobicContact CG-CB 4.33Å; T696-A699 WeakPolarHBondContact O-CB 3.23Å; T696-A699 PolarHBondContact O-N 3.24Å; E697-A699 VanDerWaalsContact C-N 3.26Å; E697-A699 PolarHBondContact O-N 3.04Å; A699-W701 PolarHBondContact O-N 2.88Å; A699-S702 PolarHBondContact O-N 3.09Å; A699-S702 VanDerWaalsContact O-N 3.15Å; A699-S702 PolarHBondContact O-OG 2.88Å; A699-C703 WeakPolarHBondContact O-CB 3.38Å; A699-C703 PolarHBondContact O-N 3.24Å; A699-C703 PolarHBondContact O-SG 3.36Å
700	F	92.3	Very high	90.4	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.009	21%	0.213	C	C	.	.	H	α-helix	trans	-66.1	-40.6	-178.3	-65.9	-85.2	0	0	0	111.7	F689 E697 S702 L704 V713 V719 A726 I727	F689-F700 HydrophobicContact CD2-CE1 4.07Å; F689-F700 HydrophobicContact CD2-CZ 4.39Å; F689-F700 HydrophobicContact CE2-CE1 4.18Å; E697-F700 PolarHBondContact O-N 3.43Å; E697-F700 VanDerWaalsContact O-N 3.13Å; F700-S702 PolarHBondContact O-N 3.28Å; F700-L704 HydrophobicContact CB-CD1 4.06Å; F700-L704 HydrophobicContact CB-CG 4.42Å; F700-L704 HydrophobicContact CD1-CD1 4.15Å; F700-L704 HydrophobicContact CD1-CD2 4.46Å; F700-L704 HydrophobicContact CD1-CG 4.41Å; F700-L704 WeakPolarHBondContact O-CB 3.08Å; F700-L704 WeakPolarHBondContact O-CG 3.37Å; F700-L704 PolarHBondContact O-N 2.98Å; F700-V713 HydrophobicContact CE1-CG2 3.91Å; F700-V713 HydrophobicContact CZ-CG1 4.23Å; F700-V713 HydrophobicContact CZ-CG2 4.23Å; F700-V719 HydrophobicContact CE2-CG1 3.89Å; F700-V719 HydrophobicContact CZ-CG1 4.03Å; F700-A726 HydrophobicContact CB-CB 3.76Å; F700-I727 HydrophobicContact CD1-CD1 4.17Å; F700-I727 HydrophobicContact CD1-CG1 4.32Å; F700-I727 HydrophobicContact CE1-CD1 4.43Å
701	W	90.8	Very high	90.5	Very high	90 Å²	90	38.3 Å²	38.3	34%	0.341	20%	0.203	S	C	.	.	H	α-helix	trans	-62.2	-23.5	173.7	-79.2	115.6	0	0	0	114.5	E697 A699 E722 N725 A726 H729 L730	E697-W701 PolarHBondContact O-N 2.98Å; E697-W701 VanDerWaalsContact O-N 3.1Å; A699-W701 PolarHBondContact O-N 2.88Å; W701-E722 VanDerWaalsContact CZ2-OE1 3.28Å; W701-E722 WeakPolarHBondContact CZ2-OE1 3.2Å; W701-E722 PolarHBondContact NE1-OE1 2.87Å; W701-N725 HydrophobicContact CZ2-CB 4.16Å; W701-A726 HydrophobicContact CD2-CB 3.57Å; W701-A726 HydrophobicContact CE3-CB 4.01Å; W701-A726 HydrophobicContact CG-CB 3.84Å; W701-A726 HydrophobicContact CH2-CB 4.45Å; W701-A726 HydrophobicContact CZ2-CB 4.08Å; W701-A726 HydrophobicContact CZ3-CB 4.42Å; W701-H729 HydrophobicContact CH2-CB 3.96Å; W701-H729 HydrophobicContact CZ3-CB 4.12Å; W701-L730 HydrophobicContact CE3-CD1 3.92Å; W701-L730 HydrophobicContact CE3-CG 4.26Å; W701-L730 HydrophobicContact CZ3-CD1 4.35Å; W701-L730 HydrophobicContact CZ3-CD2 4.41Å; W701-L730 HydrophobicContact CZ3-CG 4.18Å
702	S	89.1	Confident	90.8	Very high	43 Å²	43	37.7 Å²	37.7	30%	0.301	20%	0.199	S	C	.	.	H	α-helix	trans	-112.2	-13.5	-173.2	62.4	0	0	0	0	115.5	S675 L698 A699 F700	S675-S702 VanDerWaalsContact CB-O 3.31Å; S675-S702 WeakPolarHBondContact CB-O 3.43Å; L698-S702 WeakPolarHBondContact O-CB 3.47Å; L698-S702 PolarHBondContact O-N 2.8Å; L698-S702 PolarHBondContact O-OG 3.13Å; A699-S702 PolarHBondContact O-N 3.09Å; A699-S702 VanDerWaalsContact O-N 3.15Å; A699-S702 PolarHBondContact O-OG 2.88Å; F700-S702 PolarHBondContact O-N 3.28Å
703	C	89.8	Confident	91	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.02	20%	0.199	C	C	.	.	H	α-helix	trans	-113.7	-13.3	179.8	79.9	0	0	0	0	115.6	L674 I678 A699 L705	L674-C703 HydrophobicContact CD2-CB 4.18Å; L674-C703 HydrophobicContact CG-CB 4.27Å; I678-C703 HydrophobicContact CB-CB 4.38Å; I678-C703 HydrophobicContact CD1-CB 3.68Å; I678-C703 HydrophobicContact CG2-CB 4.33Å; I678-C703 WeakPolarHBondContact CG2-O 3.46Å; A699-C703 WeakPolarHBondContact O-CB 3.38Å; A699-C703 PolarHBondContact O-N 3.24Å; A699-C703 PolarHBondContact O-SG 3.36Å; C703-L705 PolarHBondContact O-N 3.32Å; C703-L705 VanDerWaalsContact O-N 3.15Å
704	L	90.3	Very high	91.4	Very high	10 Å²	10	40.2 Å²	40.2	5%	0.052	21%	0.208	C	C	.	.			trans	-80.2	100.7	-177.3	-67.7	-176.2	0	0	0	112.2	L687 F700 I708 L711 I727 L730 L731	L687-L704 HydrophobicContact CD2-CD2 4.03Å; F700-L704 HydrophobicContact CB-CD1 4.06Å; F700-L704 HydrophobicContact CB-CG 4.42Å; F700-L704 HydrophobicContact CD1-CD1 4.15Å; F700-L704 HydrophobicContact CD1-CD2 4.46Å; F700-L704 HydrophobicContact CD1-CG 4.41Å; F700-L704 WeakPolarHBondContact O-CB 3.08Å; F700-L704 WeakPolarHBondContact O-CG 3.37Å; F700-L704 PolarHBondContact O-N 2.98Å; L704-I708 HydrophobicContact CD2-CD1 4.1Å; L704-L711 HydrophobicContact CD2-CD1 4.24Å; L704-L711 HydrophobicContact CD2-CD2 4.1Å; L704-I727 HydrophobicContact CD1-CB 4.3Å; L704-I727 HydrophobicContact CD1-CG1 3.52Å; L704-L730 HydrophobicContact CB-CB 4.12Å; L704-L730 HydrophobicContact CB-CD1 3.88Å; L704-L731 HydrophobicContact CB-CD2 3.96Å; L704-L731 HydrophobicContact CB-CG 4.39Å; L704-L731 HydrophobicContact CD1-CD1 4.24Å; L704-L731 HydrophobicContact CD1-CG 4.3Å; L704-L731 HydrophobicContact CD2-CD1 4.18Å
705	L	89.9	Confident	91.5	Very high	33 Å²	33	38.5 Å²	38.5	17%	0.173	20%	0.198	C	C	.	.			trans	-77.1	135.3	173.8	-65	169.9	0	0	0	111.2	I678 I684 C703 S707 I708 L731	I678-L705 HydrophobicContact CG2-CD1 4.07Å; I678-L705 HydrophobicContact CG2-CG 4.37Å; I684-L705 HydrophobicContact CB-CD1 4.48Å; I684-L705 HydrophobicContact CD1-CD1 4.03Å; C703-L705 PolarHBondContact O-N 3.32Å; C703-L705 VanDerWaalsContact O-N 3.15Å; L705-S707 PolarHBondContact O-N 2.71Å; L705-I708 HydrophobicContact CB-CD1 4.28Å; L705-I708 HydrophobicContact CB-CG1 4.36Å; L705-I708 WeakPolarHBondContact O-CB 3.19Å; L705-I708 VanDerWaalsContact O-CG1 3.28Å; L705-I708 WeakPolarHBondContact O-CG1 3.48Å; L705-I708 PolarHBondContact O-N 2.84Å; L705-L731 WeakPolarHBondContact O-CD2 3.32Å
706	P	89.2	Confident	91.6	Very high	78 Å²	78	38.5 Å²	38.5	51%	0.506	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-9.8	179.8	-27	35.5	0	0	0	116.2	I708 L730	P706-I708 VanDerWaalsContact C-N 3.34Å; P706-L730 WeakPolarHBondContact CA-O 3.41Å
707	S	89.7	Confident	91.6	Very high	47 Å²	47	39.4 Å²	39.4	33%	0.329	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-6.1	175.5	60.1	0	0	0	0	114.6	I684 L705 E709	I684-S707 CarbonylContact O-C 3.59Å; I684-S707 WeakPolarHBondContact O-CB 3.48Å; I684-S707 PolarHBondContact O-OG 3.22Å; L705-S707 PolarHBondContact O-N 2.71Å; S707-E709 PolarHBondContact O-N 3.46Å
708	I	94.1	Very high	91.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.			trans	-72.5	114.7	-177.7	-64	167.1	0	0	0	110	I684 L687 L704 L705 P706 Y710 L711 L731	I684-I708 HydrophobicContact CG2-CG1 4.02Å; L687-I708 HydrophobicContact CB-CD1 4.16Å; L687-I708 HydrophobicContact CB-CG2 4.47Å; L687-I708 HydrophobicContact CD2-CD1 3.74Å; L704-I708 HydrophobicContact CD2-CD1 4.1Å; L705-I708 HydrophobicContact CB-CD1 4.28Å; L705-I708 HydrophobicContact CB-CG1 4.36Å; L705-I708 WeakPolarHBondContact O-CB 3.19Å; L705-I708 VanDerWaalsContact O-CG1 3.28Å; L705-I708 WeakPolarHBondContact O-CG1 3.48Å; L705-I708 PolarHBondContact O-N 2.84Å; P706-I708 VanDerWaalsContact C-N 3.34Å; I708-Y710 VanDerWaalsContact CG2-O 3.28Å; I708-Y710 WeakPolarHBondContact CG2-O 3.27Å; I708-L711 HydrophobicContact CG2-CB 4.23Å; I708-L731 HydrophobicContact CB-CD1 4.36Å; I708-L731 HydrophobicContact CB-CD2 3.93Å; I708-L731 HydrophobicContact CD1-CD2 4.28Å; I708-L731 HydrophobicContact CG2-CD1 4.22Å
709	E	94.8	Very high	91.6	Very high	30 Å²	30	35.4 Å²	35.4	14%	0.14	18%	0.183	C	C	.	.	S	Bend	trans	-94.3	-21.8	175.6	-65.8	177.8	-143.5	0	0	112.1	K685 S707 K735 C736	K685-E709 IonicContact NZ-OE1 2.64Å; K685-E709 PolarHBondContact NZ-OE1 3.24Å; K685-E709 PolarHBondContact O-N 3.4Å; S707-E709 PolarHBondContact O-N 3.46Å; E709-K735 HydrophobicContact CB-CD 4.21Å; E709-K735 HydrophobicContact CB-CG 4.19Å; E709-K735 HydrophobicContact CG-CD 4.28Å; E709-K735 WeakPolarHBondContact O-CA 3.47Å; E709-K735 WeakPolarHBondContact O-CB 3.44Å; E709-K735 PolarHBondContact O-N 2.97Å; E709-K735 IonicContact OE1-NZ 2.77Å; E709-K735 WeakPolarHBondContact OE2-CD 3.11Å; E709-K735 VanDerWaalsContact OE2-CE 3.29Å; E709-K735 WeakPolarHBondContact OE2-CE 3.49Å; E709-K735 IonicContact OE2-NZ 2.63Å; E709-K735 PolarHBondContact OE2-NZ 2.93Å; E709-C736 PolarHBondContact O-N 3.01Å
710	Y	96.2	Very high	91.6	Very high	89 Å²	89	36.7 Å²	36.7	35%	0.349	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	117.7	-178	-56.9	-106.3	0	0	0	109.3	K685 Q686 L687 I708 C736	K685-Y710 PolarHBondContact O-N 2.77Å; Q686-Y710 CarbonylContact C-O 3.4Å; Q686-Y710 VanDerWaalsContact CA-O 3.32Å; Q686-Y710 WeakPolarHBondContact CA-O 3.32Å; Q686-Y710 HydrophobicContact CG-CD2 3.77Å; Q686-Y710 HydrophobicContact CG-CG 4.02Å; Q686-Y710 VanDerWaalsContact NE2-CD2 3.34Å; Q686-Y710 VanDerWaalsContact NE2-CG 3.27Å; L687-Y710 PolarHBondContact N-O 3.39Å; I708-Y710 VanDerWaalsContact CG2-O 3.28Å; I708-Y710 WeakPolarHBondContact CG2-O 3.27Å; Y710-C736 WeakPolarHBondContact CA-O 3.49Å; Y710-C736 HydrophobicContact CD1-CB 3.42Å; Y710-C736 VanDerWaalsContact CD1-CB 3.42Å; Y710-C736 HydrophobicContact CE1-CB 3.88Å; Y710-C736 HydrophobicContact CG-CB 4.2Å
711	L	96.6	Very high	91.7	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	126.7	173.8	175.6	63	0	0	0	109.4	L687 F689 L704 I708 V713 I727 L731 L734 C736 F737 K738	L687-L711 HydrophobicContact CB-CD1 4.23Å; L687-L711 HydrophobicContact CD2-CD1 4.35Å; L687-L711 HydrophobicContact CG-CD1 4.28Å; L687-L711 WeakPolarHBondContact O-CA 3.4Å; F689-L711 HydrophobicContact CD2-CD1 4.41Å; F689-L711 HydrophobicContact CE2-CD1 4.45Å; L704-L711 HydrophobicContact CD2-CD1 4.24Å; L704-L711 HydrophobicContact CD2-CD2 4.1Å; I708-L711 HydrophobicContact CG2-CB 4.23Å; L711-V713 HydrophobicContact CD1-CG2 4.14Å; L711-V713 HydrophobicContact CG-CG2 4.24Å; L711-I727 HydrophobicContact CD2-CD1 3.85Å; L711-I727 HydrophobicContact CD2-CG1 3.75Å; L711-I727 HydrophobicContact CD2-CG2 4.24Å; L711-L731 HydrophobicContact CB-CD1 4.36Å; L711-L731 HydrophobicContact CD2-CD1 3.83Å; L711-L734 HydrophobicContact CB-CD1 3.95Å; L711-C736 PolarHBondContact N-O 2.81Å; L711-F737 HydrophobicContact CB-CD2 4.25Å; L711-F737 HydrophobicContact CD2-CD2 4.18Å; L711-F737 HydrophobicContact CD2-CE2 3.88Å; L711-F737 HydrophobicContact CG-CD2 4.32Å; L711-F737 HydrophobicContact CG-CE2 4.28Å; L711-F737 WeakPolarHBondContact O-CA 3.49Å; L711-K738 PolarHBondContact O-N 2.94Å
712	T	95.8	Very high	91.8	Very high	20 Å²	20	37 Å²	37	12%	0.123	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.6	171.9	83	0	0	0	0	110.7	L687 E688 F689 K738	L687-T712 PolarHBondContact O-N 3Å; E688-T712 CarbonylContact C-O 3.53Å; E688-T712 WeakPolarHBondContact CA-O 3.25Å; E688-T712 VanDerWaalsContact CB-OG1 3.23Å; E688-T712 WeakPolarHBondContact CB-OG1 3.3Å; E688-T712 HydrophobicContact CG-CG2 4.22Å; E688-T712 WeakPolarHBondContact CG-OG1 3.35Å; E688-T712 VanDerWaalsContact OE1-CG2 3.24Å; E688-T712 WeakPolarHBondContact OE1-CG2 3.42Å; E688-T712 PolarHBondContact OE1-OG1 2.93Å; F689-T712 PolarHBondContact N-O 3.09Å; T712-K738 CarbonylContact C-O 3.07Å; T712-K738 WeakPolarHBondContact CA-O 3.22Å; T712-K738 HydrophobicContact CG2-CB 4.03Å; T712-K738 HydrophobicContact CG2-CD 3.79Å; T712-K738 HydrophobicContact CG2-CG 4.15Å
713	V	95	Very high	92.1	Very high	2 Å²	2	35 Å²	35	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	121.1	177.4	-172.9	0	0	0	0	108.1	F689 F700 L711 C716 V719 K738 F739 Q740	F689-V713 HydrophobicContact CB-CG1 4.35Å; F689-V713 HydrophobicContact CD2-CG2 4.19Å; F689-V713 CarbonylContact O-C 3.59Å; F689-V713 WeakPolarHBondContact O-CA 3.5Å; F700-V713 HydrophobicContact CE1-CG2 3.91Å; F700-V713 HydrophobicContact CZ-CG1 4.23Å; F700-V713 HydrophobicContact CZ-CG2 4.23Å; L711-V713 HydrophobicContact CD1-CG2 4.14Å; L711-V713 HydrophobicContact CG-CG2 4.24Å; V713-C716 HydrophobicContact CG1-CB 4.04Å; V713-V719 HydrophobicContact CG1-CG1 4.21Å; V713-K738 PolarHBondContact N-O 3.01Å; V713-F739 HydrophobicContact CB-CD2 3.52Å; V713-F739 HydrophobicContact CB-CE2 3.63Å; V713-F739 HydrophobicContact CB-CG 4.31Å; V713-F739 HydrophobicContact CB-CZ 4.46Å; V713-F739 HydrophobicContact CG1-CD2 4.26Å; V713-F739 HydrophobicContact CG1-CE2 3.95Å; V713-F739 HydrophobicContact CG1-CZ 4.35Å; V713-F739 HydrophobicContact CG2-CD2 3.6Å; V713-F739 HydrophobicContact CG2-CE2 3.5Å; V713-F739 VanDerWaalsContact CG2-CE2 3.5Å; V713-F739 CarbonylContact O-C 3.53Å; V713-F739 WeakPolarHBondContact O-CA 3.37Å; V713-Q740 PolarHBondContact O-N 2.92Å
714	F	93.7	Very high	92.3	Very high	104 Å²	104	34.8 Å²	34.8	46%	0.456	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	119.7	-171.6	-169.4	-89.5	0	0	0	110.8	F689 E690 C691 C716 Q740	F689-F714 PolarHBondContact O-N 3.32Å; E690-F714 CarbonylContact C-O 3.59Å; E690-F714 WeakPolarHBondContact CA-O 3.42Å; E690-F714 HydrophobicContact CG-CD1 4.42Å; C691-F714 PolarHBondContact N-O 3.42Å; F714-C716 VanDerWaalsContact C-N 3.26Å; F714-C716 PolarHBondContact O-N 3.43Å; F714-Q740 HydrophobicContact CD2-CB 4.28Å
715	D	88.8	Confident	92.5	Very high	44 Å²	44	36 Å²	36	24%	0.235	19%	0.189	C	C	.	.	S	Bend	trans	55.6	33.8	174	-163.9	48.8	0	0	0	114.9	C691 N693 Y742	C691-D715 WeakPolarHBondContact CA-O 3.44Å; C691-D715 PolarHBondContact SG-OD2 2.81Å; N693-D715 PolarHBondContact OD1-O 3.13Å; N693-D715 VanDerWaalsContact OD1-O 3.08Å; D715-Y742 PolarHBondContact OD1-OH 2.57Å
716	C	90.1	Very high	92.7	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.014	18%	0.181	C	C	.	.			trans	-86.7	108.1	168.7	-62.6	0	0	0	0	108.8	C692 V713 F714 N718 V719	C692-C716 PolarHBondContact N-SG 3.02Å; C692-C716 VanDerWaalsContact N-SG 3.4Å; V713-C716 HydrophobicContact CG1-CB 4.04Å; F714-C716 VanDerWaalsContact C-N 3.26Å; F714-C716 PolarHBondContact O-N 3.43Å; C716-N718 PolarHBondContact O-N 3.28Å; C716-V719 HydrophobicContact CB-CG1 3.74Å; C716-V719 WeakPolarHBondContact O-CG2 3.45Å
717	I	87.9	Confident	93	Very high	58 Å²	58	30.7 Å²	30.7	30%	0.297	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-31.8	-167.5	-67.3	167.8	0	0	0	113.7	N693 V719	N693-I717 WeakPolarHBondContact OD1-CG1 3.35Å; N693-I717 PolarHBondContact OD1-N 2.8Å; I717-V719 VanDerWaalsContact C-N 3.33Å; I717-V719 PolarHBondContact O-N 2.76Å
718	N	88.1	Confident	93.1	Very high	83 Å²	83	28.6 Å²	28.6	44%	0.444	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	5.1	-173.6	-72.3	-2.3	0	0	0	114.6	N693 F695 C716	N693-N718 VanDerWaalsContact O-CG 3.3Å; N693-N718 PolarHBondContact O-ND2 2.85Å; F695-N718 WeakPolarHBondContact O-CB 3.46Å; C716-N718 PolarHBondContact O-N 3.28Å
719	V	89.9	Confident	93	Very high	5 Å²	5	33.9 Å²	33.9	3%	0.03	17%	0.167	C	C	.	.			trans	-73.1	141.6	-179.3	-56.3	0	0	0	0	112.5	F700 V713 C716 I717 F739 A741	F700-V719 HydrophobicContact CE2-CG1 3.89Å; F700-V719 HydrophobicContact CZ-CG1 4.03Å; V713-V719 HydrophobicContact CG1-CG1 4.21Å; C716-V719 HydrophobicContact CB-CG1 3.74Å; C716-V719 WeakPolarHBondContact O-CG2 3.45Å; I717-V719 VanDerWaalsContact C-N 3.33Å; I717-V719 PolarHBondContact O-N 2.76Å; V719-F739 HydrophobicContact CB-CE1 4Å; V719-F739 HydrophobicContact CB-CZ 3.86Å; V719-F739 HydrophobicContact CG1-CZ 4.13Å; V719-F739 HydrophobicContact CG2-CE1 3.63Å; V719-F739 HydrophobicContact CG2-CZ 3.98Å; V719-A741 HydrophobicContact CG2-CB 3.48Å; V719-A741 VanDerWaalsContact CG2-CB 3.48Å
720	S	91.8	Very high	92.9	Very high	27 Å²	27	34.5 Å²	34.5	19%	0.189	17%	0.17	C	C	.	.			trans	-135.9	171.3	-165.2	60.9	0	0	0	0	111.8	E697 E722 S723 M724	E697-S720 PolarHBondContact OE2-OG 2.82Å; S720-E722 PolarHBondContact O-N 3.07Å; S720-E722 PolarHBondContact OG-N 3.32Å; S720-S723 PolarHBondContact N-OG 3.34Å; S720-S723 VanDerWaalsContact N-OG 3.1Å; S720-S723 WeakPolarHBondContact O-CA 3.37Å; S720-S723 WeakPolarHBondContact O-CB 3.48Å; S720-S723 PolarHBondContact O-N 3.07Å; S720-S723 PolarHBondContact OG-N 2.9Å; S720-S723 PolarHBondContact OG-OG 3.46Å; S720-M724 PolarHBondContact O-N 2.79Å
721	D	94.3	Very high	92.7	Very high	30 Å²	30	30.2 Å²	30.2	16%	0.16	15%	0.154	C	C	.	.	H	α-helix	trans	-57.2	-29.1	170.3	-73	-7.9	0	0	0	112	M724 N725 I744 T745 A748 Y751	D721-M724 WeakPolarHBondContact O-CB 3.43Å; D721-M724 PolarHBondContact O-N 3.49Å; D721-N725 PolarHBondContact O-N 3.49Å; D721-I744 VanDerWaalsContact OD1-CA 3.29Å; D721-I744 WeakPolarHBondContact OD1-CA 3.37Å; D721-T745 PolarHBondContact OD1-N 2.84Å; D721-T745 WeakPolarHBondContact OD2-CB 3.23Å; D721-T745 WeakPolarHBondContact OD2-CG2 3.33Å; D721-T745 PolarHBondContact OD2-OG1 2.89Å; D721-A748 HydrophobicContact CB-CB 4.31Å; D721-A748 WeakPolarHBondContact OD1-CB 3.44Å; D721-Y751 HydrophobicContact CB-CE2 4.48Å; D721-Y751 VanDerWaalsContact O-CE2 3.31Å; D721-Y751 WeakPolarHBondContact O-CE2 3.41Å
722	E	93.9	Very high	92.4	Very high	69 Å²	69	32 Å²	32	32%	0.322	17%	0.166	S	C	.	.	H	α-helix	trans	-74.5	-28	176.3	-168.1	53.3	-139.1	0	0	112.4	E697 W701 S720 M724 N725 A726	E697-E722 HydrophobicContact CB-CB 3.96Å; E697-E722 HydrophobicContact CB-CG 4Å; E697-E722 HydrophobicContact CG-CB 4.02Å; E697-E722 HydrophobicContact CG-CG 3.91Å; W701-E722 VanDerWaalsContact CZ2-OE1 3.28Å; W701-E722 WeakPolarHBondContact CZ2-OE1 3.2Å; W701-E722 PolarHBondContact NE1-OE1 2.87Å; S720-E722 PolarHBondContact O-N 3.07Å; S720-E722 PolarHBondContact OG-N 3.32Å; E722-M724 PolarHBondContact O-N 2.9Å; E722-N725 WeakPolarHBondContact O-CB 3.37Å; E722-N725 PolarHBondContact O-N 3.08Å; E722-N725 PolarHBondContact OE1-ND2 3.03Å; E722-N725 PolarHBondContact OE2-ND2 3.35Å; E722-N725 VanDerWaalsContact OE2-ND2 3.11Å; E722-A726 PolarHBondContact O-N 3.37Å; E722-A726 VanDerWaalsContact O-N 3.13Å
723	S	94.1	Very high	92.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-36.6	167.6	-51.1	0	0	0	0	110.8	S720 I727	S720-S723 PolarHBondContact N-OG 3.34Å; S720-S723 VanDerWaalsContact N-OG 3.1Å; S720-S723 WeakPolarHBondContact O-CA 3.37Å; S720-S723 WeakPolarHBondContact O-CB 3.48Å; S720-S723 PolarHBondContact O-N 3.07Å; S720-S723 PolarHBondContact OG-N 2.9Å; S720-S723 PolarHBondContact OG-OG 3.46Å; S723-I727 WeakPolarHBondContact O-CD1 3.38Å; S723-I727 VanDerWaalsContact O-CG1 3.31Å; S723-I727 WeakPolarHBondContact O-CG1 3.18Å; S723-I727 PolarHBondContact O-N 3.18Å
724	M	94.1	Very high	92.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-72.9	-33.6	175.8	-69.2	-64	-50.4	0	0	113	S720 D721 E722 I727 G728 F737 F739 I744 A748 Y751 F752	S720-M724 PolarHBondContact O-N 2.79Å; D721-M724 WeakPolarHBondContact O-CB 3.43Å; D721-M724 PolarHBondContact O-N 3.49Å; E722-M724 PolarHBondContact O-N 2.9Å; M724-I727 PolarHBondContact O-N 3.11Å; M724-I727 HydrophobicContact SD-CD1 4.06Å; M724-G728 PolarHBondContact O-N 3.19Å; M724-F737 HydrophobicContact CE-CE1 3.68Å; M724-F737 HydrophobicContact CE-CZ 3.76Å; M724-F737 HydrophobicContact SD-CE1 4.02Å; M724-F737 HydrophobicContact SD-CZ 3.59Å; M724-F737 VanDerWaalsContact SD-CZ 3.59Å; M724-F739 HydrophobicContact CG-CE1 4.47Å; M724-F739 HydrophobicContact SD-CD1 4.05Å; M724-F739 HydrophobicContact SD-CD2 4.32Å; M724-F739 HydrophobicContact SD-CE1 3.95Å; M724-F739 HydrophobicContact SD-CE2 4.21Å; M724-F739 HydrophobicContact SD-CG 4.24Å; M724-F739 HydrophobicContact SD-CZ 4.03Å; M724-I744 HydrophobicContact CG-CD1 3.42Å; M724-I744 VanDerWaalsContact CG-CD1 3.42Å; M724-I744 HydrophobicContact CG-CG1 4.07Å; M724-I744 HydrophobicContact SD-CD1 3.72Å; M724-A748 HydrophobicContact CB-CB 3.66Å; M724-A748 HydrophobicContact CG-CB 3.78Å; M724-Y751 HydrophobicContact CB-CD2 4.45Å; M724-F752 HydrophobicContact CE-CD2 4.43Å; M724-F752 HydrophobicContact CE-CE2 3.31Å; M724-F752 HydrophobicContact CE-CZ 3.5Å
725	N	94.9	Very high	92.1	Very high	35 Å²	35	33 Å²	33	19%	0.187	17%	0.169	C	C	.	.	H	α-helix	trans	-58.5	-49.1	171	-169.4	13.1	0	0	0	111	W701 D721 E722 I727 G728 H729 Y751	W701-N725 HydrophobicContact CZ2-CB 4.16Å; D721-N725 PolarHBondContact O-N 3.49Å; E722-N725 WeakPolarHBondContact O-CB 3.37Å; E722-N725 PolarHBondContact O-N 3.08Å; E722-N725 PolarHBondContact OE1-ND2 3.03Å; E722-N725 PolarHBondContact OE2-ND2 3.35Å; E722-N725 VanDerWaalsContact OE2-ND2 3.11Å; N725-I727 VanDerWaalsContact C-N 3.35Å; N725-I727 PolarHBondContact O-N 3.34Å; N725-G728 PolarHBondContact O-N 3.34Å; N725-H729 WeakPolarHBondContact O-CB 3.28Å; N725-H729 PolarHBondContact O-N 3.34Å; N725-Y751 HydrophobicContact CB-CD1 4.1Å; N725-Y751 HydrophobicContact CB-CD2 3.73Å; N725-Y751 HydrophobicContact CB-CE1 4.12Å; N725-Y751 HydrophobicContact CB-CE2 3.78Å; N725-Y751 HydrophobicContact CB-CG 3.92Å; N725-Y751 WeakPolarHBondContact OD1-CD1 3.42Å
726	A	94.2	Very high	92.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-55.8	-46.7	174.6	0	0	0	0	0	112.4	F700 W701 E722 H729 L730	F700-A726 HydrophobicContact CB-CB 3.76Å; W701-A726 HydrophobicContact CD2-CB 3.57Å; W701-A726 HydrophobicContact CE3-CB 4.01Å; W701-A726 HydrophobicContact CG-CB 3.84Å; W701-A726 HydrophobicContact CH2-CB 4.45Å; W701-A726 HydrophobicContact CZ2-CB 4.08Å; W701-A726 HydrophobicContact CZ3-CB 4.42Å; E722-A726 PolarHBondContact O-N 3.37Å; E722-A726 VanDerWaalsContact O-N 3.13Å; A726-H729 PolarHBondContact O-N 2.84Å; A726-L730 VanDerWaalsContact O-CB 3.27Å; A726-L730 WeakPolarHBondContact O-CB 3.48Å; A726-L730 VanDerWaalsContact O-CG 3.32Å; A726-L730 WeakPolarHBondContact O-CG 3.48Å; A726-L730 PolarHBondContact O-N 3.22Å
727	I	94.2	Very high	92.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.6	-48.3	178.9	-68.5	160.6	0	0	0	111.5	F700 L704 L711 S723 M724 N725 H729 L731 L734 F737 F739 F752	F700-I727 HydrophobicContact CD1-CD1 4.17Å; F700-I727 HydrophobicContact CD1-CG1 4.32Å; F700-I727 HydrophobicContact CE1-CD1 4.43Å; L704-I727 HydrophobicContact CD1-CB 4.3Å; L704-I727 HydrophobicContact CD1-CG1 3.52Å; L711-I727 HydrophobicContact CD2-CD1 3.85Å; L711-I727 HydrophobicContact CD2-CG1 3.75Å; L711-I727 HydrophobicContact CD2-CG2 4.24Å; S723-I727 WeakPolarHBondContact O-CD1 3.38Å; S723-I727 VanDerWaalsContact O-CG1 3.31Å; S723-I727 WeakPolarHBondContact O-CG1 3.18Å; S723-I727 PolarHBondContact O-N 3.18Å; M724-I727 PolarHBondContact O-N 3.11Å; M724-I727 HydrophobicContact SD-CD1 4.06Å; N725-I727 VanDerWaalsContact C-N 3.35Å; N725-I727 PolarHBondContact O-N 3.34Å; I727-H729 VanDerWaalsContact C-N 3.28Å; I727-H729 PolarHBondContact O-N 3.28Å; I727-L731 HydrophobicContact CG2-CD1 4.42Å; I727-L731 PolarHBondContact O-N 2.84Å; I727-L734 HydrophobicContact CG2-CD2 4.12Å; I727-F737 HydrophobicContact CD1-CE2 3.89Å; I727-F737 HydrophobicContact CD1-CZ 4.03Å; I727-F737 HydrophobicContact CG2-CD2 4.37Å; I727-F737 HydrophobicContact CG2-CE2 3.91Å; I727-F737 HydrophobicContact CG2-CZ 4.23Å; I727-F739 HydrophobicContact CD1-CD2 4.2Å; I727-F739 HydrophobicContact CD1-CE2 3.54Å; I727-F739 HydrophobicContact CD1-CZ 4.2Å; I727-F752 HydrophobicContact CG2-CE1 4.47Å; I727-F752 HydrophobicContact CG2-CZ 4.5Å
728	G	92.3	Very high	93.2	Very high	2 Å²	2	32.2 Å²	32.2	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-30.4	179	0	0	0	0	0	113.5	M724 N725 Q756	M724-G728 PolarHBondContact O-N 3.19Å; N725-G728 PolarHBondContact O-N 3.34Å; G728-Q756 PolarHBondContact O-NE2 2.88Å
729	H	92.4	Very high	93.5	Very high	112 Å²	112	28.3 Å²	28.3	52%	0.519	14%	0.142	S	C	.	.	H	α-helix	trans	-83.8	-46.4	179	-152.2	105.1	0	0	0	113.5	W701 N725 A726 I727	W701-H729 HydrophobicContact CH2-CB 3.96Å; W701-H729 HydrophobicContact CZ3-CB 4.12Å; N725-H729 WeakPolarHBondContact O-CB 3.28Å; N725-H729 PolarHBondContact O-N 3.34Å; A726-H729 PolarHBondContact O-N 2.84Å; I727-H729 VanDerWaalsContact C-N 3.28Å; I727-H729 PolarHBondContact O-N 3.28Å
730	L	92.4	Very high	93.7	Very high	42 Å²	42	29.2 Å²	29.2	22%	0.22	15%	0.146	C	C	.	.	H	α-helix	trans	-87.3	-23.4	-167.5	-63	175.8	0	0	0	114.4	W701 L704 P706 A726 P732	W701-L730 HydrophobicContact CE3-CD1 3.92Å; W701-L730 HydrophobicContact CE3-CG 4.26Å; W701-L730 HydrophobicContact CZ3-CD1 4.35Å; W701-L730 HydrophobicContact CZ3-CD2 4.41Å; W701-L730 HydrophobicContact CZ3-CG 4.18Å; L704-L730 HydrophobicContact CB-CB 4.12Å; L704-L730 HydrophobicContact CB-CD1 3.88Å; P706-L730 WeakPolarHBondContact CA-O 3.41Å; A726-L730 VanDerWaalsContact O-CB 3.27Å; A726-L730 WeakPolarHBondContact O-CB 3.48Å; A726-L730 VanDerWaalsContact O-CG 3.32Å; A726-L730 WeakPolarHBondContact O-CG 3.48Å; A726-L730 PolarHBondContact O-N 3.22Å; L730-P732 WeakPolarHBondContact O-CD 3.26Å
731	L	93.3	Very high	93.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.			trans	-111.2	85.7	-173	-55.4	-170.5	0	0	0	113.2	L704 L705 I708 L711 I727 L734 Q756	L704-L731 HydrophobicContact CB-CD2 3.96Å; L704-L731 HydrophobicContact CB-CG 4.39Å; L704-L731 HydrophobicContact CD1-CD1 4.24Å; L704-L731 HydrophobicContact CD1-CG 4.3Å; L704-L731 HydrophobicContact CD2-CD1 4.18Å; L705-L731 WeakPolarHBondContact O-CD2 3.32Å; I708-L731 HydrophobicContact CB-CD1 4.36Å; I708-L731 HydrophobicContact CB-CD2 3.93Å; I708-L731 HydrophobicContact CD1-CD2 4.28Å; I708-L731 HydrophobicContact CG2-CD1 4.22Å; L711-L731 HydrophobicContact CB-CD1 4.36Å; L711-L731 HydrophobicContact CD2-CD1 3.83Å; I727-L731 HydrophobicContact CG2-CD1 4.42Å; I727-L731 PolarHBondContact O-N 2.84Å; L731-L734 HydrophobicContact CB-CB 4.1Å; L731-L734 HydrophobicContact CB-CD2 4.36Å; L731-L734 HydrophobicContact CD1-CD1 4.11Å; L731-L734 HydrophobicContact CD1-CD2 4.27Å; L731-Q756 WeakPolarHBondContact O-CG 3.46Å; L731-Q756 PolarHBondContact O-NE2 2.86Å
732	P	90.2	Very high	93.3	Very high	38 Å²	38	29.5 Å²	29.5	25%	0.247	14%	0.141	C	C	.	.	S	Bend	trans	-78.4	-29.6	176.2	31.3	-34.8	0	0	0	113.5	L730 L734 K755 N759	L730-P732 WeakPolarHBondContact O-CD 3.26Å; P732-L734 VanDerWaalsContact C-N 3.3Å; P732-L734 PolarHBondContact O-N 2.88Å; P732-K755 HydrophobicContact CB-CB 4.35Å; P732-N759 PolarHBondContact O-ND2 3.44Å
733	E	89.3	Confident	92.9	Very high	86 Å²	86	30.5 Å²	30.5	40%	0.402	15%	0.145	S	C	.	.	S	Bend	trans	-89	11.8	-177.1	-64.4	-55.8	124.8	0	0	113.7	K735 N759	E733-K735 WeakPolarHBondContact O-CG 3.44Å; E733-K735 PolarHBondContact O-N 3.05Å; E733-N759 PolarHBondContact OE1-ND2 2.83Å; E733-N759 PolarHBondContact OE2-ND2 2.96Å
734	L	94	Very high	92.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.145	C	C	.	.			trans	-66.4	120	-174.3	-168.2	60.6	0	0	0	111.9	L711 I727 L731 P732 F737 N759 M760	L711-L734 HydrophobicContact CB-CD1 3.95Å; I727-L734 HydrophobicContact CG2-CD2 4.12Å; L731-L734 HydrophobicContact CB-CB 4.1Å; L731-L734 HydrophobicContact CB-CD2 4.36Å; L731-L734 HydrophobicContact CD1-CD1 4.11Å; L731-L734 HydrophobicContact CD1-CD2 4.27Å; P732-L734 VanDerWaalsContact C-N 3.3Å; P732-L734 PolarHBondContact O-N 2.88Å; L734-F737 HydrophobicContact CD2-CB 3.96Å; L734-F737 HydrophobicContact CD2-CD2 4.02Å; L734-F737 HydrophobicContact CD2-CG 4.15Å; L734-F737 HydrophobicContact CG-CB 4.36Å; L734-N759 CarbonylContact O-C 3.37Å; L734-M760 VanDerWaalsContact O-CA 3.23Å; L734-M760 WeakPolarHBondContact O-CA 3.44Å; L734-M760 WeakPolarHBondContact O-CB 3.43Å; L734-M760 PolarHBondContact O-N 3.09Å
735	K	94.9	Very high	92.9	Very high	60 Å²	60	33.1 Å²	33.1	26%	0.261	16%	0.162	S	C	.	.			trans	-105.8	-39	-177.2	-53.8	-174.7	-176.4	163.7	0	112.6	E709 E733 N759 H761 T762	E709-K735 HydrophobicContact CB-CD 4.21Å; E709-K735 HydrophobicContact CB-CG 4.19Å; E709-K735 HydrophobicContact CG-CD 4.28Å; E709-K735 WeakPolarHBondContact O-CA 3.47Å; E709-K735 WeakPolarHBondContact O-CB 3.44Å; E709-K735 PolarHBondContact O-N 2.97Å; E709-K735 IonicContact OE1-NZ 2.77Å; E709-K735 WeakPolarHBondContact OE2-CD 3.11Å; E709-K735 VanDerWaalsContact OE2-CE 3.29Å; E709-K735 WeakPolarHBondContact OE2-CE 3.49Å; E709-K735 IonicContact OE2-NZ 2.63Å; E709-K735 PolarHBondContact OE2-NZ 2.93Å; E733-K735 WeakPolarHBondContact O-CG 3.44Å; E733-K735 PolarHBondContact O-N 3.05Å; K735-N759 WeakPolarHBondContact CA-O 3.37Å; K735-N759 HydrophobicContact CG-CB 4.4Å; K735-H761 PolarHBondContact O-N 3.3Å; K735-T762 PolarHBondContact O-N 3.37Å
736	C	95.9	Very high	92.9	Very high	15 Å²	15	33.3 Å²	33.3	10%	0.101	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	121.7	177.7	-177.3	0	0	0	0	109.9	E709 Y710 L711 T762	E709-C736 PolarHBondContact O-N 3.01Å; Y710-C736 WeakPolarHBondContact CA-O 3.49Å; Y710-C736 HydrophobicContact CD1-CB 3.42Å; Y710-C736 VanDerWaalsContact CD1-CB 3.42Å; Y710-C736 HydrophobicContact CE1-CB 3.88Å; Y710-C736 HydrophobicContact CG-CB 4.2Å; L711-C736 PolarHBondContact N-O 2.81Å; C736-T762 WeakPolarHBondContact CA-O 3.38Å
737	F	96.3	Very high	92.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.3	175.9	-176.6	-123	0	0	0	109.7	L711 M724 I727 L734 F739 F752 T762 M763 E764 L765	L711-F737 HydrophobicContact CB-CD2 4.25Å; L711-F737 HydrophobicContact CD2-CD2 4.18Å; L711-F737 HydrophobicContact CD2-CE2 3.88Å; L711-F737 HydrophobicContact CG-CD2 4.32Å; L711-F737 HydrophobicContact CG-CE2 4.28Å; L711-F737 WeakPolarHBondContact O-CA 3.49Å; M724-F737 HydrophobicContact CE-CE1 3.68Å; M724-F737 HydrophobicContact CE-CZ 3.76Å; M724-F737 HydrophobicContact SD-CE1 4.02Å; M724-F737 HydrophobicContact SD-CZ 3.59Å; M724-F737 VanDerWaalsContact SD-CZ 3.59Å; I727-F737 HydrophobicContact CD1-CE2 3.89Å; I727-F737 HydrophobicContact CD1-CZ 4.03Å; I727-F737 HydrophobicContact CG2-CD2 4.37Å; I727-F737 HydrophobicContact CG2-CE2 3.91Å; I727-F737 HydrophobicContact CG2-CZ 4.23Å; L734-F737 HydrophobicContact CD2-CB 3.96Å; L734-F737 HydrophobicContact CD2-CD2 4.02Å; L734-F737 HydrophobicContact CD2-CG 4.15Å; L734-F737 HydrophobicContact CG-CB 4.36Å; F737-F739 HydrophobicContact CE1-CB 3.75Å; F737-F739 HydrophobicContact CE1-CD2 4.31Å; F737-F739 HydrophobicContact CE1-CG 4.2Å; F737-F739 HydrophobicContact CE2-CB 4.18Å; F737-F739 AromaticContact CE2-CD2 3.53Å; F737-F739 HydrophobicContact CE2-CD2 3.53Å; F737-F739 HydrophobicContact CE2-CE2 4.27Å; F737-F739 HydrophobicContact CE2-CG 4.2Å; F737-F739 HydrophobicContact CZ-CB 3.53Å; F737-F739 AromaticContact CZ-CD2 3.27Å; F737-F739 HydrophobicContact CZ-CD2 3.27Å; F737-F739 HydrophobicContact CZ-CE2 4.05Å; F737-F739 AromaticContact CZ-CG 3.55Å; F737-F739 HydrophobicContact CZ-CG 3.55Å; F737-F752 HydrophobicContact CD1-CZ 4.02Å; F737-F752 AromaticContact CE1-CZ 3.93Å; F737-F752 HydrophobicContact CE1-CZ 3.93Å; F737-T762 PolarHBondContact N-O 3.03Å; F737-M763 HydrophobicContact CD1-CE 3.87Å; F737-M763 HydrophobicContact CD1-CG 4.36Å; F737-M763 HydrophobicContact CE1-CE 4.48Å; F737-M763 CarbonylContact O-C 3.51Å; F737-M763 WeakPolarHBondContact O-CA 3.33Å; F737-E764 PolarHBondContact O-N 3.11Å; F737-L765 HydrophobicContact CD1-CD2 4.46Å; F737-L765 HydrophobicContact CE1-CD2 3.99Å
738	K	96.2	Very high	93	Very high	73 Å²	73	35.2 Å²	35.2	32%	0.317	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	126.8	174	-59.6	178.9	174.7	-99.4	0	108.6	L711 T712 V713 E764	L711-K738 PolarHBondContact O-N 2.94Å; T712-K738 CarbonylContact C-O 3.07Å; T712-K738 WeakPolarHBondContact CA-O 3.22Å; T712-K738 HydrophobicContact CG2-CB 4.03Å; T712-K738 HydrophobicContact CG2-CD 3.79Å; T712-K738 HydrophobicContact CG2-CG 4.15Å; V713-K738 PolarHBondContact N-O 3.01Å; K738-E764 WeakPolarHBondContact CA-O 3.43Å; K738-E764 HydrophobicContact CB-CB 4.44Å; K738-E764 HydrophobicContact CG-CB 4.12Å; K738-E764 HydrophobicContact CG-CG 4.39Å; K738-E764 IonicContact NZ-OE1 2.8Å; K738-E764 PolarHBondContact NZ-OE1 3.24Å; K738-E764 IonicContact NZ-OE2 3.4Å; K738-E764 PolarHBondContact NZ-OE2 3.01Å
739	F	95	Very high	93.1	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	117.8	-174.4	-146.7	-99.4	0	0	0	110.5	V713 V719 M724 I727 F737 A741 I744 E764 L765 T766	V713-F739 HydrophobicContact CB-CD2 3.52Å; V713-F739 HydrophobicContact CB-CE2 3.63Å; V713-F739 HydrophobicContact CB-CG 4.31Å; V713-F739 HydrophobicContact CB-CZ 4.46Å; V713-F739 HydrophobicContact CG1-CD2 4.26Å; V713-F739 HydrophobicContact CG1-CE2 3.95Å; V713-F739 HydrophobicContact CG1-CZ 4.35Å; V713-F739 HydrophobicContact CG2-CD2 3.6Å; V713-F739 HydrophobicContact CG2-CE2 3.5Å; V713-F739 VanDerWaalsContact CG2-CE2 3.5Å; V713-F739 CarbonylContact O-C 3.53Å; V713-F739 WeakPolarHBondContact O-CA 3.37Å; V719-F739 HydrophobicContact CB-CE1 4Å; V719-F739 HydrophobicContact CB-CZ 3.86Å; V719-F739 HydrophobicContact CG1-CZ 4.13Å; V719-F739 HydrophobicContact CG2-CE1 3.63Å; V719-F739 HydrophobicContact CG2-CZ 3.98Å; M724-F739 HydrophobicContact CG-CE1 4.47Å; M724-F739 HydrophobicContact SD-CD1 4.05Å; M724-F739 HydrophobicContact SD-CD2 4.32Å; M724-F739 HydrophobicContact SD-CE1 3.95Å; M724-F739 HydrophobicContact SD-CE2 4.21Å; M724-F739 HydrophobicContact SD-CG 4.24Å; M724-F739 HydrophobicContact SD-CZ 4.03Å; I727-F739 HydrophobicContact CD1-CD2 4.2Å; I727-F739 HydrophobicContact CD1-CE2 3.54Å; I727-F739 HydrophobicContact CD1-CZ 4.2Å; F737-F739 HydrophobicContact CE1-CB 3.75Å; F737-F739 HydrophobicContact CE1-CD2 4.31Å; F737-F739 HydrophobicContact CE1-CG 4.2Å; F737-F739 HydrophobicContact CE2-CB 4.18Å; F737-F739 AromaticContact CE2-CD2 3.53Å; F737-F739 HydrophobicContact CE2-CD2 3.53Å; F737-F739 HydrophobicContact CE2-CE2 4.27Å; F737-F739 HydrophobicContact CE2-CG 4.2Å; F737-F739 HydrophobicContact CZ-CB 3.53Å; F737-F739 AromaticContact CZ-CD2 3.27Å; F737-F739 HydrophobicContact CZ-CD2 3.27Å; F737-F739 HydrophobicContact CZ-CE2 4.05Å; F737-F739 AromaticContact CZ-CG 3.55Å; F737-F739 HydrophobicContact CZ-CG 3.55Å; F739-A741 HydrophobicContact CD1-CB 3.5Å; F739-A741 HydrophobicContact CE1-CB 3.51Å; F739-I744 HydrophobicContact CD1-CD1 3.49Å; F739-I744 VanDerWaalsContact CD1-CD1 3.49Å; F739-I744 HydrophobicContact CE1-CD1 3.5Å; F739-I744 HydrophobicContact CE1-CG1 4.45Å; F739-E764 PolarHBondContact N-O 3.04Å; F739-L765 HydrophobicContact CB-CD2 4.26Å; F739-T766 PolarHBondContact O-N 2.99Å
740	Q	94	Very high	93.1	Very high	23 Å²	23	33 Å²	33	11%	0.107	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	115	167.5	-179.3	166.2	-48.2	0	0	109.5	V713 F714 Y742 T766 Q767	V713-Q740 PolarHBondContact O-N 2.92Å; F714-Q740 HydrophobicContact CD2-CB 4.28Å; Q740-Y742 PolarHBondContact NE2-OH 2.94Å; Q740-T766 VanDerWaalsContact CA-O 3.27Å; Q740-T766 WeakPolarHBondContact CA-O 3.31Å; Q740-T766 HydrophobicContact CB-CG2 4.48Å; Q740-T766 HydrophobicContact CG-CG2 4.31Å; Q740-Q767 HydrophobicContact CG-CB 4.38Å; Q740-Q767 HydrophobicContact CG-CG 4.49Å
741	A	88.2	Confident	93.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.179	C	C	.	.			trans	-151.4	127.4	-173.9	0	0	0	0	0	112.5	V719 F739 I744 T766 Q767 C768	V719-A741 HydrophobicContact CG2-CB 3.48Å; V719-A741 VanDerWaalsContact CG2-CB 3.48Å; F739-A741 HydrophobicContact CD1-CB 3.5Å; F739-A741 HydrophobicContact CE1-CB 3.51Å; A741-I744 HydrophobicContact CB-CB 4.48Å; A741-I744 HydrophobicContact CB-CD1 3.72Å; A741-I744 HydrophobicContact CB-CG1 3.87Å; A741-T766 PolarHBondContact N-O 2.91Å; A741-T766 VanDerWaalsContact N-O 3.16Å; A741-Q767 CarbonylContact O-C 3.53Å; A741-C768 WeakPolarHBondContact O-CA 3.27Å
742	Y	89.7	Confident	93.1	Very high	64 Å²	64	34.9 Å²	34.9	25%	0.251	18%	0.18	S	C	.	.	S	Bend	trans	-87.1	-7.8	-173.9	-48.5	-68.8	0	0	0	114.2	D715 Q740 Q767	D715-Y742 PolarHBondContact OD1-OH 2.57Å; Q740-Y742 PolarHBondContact NE2-OH 2.94Å; Y742-Q767 HydrophobicContact CD1-CB 3.89Å; Y742-Q767 HydrophobicContact CE1-CB 3.82Å; Y742-Q767 HydrophobicContact CE1-CG 4.22Å
743	H	86.3	Confident	92.9	Very high	89 Å²	89	34.5 Å²	34.5	41%	0.412	18%	0.178	S	C	.	.	S	Bend	trans	-131.8	17.2	-167.6	-62.4	-35	0	0	0	113.7
744	I	92.5	Very high	92.7	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.			trans	-79.8	134.1	173.1	-81.9	-178.5	0	0	0	111.1	D721 M724 F739 A741 A748 D770 V771	D721-I744 VanDerWaalsContact OD1-CA 3.29Å; D721-I744 WeakPolarHBondContact OD1-CA 3.37Å; M724-I744 HydrophobicContact CG-CD1 3.42Å; M724-I744 VanDerWaalsContact CG-CD1 3.42Å; M724-I744 HydrophobicContact CG-CG1 4.07Å; M724-I744 HydrophobicContact SD-CD1 3.72Å; F739-I744 HydrophobicContact CD1-CD1 3.49Å; F739-I744 VanDerWaalsContact CD1-CD1 3.49Å; F739-I744 HydrophobicContact CE1-CD1 3.5Å; F739-I744 HydrophobicContact CE1-CG1 4.45Å; A741-I744 HydrophobicContact CB-CB 4.48Å; A741-I744 HydrophobicContact CB-CD1 3.72Å; A741-I744 HydrophobicContact CB-CG1 3.87Å; I744-A748 HydrophobicContact CG1-CB 4.49Å; I744-A748 HydrophobicContact CG2-CB 3.77Å; I744-D770 WeakPolarHBondContact O-CB 3.23Å; I744-V771 HydrophobicContact CG2-CG2 3.65Å
745	T	94.5	Very high	92.3	Very high	56 Å²	56	39.9 Å²	39.9	34%	0.344	21%	0.209	S	C	.	.			trans	-108.2	179.9	172.5	86.4	0	0	0	0	112.1	D721 A747 A748	D721-T745 PolarHBondContact OD1-N 2.84Å; D721-T745 WeakPolarHBondContact OD2-CB 3.23Å; D721-T745 WeakPolarHBondContact OD2-CG2 3.33Å; D721-T745 PolarHBondContact OD2-OG1 2.89Å; T745-A747 PolarHBondContact O-N 2.89Å; T745-A747 PolarHBondContact OG1-N 3.24Å; T745-A748 WeakPolarHBondContact O-CB 3.38Å; T745-A748 PolarHBondContact O-N 3.31Å
746	D	95.3	Very high	92	Very high	38 Å²	38	37 Å²	37	20%	0.203	20%	0.196	C	C	.	.	H	α-helix	trans	-60.2	-24.8	174.4	-64.6	-36.8	0	0	0	113.5	A748 L749 T772 G775	D746-A748 VanDerWaalsContact C-N 3.34Å; D746-A748 PolarHBondContact O-N 3.38Å; D746-L749 PolarHBondContact O-N 3.38Å; D746-T772 PolarHBondContact OD1-N 3.33Å; D746-T772 WeakPolarHBondContact OD2-CB 3.35Å; D746-T772 WeakPolarHBondContact OD2-CG2 3.43Å; D746-T772 PolarHBondContact OD2-OG1 3.32Å; D746-G775 VanDerWaalsContact CG-N 3.27Å; D746-G775 WeakPolarHBondContact OD1-CA 3.42Å; D746-G775 PolarHBondContact OD1-N 3.35Å
747	A	94.9	Very high	91.5	Very high	40 Å²	40	39.7 Å²	39.7	33%	0.331	20%	0.204	S	C	.	.	H	α-helix	trans	-62.2	-40.3	179.5	0	0	0	0	0	111.9	T745 L749 S750	T745-A747 PolarHBondContact O-N 2.89Å; T745-A747 PolarHBondContact OG1-N 3.24Å; A747-L749 PolarHBondContact O-N 2.95Å; A747-S750 WeakPolarHBondContact O-CB 3.34Å; A747-S750 PolarHBondContact O-N 3.45Å; A747-S750 PolarHBondContact O-OG 3.25Å
748	A	94.6	Very high	90.9	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-52.4	-39.4	175.7	0	0	0	0	0	113.6	D721 M724 I744 T745 D746 S750 Y751	D721-A748 HydrophobicContact CB-CB 4.31Å; D721-A748 WeakPolarHBondContact OD1-CB 3.44Å; M724-A748 HydrophobicContact CB-CB 3.66Å; M724-A748 HydrophobicContact CG-CB 3.78Å; I744-A748 HydrophobicContact CG1-CB 4.49Å; I744-A748 HydrophobicContact CG2-CB 3.77Å; T745-A748 WeakPolarHBondContact O-CB 3.38Å; T745-A748 PolarHBondContact O-N 3.31Å; D746-A748 VanDerWaalsContact C-N 3.34Å; D746-A748 PolarHBondContact O-N 3.38Å; A748-S750 PolarHBondContact O-N 3.38Å; A748-Y751 WeakPolarHBondContact O-CD2 3.38Å; A748-Y751 PolarHBondContact O-N 2.91Å
749	L	94.7	Very high	90.5	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-76.2	-16	-175.3	-57.8	-177.8	0	0	0	112.2	D746 A747 F752 L765 V771 G775 I776 L779	D746-L749 PolarHBondContact O-N 3.38Å; A747-L749 PolarHBondContact O-N 2.95Å; L749-F752 HydrophobicContact CD2-CD2 4.48Å; L749-F752 HydrophobicContact CD2-CE2 4.34Å; L749-L765 HydrophobicContact CD1-CD1 4.37Å; L749-L765 HydrophobicContact CD2-CD1 3.8Å; L749-V771 HydrophobicContact CD1-CG1 3.73Å; L749-V771 HydrophobicContact CD1-CG2 4.32Å; L749-G775 WeakPolarHBondContact CD1-O 3.34Å; L749-I776 HydrophobicContact CD1-CD1 4.28Å; L749-L779 HydrophobicContact CD1-CB 4.43Å; L749-L779 HydrophobicContact CD1-CD1 4.11Å; L749-L779 HydrophobicContact CD2-CD1 4.34Å
750	S	93	Very high	90.4	Very high	68 Å²	68	44.1 Å²	44.1	48%	0.476	23%	0.23	S	C	.	.	H	α-helix	trans	-76.8	-17.1	172.5	78.3	0	0	0	0	114.3	A747 A748 F752	A747-S750 WeakPolarHBondContact O-CB 3.34Å; A747-S750 PolarHBondContact O-N 3.45Å; A747-S750 PolarHBondContact O-OG 3.25Å; A748-S750 PolarHBondContact O-N 3.38Å; S750-F752 VanDerWaalsContact C-N 3.3Å; S750-F752 PolarHBondContact O-N 3.42Å
751	Y	92.7	Very high	90.5	Very high	76 Å²	76	46.6 Å²	46.6	30%	0.298	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-15.4	175.9	-55.9	-57.2	0	0	0	113.3	D721 M724 N725 A748 S753	D721-Y751 HydrophobicContact CB-CE2 4.48Å; D721-Y751 VanDerWaalsContact O-CE2 3.31Å; D721-Y751 WeakPolarHBondContact O-CE2 3.41Å; M724-Y751 HydrophobicContact CB-CD2 4.45Å; N725-Y751 HydrophobicContact CB-CD1 4.1Å; N725-Y751 HydrophobicContact CB-CD2 3.73Å; N725-Y751 HydrophobicContact CB-CE1 4.12Å; N725-Y751 HydrophobicContact CB-CE2 3.78Å; N725-Y751 HydrophobicContact CB-CG 3.92Å; N725-Y751 WeakPolarHBondContact OD1-CD1 3.42Å; A748-Y751 WeakPolarHBondContact O-CD2 3.38Å; A748-Y751 PolarHBondContact O-N 2.91Å; Y751-S753 PolarHBondContact O-N 3.01Å
752	F	92	Very high	90.9	Very high	5 Å²	5	47.7 Å²	47.7	2%	0.022	25%	0.248	C	C	.	.			trans	-70.8	128.4	172.2	-77.3	-68	0	0	0	111.1	M724 I727 F737 L749 S750 Q756 M763 L783	M724-F752 HydrophobicContact CE-CD2 4.43Å; M724-F752 HydrophobicContact CE-CE2 3.31Å; M724-F752 HydrophobicContact CE-CZ 3.5Å; I727-F752 HydrophobicContact CG2-CE1 4.47Å; I727-F752 HydrophobicContact CG2-CZ 4.5Å; F737-F752 HydrophobicContact CD1-CZ 4.02Å; F737-F752 AromaticContact CE1-CZ 3.93Å; F737-F752 HydrophobicContact CE1-CZ 3.93Å; L749-F752 HydrophobicContact CD2-CD2 4.48Å; L749-F752 HydrophobicContact CD2-CE2 4.34Å; S750-F752 VanDerWaalsContact C-N 3.3Å; S750-F752 PolarHBondContact O-N 3.42Å; F752-Q756 HydrophobicContact CD1-CG 4.3Å; F752-M763 HydrophobicContact CD1-CE 4.42Å; F752-M763 HydrophobicContact CD2-CE 3.88Å; F752-M763 HydrophobicContact CE1-CE 3.94Å; F752-M763 HydrophobicContact CE2-CE 3.3Å; F752-M763 HydrophobicContact CG-CE 4.4Å; F752-M763 HydrophobicContact CZ-CE 3.35Å; F752-L783 HydrophobicContact CB-CD1 3.92Å; F752-L783 HydrophobicContact CB-CD2 4.47Å; F752-L783 HydrophobicContact CB-CG 4.45Å; F752-L783 HydrophobicContact CD1-CD1 4.24Å; F752-L783 HydrophobicContact CD2-CD1 4.23Å; F752-L783 HydrophobicContact CG-CD1 3.87Å
753	S	86.8	Confident	91.2	Very high	31 Å²	31	44.7 Å²	44.7	22%	0.217	24%	0.236	C	C	.	.			trans	-112.1	175.3	-168.6	80.4	0	0	0	0	112.7	Y751 K755 Q756	Y751-S753 PolarHBondContact O-N 3.01Å; S753-K755 PolarHBondContact O-N 3.47Å; S753-K755 VanDerWaalsContact O-N 3.11Å; S753-K755 VanDerWaalsContact OG-CB 3.31Å; S753-K755 WeakPolarHBondContact OG-CB 3.46Å; S753-K755 VanDerWaalsContact OG-CG 3.27Å; S753-K755 WeakPolarHBondContact OG-CG 3.47Å; S753-K755 PolarHBondContact OG-N 2.97Å; S753-Q756 VanDerWaalsContact N-OE1 3.09Å; S753-Q756 PolarHBondContact O-N 2.84Å; S753-Q756 PolarHBondContact O-OE1 2.99Å; S753-Q756 PolarHBondContact OG-OE1 2.61Å
754	T	84.5	Confident	91.7	Very high	95 Å²	95	42.6 Å²	42.6	58%	0.583	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-20.5	171.8	58.3	0	0	0	0	113.7
755	K	86.5	Confident	91.8	Very high	104 Å²	104	42.6 Å²	42.6	45%	0.452	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-52.1	178.3	-56.6	170.8	-174.5	173.2	0	111.2	P732 S753 R757	P732-K755 HydrophobicContact CB-CB 4.35Å; S753-K755 PolarHBondContact O-N 3.47Å; S753-K755 VanDerWaalsContact O-N 3.11Å; S753-K755 VanDerWaalsContact OG-CB 3.31Å; S753-K755 WeakPolarHBondContact OG-CB 3.46Å; S753-K755 VanDerWaalsContact OG-CG 3.27Å; S753-K755 WeakPolarHBondContact OG-CG 3.47Å; S753-K755 PolarHBondContact OG-N 2.97Å; K755-R757 VanDerWaalsContact C-N 3.31Å; K755-R757 PolarHBondContact O-N 2.85Å
756	Q	87.5	Confident	91.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-68.5	-27.5	-173.8	-71.7	80.9	12.2	0	0	113.2	G728 L731 F752 S753 I758 N759 M760 L783	G728-Q756 PolarHBondContact O-NE2 2.88Å; L731-Q756 WeakPolarHBondContact O-CG 3.46Å; L731-Q756 PolarHBondContact O-NE2 2.86Å; F752-Q756 HydrophobicContact CD1-CG 4.3Å; S753-Q756 VanDerWaalsContact N-OE1 3.09Å; S753-Q756 PolarHBondContact O-N 2.84Å; S753-Q756 PolarHBondContact O-OE1 2.99Å; S753-Q756 PolarHBondContact OG-OE1 2.61Å; Q756-I758 PolarHBondContact O-N 3.5Å; Q756-N759 PolarHBondContact O-N 2.95Å; Q756-M760 WeakPolarHBondContact O-CB 3.38Å; Q756-M760 PolarHBondContact O-N 3Å; Q756-L783 HydrophobicContact CB-CD2 3.99Å
757	R	85.9	Confident	91.7	Very high	70 Å²	70	42.1 Å²	42.1	26%	0.264	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-51	-32.7	-175	-175.4	-171.5	-67.1	132.8	-7.9	115	K755 T782 N784 N785	K755-R757 VanDerWaalsContact C-N 3.31Å; K755-R757 PolarHBondContact O-N 2.85Å; R757-T782 WeakPolarHBondContact CB-O 3.41Å; R757-T782 WeakPolarHBondContact CG-O 3.34Å; R757-T782 PolarHBondContact NE-O 3.13Å; R757-T782 PolarHBondContact NH2-O 3.1Å; R757-N784 WeakPolarHBondContact CD-OD1 3.18Å; R757-N784 WeakPolarHBondContact CG-OD1 3.49Å; R757-N785 WeakPolarHBondContact O-CB 3.27Å; R757-N785 PolarHBondContact O-ND2 3.18Å
758	I	84.7	Confident	91.7	Very high	133 Å²	133	40.2 Å²	40.2	68%	0.682	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-78.9	-37.1	-177	-57.4	176.6	0	0	0	110.9	Q756	Q756-I758 PolarHBondContact O-N 3.5Å
759	N	87.6	Confident	91.5	Very high	32 Å²	32	43.4 Å²	43.4	17%	0.171	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-29	-171	-76.9	-38.6	0	0	0	113.5	P732 E733 L734 K735 Q756 H761	P732-N759 PolarHBondContact O-ND2 3.44Å; E733-N759 PolarHBondContact OE1-ND2 2.83Å; E733-N759 PolarHBondContact OE2-ND2 2.96Å; L734-N759 CarbonylContact O-C 3.37Å; K735-N759 WeakPolarHBondContact CA-O 3.37Å; K735-N759 HydrophobicContact CG-CB 4.4Å; Q756-N759 PolarHBondContact O-N 2.95Å; N759-H761 PolarHBondContact O-CE1 2.8Å; N759-H761 PolarHBondContact O-N 3.04Å; N759-H761 PolarHBondContact O-ND1 3.06Å
760	M	93.3	Very high	91.5	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	24%	0.239	C	C	.	.			trans	-81.3	115.1	-169.9	-152.7	-165.7	70.2	0	0	112.8	L734 Q756 M763 L783 L786	L734-M760 VanDerWaalsContact O-CA 3.23Å; L734-M760 WeakPolarHBondContact O-CA 3.44Å; L734-M760 WeakPolarHBondContact O-CB 3.43Å; L734-M760 PolarHBondContact O-N 3.09Å; Q756-M760 WeakPolarHBondContact O-CB 3.38Å; Q756-M760 PolarHBondContact O-N 3Å; M760-M763 HydrophobicContact CE-CB 3.8Å; M760-M763 HydrophobicContact CE-CE 3.86Å; M760-M763 HydrophobicContact CE-SD 4.18Å; M760-M763 HydrophobicContact SD-CB 4.38Å; M760-M763 HydrophobicContact SD-CE 3.72Å; M760-L783 HydrophobicContact CE-CB 3.89Å; M760-L783 HydrophobicContact CE-CD1 3.49Å; M760-L783 VanDerWaalsContact CE-CD1 3.49Å; M760-L783 HydrophobicContact CE-CD2 4.11Å; M760-L783 HydrophobicContact CE-CG 4Å; M760-L783 HydrophobicContact SD-CD1 4.12Å; M760-L786 HydrophobicContact CE-CD1 4.05Å; M760-L786 HydrophobicContact CE-CD2 3.64Å; M760-L786 HydrophobicContact CE-CG 3.8Å
761	H	94.5	Very high	91.6	Very high	75 Å²	75	43.4 Å²	43.4	35%	0.347	22%	0.216	S	C	.	.			trans	-107.2	-29.2	-178.1	-70.3	66.1	0	0	0	112.6	K735 N759 Q787 V788	K735-H761 PolarHBondContact O-N 3.3Å; N759-H761 PolarHBondContact O-CE1 2.8Å; N759-H761 PolarHBondContact O-N 3.04Å; N759-H761 PolarHBondContact O-ND1 3.06Å; H761-Q787 PolarHBondContact CD2-NE2 2.67Å; H761-Q787 VanDerWaalsContact CD2-NE2 3.34Å; H761-Q787 PolarHBondContact O-N 3.32Å; H761-V788 PolarHBondContact O-N 2.7Å
762	T	96.6	Very high	91.7	Very high	24 Å²	24	41.8 Å²	41.8	15%	0.147	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.6	-175.8	-60.5	0	0	0	0	110.7	K735 C736 F737 E764 V788	K735-T762 PolarHBondContact O-N 3.37Å; C736-T762 WeakPolarHBondContact CA-O 3.38Å; F737-T762 PolarHBondContact N-O 3.03Å; T762-E764 HydrophobicContact CG2-CG 4.03Å; T762-V788 WeakPolarHBondContact CA-O 3.21Å; T762-V788 HydrophobicContact CG2-CB 3.89Å; T762-V788 HydrophobicContact CG2-CG1 3.9Å
763	M	96.3	Very high	91.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	119.2	170.4	175.1	169	-90.2	0	0	109	F737 F752 M760 L765 L779 L783 L786 V788 L789 S790	F737-M763 HydrophobicContact CD1-CE 3.87Å; F737-M763 HydrophobicContact CD1-CG 4.36Å; F737-M763 HydrophobicContact CE1-CE 4.48Å; F737-M763 CarbonylContact O-C 3.51Å; F737-M763 WeakPolarHBondContact O-CA 3.33Å; F752-M763 HydrophobicContact CD1-CE 4.42Å; F752-M763 HydrophobicContact CD2-CE 3.88Å; F752-M763 HydrophobicContact CE1-CE 3.94Å; F752-M763 HydrophobicContact CE2-CE 3.3Å; F752-M763 HydrophobicContact CG-CE 4.4Å; F752-M763 HydrophobicContact CZ-CE 3.35Å; M760-M763 HydrophobicContact CE-CB 3.8Å; M760-M763 HydrophobicContact CE-CE 3.86Å; M760-M763 HydrophobicContact CE-SD 4.18Å; M760-M763 HydrophobicContact SD-CB 4.38Å; M760-M763 HydrophobicContact SD-CE 3.72Å; M763-L765 HydrophobicContact CG-CD2 4.36Å; M763-L765 HydrophobicContact CG-CG 4.09Å; M763-L765 HydrophobicContact SD-CD1 4.41Å; M763-L779 HydrophobicContact SD-CD1 3.57Å; M763-L779 VanDerWaalsContact SD-CD1 3.57Å; M763-L779 HydrophobicContact SD-CD2 4.13Å; M763-L779 HydrophobicContact SD-CG 3.78Å; M763-L783 HydrophobicContact CE-CD1 3.72Å; M763-L783 HydrophobicContact SD-CD1 4.16Å; M763-L786 HydrophobicContact CB-CD1 4.44Å; M763-L786 HydrophobicContact CB-CD2 3.76Å; M763-V788 PolarHBondContact N-O 2.68Å; M763-L789 HydrophobicContact CB-CD1 4.43Å; M763-L789 HydrophobicContact CG-CD1 4.43Å; M763-L789 CarbonylContact O-C 3.57Å; M763-L789 WeakPolarHBondContact O-CA 3.5Å; M763-S790 PolarHBondContact O-N 2.85Å
764	E	96.8	Very high	92.4	Very high	46 Å²	46	46.9 Å²	46.9	22%	0.215	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	96.6	178.1	-60.9	178.2	-159.2	0	0	110.3	F737 K738 F739 T762	F737-E764 PolarHBondContact O-N 3.11Å; K738-E764 WeakPolarHBondContact CA-O 3.43Å; K738-E764 HydrophobicContact CB-CB 4.44Å; K738-E764 HydrophobicContact CG-CB 4.12Å; K738-E764 HydrophobicContact CG-CG 4.39Å; K738-E764 IonicContact NZ-OE1 2.8Å; K738-E764 PolarHBondContact NZ-OE1 3.24Å; K738-E764 IonicContact NZ-OE2 3.4Å; K738-E764 PolarHBondContact NZ-OE2 3.01Å; F739-E764 PolarHBondContact N-O 3.04Å; T762-E764 HydrophobicContact CG2-CG 4.03Å
765	L	95.8	Very high	92.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	128.7	171.3	-55.9	178.9	0	0	0	108.4	F737 F739 L749 M763 L779 S790 L791 S792	F737-L765 HydrophobicContact CD1-CD2 4.46Å; F737-L765 HydrophobicContact CE1-CD2 3.99Å; F739-L765 HydrophobicContact CB-CD2 4.26Å; L749-L765 HydrophobicContact CD1-CD1 4.37Å; L749-L765 HydrophobicContact CD2-CD1 3.8Å; M763-L765 HydrophobicContact CG-CD2 4.36Å; M763-L765 HydrophobicContact CG-CG 4.09Å; M763-L765 HydrophobicContact SD-CD1 4.41Å; L765-L779 HydrophobicContact CD1-CD1 4Å; L765-S790 PolarHBondContact N-O 3.05Å; L765-S790 CarbonylContact O-C 3.51Å; L765-S790 VanDerWaalsContact O-O 3.1Å; L765-L791 HydrophobicContact CB-CD2 4.18Å; L765-L791 HydrophobicContact CD1-CD2 3.98Å; L765-L791 HydrophobicContact CG-CD2 4.42Å; L765-L791 CarbonylContact O-C 3.57Å; L765-L791 WeakPolarHBondContact O-CA 3.5Å; L765-S792 PolarHBondContact O-N 3.5Å
766	T	94.9	Very high	93.4	Very high	30 Å²	30	37.4 Å²	37.4	18%	0.184	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	129.7	-170.7	-53.5	0	0	0	0	110.5	F739 Q740 A741 C768 S792	F739-T766 PolarHBondContact O-N 2.99Å; Q740-T766 VanDerWaalsContact CA-O 3.27Å; Q740-T766 WeakPolarHBondContact CA-O 3.31Å; Q740-T766 HydrophobicContact CB-CG2 4.48Å; Q740-T766 HydrophobicContact CG-CG2 4.31Å; A741-T766 PolarHBondContact N-O 2.91Å; A741-T766 VanDerWaalsContact N-O 3.16Å; T766-C768 PolarHBondContact O-N 2.56Å; T766-C768 VanDerWaalsContact O-N 3.15Å; T766-S792 CarbonylContact C-O 3.4Å; T766-S792 WeakPolarHBondContact CA-O 3.14Å
767	Q	92.8	Very high	93.8	Very high	54 Å²	54	40.1 Å²	40.1	25%	0.252	20%	0.2	S	C	.	.	S	Bend	trans	54.4	24.9	-173.8	-55.7	-59.2	-28.4	0	0	114.6	Q740 A741 Y742 M769 S792	Q740-Q767 HydrophobicContact CG-CB 4.38Å; Q740-Q767 HydrophobicContact CG-CG 4.49Å; A741-Q767 CarbonylContact O-C 3.53Å; Y742-Q767 HydrophobicContact CD1-CB 3.89Å; Y742-Q767 HydrophobicContact CE1-CB 3.82Å; Y742-Q767 HydrophobicContact CE1-CG 4.22Å; Q767-M769 WeakPolarHBondContact O-CG 3.34Å; Q767-M769 PolarHBondContact O-N 2.75Å; Q767-S792 PolarHBondContact N-O 3.1Å
768	C	93.4	Very high	94.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.			trans	-75.4	65.1	173.5	-59.5	0	0	0	0	110.6	A741 T766 D770 V771	A741-C768 WeakPolarHBondContact O-CA 3.27Å; T766-C768 PolarHBondContact O-N 2.56Å; T766-C768 VanDerWaalsContact O-N 3.15Å; C768-D770 PolarHBondContact O-N 2.97Å; C768-D770 VanDerWaalsContact O-N 3.11Å; C768-V771 HydrophobicContact CB-CG2 3.88Å; C768-V771 PolarHBondContact O-N 3.12Å
769	M	91.5	Very high	94.7	Very high	66 Å²	66	32.3 Å²	32.3	33%	0.325	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.8	-171.6	-66.3	-67.4	-75.1	0	0	113.4	Q767 S795 K796	Q767-M769 WeakPolarHBondContact O-CG 3.34Å; Q767-M769 PolarHBondContact O-N 2.75Å; M769-S795 WeakPolarHBondContact CE-OG 3.33Å; M769-S795 PolarHBondContact O-OG 2.93Å; M769-K796 WeakPolarHBondContact O-CE 3.44Å; M769-K796 WeakPolarHBondContact O-CG 3.34Å
770	D	93.7	Very high	95	Very high	68 Å²	68	30.8 Å²	30.8	36%	0.364	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-12.7	-173.2	-84.1	-57.4	0	0	0	115.4	I744 C768 K796	I744-D770 WeakPolarHBondContact O-CB 3.23Å; C768-D770 PolarHBondContact O-N 2.97Å; C768-D770 VanDerWaalsContact O-N 3.11Å; D770-K796 VanDerWaalsContact CA-NZ 3.32Å; D770-K796 PolarHBondContact O-NZ 3.07Å; D770-K796 VanDerWaalsContact OD1-CE 3.27Å; D770-K796 WeakPolarHBondContact OD1-CE 3.44Å; D770-K796 IonicContact OD1-NZ 2.6Å; D770-K796 PolarHBondContact OD1-NZ 3.31Å
771	V	95.4	Very high	95	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	18%	0.181	C	C	.	.			trans	-67.2	133.9	174	175.4	0	0	0	0	111.3	I744 L749 C768 I776 K796	I744-V771 HydrophobicContact CG2-CG2 3.65Å; L749-V771 HydrophobicContact CD1-CG1 3.73Å; L749-V771 HydrophobicContact CD1-CG2 4.32Å; C768-V771 HydrophobicContact CB-CG2 3.88Å; C768-V771 PolarHBondContact O-N 3.12Å; V771-I776 HydrophobicContact CG1-CD1 3.79Å; V771-I776 HydrophobicContact CG1-CG1 4.03Å; V771-K796 WeakPolarHBondContact O-CB 3.43Å
772	T	96	Very high	95	Very high	42 Å²	42	34.3 Å²	34.3	26%	0.258	17%	0.172	S	C	.	.			trans	-113.1	178.4	177.8	84	0	0	0	0	111.8	D746 Q774 G775 I776 K796	D746-T772 PolarHBondContact OD1-N 3.33Å; D746-T772 WeakPolarHBondContact OD2-CB 3.35Å; D746-T772 WeakPolarHBondContact OD2-CG2 3.43Å; D746-T772 PolarHBondContact OD2-OG1 3.32Å; T772-Q774 PolarHBondContact O-N 2.58Å; T772-Q774 VanDerWaalsContact O-N 3.12Å; T772-Q774 PolarHBondContact OG1-N 2.91Å; T772-Q774 VanDerWaalsContact OG1-N 3.12Å; T772-G775 PolarHBondContact O-N 3.04Å; T772-I776 WeakPolarHBondContact O-CG1 3.42Å; T772-I776 PolarHBondContact O-N 3.08Å; T772-K796 HydrophobicContact CG2-CB 4.35Å; T772-K796 HydrophobicContact CG2-CD 3.76Å
773	N	96.3	Very high	94.8	Very high	33 Å²	33	33.2 Å²	33.2	18%	0.176	17%	0.165	C	C	.	.	H	α-helix	trans	-51.2	-33.3	172.1	-55.5	-4.2	0	0	0	112.4	I776 M777 T798 D800 G801	N773-I776 CarbonylContact O-C 3.4Å; N773-I776 PolarHBondContact O-N 2.61Å; N773-M777 VanDerWaalsContact O-CG 3.23Å; N773-M777 WeakPolarHBondContact O-CG 3.39Å; N773-M777 PolarHBondContact O-N 3.38Å; N773-T798 PolarHBondContact ND2-OG1 3.1Å; N773-T798 PolarHBondContact OD1-N 3.11Å; N773-T798 VanDerWaalsContact OD1-N 3.12Å; N773-T798 PolarHBondContact OD1-OG1 2.92Å; N773-D800 PolarHBondContact ND2-OD2 3.15Å; N773-G801 PolarHBondContact ND2-N 3.35Å
774	Q	96.1	Very high	94.6	Very high	109 Å²	109	36.3 Å²	36.3	51%	0.509	18%	0.182	S	C	.	.	H	α-helix	trans	-66.6	-41.5	-177.4	-175.2	61.1	39.7	0	0	112.6	T772 I776 T778	T772-Q774 PolarHBondContact O-N 2.58Å; T772-Q774 VanDerWaalsContact O-N 3.12Å; T772-Q774 PolarHBondContact OG1-N 2.91Å; T772-Q774 VanDerWaalsContact OG1-N 3.12Å; Q774-I776 VanDerWaalsContact C-N 3.34Å; Q774-T778 PolarHBondContact O-N 3.06Å; Q774-T778 PolarHBondContact O-OG1 3.01Å
775	G	95.5	Very high	94.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.1	-38.1	172.4	0	0	0	0	0	111.5	D746 L749 T772 T778 L779	D746-G775 VanDerWaalsContact CG-N 3.27Å; D746-G775 WeakPolarHBondContact OD1-CA 3.42Å; D746-G775 PolarHBondContact OD1-N 3.35Å; L749-G775 WeakPolarHBondContact CD1-O 3.34Å; T772-G775 PolarHBondContact O-N 3.04Å; G775-T778 WeakPolarHBondContact O-CB 3.49Å; G775-T778 PolarHBondContact O-N 2.94Å; G775-L779 WeakPolarHBondContact O-CB 3.29Å; G775-L779 PolarHBondContact O-N 2.96Å
776	I	96.3	Very high	94.4	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-65.6	-39.8	175.6	-63	-49	0	0	0	112.7	L749 V771 T772 N773 Q774 T778 L779 A780 L791 L797 G801 I805	L749-I776 HydrophobicContact CD1-CD1 4.28Å; V771-I776 HydrophobicContact CG1-CD1 3.79Å; V771-I776 HydrophobicContact CG1-CG1 4.03Å; T772-I776 WeakPolarHBondContact O-CG1 3.42Å; T772-I776 PolarHBondContact O-N 3.08Å; N773-I776 CarbonylContact O-C 3.4Å; N773-I776 PolarHBondContact O-N 2.61Å; Q774-I776 VanDerWaalsContact C-N 3.34Å; I776-T778 VanDerWaalsContact C-N 3.31Å; I776-T778 PolarHBondContact O-N 3.46Å; I776-L779 HydrophobicContact CD1-CD1 4.11Å; I776-L779 PolarHBondContact O-N 2.97Å; I776-A780 VanDerWaalsContact O-CB 3.29Å; I776-A780 WeakPolarHBondContact O-CB 3.49Å; I776-A780 PolarHBondContact O-N 2.8Å; I776-L791 HydrophobicContact CD1-CD1 3.59Å; I776-L791 HydrophobicContact CD1-CD2 3.61Å; I776-L791 HydrophobicContact CD1-CG 4.27Å; I776-L791 HydrophobicContact CG1-CD1 4.14Å; I776-L791 HydrophobicContact CG2-CD1 4.47Å; I776-L797 HydrophobicContact CG1-CD1 4.24Å; I776-G801 WeakPolarHBondContact CG2-O 3.36Å; I776-I805 HydrophobicContact CG2-CD1 3.55Å; I776-I805 HydrophobicContact CG2-CG1 3.6Å
777	M	95.8	Very high	94.5	Very high	56 Å²	56	37 Å²	37	28%	0.276	18%	0.184	S	C	.	.	H	α-helix	trans	-58.6	-47	171.1	-62.8	-146.2	-61.4	0	0	110.6	N773 L779 A780 Y781 V804	N773-M777 VanDerWaalsContact O-CG 3.23Å; N773-M777 WeakPolarHBondContact O-CG 3.39Å; N773-M777 PolarHBondContact O-N 3.38Å; M777-L779 VanDerWaalsContact C-N 3.34Å; M777-L779 PolarHBondContact O-N 2.77Å; M777-A780 PolarHBondContact O-N 3.34Å; M777-A780 VanDerWaalsContact O-N 3.17Å; M777-Y781 HydrophobicContact CB-CD2 4.35Å; M777-Y781 HydrophobicContact CB-CE2 4.21Å; M777-Y781 WeakPolarHBondContact O-CD2 3.48Å; M777-Y781 PolarHBondContact O-N 2.86Å; M777-V804 HydrophobicContact CB-CG1 4.13Å; M777-V804 HydrophobicContact CG-CB 4.23Å; M777-V804 HydrophobicContact CG-CG1 3.87Å; M777-V804 HydrophobicContact CG-CG2 4.06Å; M777-V804 HydrophobicContact SD-CG1 4.34Å; M777-V804 HydrophobicContact SD-CG2 3.91Å
778	T	94.9	Very high	94.8	Very high	39 Å²	39	36.2 Å²	36.2	24%	0.239	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-43.7	-179.1	-52.9	0	0	0	0	111.2	Q774 G775 I776 T782	Q774-T778 PolarHBondContact O-N 3.06Å; Q774-T778 PolarHBondContact O-OG1 3.01Å; G775-T778 WeakPolarHBondContact O-CB 3.49Å; G775-T778 PolarHBondContact O-N 2.94Å; I776-T778 VanDerWaalsContact C-N 3.31Å; I776-T778 PolarHBondContact O-N 3.46Å; T778-T782 WeakPolarHBondContact O-CB 3.4Å; T778-T782 VanDerWaalsContact O-CG2 3.28Å; T778-T782 WeakPolarHBondContact O-CG2 3.31Å; T778-T782 PolarHBondContact O-N 2.86Å; T778-T782 VanDerWaalsContact O-N 3.11Å; T778-T782 PolarHBondContact O-OG1 3.35Å
779	L	95.2	Very high	95	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-60.8	-47.7	172.3	-174.6	173.2	0	0	0	111.6	L749 M763 L765 G775 I776 M777 T782 L783 L786	L749-L779 HydrophobicContact CD1-CB 4.43Å; L749-L779 HydrophobicContact CD1-CD1 4.11Å; L749-L779 HydrophobicContact CD2-CD1 4.34Å; M763-L779 HydrophobicContact SD-CD1 3.57Å; M763-L779 VanDerWaalsContact SD-CD1 3.57Å; M763-L779 HydrophobicContact SD-CD2 4.13Å; M763-L779 HydrophobicContact SD-CG 3.78Å; L765-L779 HydrophobicContact CD1-CD1 4Å; G775-L779 WeakPolarHBondContact O-CB 3.29Å; G775-L779 PolarHBondContact O-N 2.96Å; I776-L779 HydrophobicContact CD1-CD1 4.11Å; I776-L779 PolarHBondContact O-N 2.97Å; M777-L779 VanDerWaalsContact C-N 3.34Å; M777-L779 PolarHBondContact O-N 2.77Å; L779-T782 WeakPolarHBondContact CA-OG1 3.42Å; L779-T782 PolarHBondContact O-N 2.73Å; L779-T782 PolarHBondContact O-OG1 3.02Å; L779-T782 VanDerWaalsContact O-OG1 3.05Å; L779-L783 HydrophobicContact CG-CD1 4.38Å; L779-L783 WeakPolarHBondContact O-CB 3.39Å; L779-L783 PolarHBondContact O-N 3.46Å; L779-L786 HydrophobicContact CD2-CD1 3.68Å
780	A	94.7	Very high	95.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-44.3	-175.7	0	0	0	0	0	112.6	I776 M777 V804 N808 L809	I776-A780 VanDerWaalsContact O-CB 3.29Å; I776-A780 WeakPolarHBondContact O-CB 3.49Å; I776-A780 PolarHBondContact O-N 2.8Å; M777-A780 PolarHBondContact O-N 3.34Å; M777-A780 VanDerWaalsContact O-N 3.17Å; A780-V804 HydrophobicContact CB-CG1 4.2Å; A780-N808 HydrophobicContact CB-CB 4.03Å; A780-L809 HydrophobicContact CB-CD2 4.4Å; A780-L809 HydrophobicContact CB-CG 4.46Å
781	Y	93.7	Very high	95.4	Very high	125 Å²	125	30.1 Å²	30.1	49%	0.49	15%	0.152	S	C	.	.	H	α-helix	trans	-69.5	-30.7	175.1	-70.1	-58.7	0	0	0	113.2	M777 V804 N808	M777-Y781 HydrophobicContact CB-CD2 4.35Å; M777-Y781 HydrophobicContact CB-CE2 4.21Å; M777-Y781 WeakPolarHBondContact O-CD2 3.48Å; M777-Y781 PolarHBondContact O-N 2.86Å; Y781-V804 HydrophobicContact CE2-CG1 4.35Å; Y781-N808 VanDerWaalsContact CD1-OD1 3.31Å; Y781-N808 WeakPolarHBondContact CD1-OD1 3.39Å; Y781-N808 VanDerWaalsContact CE1-OD1 3.24Å; Y781-N808 WeakPolarHBondContact CE1-OD1 3.23Å
782	T	92.9	Very high	95.4	Very high	26 Å²	26	30.7 Å²	30.7	16%	0.16	16%	0.156	C	C	.	.	H	α-helix	trans	-79.5	-39.7	178	49.6	0	0	0	0	112.5	R757 T778 L779	R757-T782 WeakPolarHBondContact CB-O 3.41Å; R757-T782 WeakPolarHBondContact CG-O 3.34Å; R757-T782 PolarHBondContact NE-O 3.13Å; R757-T782 PolarHBondContact NH2-O 3.1Å; T778-T782 WeakPolarHBondContact O-CB 3.4Å; T778-T782 VanDerWaalsContact O-CG2 3.28Å; T778-T782 WeakPolarHBondContact O-CG2 3.31Å; T778-T782 PolarHBondContact O-N 2.86Å; T778-T782 VanDerWaalsContact O-N 3.11Å; T778-T782 PolarHBondContact O-OG1 3.35Å; L779-T782 WeakPolarHBondContact CA-OG1 3.42Å; L779-T782 PolarHBondContact O-N 2.73Å; L779-T782 PolarHBondContact O-OG1 3.02Å; L779-T782 VanDerWaalsContact O-OG1 3.05Å
783	L	93.9	Very high	95.3	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	15%	0.145	C	C	.	.			trans	-120.6	37.1	-162.9	-57	169.7	0	0	0	114	F752 Q756 M760 M763 L779 N785 L786	F752-L783 HydrophobicContact CB-CD1 3.92Å; F752-L783 HydrophobicContact CB-CD2 4.47Å; F752-L783 HydrophobicContact CB-CG 4.45Å; F752-L783 HydrophobicContact CD1-CD1 4.24Å; F752-L783 HydrophobicContact CD2-CD1 4.23Å; F752-L783 HydrophobicContact CG-CD1 3.87Å; Q756-L783 HydrophobicContact CB-CD2 3.99Å; M760-L783 HydrophobicContact CE-CB 3.89Å; M760-L783 HydrophobicContact CE-CD1 3.49Å; M760-L783 VanDerWaalsContact CE-CD1 3.49Å; M760-L783 HydrophobicContact CE-CD2 4.11Å; M760-L783 HydrophobicContact CE-CG 4Å; M760-L783 HydrophobicContact SD-CD1 4.12Å; M763-L783 HydrophobicContact CE-CD1 3.72Å; M763-L783 HydrophobicContact SD-CD1 4.16Å; L779-L783 HydrophobicContact CG-CD1 4.38Å; L779-L783 WeakPolarHBondContact O-CB 3.39Å; L779-L783 PolarHBondContact O-N 3.46Å; L783-N785 PolarHBondContact O-N 3.29Å; L783-L786 HydrophobicContact CB-CD1 4.06Å; L783-L786 HydrophobicContact CB-CG 4.41Å; L783-L786 WeakPolarHBondContact O-CG 3.13Å; L783-L786 PolarHBondContact O-N 3.22Å; L783-L786 VanDerWaalsContact O-N 3.08Å
784	N	91.8	Very high	95.3	Very high	65 Å²	65	27.2 Å²	27.2	35%	0.348	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-2.2	-175.9	68.5	-3.1	0	0	0	118.4	R757	R757-N784 WeakPolarHBondContact CD-OD1 3.18Å; R757-N784 WeakPolarHBondContact CG-OD1 3.49Å
785	N	92.5	Very high	95.1	Very high	41 Å²	41	23.5 Å²	23.5	22%	0.219	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-1.4	172.2	-79	-48.1	0	0	0	114.6	R757 L783 Q787 R811	R757-N785 WeakPolarHBondContact O-CB 3.27Å; R757-N785 PolarHBondContact O-ND2 3.18Å; L783-N785 PolarHBondContact O-N 3.29Å; N785-Q787 PolarHBondContact O-N 2.86Å; N785-R811 WeakPolarHBondContact OD1-CD 3.43Å; N785-R811 PolarHBondContact OD1-NH1 3.13Å
786	L	96	Very high	95	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.			trans	-49.4	134.8	-179.6	-91.9	167.2	0	0	0	113.4	M760 M763 L779 L783 V788 L789 L809 R811 L812	M760-L786 HydrophobicContact CE-CD1 4.05Å; M760-L786 HydrophobicContact CE-CD2 3.64Å; M760-L786 HydrophobicContact CE-CG 3.8Å; M763-L786 HydrophobicContact CB-CD1 4.44Å; M763-L786 HydrophobicContact CB-CD2 3.76Å; L779-L786 HydrophobicContact CD2-CD1 3.68Å; L783-L786 HydrophobicContact CB-CD1 4.06Å; L783-L786 HydrophobicContact CB-CG 4.41Å; L783-L786 WeakPolarHBondContact O-CG 3.13Å; L783-L786 PolarHBondContact O-N 3.22Å; L783-L786 VanDerWaalsContact O-N 3.08Å; L786-V788 WeakPolarHBondContact CD2-O 3.34Å; L786-L789 HydrophobicContact CD1-CD1 4.42Å; L786-L809 HydrophobicContact CB-CD1 4.27Å; L786-L809 HydrophobicContact CB-CD2 4.39Å; L786-L809 HydrophobicContact CD1-CD1 4.01Å; L786-R811 CarbonylContact O-C 3.57Å; L786-L812 HydrophobicContact CB-CD1 4.2Å; L786-L812 PolarHBondContact O-N 3.49Å
787	Q	96.8	Very high	95	Very high	49 Å²	49	26.9 Å²	26.9	23%	0.229	14%	0.137	C	C	.	.	S	Bend	trans	-115	-27.6	175.9	-64	-178.6	15.5	0	0	112.1	H761 N785 I813 S814	H761-Q787 PolarHBondContact CD2-NE2 2.67Å; H761-Q787 VanDerWaalsContact CD2-NE2 3.34Å; H761-Q787 PolarHBondContact O-N 3.32Å; N785-Q787 PolarHBondContact O-N 2.86Å; Q787-I813 HydrophobicContact CB-CD1 4.15Å; Q787-I813 HydrophobicContact CB-CG1 4.23Å; Q787-I813 HydrophobicContact CG-CD1 4.26Å; Q787-I813 WeakPolarHBondContact O-CA 3.38Å; Q787-I813 PolarHBondContact O-N 3.11Å; Q787-S814 PolarHBondContact O-N 3.13Å
788	V	97.8	Very high	95.1	Very high	37 Å²	37	25.8 Å²	25.8	22%	0.224	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	114.2	175.9	-179.3	0	0	0	0	108.4	H761 T762 M763 L786 S814	H761-V788 PolarHBondContact O-N 2.7Å; T762-V788 WeakPolarHBondContact CA-O 3.21Å; T762-V788 HydrophobicContact CG2-CB 3.89Å; T762-V788 HydrophobicContact CG2-CG1 3.9Å; M763-V788 PolarHBondContact N-O 2.68Å; L786-V788 WeakPolarHBondContact CD2-O 3.34Å; V788-S814 WeakPolarHBondContact CA-O 3.47Å
789	L	97.7	Very high	95.2	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.2	173.3	-179.6	60.2	0	0	0	109.7	M763 L786 L791 I805 L809 L812 S814 L815 N816	M763-L789 HydrophobicContact CB-CD1 4.43Å; M763-L789 HydrophobicContact CG-CD1 4.43Å; M763-L789 CarbonylContact O-C 3.57Å; M763-L789 WeakPolarHBondContact O-CA 3.5Å; L786-L789 HydrophobicContact CD1-CD1 4.42Å; L789-L791 HydrophobicContact CD1-CD2 3.94Å; L789-L791 HydrophobicContact CD1-CG 4.08Å; L789-L791 HydrophobicContact CD2-CD1 4.14Å; L789-L791 HydrophobicContact CD2-CG 4.3Å; L789-L791 HydrophobicContact CG-CD1 4.46Å; L789-L791 HydrophobicContact CG-CD2 4.49Å; L789-L791 HydrophobicContact CG-CG 4.07Å; L789-I805 HydrophobicContact CD2-CD1 3.89Å; L789-I805 HydrophobicContact CD2-CG1 4.2Å; L789-I805 HydrophobicContact CD2-CG2 4.38Å; L789-L809 HydrophobicContact CD2-CD1 3.71Å; L789-L812 HydrophobicContact CB-CD1 3.79Å; L789-L812 HydrophobicContact CB-CD2 4.29Å; L789-S814 PolarHBondContact N-O 2.88Å; L789-L815 HydrophobicContact CB-CD1 4.34Å; L789-L815 HydrophobicContact CD2-CD1 4.36Å; L789-L815 HydrophobicContact CG-CD1 4.41Å; L789-L815 CarbonylContact O-C 3.31Å; L789-L815 WeakPolarHBondContact O-CA 3.23Å; L789-N816 PolarHBondContact O-N 3.33Å
790	S	97.3	Very high	95.2	Very high	5 Å²	5	30.5 Å²	30.5	4%	0.035	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.2	164.2	176.9	0	0	0	0	109.2	M763 L765 N816	M763-S790 PolarHBondContact O-N 2.85Å; L765-S790 PolarHBondContact N-O 3.05Å; L765-S790 CarbonylContact O-C 3.51Å; L765-S790 VanDerWaalsContact O-O 3.1Å; S790-N816 WeakPolarHBondContact CA-O 3.47Å; S790-N816 PolarHBondContact OG-ND2 2.76Å
791	L	96.6	Very high	95.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	32.4	172.8	-61.7	178.8	0	0	0	109.6	L765 I776 L789 G793 C794 L797 I805 N816 C820	L765-L791 HydrophobicContact CB-CD2 4.18Å; L765-L791 HydrophobicContact CD1-CD2 3.98Å; L765-L791 HydrophobicContact CG-CD2 4.42Å; L765-L791 CarbonylContact O-C 3.57Å; L765-L791 WeakPolarHBondContact O-CA 3.5Å; I776-L791 HydrophobicContact CD1-CD1 3.59Å; I776-L791 HydrophobicContact CD1-CD2 3.61Å; I776-L791 HydrophobicContact CD1-CG 4.27Å; I776-L791 HydrophobicContact CG1-CD1 4.14Å; I776-L791 HydrophobicContact CG2-CD1 4.47Å; L789-L791 HydrophobicContact CD1-CD2 3.94Å; L789-L791 HydrophobicContact CD1-CG 4.08Å; L789-L791 HydrophobicContact CD2-CD1 4.14Å; L789-L791 HydrophobicContact CD2-CG 4.3Å; L789-L791 HydrophobicContact CG-CD1 4.46Å; L789-L791 HydrophobicContact CG-CD2 4.49Å; L789-L791 HydrophobicContact CG-CG 4.07Å; L791-G793 PolarHBondContact O-N 3.46Å; L791-G793 VanDerWaalsContact O-N 3.1Å; L791-C794 HydrophobicContact CB-CB 4.15Å; L791-C794 VanDerWaalsContact O-CB 3.3Å; L791-C794 WeakPolarHBondContact O-CB 3.48Å; L791-C794 PolarHBondContact O-N 2.97Å; L791-C794 PolarHBondContact O-SG 3.04Å; L791-C794 VanDerWaalsContact O-SG 3.39Å; L791-L797 HydrophobicContact CB-CD2 4.36Å; L791-L797 HydrophobicContact CD1-CD2 3.78Å; L791-I805 HydrophobicContact CD1-CD1 3.61Å; L791-N816 PolarHBondContact N-O 3.19Å; L791-C820 PolarHBondContact O-SG 3.16Å
792	S	96.3	Very high	95.5	Very high	14 Å²	14	24.6 Å²	24.6	10%	0.098	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	111	-170	175	0	0	0	0	111.4	L765 T766 Q767 N816 S818	L765-S792 PolarHBondContact O-N 3.5Å; T766-S792 CarbonylContact C-O 3.4Å; T766-S792 WeakPolarHBondContact CA-O 3.14Å; Q767-S792 PolarHBondContact N-O 3.1Å; S792-N816 WeakPolarHBondContact CB-ND2 3.26Å; S792-S818 CarbonylContact C-O 3.43Å; S792-S818 WeakPolarHBondContact CA-O 3.31Å; S792-S818 PolarHBondContact OG-O 3.25Å
793	G	93.8	Very high	95.7	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.01	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.2	10.7	-174	0	0	0	0	0	114.9	L791 S795 S818	L791-G793 PolarHBondContact O-N 3.46Å; L791-G793 VanDerWaalsContact O-N 3.1Å; G793-S795 PolarHBondContact O-N 3Å; G793-S818 PolarHBondContact N-O 3.38Å
794	C	95	Very high	95.8	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.			trans	-73.1	74.1	167.5	-67.3	0	0	0	0	110.1	L791 K796 L797 C820	L791-C794 HydrophobicContact CB-CB 4.15Å; L791-C794 VanDerWaalsContact O-CB 3.3Å; L791-C794 WeakPolarHBondContact O-CB 3.48Å; L791-C794 PolarHBondContact O-N 2.97Å; L791-C794 PolarHBondContact O-SG 3.04Å; L791-C794 VanDerWaalsContact O-SG 3.39Å; C794-K796 PolarHBondContact O-N 2.83Å; C794-L797 HydrophobicContact CB-CB 4.33Å; C794-L797 VanDerWaalsContact O-CB 3.26Å; C794-L797 WeakPolarHBondContact O-CB 3.37Å; C794-L797 PolarHBondContact O-N 3.4Å; C794-L797 VanDerWaalsContact O-N 3.11Å; C794-C820 PolarHBondContact O-SG 2.67Å
795	S	92.4	Very high	96	Very high	32 Å²	32	24 Å²	24	22%	0.224	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.5	-169.1	69.9	0	0	0	0	115.9	M769 G793 K822	M769-S795 WeakPolarHBondContact CE-OG 3.33Å; M769-S795 PolarHBondContact O-OG 2.93Å; G793-S795 PolarHBondContact O-N 3Å; S795-K822 WeakPolarHBondContact O-CE 3.44Å
796	K	94.6	Very high	96.2	Very high	72 Å²	72	22 Å²	22	31%	0.313	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-17.7	178.4	-61.7	177.1	-170.7	171.8	0	113.3	M769 D770 V771 T772 C794 T798 K822	M769-K796 WeakPolarHBondContact O-CE 3.44Å; M769-K796 WeakPolarHBondContact O-CG 3.34Å; D770-K796 VanDerWaalsContact CA-NZ 3.32Å; D770-K796 PolarHBondContact O-NZ 3.07Å; D770-K796 VanDerWaalsContact OD1-CE 3.27Å; D770-K796 WeakPolarHBondContact OD1-CE 3.44Å; D770-K796 IonicContact OD1-NZ 2.6Å; D770-K796 PolarHBondContact OD1-NZ 3.31Å; V771-K796 WeakPolarHBondContact O-CB 3.43Å; T772-K796 HydrophobicContact CG2-CB 4.35Å; T772-K796 HydrophobicContact CG2-CD 3.76Å; C794-K796 PolarHBondContact O-N 2.83Å; K796-T798 PolarHBondContact O-N 2.9Å; K796-K822 PolarHBondContact O-NZ 3.17Å
797	L	96.3	Very high	96.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.			trans	-58.3	126.2	178.7	179.8	59.7	0	0	0	111	I776 L791 C794 L817 I823	I776-L797 HydrophobicContact CG1-CD1 4.24Å; L791-L797 HydrophobicContact CB-CD2 4.36Å; L791-L797 HydrophobicContact CD1-CD2 3.78Å; C794-L797 HydrophobicContact CB-CB 4.33Å; C794-L797 VanDerWaalsContact O-CB 3.26Å; C794-L797 WeakPolarHBondContact O-CB 3.37Å; C794-L797 PolarHBondContact O-N 3.4Å; C794-L797 VanDerWaalsContact O-N 3.11Å; L797-L817 HydrophobicContact CD2-CD2 3.85Å; L797-I823 HydrophobicContact CD2-CD1 4.06Å; L797-I823 HydrophobicContact CG-CD1 4.27Å
798	T	96.8	Very high	96.1	Very high	32 Å²	32	26.6 Å²	26.6	20%	0.196	14%	0.143	C	C	.	.			trans	-114.4	177.3	172.2	54.6	0	0	0	0	110.6	N773 K796 D800 G801 L802 K822	N773-T798 PolarHBondContact ND2-OG1 3.1Å; N773-T798 PolarHBondContact OD1-N 3.11Å; N773-T798 VanDerWaalsContact OD1-N 3.12Å; N773-T798 PolarHBondContact OD1-OG1 2.92Å; K796-T798 PolarHBondContact O-N 2.9Å; T798-D800 WeakPolarHBondContact CB-OD2 3.29Å; T798-D800 PolarHBondContact O-N 2.87Å; T798-D800 PolarHBondContact OG1-OD2 2.78Å; T798-G801 PolarHBondContact O-N 2.88Å; T798-L802 PolarHBondContact O-N 3.1Å; T798-K822 HydrophobicContact CG2-CB 3.93Å; T798-K822 HydrophobicContact CG2-CD 3.53Å; T798-K822 HydrophobicContact CG2-CG 4.47Å
799	D	96.9	Very high	96	Very high	30 Å²	30	24.8 Å²	24.8	16%	0.16	13%	0.132	C	C	.	.	H	α-helix	trans	-54.7	-34.4	178.6	-61.2	-33.1	0	0	0	112.9	G801 L802 D803 I823 T824 G827	D799-G801 VanDerWaalsContact C-N 3.27Å; D799-G801 PolarHBondContact O-N 3.06Å; D799-L802 CarbonylContact O-C 3.51Å; D799-L802 WeakPolarHBondContact O-CA 3.28Å; D799-L802 WeakPolarHBondContact O-CB 3.49Å; D799-L802 PolarHBondContact O-N 3.47Å; D799-D803 WeakPolarHBondContact O-CB 3.42Å; D799-D803 PolarHBondContact O-N 3.48Å; D799-I823 VanDerWaalsContact OD1-CA 3.3Å; D799-I823 WeakPolarHBondContact OD1-CA 3.11Å; D799-I823 WeakPolarHBondContact OD1-CG2 3.17Å; D799-T824 PolarHBondContact OD1-N 3.42Å; D799-T824 WeakPolarHBondContact OD2-CB 3.45Å; D799-T824 WeakPolarHBondContact OD2-CG2 3.45Å; D799-T824 PolarHBondContact OD2-N 3.38Å; D799-T824 PolarHBondContact OD2-OG1 2.71Å; D799-G827 WeakPolarHBondContact OD1-CA 3.48Å; D799-G827 PolarHBondContact OD1-N 3.16Å
800	D	96.6	Very high	95.8	Very high	110 Å²	110	28.9 Å²	28.9	59%	0.588	15%	0.149	S	C	*	.	H	α-helix	trans	-61.6	-33.9	177.1	-24.7	-101.2	0	0	0	112.5	N773 T798 V804	N773-D800 PolarHBondContact ND2-OD2 3.15Å; T798-D800 WeakPolarHBondContact CB-OD2 3.29Å; T798-D800 PolarHBondContact O-N 2.87Å; T798-D800 PolarHBondContact OG1-OD2 2.78Å; D800-V804 WeakPolarHBondContact O-CG2 3.43Å; D800-V804 PolarHBondContact O-N 2.84Å
801	G	96.4	Very high	95.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-78.3	-24.9	174.6	0	0	0	0	0	113	N773 I776 T798 D799 I805	N773-G801 PolarHBondContact ND2-N 3.35Å; I776-G801 WeakPolarHBondContact CG2-O 3.36Å; T798-G801 PolarHBondContact O-N 2.88Å; D799-G801 VanDerWaalsContact C-N 3.27Å; D799-G801 PolarHBondContact O-N 3.06Å; G801-I805 WeakPolarHBondContact O-CG1 3.49Å; G801-I805 PolarHBondContact O-N 3.21Å
802	L	97	Very high	95.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-78.1	-33.6	173	-178.2	55.8	0	0	0	111.7	T798 D799 I805 C806 L815 L817 I823 G827 V831	T798-L802 PolarHBondContact O-N 3.1Å; D799-L802 CarbonylContact O-C 3.51Å; D799-L802 WeakPolarHBondContact O-CA 3.28Å; D799-L802 WeakPolarHBondContact O-CB 3.49Å; D799-L802 PolarHBondContact O-N 3.47Å; L802-I805 HydrophobicContact CD1-CB 4.38Å; L802-I805 HydrophobicContact CD1-CD1 4.44Å; L802-I805 HydrophobicContact CD1-CG2 4.3Å; L802-I805 WeakPolarHBondContact O-CB 3.37Å; L802-I805 PolarHBondContact O-N 2.86Å; L802-C806 PolarHBondContact O-N 2.74Å; L802-C806 PolarHBondContact O-SG 3.2Å; L802-L815 HydrophobicContact CD1-CD2 4.15Å; L802-L817 HydrophobicContact CD1-CD1 3.87Å; L802-L817 HydrophobicContact CD1-CD2 4.42Å; L802-L817 HydrophobicContact CD2-CD1 3.93Å; L802-I823 HydrophobicContact CD2-CD1 4.31Å; L802-I823 HydrophobicContact CD2-CG2 3.71Å; L802-G827 WeakPolarHBondContact CD2-O 3.09Å; L802-V831 HydrophobicContact CD1-CG2 3.8Å; L802-V831 HydrophobicContact CD2-CG2 3.85Å; L802-V831 HydrophobicContact CG-CG2 3.95Å
803	D	96.7	Very high	95.8	Very high	63 Å²	63	36.6 Å²	36.6	34%	0.337	18%	0.18	S	C	.	.	H	α-helix	trans	-61.9	-47.9	174.9	-163.9	38.8	0	0	0	110.6	D799 I805 C806 E807 C830	D799-D803 WeakPolarHBondContact O-CB 3.42Å; D799-D803 PolarHBondContact O-N 3.48Å; D803-I805 VanDerWaalsContact C-N 3.27Å; D803-I805 PolarHBondContact O-N 3.05Å; D803-C806 CarbonylContact O-C 3.55Å; D803-C806 WeakPolarHBondContact O-CA 3.38Å; D803-C806 WeakPolarHBondContact O-CB 3.43Å; D803-C806 PolarHBondContact O-N 3.12Å; D803-E807 PolarHBondContact O-N 2.95Å; D803-C830 PolarHBondContact OD1-SG 2.91Å
804	V	96.5	Very high	96	Very high	16 Å²	16	37.3 Å²	37.3	10%	0.097	19%	0.185	C	C	.	.	H	α-helix	trans	-63.7	-29.7	175.5	179.7	0	0	0	0	112.8	M777 A780 Y781 D800 N808	M777-V804 HydrophobicContact CB-CG1 4.13Å; M777-V804 HydrophobicContact CG-CB 4.23Å; M777-V804 HydrophobicContact CG-CG1 3.87Å; M777-V804 HydrophobicContact CG-CG2 4.06Å; M777-V804 HydrophobicContact SD-CG1 4.34Å; M777-V804 HydrophobicContact SD-CG2 3.91Å; A780-V804 HydrophobicContact CB-CG1 4.2Å; Y781-V804 HydrophobicContact CE2-CG1 4.35Å; D800-V804 WeakPolarHBondContact O-CG2 3.43Å; D800-V804 PolarHBondContact O-N 2.84Å; V804-N808 WeakPolarHBondContact O-CB 3.42Å; V804-N808 PolarHBondContact O-N 3.32Å; V804-N808 PolarHBondContact O-ND2 2.87Å
805	I	96.9	Very high	96.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.3	-45.8	168	-76.5	166.1	0	0	0	110.6	I776 L789 L791 G801 L802 D803 N808 L809	I776-I805 HydrophobicContact CG2-CD1 3.55Å; I776-I805 HydrophobicContact CG2-CG1 3.6Å; L789-I805 HydrophobicContact CD2-CD1 3.89Å; L789-I805 HydrophobicContact CD2-CG1 4.2Å; L789-I805 HydrophobicContact CD2-CG2 4.38Å; L791-I805 HydrophobicContact CD1-CD1 3.61Å; G801-I805 WeakPolarHBondContact O-CG1 3.49Å; G801-I805 PolarHBondContact O-N 3.21Å; L802-I805 HydrophobicContact CD1-CB 4.38Å; L802-I805 HydrophobicContact CD1-CD1 4.44Å; L802-I805 HydrophobicContact CD1-CG2 4.3Å; L802-I805 WeakPolarHBondContact O-CB 3.37Å; L802-I805 PolarHBondContact O-N 2.86Å; D803-I805 VanDerWaalsContact C-N 3.27Å; D803-I805 PolarHBondContact O-N 3.05Å; I805-N808 PolarHBondContact O-N 3.17Å; I805-L809 HydrophobicContact CG1-CD1 4.49Å; I805-L809 HydrophobicContact CG2-CD1 4.2Å; I805-L809 WeakPolarHBondContact O-CA 3.4Å; I805-L809 VanDerWaalsContact O-CB 3.28Å; I805-L809 WeakPolarHBondContact O-CB 3.4Å; I805-L809 PolarHBondContact O-N 3.28Å
806	C	95.9	Very high	96.4	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.8	-42.3	-179.4	-65.7	0	0	0	0	111.9	L802 D803 N808 K810 C830 D834	L802-C806 PolarHBondContact O-N 2.74Å; L802-C806 PolarHBondContact O-SG 3.2Å; D803-C806 CarbonylContact O-C 3.55Å; D803-C806 WeakPolarHBondContact O-CA 3.38Å; D803-C806 WeakPolarHBondContact O-CB 3.43Å; D803-C806 PolarHBondContact O-N 3.12Å; C806-N808 PolarHBondContact O-N 2.87Å; C806-K810 WeakPolarHBondContact O-CD 3.37Å; C806-K810 WeakPolarHBondContact O-CE 3.46Å; C806-K810 PolarHBondContact O-NZ 3.28Å; C806-C830 HydrophobicContact CB-CB 4.22Å; C806-D834 HydrophobicContact CB-CB 3.82Å
807	E	95.3	Very high	96.5	Very high	104 Å²	104	33.6 Å²	33.6	49%	0.486	17%	0.166	S	C	.	.	H	α-helix	trans	-59.6	-45.7	174.6	-74.7	-159.5	128.1	0	0	112.7	D803 K810	D803-E807 PolarHBondContact O-N 2.95Å; E807-K810 WeakPolarHBondContact O-CE 3.38Å; E807-K810 PolarHBondContact O-NZ 3Å
808	N	94.7	Very high	96.5	Very high	41 Å²	41	33.9 Å²	33.9	22%	0.219	17%	0.167	C	C	.	.	H	α-helix	trans	-101.3	-31.7	-165.6	-70.8	-86.5	0	0	0	114.4	A780 Y781 V804 I805 C806 K810	A780-N808 HydrophobicContact CB-CB 4.03Å; Y781-N808 VanDerWaalsContact CD1-OD1 3.31Å; Y781-N808 WeakPolarHBondContact CD1-OD1 3.39Å; Y781-N808 VanDerWaalsContact CE1-OD1 3.24Å; Y781-N808 WeakPolarHBondContact CE1-OD1 3.23Å; V804-N808 WeakPolarHBondContact O-CB 3.42Å; V804-N808 PolarHBondContact O-N 3.32Å; V804-N808 PolarHBondContact O-ND2 2.87Å; I805-N808 PolarHBondContact O-N 3.17Å; C806-N808 PolarHBondContact O-N 2.87Å; N808-K810 PolarHBondContact O-N 3.44Å
809	L	95.7	Very high	96.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.175	C	C	.	.			trans	-96.6	43.2	-173.3	-54.2	-168.1	0	0	0	113	A780 L786 L789 I805 R811 L812	A780-L809 HydrophobicContact CB-CD2 4.4Å; A780-L809 HydrophobicContact CB-CG 4.46Å; L786-L809 HydrophobicContact CB-CD1 4.27Å; L786-L809 HydrophobicContact CB-CD2 4.39Å; L786-L809 HydrophobicContact CD1-CD1 4.01Å; L789-L809 HydrophobicContact CD2-CD1 3.71Å; I805-L809 HydrophobicContact CG1-CD1 4.49Å; I805-L809 HydrophobicContact CG2-CD1 4.2Å; I805-L809 WeakPolarHBondContact O-CA 3.4Å; I805-L809 VanDerWaalsContact O-CB 3.28Å; I805-L809 WeakPolarHBondContact O-CB 3.4Å; I805-L809 PolarHBondContact O-N 3.28Å; L809-R811 PolarHBondContact O-N 3.21Å; L809-L812 WeakPolarHBondContact O-CB 3.49Å; L809-L812 PolarHBondContact O-N 3.37Å
810	K	94.2	Very high	96.4	Very high	86 Å²	86	35.5 Å²	35.5	37%	0.374	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-11.6	-178.8	-54.6	-61.2	-170.6	-155.6	0	115.6	C806 E807 N808 D834	C806-K810 WeakPolarHBondContact O-CD 3.37Å; C806-K810 WeakPolarHBondContact O-CE 3.46Å; C806-K810 PolarHBondContact O-NZ 3.28Å; E807-K810 WeakPolarHBondContact O-CE 3.38Å; E807-K810 PolarHBondContact O-NZ 3Å; N808-K810 PolarHBondContact O-N 3.44Å; K810-D834 IonicContact NZ-OD1 2.66Å; K810-D834 PolarHBondContact NZ-OD1 3.32Å; K810-D834 IonicContact NZ-OD2 3.63Å; K810-D834 PolarHBondContact NZ-OD2 3.48Å
811	R	95	Very high	96.2	Very high	121 Å²	121	32.8 Å²	32.8	46%	0.457	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	1.5	177.7	-57.8	-167.6	71.3	-176.5	-0.9	114.1	N785 L786 L809	N785-R811 WeakPolarHBondContact OD1-CD 3.43Å; N785-R811 PolarHBondContact OD1-NH1 3.13Å; L786-R811 CarbonylContact O-C 3.57Å; L809-R811 PolarHBondContact O-N 3.21Å
812	L	97	Very high	96.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.177	C	C	.	.			trans	-66.4	134	-174.1	-145	72.1	0	0	0	113.1	L786 L789 L809 L815 L835 L837 L838	L786-L812 HydrophobicContact CB-CD1 4.2Å; L786-L812 PolarHBondContact O-N 3.49Å; L789-L812 HydrophobicContact CB-CD1 3.79Å; L789-L812 HydrophobicContact CB-CD2 4.29Å; L809-L812 WeakPolarHBondContact O-CB 3.49Å; L809-L812 PolarHBondContact O-N 3.37Å; L812-L815 HydrophobicContact CD2-CB 3.73Å; L812-L815 HydrophobicContact CD2-CD1 3.9Å; L812-L815 HydrophobicContact CD2-CD2 4.2Å; L812-L815 HydrophobicContact CD2-CG 4.14Å; L812-L835 HydrophobicContact CB-CD2 4.28Å; L812-L835 HydrophobicContact CD2-CD1 4.17Å; L812-L837 CarbonylContact O-C 3.54Å; L812-L837 VanDerWaalsContact O-C 3.3Å; L812-L838 HydrophobicContact CB-CD1 4.48Å; L812-L838 HydrophobicContact CD2-CD1 4.26Å; L812-L838 HydrophobicContact CG-CD1 4.41Å; L812-L838 PolarHBondContact O-N 3.26Å
813	I	97.6	Very high	96.1	Very high	61 Å²	61	37.3 Å²	37.3	31%	0.313	18%	0.177	S	C	.	.	S	Bend	trans	-115.3	-31.6	179.5	-53.3	179.1	0	0	0	110.3	Q787 K839 K840	Q787-I813 HydrophobicContact CB-CD1 4.15Å; Q787-I813 HydrophobicContact CB-CG1 4.23Å; Q787-I813 HydrophobicContact CG-CD1 4.26Å; Q787-I813 WeakPolarHBondContact O-CA 3.38Å; Q787-I813 PolarHBondContact O-N 3.11Å; I813-K839 HydrophobicContact CG2-CB 4.12Å; I813-K839 HydrophobicContact CG2-CD 3.96Å; I813-K839 HydrophobicContact CG2-CG 4.07Å; I813-K839 PolarHBondContact O-N 3.48Å; I813-K840 PolarHBondContact O-N 3.43Å
814	S	98.1	Very high	96.1	Very high	16 Å²	16	36.4 Å²	36.4	11%	0.112	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	129	175.9	-179.1	0	0	0	0	111.2	Q787 V788 L789 K840	Q787-S814 PolarHBondContact O-N 3.13Å; V788-S814 WeakPolarHBondContact CA-O 3.47Å; L789-S814 PolarHBondContact N-O 2.88Å; S814-K840 CarbonylContact C-O 3.5Å; S814-K840 WeakPolarHBondContact CA-O 2.98Å
815	L	98.1	Very high	96.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133.3	175.4	-176.6	51.7	0	0	0	109.6	L789 L802 L812 L817 V831 L835 L838 K840 L841 L842	L789-L815 HydrophobicContact CB-CD1 4.34Å; L789-L815 HydrophobicContact CD2-CD1 4.36Å; L789-L815 HydrophobicContact CG-CD1 4.41Å; L789-L815 CarbonylContact O-C 3.31Å; L789-L815 WeakPolarHBondContact O-CA 3.23Å; L802-L815 HydrophobicContact CD1-CD2 4.15Å; L812-L815 HydrophobicContact CD2-CB 3.73Å; L812-L815 HydrophobicContact CD2-CD1 3.9Å; L812-L815 HydrophobicContact CD2-CD2 4.2Å; L812-L815 HydrophobicContact CD2-CG 4.14Å; L815-L817 HydrophobicContact CD1-CD1 4.41Å; L815-L817 HydrophobicContact CD1-CD2 4.06Å; L815-L817 HydrophobicContact CD1-CG 4Å; L815-L817 HydrophobicContact CD2-CD1 3.88Å; L815-L817 HydrophobicContact CD2-CG 4.35Å; L815-L817 HydrophobicContact CG-CD1 3.99Å; L815-L817 HydrophobicContact CG-CG 3.94Å; L815-V831 HydrophobicContact CD2-CG2 4.18Å; L815-L835 HydrophobicContact CD2-CD1 3.9Å; L815-L838 HydrophobicContact CB-CD1 3.77Å; L815-L838 HydrophobicContact CB-CD2 4.45Å; L815-K840 PolarHBondContact N-O 3.22Å; L815-L841 HydrophobicContact CB-CD1 3.97Å; L815-L841 HydrophobicContact CD2-CD1 4.07Å; L815-L841 HydrophobicContact CG-CD1 4.03Å; L815-L841 WeakPolarHBondContact O-CA 3.25Å; L815-L842 PolarHBondContact O-N 2.84Å
816	N	97.8	Very high	96.1	Very high	26 Å²	26	39.8 Å²	39.8	14%	0.139	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	114.5	173.6	178.1	21.2	0	0	0	110.2	L789 S790 L791 S792 S818 L842	L789-N816 PolarHBondContact O-N 3.33Å; S790-N816 WeakPolarHBondContact CA-O 3.47Å; S790-N816 PolarHBondContact OG-ND2 2.76Å; L791-N816 PolarHBondContact N-O 3.19Å; S792-N816 WeakPolarHBondContact CB-ND2 3.26Å; N816-S818 VanDerWaalsContact OD1-CB 3.27Å; N816-S818 WeakPolarHBondContact OD1-CB 3.36Å; N816-S818 PolarHBondContact OD1-N 3.18Å; N816-S818 VanDerWaalsContact OD1-N 3.12Å; N816-S818 PolarHBondContact OD1-OG 2.83Å; N816-L842 HydrophobicContact CB-CB 4.13Å; N816-L842 HydrophobicContact CB-CD1 4.12Å; N816-L842 HydrophobicContact CB-CG 4.45Å; N816-L842 WeakPolarHBondContact OD1-CB 3.43Å
817	L	97.1	Very high	96.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.197	C	C	.	.			trans	-118.9	16.6	-179.4	-61.7	164.6	0	0	0	111.1	L797 L802 L815 W819 C820 I823 L842 L843 C846	L797-L817 HydrophobicContact CD2-CD2 3.85Å; L802-L817 HydrophobicContact CD1-CD1 3.87Å; L802-L817 HydrophobicContact CD1-CD2 4.42Å; L802-L817 HydrophobicContact CD2-CD1 3.93Å; L815-L817 HydrophobicContact CD1-CD1 4.41Å; L815-L817 HydrophobicContact CD1-CD2 4.06Å; L815-L817 HydrophobicContact CD1-CG 4Å; L815-L817 HydrophobicContact CD2-CD1 3.88Å; L815-L817 HydrophobicContact CD2-CG 4.35Å; L815-L817 HydrophobicContact CG-CD1 3.99Å; L815-L817 HydrophobicContact CG-CG 3.94Å; L817-W819 PolarHBondContact O-N 3.12Å; L817-C820 HydrophobicContact CB-CB 4.46Å; L817-C820 WeakPolarHBondContact O-CB 3.19Å; L817-C820 PolarHBondContact O-N 3.15Å; L817-I823 HydrophobicContact CB-CD1 3.95Å; L817-I823 HydrophobicContact CD1-CD1 3.91Å; L817-I823 HydrophobicContact CD2-CD1 3.82Å; L817-I823 HydrophobicContact CG-CD1 4.1Å; L817-L842 PolarHBondContact N-O 3.43Å; L817-L843 HydrophobicContact CB-CD2 4.21Å; L817-L843 HydrophobicContact CD1-CD2 4.06Å; L817-C846 PolarHBondContact O-SG 3.24Å
818	S	96.7	Very high	96.2	Very high	5 Å²	5	34.9 Å²	34.9	4%	0.035	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	138.7	-179.3	-56.9	0	0	0	0	111.2	S792 G793 N816 C820 D844	S792-S818 CarbonylContact C-O 3.43Å; S792-S818 WeakPolarHBondContact CA-O 3.31Å; S792-S818 PolarHBondContact OG-O 3.25Å; G793-S818 PolarHBondContact N-O 3.38Å; N816-S818 VanDerWaalsContact OD1-CB 3.27Å; N816-S818 WeakPolarHBondContact OD1-CB 3.36Å; N816-S818 PolarHBondContact OD1-N 3.18Å; N816-S818 VanDerWaalsContact OD1-N 3.12Å; N816-S818 PolarHBondContact OD1-OG 2.83Å; S818-C820 PolarHBondContact O-N 3.1Å; S818-D844 CarbonylContact C-O 3.45Å; S818-D844 WeakPolarHBondContact CA-O 3.27Å; S818-D844 WeakPolarHBondContact CB-O 3.49Å; S818-D844 WeakPolarHBondContact OG-CB 3.27Å; S818-D844 PolarHBondContact OG-N 2.89Å
819	W	95.3	Very high	96.3	Very high	96 Å²	96	37.4 Å²	37.4	36%	0.364	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	4.8	-171.7	-53.5	87.6	0	0	0	116.5	N14 L817 S821 D844 R845	N14-W819 VanDerWaalsContact OD1-CZ3 3.29Å; N14-W819 WeakPolarHBondContact OD1-CZ3 3.42Å; L817-W819 PolarHBondContact O-N 3.12Å; W819-S821 VanDerWaalsContact C-N 3.32Å; W819-S821 PolarHBondContact O-N 3.16Å; W819-D844 PolarHBondContact N-O 3.49Å; W819-R845 HydrophobicContact CD2-CB 4.38Å; W819-R845 VanDerWaalsContact CE2-CD 3.43Å; W819-R845 HydrophobicContact CE3-CB 4.36Å; W819-R845 VanDerWaalsContact CZ3-CD 3.48Å
820	C	95.5	Very high	96.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.			trans	-78	83.6	167.2	-65.7	0	0	0	0	109.8	L791 C794 L817 S818 K822 I823 C846	L791-C820 PolarHBondContact O-SG 3.16Å; C794-C820 PolarHBondContact O-SG 2.67Å; L817-C820 HydrophobicContact CB-CB 4.46Å; L817-C820 WeakPolarHBondContact O-CB 3.19Å; L817-C820 PolarHBondContact O-N 3.15Å; S818-C820 PolarHBondContact O-N 3.1Å; C820-K822 PolarHBondContact O-N 3.42Å; C820-I823 HydrophobicContact CB-CD1 3.45Å; C820-I823 VanDerWaalsContact CB-CD1 3.45Å; C820-I823 HydrophobicContact CB-CG1 3.92Å; C820-I823 PolarHBondContact O-N 3.43Å; C820-C846 PolarHBondContact O-SG 3.24Å; C820-C846 VanDerWaalsContact O-SG 3.36Å
821	S	92.2	Very high	96.4	Very high	53 Å²	53	35 Å²	35	37%	0.371	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	7.9	-170.9	71.1	0	0	0	0	115.7	W819	W819-S821 VanDerWaalsContact C-N 3.32Å; W819-S821 PolarHBondContact O-N 3.16Å
822	K	95.2	Very high	96.3	Very high	95 Å²	95	29.8 Å²	29.8	41%	0.413	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	6.6	174.4	-47.6	-179.7	-176.5	175.7	0	113.6	S795 K796 T798 C820	S795-K822 WeakPolarHBondContact O-CE 3.44Å; K796-K822 PolarHBondContact O-NZ 3.17Å; T798-K822 HydrophobicContact CG2-CB 3.93Å; T798-K822 HydrophobicContact CG2-CD 3.53Å; T798-K822 HydrophobicContact CG2-CG 4.47Å; C820-K822 PolarHBondContact O-N 3.42Å
823	I	96.9	Very high	96.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.19	C	C	.	.			trans	-84.8	126.6	176.5	-61.9	-179.9	0	0	0	107.7	L797 D799 L802 L817 C820	L797-I823 HydrophobicContact CD2-CD1 4.06Å; L797-I823 HydrophobicContact CG-CD1 4.27Å; D799-I823 VanDerWaalsContact OD1-CA 3.3Å; D799-I823 WeakPolarHBondContact OD1-CA 3.11Å; D799-I823 WeakPolarHBondContact OD1-CG2 3.17Å; L802-I823 HydrophobicContact CD2-CD1 4.31Å; L802-I823 HydrophobicContact CD2-CG2 3.71Å; L817-I823 HydrophobicContact CB-CD1 3.95Å; L817-I823 HydrophobicContact CD1-CD1 3.91Å; L817-I823 HydrophobicContact CD2-CD1 3.82Å; L817-I823 HydrophobicContact CG-CD1 4.1Å; C820-I823 HydrophobicContact CB-CD1 3.45Å; C820-I823 VanDerWaalsContact CB-CD1 3.45Å; C820-I823 HydrophobicContact CB-CG1 3.92Å; C820-I823 PolarHBondContact O-N 3.43Å
824	T	96.9	Very high	96	Very high	44 Å²	44	33.6 Å²	33.6	27%	0.27	19%	0.188	S	C	.	.			trans	-111	-178.3	-175.6	81.8	0	0	0	0	111.2	D799 S826 G827 L828 E848	D799-T824 PolarHBondContact OD1-N 3.42Å; D799-T824 WeakPolarHBondContact OD2-CB 3.45Å; D799-T824 WeakPolarHBondContact OD2-CG2 3.45Å; D799-T824 PolarHBondContact OD2-N 3.38Å; D799-T824 PolarHBondContact OD2-OG1 2.71Å; T824-S826 PolarHBondContact O-N 2.96Å; T824-S826 PolarHBondContact OG1-N 2.73Å; T824-S826 PolarHBondContact OG1-OG 3.12Å; T824-G827 PolarHBondContact O-N 3.02Å; T824-G827 VanDerWaalsContact O-N 3.15Å; T824-L828 PolarHBondContact O-N 3.33Å; T824-E848 HydrophobicContact CG2-CB 4.18Å
825	D	96.8	Very high	95.9	Very high	17 Å²	17	32.9 Å²	32.9	9%	0.091	18%	0.183	C	C	.	.	H	α-helix	trans	-59.4	-31	177.2	-62	-33.5	0	0	0	112.3	G827 L828 E829 L849 T850 L852 G853	D825-G827 PolarHBondContact O-N 2.72Å; D825-L828 WeakPolarHBondContact O-CA 3.32Å; D825-L828 WeakPolarHBondContact O-CB 3.4Å; D825-L828 PolarHBondContact O-N 2.85Å; D825-E829 PolarHBondContact O-N 3.27Å; D825-L849 WeakPolarHBondContact OD1-CA 3.5Å; D825-T850 PolarHBondContact OD1-N 3.14Å; D825-T850 VanDerWaalsContact OD2-CB 3.31Å; D825-T850 WeakPolarHBondContact OD2-CB 3.4Å; D825-T850 WeakPolarHBondContact OD2-CG2 3.28Å; D825-T850 PolarHBondContact OD2-N 3.14Å; D825-T850 PolarHBondContact OD2-OG1 3.03Å; D825-L852 HydrophobicContact CB-CB 4.37Å; D825-L852 HydrophobicContact CB-CD2 4.31Å; D825-L852 HydrophobicContact CB-CG 4.38Å; D825-G853 WeakPolarHBondContact OD1-CA 3.34Å; D825-G853 PolarHBondContact OD1-N 3.26Å
826	S	96.4	Very high	95.6	Very high	71 Å²	71	37.4 Å²	37.4	50%	0.497	21%	0.21	S	C	.	.	H	α-helix	trans	-59.6	-42.8	174.8	-47.3	0	0	0	0	112.1	T824 L828 E829 C830	T824-S826 PolarHBondContact O-N 2.96Å; T824-S826 PolarHBondContact OG1-N 2.73Å; T824-S826 PolarHBondContact OG1-OG 3.12Å; S826-L828 PolarHBondContact O-N 2.98Å; S826-E829 WeakPolarHBondContact O-CB 3.44Å; S826-E829 PolarHBondContact O-N 3.33Å; S826-E829 VanDerWaalsContact O-N 3.15Å; S826-C830 PolarHBondContact O-N 3.49Å
827	G	96	Very high	95.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65.4	-28.2	175.4	0	0	0	0	0	113	D799 L802 T824 D825 V831	D799-G827 WeakPolarHBondContact OD1-CA 3.48Å; D799-G827 PolarHBondContact OD1-N 3.16Å; L802-G827 WeakPolarHBondContact CD2-O 3.09Å; T824-G827 PolarHBondContact O-N 3.02Å; T824-G827 VanDerWaalsContact O-N 3.15Å; D825-G827 PolarHBondContact O-N 2.72Å; G827-V831 WeakPolarHBondContact O-CG2 3.26Å; G827-V831 PolarHBondContact O-N 2.93Å
828	L	96.8	Very high	95.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-77.8	-25.7	173.3	-64.8	-172.1	0	0	0	113.4	T824 D825 S826 V831 A832 L841 L843 L849 L857	T824-L828 PolarHBondContact O-N 3.33Å; D825-L828 WeakPolarHBondContact O-CA 3.32Å; D825-L828 WeakPolarHBondContact O-CB 3.4Å; D825-L828 PolarHBondContact O-N 2.85Å; S826-L828 PolarHBondContact O-N 2.98Å; L828-V831 PolarHBondContact O-N 2.86Å; L828-A832 VanDerWaalsContact O-CB 3.28Å; L828-A832 WeakPolarHBondContact O-CB 3.31Å; L828-A832 PolarHBondContact O-N 3.46Å; L828-L841 HydrophobicContact CD2-CD2 4.49Å; L828-L843 HydrophobicContact CD1-CD1 4.06Å; L828-L843 HydrophobicContact CD2-CD1 3.93Å; L828-L843 HydrophobicContact CD2-CD2 3.98Å; L828-L849 HydrophobicContact CD1-CD1 3.99Å; L828-L849 HydrophobicContact CD1-CD2 3.64Å; L828-L849 HydrophobicContact CD1-CG 4.36Å; L828-L849 HydrophobicContact CG-CD2 3.93Å; L828-L857 HydrophobicContact CD1-CD1 4.04Å; L828-L857 HydrophobicContact CD1-CG 4.36Å; L828-L857 HydrophobicContact CD2-CD2 4.5Å
829	E	96.3	Very high	95.5	Very high	95 Å²	95	44.4 Å²	44.4	44%	0.444	24%	0.243	S	C	.	.	H	α-helix	trans	-62.8	-47.5	169.4	-176.3	160.1	-129.6	0	0	111	D825 S826 V831 A832 C833 H856	D825-E829 PolarHBondContact O-N 3.27Å; S826-E829 WeakPolarHBondContact O-CB 3.44Å; S826-E829 PolarHBondContact O-N 3.33Å; S826-E829 VanDerWaalsContact O-N 3.15Å; E829-V831 PolarHBondContact O-N 3.24Å; E829-A832 PolarHBondContact O-N 3.21Å; E829-C833 WeakPolarHBondContact O-CB 3.37Å; E829-C833 PolarHBondContact O-N 2.97Å; E829-C833 PolarHBondContact O-SG 3.29Å; E829-C833 VanDerWaalsContact O-SG 3.37Å; E829-H856 HydrophobicContact CB-CB 4.48Å; E829-H856 WeakPolarHBondContact CG-ND1 3.07Å; E829-H856 IonicContact OE1-CE1 3.12Å; E829-H856 PolarHBondContact OE1-CE1 2.81Å; E829-H856 IonicContact OE1-ND1 3.25Å; E829-H856 PolarHBondContact OE1-ND1 2.93Å; E829-H856 IonicContact OE2-CE1 3.85Å
830	C	95.3	Very high	95.6	Very high	34 Å²	34	43.7 Å²	43.7	23%	0.23	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-48.3	174	-58.9	0	0	0	0	111.5	D803 C806 S826 A832 C833 D834	D803-C830 PolarHBondContact OD1-SG 2.91Å; C806-C830 HydrophobicContact CB-CB 4.22Å; S826-C830 PolarHBondContact O-N 3.49Å; C830-A832 VanDerWaalsContact C-N 3.31Å; C830-A832 PolarHBondContact O-N 2.97Å; C830-C833 PolarHBondContact O-N 3.11Å; C830-D834 WeakPolarHBondContact O-CB 3.44Å; C830-D834 PolarHBondContact O-N 3.28Å
831	V	96.5	Very high	95.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.1	-42.4	176.8	166.2	0	0	0	0	112.2	L802 L815 G827 L828 E829 L835 L838 L841 L857 M860	L802-V831 HydrophobicContact CD1-CG2 3.8Å; L802-V831 HydrophobicContact CD2-CG2 3.85Å; L802-V831 HydrophobicContact CG-CG2 3.95Å; L815-V831 HydrophobicContact CD2-CG2 4.18Å; G827-V831 WeakPolarHBondContact O-CG2 3.26Å; G827-V831 PolarHBondContact O-N 2.93Å; L828-V831 PolarHBondContact O-N 2.86Å; E829-V831 PolarHBondContact O-N 3.24Å; V831-L835 HydrophobicContact CG1-CD1 4.34Å; V831-L835 HydrophobicContact CG2-CD1 4.26Å; V831-L835 WeakPolarHBondContact O-CB 3.38Å; V831-L835 PolarHBondContact O-N 3.32Å; V831-L835 VanDerWaalsContact O-N 3.16Å; V831-L838 HydrophobicContact CG1-CD2 3.95Å; V831-L841 HydrophobicContact CG1-CD2 4.1Å; V831-L857 HydrophobicContact CG1-CD2 4.24Å; V831-M860 HydrophobicContact CG1-CE 4.25Å; V831-M860 HydrophobicContact CG1-SD 4.26Å; V831-M860 VanDerWaalsContact O-CE 3.29Å; V831-M860 WeakPolarHBondContact O-CE 3.28Å
832	A	94.3	Very high	96	Very high	12 Å²	12	42.7 Å²	42.7	10%	0.099	23%	0.232	C	C	.	.	H	α-helix	trans	-69.3	-41	-178.8	0	0	0	0	0	112.9	L828 E829 C830 H856 M860	L828-A832 VanDerWaalsContact O-CB 3.28Å; L828-A832 WeakPolarHBondContact O-CB 3.31Å; L828-A832 PolarHBondContact O-N 3.46Å; E829-A832 PolarHBondContact O-N 3.21Å; C830-A832 VanDerWaalsContact C-N 3.31Å; C830-A832 PolarHBondContact O-N 2.97Å; A832-H856 HydrophobicContact CB-CB 4.03Å; A832-H856 WeakPolarHBondContact CB-O 3.35Å; A832-M860 HydrophobicContact CB-CG 4.11Å; A832-M860 HydrophobicContact CB-SD 4.42Å
833	C	93.9	Very high	96.1	Very high	91 Å²	91	38.1 Å²	38.1	62%	0.615	21%	0.213	S	C	*	.	H	α-helix	trans	-69.3	-42.8	179.3	-72.3	0	0	0	0	112.8	E829 C830	E829-C833 WeakPolarHBondContact O-CB 3.37Å; E829-C833 PolarHBondContact O-N 2.97Å; E829-C833 PolarHBondContact O-SG 3.29Å; E829-C833 VanDerWaalsContact O-SG 3.37Å; C830-C833 PolarHBondContact O-N 3.11Å
834	D	94	Very high	96	Very high	51 Å²	51	39.6 Å²	39.6	27%	0.273	22%	0.221	S	C	.	.	H	α-helix	trans	-103.8	-35.8	-164.1	-101.1	-22.4	0	0	0	115.6	C806 K810 C830 V836	C806-D834 HydrophobicContact CB-CB 3.82Å; K810-D834 IonicContact NZ-OD1 2.66Å; K810-D834 PolarHBondContact NZ-OD1 3.32Å; K810-D834 IonicContact NZ-OD2 3.63Å; K810-D834 PolarHBondContact NZ-OD2 3.48Å; C830-D834 WeakPolarHBondContact O-CB 3.44Å; C830-D834 PolarHBondContact O-N 3.28Å; D834-V836 PolarHBondContact O-N 3.22Å
835	L	95.4	Very high	95.9	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.218	C	C	.	.			trans	-87.9	55.8	-173.2	-60.5	-177.6	0	0	0	111.3	L812 L815 V831 L837 L838 M860	L812-L835 HydrophobicContact CB-CD2 4.28Å; L812-L835 HydrophobicContact CD2-CD1 4.17Å; L815-L835 HydrophobicContact CD2-CD1 3.9Å; V831-L835 HydrophobicContact CG1-CD1 4.34Å; V831-L835 HydrophobicContact CG2-CD1 4.26Å; V831-L835 WeakPolarHBondContact O-CB 3.38Å; V831-L835 PolarHBondContact O-N 3.32Å; V831-L835 VanDerWaalsContact O-N 3.16Å; L835-L837 PolarHBondContact O-N 3.07Å; L835-L838 HydrophobicContact CB-CB 4.07Å; L835-L838 WeakPolarHBondContact O-CB 3.32Å; L835-L838 PolarHBondContact O-N 3.21Å; L835-M860 HydrophobicContact CB-CE 4.44Å; L835-M860 WeakPolarHBondContact O-CE 3.44Å
836	V	93	Very high	95.9	Very high	94 Å²	94	39.4 Å²	39.4	57%	0.57	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-25.4	-174.3	-173.3	0	0	0	0	113.5	D834 N862	D834-V836 PolarHBondContact O-N 3.22Å; V836-N862 PolarHBondContact O-ND2 2.79Å
837	L	95.4	Very high	95.7	Very high	92 Å²	92	37.9 Å²	37.9	48%	0.482	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-3.2	178.4	-63.7	-179	0	0	0	114.5	L812 L835 K839	L812-L837 CarbonylContact O-C 3.54Å; L812-L837 VanDerWaalsContact O-C 3.3Å; L835-L837 PolarHBondContact O-N 3.07Å; L837-K839 PolarHBondContact O-N 3.39Å
838	L	97	Very high	95.6	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.222	C	C	.	.			trans	-67.7	128.8	-174.5	-164.4	73.8	0	0	0	111.7	L812 L815 V831 L835 L841 M860 N862	L812-L838 HydrophobicContact CB-CD1 4.48Å; L812-L838 HydrophobicContact CD2-CD1 4.26Å; L812-L838 HydrophobicContact CG-CD1 4.41Å; L812-L838 PolarHBondContact O-N 3.26Å; L815-L838 HydrophobicContact CB-CD1 3.77Å; L815-L838 HydrophobicContact CB-CD2 4.45Å; V831-L838 HydrophobicContact CG1-CD2 3.95Å; L835-L838 HydrophobicContact CB-CB 4.07Å; L835-L838 WeakPolarHBondContact O-CB 3.32Å; L835-L838 PolarHBondContact O-N 3.21Å; L838-L841 HydrophobicContact CD2-CB 4.07Å; L838-L841 HydrophobicContact CD2-CD1 4.26Å; L838-L841 HydrophobicContact CD2-CD2 4.31Å; L838-L841 HydrophobicContact CD2-CG 4.45Å; L838-M860 HydrophobicContact CB-CE 3.91Å; L838-M860 HydrophobicContact CD2-CE 4.01Å; L838-N862 CarbonylContact O-C 3.6Å
839	K	97	Very high	95.6	Very high	85 Å²	85	42.3 Å²	42.3	37%	0.37	22%	0.222	S	C	.	.			trans	-116.3	-24.2	178.7	-62.3	-177.3	-176.8	175.6	0	112.9	I813 L837 Q864 H865	I813-K839 HydrophobicContact CG2-CB 4.12Å; I813-K839 HydrophobicContact CG2-CD 3.96Å; I813-K839 HydrophobicContact CG2-CG 4.07Å; I813-K839 PolarHBondContact O-N 3.48Å; L837-K839 PolarHBondContact O-N 3.39Å; K839-Q864 HydrophobicContact CB-CB 4.46Å; K839-Q864 CarbonylContact O-C 3.51Å; K839-Q864 WeakPolarHBondContact O-CA 3.48Å; K839-Q864 PolarHBondContact O-N 2.98Å; K839-H865 PolarHBondContact O-N 3.13Å
840	K	97.8	Very high	95.6	Very high	82 Å²	82	40.2 Å²	40.2	36%	0.357	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.8	-179.4	178.3	175.3	174	-168.1	0	110.5	I813 S814 L815 L842 H865	I813-K840 PolarHBondContact O-N 3.43Å; S814-K840 CarbonylContact C-O 3.5Å; S814-K840 WeakPolarHBondContact CA-O 2.98Å; L815-K840 PolarHBondContact N-O 3.22Å; K840-L842 HydrophobicContact CG-CD2 4.42Å; K840-L842 HydrophobicContact CG-CG 4.45Å; K840-H865 WeakPolarHBondContact CA-O 3.36Å; K840-H865 HydrophobicContact CB-CB 4.1Å; K840-H865 HydrophobicContact CG-CB 3.96Å
841	L	97.9	Very high	95.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	122.8	176.1	-176.4	54.6	0	0	0	109.3	L815 L828 V831 L838 L843 L857 L863 H865 L866 S867	L815-L841 HydrophobicContact CB-CD1 3.97Å; L815-L841 HydrophobicContact CD2-CD1 4.07Å; L815-L841 HydrophobicContact CG-CD1 4.03Å; L815-L841 WeakPolarHBondContact O-CA 3.25Å; L828-L841 HydrophobicContact CD2-CD2 4.49Å; V831-L841 HydrophobicContact CG1-CD2 4.1Å; L838-L841 HydrophobicContact CD2-CB 4.07Å; L838-L841 HydrophobicContact CD2-CD1 4.26Å; L838-L841 HydrophobicContact CD2-CD2 4.31Å; L838-L841 HydrophobicContact CD2-CG 4.45Å; L841-L843 HydrophobicContact CD1-CD2 3.96Å; L841-L843 HydrophobicContact CD1-CG 4.19Å; L841-L843 HydrophobicContact CD2-CD1 3.98Å; L841-L843 HydrophobicContact CD2-CG 4.42Å; L841-L843 HydrophobicContact CG-CD1 3.99Å; L841-L843 HydrophobicContact CG-CD2 4.22Å; L841-L843 HydrophobicContact CG-CG 3.93Å; L841-L857 HydrophobicContact CD2-CD1 3.84Å; L841-L857 HydrophobicContact CD2-CD2 3.58Å; L841-L857 HydrophobicContact CD2-CG 4.4Å; L841-L863 HydrophobicContact CB-CD1 3.9Å; L841-H865 PolarHBondContact N-O 3.35Å; L841-L866 HydrophobicContact CB-CD1 4.12Å; L841-L866 HydrophobicContact CD2-CD1 4.26Å; L841-L866 HydrophobicContact CG-CD1 4.2Å; L841-L866 WeakPolarHBondContact O-CA 3.17Å; L841-S867 PolarHBondContact O-N 3.17Å
842	L	97.8	Very high	95.6	Very high	31 Å²	31	44.5 Å²	44.5	16%	0.162	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.5	175.3	-52.4	-179.9	0	0	0	109.3	L815 N816 L817 K840	L815-L842 PolarHBondContact O-N 2.84Å; N816-L842 HydrophobicContact CB-CB 4.13Å; N816-L842 HydrophobicContact CB-CD1 4.12Å; N816-L842 HydrophobicContact CB-CG 4.45Å; N816-L842 WeakPolarHBondContact OD1-CB 3.43Å; L817-L842 PolarHBondContact N-O 3.43Å; K840-L842 HydrophobicContact CG-CD2 4.42Å; K840-L842 HydrophobicContact CG-CG 4.45Å
843	L	96.7	Very high	95.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.			trans	-130.2	24.7	-173	-61	168.5	0	0	0	110.8	L817 L828 L841 R845 C846 L849 L857 L866 S867 V868 C871	L817-L843 HydrophobicContact CB-CD2 4.21Å; L817-L843 HydrophobicContact CD1-CD2 4.06Å; L828-L843 HydrophobicContact CD1-CD1 4.06Å; L828-L843 HydrophobicContact CD2-CD1 3.93Å; L828-L843 HydrophobicContact CD2-CD2 3.98Å; L841-L843 HydrophobicContact CD1-CD2 3.96Å; L841-L843 HydrophobicContact CD1-CG 4.19Å; L841-L843 HydrophobicContact CD2-CD1 3.98Å; L841-L843 HydrophobicContact CD2-CG 4.42Å; L841-L843 HydrophobicContact CG-CD1 3.99Å; L841-L843 HydrophobicContact CG-CD2 4.22Å; L841-L843 HydrophobicContact CG-CG 3.93Å; L843-R845 PolarHBondContact O-N 3.46Å; L843-C846 HydrophobicContact CB-CB 4.47Å; L843-C846 WeakPolarHBondContact O-CB 3.49Å; L843-C846 PolarHBondContact O-N 3.38Å; L843-L849 HydrophobicContact CB-CD1 3.93Å; L843-L849 HydrophobicContact CD1-CD1 3.88Å; L843-L849 HydrophobicContact CD2-CD1 4.35Å; L843-L849 HydrophobicContact CG-CD1 4.27Å; L843-L857 HydrophobicContact CD1-CD1 4.17Å; L843-L866 HydrophobicContact CD1-CD1 4.19Å; L843-S867 PolarHBondContact N-O 3.34Å; L843-V868 HydrophobicContact CB-CG1 4.22Å; L843-V868 HydrophobicContact CD1-CG1 4.13Å; L843-C871 PolarHBondContact O-SG 3.11Å
844	D	95.8	Very high	95.7	Very high	31 Å²	31	39.7 Å²	39.7	17%	0.166	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	123	-170.3	-60.2	-25.2	0	0	0	110.3	S818 W819 C846 S867 R869	S818-D844 CarbonylContact C-O 3.45Å; S818-D844 WeakPolarHBondContact CA-O 3.27Å; S818-D844 WeakPolarHBondContact CB-O 3.49Å; S818-D844 WeakPolarHBondContact OG-CB 3.27Å; S818-D844 PolarHBondContact OG-N 2.89Å; W819-D844 PolarHBondContact N-O 3.49Å; D844-C846 VanDerWaalsContact C-N 3.32Å; D844-C846 PolarHBondContact O-N 3.11Å; D844-S867 VanDerWaalsContact OD1-CB 3.29Å; D844-S867 WeakPolarHBondContact OD1-CB 3.38Å; D844-S867 PolarHBondContact OD1-OG 3.26Å; D844-S867 PolarHBondContact OD2-OG 2.91Å; D844-R869 CarbonylContact C-O 3.57Å; D844-R869 VanDerWaalsContact CA-O 3.31Å; D844-R869 WeakPolarHBondContact CA-O 3.32Å; D844-R869 HydrophobicContact CB-CB 3.88Å; D844-R869 VanDerWaalsContact OD1-CB 3.27Å; D844-R869 WeakPolarHBondContact OD1-CB 3.33Å; D844-R869 VanDerWaalsContact OD1-CG 3.26Å; D844-R869 WeakPolarHBondContact OD1-CG 3.41Å; D844-R869 PolarHBondContact OD1-N 3.03Å
845	R	94.7	Very high	95.8	Very high	57 Å²	57	38.7 Å²	38.7	22%	0.215	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	21.1	-176	-57.6	164.9	176.1	-87	0.4	115.5	W819 L843 T847 R869 W870	W819-R845 HydrophobicContact CD2-CB 4.38Å; W819-R845 VanDerWaalsContact CE2-CD 3.43Å; W819-R845 HydrophobicContact CE3-CB 4.36Å; W819-R845 VanDerWaalsContact CZ3-CD 3.48Å; L843-R845 PolarHBondContact O-N 3.46Å; R845-T847 PolarHBondContact O-N 3.08Å; R845-T847 VanDerWaalsContact O-N 3.15Å; R845-R869 PolarHBondContact N-O 2.75Å; R845-W870 HydrophobicContact CG-CB 3.69Å; R845-W870 HydrophobicContact CG-CG 4.28Å
846	C	95.3	Very high	95.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.207	C	C	.	.			trans	-69.6	102.3	155.7	-64.5	0	0	0	0	107.7	L817 C820 L843 D844 L849 C871	L817-C846 PolarHBondContact O-SG 3.24Å; C820-C846 PolarHBondContact O-SG 3.24Å; C820-C846 VanDerWaalsContact O-SG 3.36Å; L843-C846 HydrophobicContact CB-CB 4.47Å; L843-C846 WeakPolarHBondContact O-CB 3.49Å; L843-C846 PolarHBondContact O-N 3.38Å; D844-C846 VanDerWaalsContact C-N 3.32Å; D844-C846 PolarHBondContact O-N 3.11Å; C846-L849 HydrophobicContact CB-CD1 3.47Å; C846-L849 VanDerWaalsContact CB-CD1 3.47Å; C846-L849 HydrophobicContact CB-CG 3.72Å; C846-C871 PolarHBondContact O-SG 2.96Å
847	T	92.8	Very high	95.8	Very high	38 Å²	38	35.9 Å²	35.9	23%	0.233	18%	0.18	C	C	.	.			trans	-79.1	-31.9	-169	44.7	0	0	0	0	114	R845 L849 I872 N873	R845-T847 PolarHBondContact O-N 3.08Å; R845-T847 VanDerWaalsContact O-N 3.15Å; T847-L849 VanDerWaalsContact C-N 3.27Å; T847-L849 PolarHBondContact O-N 3.44Å; T847-I872 HydrophobicContact CG2-CD1 4.45Å; T847-I872 HydrophobicContact CG2-CG1 4.48Å; T847-N873 PolarHBondContact O-ND2 3.19Å
848	E	94.7	Very high	95.6	Very high	94 Å²	94	32.4 Å²	32.4	44%	0.439	17%	0.165	S	C	.	.	S	Bend	trans	-79.6	-9.3	-174.5	-49.1	-44.2	110.4	0	0	113.3	T824 T850	T824-E848 HydrophobicContact CG2-CB 4.18Å; E848-T850 PolarHBondContact O-N 2.67Å
849	L	96.2	Very high	95.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.193	C	C	.	.			trans	-67	129.8	177.7	-60.2	-176.8	0	0	0	111.9	D825 L828 L843 C846 T847 N873	D825-L849 WeakPolarHBondContact OD1-CA 3.5Å; L828-L849 HydrophobicContact CD1-CD1 3.99Å; L828-L849 HydrophobicContact CD1-CD2 3.64Å; L828-L849 HydrophobicContact CD1-CG 4.36Å; L828-L849 HydrophobicContact CG-CD2 3.93Å; L843-L849 HydrophobicContact CB-CD1 3.93Å; L843-L849 HydrophobicContact CD1-CD1 3.88Å; L843-L849 HydrophobicContact CD2-CD1 4.35Å; L843-L849 HydrophobicContact CG-CD1 4.27Å; C846-L849 HydrophobicContact CB-CD1 3.47Å; C846-L849 VanDerWaalsContact CB-CD1 3.47Å; C846-L849 HydrophobicContact CB-CG 3.72Å; T847-L849 VanDerWaalsContact C-N 3.27Å; T847-L849 PolarHBondContact O-N 3.44Å; L849-N873 VanDerWaalsContact O-CB 3.26Å; L849-N873 WeakPolarHBondContact O-CB 3.04Å
850	T	96.1	Very high	95.1	Very high	50 Å²	50	33.6 Å²	33.6	31%	0.307	18%	0.179	S	C	.	.			trans	-114	-177.6	176.5	86.1	0	0	0	0	111.4	D825 E848 L852 G853 L874	D825-T850 PolarHBondContact OD1-N 3.14Å; D825-T850 VanDerWaalsContact OD2-CB 3.31Å; D825-T850 WeakPolarHBondContact OD2-CB 3.4Å; D825-T850 WeakPolarHBondContact OD2-CG2 3.28Å; D825-T850 PolarHBondContact OD2-N 3.14Å; D825-T850 PolarHBondContact OD2-OG1 3.03Å; E848-T850 PolarHBondContact O-N 2.67Å; T850-L852 PolarHBondContact O-N 3.1Å; T850-L852 WeakPolarHBondContact OG1-CB 3.5Å; T850-L852 PolarHBondContact OG1-N 3.46Å; T850-G853 PolarHBondContact O-N 3.43Å; T850-L874 VanDerWaalsContact C-CD2 3.43Å; T850-L874 VanDerWaalsContact O-CD2 3.25Å; T850-L874 WeakPolarHBondContact O-CD2 3.37Å
851	D	95.5	Very high	94.6	Very high	28 Å²	28	33.9 Å²	33.9	15%	0.15	19%	0.191	C	C	.	.	H	α-helix	trans	-59.9	-24	175.5	-58.7	-42.7	0	0	0	112.3	I854 S855 S875 S878	D851-I854 PolarHBondContact O-N 3.2Å; D851-S855 PolarHBondContact O-N 3.29Å; D851-S875 PolarHBondContact OD1-N 3.24Å; D851-S875 WeakPolarHBondContact OD2-CB 3.44Å; D851-S875 PolarHBondContact OD2-N 3.48Å; D851-S875 PolarHBondContact OD2-OG 2.96Å; D851-S878 VanDerWaalsContact CG-N 3.33Å; D851-S878 VanDerWaalsContact OD1-CB 3.24Å; D851-S878 WeakPolarHBondContact OD1-CB 3.47Å; D851-S878 PolarHBondContact OD1-N 3.47Å; D851-S878 VanDerWaalsContact OD1-N 3.08Å
852	L	95.5	Very high	94.3	Very high	97 Å²	97	36.8 Å²	36.8	51%	0.508	21%	0.206	S	C	.	.	H	α-helix	trans	-64.2	-46.5	175.2	-177.8	68.2	0	0	0	111.7	D825 T850 I854 S855 H856	D825-L852 HydrophobicContact CB-CB 4.37Å; D825-L852 HydrophobicContact CB-CD2 4.31Å; D825-L852 HydrophobicContact CB-CG 4.38Å; T850-L852 PolarHBondContact O-N 3.1Å; T850-L852 WeakPolarHBondContact OG1-CB 3.5Å; T850-L852 PolarHBondContact OG1-N 3.46Å; L852-I854 VanDerWaalsContact C-N 3.26Å; L852-I854 PolarHBondContact O-N 2.7Å; L852-S855 WeakPolarHBondContact O-CA 3.28Å; L852-S855 VanDerWaalsContact O-CB 3.22Å; L852-S855 WeakPolarHBondContact O-CB 3.43Å; L852-S855 PolarHBondContact O-N 3.04Å; L852-S855 PolarHBondContact O-OG 3.44Å; L852-H856 PolarHBondContact O-CD2 3.13Å; L852-H856 PolarHBondContact O-N 3.3Å
853	G	95.4	Very high	94.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.2	-38.6	176.7	0	0	0	0	0	112.7	D825 T850 S855 H856 L857	D825-G853 WeakPolarHBondContact OD1-CA 3.34Å; D825-G853 PolarHBondContact OD1-N 3.26Å; T850-G853 PolarHBondContact O-N 3.43Å; G853-S855 VanDerWaalsContact C-N 3.29Å; G853-S855 PolarHBondContact O-N 3.18Å; G853-H856 PolarHBondContact O-N 2.95Å; G853-L857 PolarHBondContact O-N 3.43Å
854	I	95.9	Very high	94.1	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-69.1	-28.6	174.1	-50.3	-56.3	0	0	0	111.8	D851 L852 L857 A858 V868 L874 H881 L882	D851-I854 PolarHBondContact O-N 3.2Å; L852-I854 VanDerWaalsContact C-N 3.26Å; L852-I854 PolarHBondContact O-N 2.7Å; I854-L857 HydrophobicContact CD1-CD1 4.21Å; I854-L857 PolarHBondContact O-N 3.36Å; I854-A858 PolarHBondContact O-N 3.39Å; I854-A858 VanDerWaalsContact O-N 3.07Å; I854-V868 HydrophobicContact CD1-CG1 4.13Å; I854-L874 HydrophobicContact CD1-CD1 4.14Å; I854-L874 HydrophobicContact CD1-CD2 4.15Å; I854-L874 HydrophobicContact CG1-CD1 4.2Å; I854-L874 HydrophobicContact CG1-CD2 3.59Å; I854-H881 HydrophobicContact CG2-CB 4.23Å; I854-L882 HydrophobicContact CG2-CD1 4.42Å; I854-L882 HydrophobicContact CG2-CD2 3.71Å; I854-L882 HydrophobicContact CG2-CG 3.74Å
855	S	95.3	Very high	94.2	Very high	30 Å²	30	40.9 Å²	40.9	21%	0.21	22%	0.224	C	C	.	.	H	α-helix	trans	-66.6	-36.1	173.4	88.3	0	0	0	0	113.1	D851 L852 G853 A858 H881	D851-S855 PolarHBondContact O-N 3.29Å; L852-S855 WeakPolarHBondContact O-CA 3.28Å; L852-S855 VanDerWaalsContact O-CB 3.22Å; L852-S855 WeakPolarHBondContact O-CB 3.43Å; L852-S855 PolarHBondContact O-N 3.04Å; L852-S855 PolarHBondContact O-OG 3.44Å; G853-S855 VanDerWaalsContact C-N 3.29Å; G853-S855 PolarHBondContact O-N 3.18Å; S855-A858 WeakPolarHBondContact O-CB 3.38Å; S855-A858 PolarHBondContact O-N 2.92Å; S855-H881 VanDerWaalsContact CB-CE1 3.45Å; S855-H881 WeakPolarHBondContact CB-CE1 3.24Å
856	H	95	Very high	94.3	Very high	34 Å²	34	38.2 Å²	38.2	16%	0.157	21%	0.214	C	C	.	.	H	α-helix	trans	-66.3	-45.7	172.1	-61	-84.5	0	0	0	110.6	E829 A832 L852 G853 A858 T859	E829-H856 HydrophobicContact CB-CB 4.48Å; E829-H856 WeakPolarHBondContact CG-ND1 3.07Å; E829-H856 IonicContact OE1-CE1 3.12Å; E829-H856 PolarHBondContact OE1-CE1 2.81Å; E829-H856 IonicContact OE1-ND1 3.25Å; E829-H856 PolarHBondContact OE1-ND1 2.93Å; E829-H856 IonicContact OE2-CE1 3.85Å; A832-H856 HydrophobicContact CB-CB 4.03Å; A832-H856 WeakPolarHBondContact CB-O 3.35Å; L852-H856 PolarHBondContact O-CD2 3.13Å; L852-H856 PolarHBondContact O-N 3.3Å; G853-H856 PolarHBondContact O-N 2.95Å; H856-A858 PolarHBondContact O-N 3.31Å; H856-A858 VanDerWaalsContact O-N 3.12Å; H856-T859 WeakPolarHBondContact O-CB 3.41Å; H856-T859 PolarHBondContact O-N 3.1Å; H856-T859 VanDerWaalsContact O-N 3.14Å; H856-T859 PolarHBondContact O-OG1 2.83Å
857	L	94.2	Very high	94.3	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-60.3	-21.4	176	-63.5	-179.2	0	0	0	113.7	L828 V831 L841 L843 G853 I854 T859 M860 L866	L828-L857 HydrophobicContact CD1-CD1 4.04Å; L828-L857 HydrophobicContact CD1-CG 4.36Å; L828-L857 HydrophobicContact CD2-CD2 4.5Å; V831-L857 HydrophobicContact CG1-CD2 4.24Å; L841-L857 HydrophobicContact CD2-CD1 3.84Å; L841-L857 HydrophobicContact CD2-CD2 3.58Å; L841-L857 HydrophobicContact CD2-CG 4.4Å; L843-L857 HydrophobicContact CD1-CD1 4.17Å; G853-L857 PolarHBondContact O-N 3.43Å; I854-L857 HydrophobicContact CD1-CD1 4.21Å; I854-L857 PolarHBondContact O-N 3.36Å; L857-T859 PolarHBondContact O-N 3.23Å; L857-T859 VanDerWaalsContact O-N 3.14Å; L857-M860 HydrophobicContact CD2-SD 3.58Å; L857-M860 VanDerWaalsContact CD2-SD 3.58Å; L857-M860 WeakPolarHBondContact O-CB 3.24Å; L857-M860 PolarHBondContact O-N 2.59Å; L857-L866 HydrophobicContact CD1-CD1 4.08Å; L857-L866 HydrophobicContact CD1-CD2 4.41Å
858	A	91.7	Very high	94.5	Very high	20 Å²	20	36.7 Å²	36.7	17%	0.165	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.5	175.1	0	0	0	0	0	113.6	I854 S855 H856 M860 H881	I854-A858 PolarHBondContact O-N 3.39Å; I854-A858 VanDerWaalsContact O-N 3.07Å; S855-A858 WeakPolarHBondContact O-CB 3.38Å; S855-A858 PolarHBondContact O-N 2.92Å; H856-A858 PolarHBondContact O-N 3.31Å; H856-A858 VanDerWaalsContact O-N 3.12Å; A858-M860 VanDerWaalsContact C-N 3.32Å; A858-H881 HydrophobicContact CB-CB 4.11Å
859	T	90.1	Very high	94.4	Very high	99 Å²	99	35 Å²	35	61%	0.607	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-19.1	179	65.7	0	0	0	0	113.5	H856 L857 S861	H856-T859 WeakPolarHBondContact O-CB 3.41Å; H856-T859 PolarHBondContact O-N 3.1Å; H856-T859 VanDerWaalsContact O-N 3.14Å; H856-T859 PolarHBondContact O-OG1 2.83Å; L857-T859 PolarHBondContact O-N 3.23Å; L857-T859 VanDerWaalsContact O-N 3.14Å; T859-S861 PolarHBondContact O-N 3.34Å
860	M	92.3	Very high	94.3	Very high	12 Å²	12	36.9 Å²	36.9	6%	0.059	20%	0.201	C	C	.	.			trans	-77.9	84.5	-170.1	-60	-166.7	90.9	0	0	113.1	V831 A832 L835 L838 L857 A858 N862 L863	V831-M860 HydrophobicContact CG1-CE 4.25Å; V831-M860 HydrophobicContact CG1-SD 4.26Å; V831-M860 VanDerWaalsContact O-CE 3.29Å; V831-M860 WeakPolarHBondContact O-CE 3.28Å; A832-M860 HydrophobicContact CB-CG 4.11Å; A832-M860 HydrophobicContact CB-SD 4.42Å; L835-M860 HydrophobicContact CB-CE 4.44Å; L835-M860 WeakPolarHBondContact O-CE 3.44Å; L838-M860 HydrophobicContact CB-CE 3.91Å; L838-M860 HydrophobicContact CD2-CE 4.01Å; L857-M860 HydrophobicContact CD2-SD 3.58Å; L857-M860 VanDerWaalsContact CD2-SD 3.58Å; L857-M860 WeakPolarHBondContact O-CB 3.24Å; L857-M860 PolarHBondContact O-N 2.59Å; A858-M860 VanDerWaalsContact C-N 3.32Å; M860-N862 PolarHBondContact O-N 2.55Å; M860-N862 VanDerWaalsContact O-N 3.07Å; M860-L863 HydrophobicContact CB-CB 3.89Å; M860-L863 WeakPolarHBondContact O-CB 3.31Å; M860-L863 PolarHBondContact O-N 3.15Å; M860-L863 VanDerWaalsContact O-N 3.07Å
861	S	87.6	Confident	94.2	Very high	87 Å²	87	34.5 Å²	34.5	61%	0.608	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-24.6	-179.7	62.2	0	0	0	0	116	T859	T859-S861 PolarHBondContact O-N 3.34Å
862	N	92.4	Very high	94	Very high	61 Å²	61	36.8 Å²	36.8	33%	0.326	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-8.2	179.2	-78.2	-47.2	0	0	0	114.7	V836 L838 M860 Q864	V836-N862 PolarHBondContact O-ND2 2.79Å; L838-N862 CarbonylContact O-C 3.6Å; M860-N862 PolarHBondContact O-N 2.55Å; M860-N862 VanDerWaalsContact O-N 3.07Å; N862-Q864 PolarHBondContact O-N 3.34Å
863	L	95.2	Very high	93.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.187	C	C	.	.			trans	-70.3	121	-175.5	-172.5	64.1	0	0	0	110.8	L841 M860 L866 G887 L888	L841-L863 HydrophobicContact CB-CD1 3.9Å; M860-L863 HydrophobicContact CB-CB 3.89Å; M860-L863 WeakPolarHBondContact O-CB 3.31Å; M860-L863 PolarHBondContact O-N 3.15Å; M860-L863 VanDerWaalsContact O-N 3.07Å; L863-L866 HydrophobicContact CD2-CB 4.43Å; L863-G887 CarbonylContact O-C 3.55Å; L863-L888 WeakPolarHBondContact O-CA 3.45Å; L863-L888 PolarHBondContact O-N 2.85Å
864	Q	95.5	Very high	93.8	Very high	80 Å²	80	34.8 Å²	34.8	37%	0.374	19%	0.187	S	C	.	.			trans	-116	-26.9	-173.1	-74.1	174.7	-6.7	0	0	113.4	K839 N862 S889 Y890	K839-Q864 HydrophobicContact CB-CB 4.46Å; K839-Q864 CarbonylContact O-C 3.51Å; K839-Q864 WeakPolarHBondContact O-CA 3.48Å; K839-Q864 PolarHBondContact O-N 2.98Å; N862-Q864 PolarHBondContact O-N 3.34Å; Q864-S889 WeakPolarHBondContact O-CA 3.15Å; Q864-S889 PolarHBondContact O-N 2.9Å; Q864-S889 PolarHBondContact O-OG 2.9Å; Q864-Y890 PolarHBondContact O-N 3.39Å
865	H	96.6	Very high	93.7	Very high	69 Å²	69	35.8 Å²	35.8	32%	0.319	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	119.4	177.3	-69	-103.9	0	0	0	110.1	K839 K840 L841 Y890	K839-H865 PolarHBondContact O-N 3.13Å; K840-H865 WeakPolarHBondContact CA-O 3.36Å; K840-H865 HydrophobicContact CB-CB 4.1Å; K840-H865 HydrophobicContact CG-CB 3.96Å; L841-H865 PolarHBondContact N-O 3.35Å; H865-Y890 WeakPolarHBondContact CA-O 3.22Å; H865-Y890 WeakPolarHBondContact ND1-CB 3.38Å; H865-Y890 AromaticContact ND1-CD1 3.98Å; H865-Y890 AromaticContact ND1-CD2 3.77Å; H865-Y890 AromaticContact ND1-CG 3.39Å
866	L	96.7	Very high	93.6	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132.3	172.1	-177.6	60.6	0	0	0	110.1	L841 L843 L857 L863 V868 L882 L888 Y890 L891 C892	L841-L866 HydrophobicContact CB-CD1 4.12Å; L841-L866 HydrophobicContact CD2-CD1 4.26Å; L841-L866 HydrophobicContact CG-CD1 4.2Å; L841-L866 WeakPolarHBondContact O-CA 3.17Å; L843-L866 HydrophobicContact CD1-CD1 4.19Å; L857-L866 HydrophobicContact CD1-CD1 4.08Å; L857-L866 HydrophobicContact CD1-CD2 4.41Å; L863-L866 HydrophobicContact CD2-CB 4.43Å; L866-V868 HydrophobicContact CD1-CG1 4.14Å; L866-V868 HydrophobicContact CG-CG1 4.21Å; L866-L882 HydrophobicContact CD2-CD2 3.65Å; L866-L888 HydrophobicContact CB-CD1 3.77Å; L866-Y890 PolarHBondContact N-O 2.87Å; L866-L891 HydrophobicContact CB-CD1 4.37Å; L866-L891 HydrophobicContact CD2-CD1 4.34Å; L866-L891 HydrophobicContact CG-CD1 4.45Å; L866-L891 WeakPolarHBondContact O-CA 3.49Å; L866-C892 PolarHBondContact O-N 2.92Å
867	S	96.4	Very high	93.4	Very high	4 Å²	4	37 Å²	37	3%	0.028	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	124.7	172.2	-164.5	0	0	0	0	109.8	L841 L843 D844	L841-S867 PolarHBondContact O-N 3.17Å; L843-S867 PolarHBondContact N-O 3.34Å; D844-S867 VanDerWaalsContact OD1-CB 3.29Å; D844-S867 WeakPolarHBondContact OD1-CB 3.38Å; D844-S867 PolarHBondContact OD1-OG 3.26Å; D844-S867 PolarHBondContact OD2-OG 2.91Å
868	V	95.4	Very high	93.4	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	21%	0.208	C	C	.	.			trans	-129.5	39.9	-179	-69.9	0	0	0	0	109.9	L843 I854 L866 W870 C871 L874 C892 L893 C896	L843-V868 HydrophobicContact CB-CG1 4.22Å; L843-V868 HydrophobicContact CD1-CG1 4.13Å; I854-V868 HydrophobicContact CD1-CG1 4.13Å; L866-V868 HydrophobicContact CD1-CG1 4.14Å; L866-V868 HydrophobicContact CG-CG1 4.21Å; V868-W870 PolarHBondContact O-N 2.88Å; V868-C871 HydrophobicContact CB-CB 4.18Å; V868-C871 WeakPolarHBondContact O-CB 3.46Å; V868-C871 PolarHBondContact O-N 3.48Å; V868-C871 VanDerWaalsContact O-N 3.12Å; V868-C871 PolarHBondContact O-SG 3.21Å; V868-L874 HydrophobicContact CB-CD1 3.72Å; V868-L874 HydrophobicContact CG1-CD1 4.14Å; V868-L874 HydrophobicContact CG2-CD1 3.63Å; V868-C892 VanDerWaalsContact CG2-O 3.23Å; V868-C892 WeakPolarHBondContact CG2-O 3.32Å; V868-C892 PolarHBondContact N-O 3.16Å; V868-L893 HydrophobicContact CG2-CD2 3.77Å; V868-C896 PolarHBondContact O-SG 3.15Å
869	R	93.9	Very high	93.5	Very high	59 Å²	59	36 Å²	36	22%	0.223	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	131.3	-172.6	-62.3	175.5	73.9	110.6	2.3	110.2	D844 R845 C871 C892 S894 E917	D844-R869 CarbonylContact C-O 3.57Å; D844-R869 VanDerWaalsContact CA-O 3.31Å; D844-R869 WeakPolarHBondContact CA-O 3.32Å; D844-R869 HydrophobicContact CB-CB 3.88Å; D844-R869 VanDerWaalsContact OD1-CB 3.27Å; D844-R869 WeakPolarHBondContact OD1-CB 3.33Å; D844-R869 VanDerWaalsContact OD1-CG 3.26Å; D844-R869 WeakPolarHBondContact OD1-CG 3.41Å; D844-R869 PolarHBondContact OD1-N 3.03Å; R845-R869 PolarHBondContact N-O 2.75Å; R869-C871 PolarHBondContact O-N 3.02Å; R869-C892 WeakPolarHBondContact CD-SG 3.4Å; R869-C892 HydrophobicContact CG-CB 4.15Å; R869-C892 WeakPolarHBondContact CG-SG 3.29Å; R869-C892 PolarHBondContact NH1-SG 3.43Å; R869-C892 VanDerWaalsContact NH1-SG 3.37Å; R869-S894 CarbonylContact C-O 3.6Å; R869-S894 VanDerWaalsContact CA-O 3.26Å; R869-S894 WeakPolarHBondContact CA-O 3.44Å; R869-E917 IonicContact NH1-OE1 2.71Å; R869-E917 IonicContact NH1-OE2 2.72Å; R869-E917 PolarHBondContact NH1-OE2 3.2Å
870	W	93.3	Very high	93.5	Very high	39 Å²	39	34.8 Å²	34.8	15%	0.148	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	22	-178.1	-52.3	90.7	0	0	0	114.9	L18 R845 V868 I872 S894 H920	L18-W870 HydrophobicContact CD2-CH2 3.41Å; L18-W870 VanDerWaalsContact CD2-CH2 3.41Å; L18-W870 HydrophobicContact CD2-CZ2 4Å; L18-W870 HydrophobicContact CD2-CZ3 4Å; R845-W870 HydrophobicContact CG-CB 3.69Å; R845-W870 HydrophobicContact CG-CG 4.28Å; V868-W870 PolarHBondContact O-N 2.88Å; W870-I872 VanDerWaalsContact C-N 3.26Å; W870-I872 WeakPolarHBondContact O-CG2 3.29Å; W870-I872 PolarHBondContact O-N 3.45Å; W870-S894 PolarHBondContact N-O 3.47Å; W870-H920 HydrophobicContact CH2-CB 4.03Å; W870-H920 HydrophobicContact CZ2-CB 4.1Å; W870-H920 AromaticContact CZ2-CD2 3.77Å; W870-H920 AromaticContact CZ2-CG 3.98Å
871	C	93.9	Very high	93.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.206	C	C	.	.			trans	-69.5	89.3	162.2	-66.7	0	0	0	0	108	L843 C846 V868 R869 N873 L874 C896	L843-C871 PolarHBondContact O-SG 3.11Å; C846-C871 PolarHBondContact O-SG 2.96Å; V868-C871 HydrophobicContact CB-CB 4.18Å; V868-C871 WeakPolarHBondContact O-CB 3.46Å; V868-C871 PolarHBondContact O-N 3.48Å; V868-C871 VanDerWaalsContact O-N 3.12Å; V868-C871 PolarHBondContact O-SG 3.21Å; R869-C871 PolarHBondContact O-N 3.02Å; C871-N873 PolarHBondContact O-N 2.85Å; C871-L874 HydrophobicContact CB-CD1 3.71Å; C871-L874 HydrophobicContact CB-CG 3.78Å; C871-L874 PolarHBondContact O-N 2.81Å; C871-C896 PolarHBondContact O-SG 3.34Å; C871-C896 VanDerWaalsContact O-SG 3.35Å
872	I	91.3	Very high	93.7	Very high	76 Å²	76	33.4 Å²	33.4	39%	0.39	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-22.3	-168.9	56.9	173.7	0	0	0	113.9	T847 W870 R898	T847-I872 HydrophobicContact CG2-CD1 4.45Å; T847-I872 HydrophobicContact CG2-CG1 4.48Å; W870-I872 VanDerWaalsContact C-N 3.26Å; W870-I872 WeakPolarHBondContact O-CG2 3.29Å; W870-I872 PolarHBondContact O-N 3.45Å; I872-R898 WeakPolarHBondContact O-CD 3.38Å; I872-R898 WeakPolarHBondContact O-CG 3.15Å
873	N	93.2	Very high	93.5	Very high	54 Å²	54	32.5 Å²	32.5	29%	0.289	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-11.2	-177.6	-77.2	-14.4	0	0	0	113.4	T847 L849 C871 R898	T847-N873 PolarHBondContact O-ND2 3.19Å; L849-N873 VanDerWaalsContact O-CB 3.26Å; L849-N873 WeakPolarHBondContact O-CB 3.04Å; C871-N873 PolarHBondContact O-N 2.85Å; N873-R898 PolarHBondContact O-NH1 3.26Å
874	L	94.3	Very high	93.1	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	19%	0.193	C	C	.	.			trans	-70.4	132.6	173.5	-59.4	-174.8	0	0	0	111.7	T850 I854 V868 C871 R898	T850-L874 VanDerWaalsContact C-CD2 3.43Å; T850-L874 VanDerWaalsContact O-CD2 3.25Å; T850-L874 WeakPolarHBondContact O-CD2 3.37Å; I854-L874 HydrophobicContact CD1-CD1 4.14Å; I854-L874 HydrophobicContact CD1-CD2 4.15Å; I854-L874 HydrophobicContact CG1-CD1 4.2Å; I854-L874 HydrophobicContact CG1-CD2 3.59Å; V868-L874 HydrophobicContact CB-CD1 3.72Å; V868-L874 HydrophobicContact CG1-CD1 4.14Å; V868-L874 HydrophobicContact CG2-CD1 3.63Å; C871-L874 HydrophobicContact CB-CD1 3.71Å; C871-L874 HydrophobicContact CB-CG 3.78Å; C871-L874 PolarHBondContact O-N 2.81Å; L874-R898 WeakPolarHBondContact O-CB 3.39Å
875	S	93.6	Very high	92.8	Very high	23 Å²	23	31.9 Å²	31.9	16%	0.161	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-124.7	-170.9	178.5	87.1	0	0	0	0	111.5	D851 G877 S878	D851-S875 PolarHBondContact OD1-N 3.24Å; D851-S875 WeakPolarHBondContact OD2-CB 3.44Å; D851-S875 PolarHBondContact OD2-N 3.48Å; D851-S875 PolarHBondContact OD2-OG 2.96Å; S875-G877 PolarHBondContact O-N 2.84Å; S875-G877 VanDerWaalsContact O-N 3.13Å; S875-G877 PolarHBondContact OG-N 3.3Å; S875-S878 PolarHBondContact O-N 2.87Å; S875-S878 VanDerWaalsContact O-N 3.11Å; S875-S878 PolarHBondContact O-OG 2.82Å
876	D	93	Very high	92	Very high	54 Å²	54	32.2 Å²	32.2	29%	0.289	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.8	175.8	-63.1	-29.7	0	0	0	113.4	S878 I879 P880 I899 S900 G903	D876-S878 PolarHBondContact O-N 3.46Å; D876-I879 PolarHBondContact O-N 3.08Å; D876-P880 WeakPolarHBondContact O-CD 3.31Å; D876-I899 WeakPolarHBondContact OD1-CA 3.21Å; D876-I899 WeakPolarHBondContact OD1-CG2 3.47Å; D876-S900 VanDerWaalsContact CG-OG 3.26Å; D876-S900 PolarHBondContact OD1-N 3.47Å; D876-S900 PolarHBondContact OD1-OG 3.29Å; D876-S900 WeakPolarHBondContact OD2-CB 3.41Å; D876-S900 PolarHBondContact OD2-OG 3.09Å; D876-G903 WeakPolarHBondContact OD1-CA 3.37Å
877	G	91.6	Very high	91.5	Very high	35 Å²	35	33 Å²	33	36%	0.361	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-30	172.9	0	0	0	0	0	113.6	S875 I879 P880 H881	S875-G877 PolarHBondContact O-N 2.84Å; S875-G877 VanDerWaalsContact O-N 3.13Å; S875-G877 PolarHBondContact OG-N 3.3Å; G877-I879 VanDerWaalsContact C-N 3.35Å; G877-I879 PolarHBondContact O-N 3.36Å; G877-P880 WeakPolarHBondContact O-CD 3.41Å; G877-H881 PolarHBondContact O-CD2 3.43Å; G877-H881 VanDerWaalsContact O-CD2 3.23Å
878	S	94	Very high	91.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-70.2	-25.7	175	63.3	0	0	0	0	113.9	D851 S875 D876 H881 L882	D851-S878 VanDerWaalsContact CG-N 3.33Å; D851-S878 VanDerWaalsContact OD1-CB 3.24Å; D851-S878 WeakPolarHBondContact OD1-CB 3.47Å; D851-S878 PolarHBondContact OD1-N 3.47Å; D851-S878 VanDerWaalsContact OD1-N 3.08Å; S875-S878 PolarHBondContact O-N 2.87Å; S875-S878 VanDerWaalsContact O-N 3.11Å; S875-S878 PolarHBondContact O-OG 2.82Å; D876-S878 PolarHBondContact O-N 3.46Å; S878-H881 WeakPolarHBondContact O-CB 3.38Å; S878-H881 PolarHBondContact O-N 2.92Å; S878-L882 WeakPolarHBondContact O-CG 3.41Å; S878-L882 PolarHBondContact O-N 3.29Å
879	I	92.9	Very high	91.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.9	-42.6	-169.4	-51.8	-63.3	0	0	0	113.2	D876 G877 H881 L882 L883 L893 I899 T906 L907	D876-I879 PolarHBondContact O-N 3.08Å; G877-I879 VanDerWaalsContact C-N 3.35Å; G877-I879 PolarHBondContact O-N 3.36Å; I879-H881 VanDerWaalsContact C-N 3.25Å; I879-H881 PolarHBondContact O-N 3.36Å; I879-L882 HydrophobicContact CD1-CD1 4.23Å; I879-L882 PolarHBondContact O-N 3.15Å; I879-L883 HydrophobicContact CG2-CD1 4.28Å; I879-L883 HydrophobicContact CG2-CG 4.36Å; I879-L883 WeakPolarHBondContact O-CG 3.3Å; I879-L883 PolarHBondContact O-N 3.42Å; I879-L893 HydrophobicContact CD1-CD1 4.13Å; I879-I899 HydrophobicContact CD1-CD1 4.41Å; I879-I899 HydrophobicContact CD1-CG2 4.28Å; I879-T906 VanDerWaalsContact CG2-OG1 3.23Å; I879-T906 WeakPolarHBondContact CG2-OG1 3.49Å; I879-L907 HydrophobicContact CG2-CB 3.92Å; I879-L907 HydrophobicContact CG2-CD1 4.26Å
880	P	91.4	Very high	91.1	Very high	75 Å²	75	33.5 Å²	33.5	49%	0.487	20%	0.198	S	C	.	.	H	α-helix	trans	-54.5	-40.1	171	-28.2	36.1	0	0	0	113.3	D876 G877 L883 S884	D876-P880 WeakPolarHBondContact O-CD 3.31Å; G877-P880 WeakPolarHBondContact O-CD 3.41Å; P880-L883 WeakPolarHBondContact O-CB 3.18Å; P880-L883 PolarHBondContact O-N 2.95Å; P880-S884 PolarHBondContact O-N 2.88Å; P880-S884 PolarHBondContact O-OG 3.47Å
881	H	92.8	Very high	91.2	Very high	67 Å²	67	31.7 Å²	31.7	31%	0.31	19%	0.191	S	C	.	.	H	α-helix	trans	-68.5	-41.5	178.6	-63.4	-57.8	0	0	0	112.1	I854 S855 A858 G877 S878 I879 L883 S884 T885	I854-H881 HydrophobicContact CG2-CB 4.23Å; S855-H881 VanDerWaalsContact CB-CE1 3.45Å; S855-H881 WeakPolarHBondContact CB-CE1 3.24Å; A858-H881 HydrophobicContact CB-CB 4.11Å; G877-H881 PolarHBondContact O-CD2 3.43Å; G877-H881 VanDerWaalsContact O-CD2 3.23Å; S878-H881 WeakPolarHBondContact O-CB 3.38Å; S878-H881 PolarHBondContact O-N 2.92Å; I879-H881 VanDerWaalsContact C-N 3.25Å; I879-H881 PolarHBondContact O-N 3.36Å; H881-L883 VanDerWaalsContact C-N 3.34Å; H881-L883 PolarHBondContact O-N 3.29Å; H881-S884 WeakPolarHBondContact CA-OG 3.47Å; H881-S884 PolarHBondContact O-N 3.28Å; H881-S884 PolarHBondContact O-OG 3.15Å; H881-T885 PolarHBondContact O-N 2.78Å
882	L	91	Very high	91.2	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-63.5	-38	171.8	-66.1	169	0	0	0	111.9	I854 L866 S878 I879 S884 T885 L888 L891 L893 H910	I854-L882 HydrophobicContact CG2-CD1 4.42Å; I854-L882 HydrophobicContact CG2-CD2 3.71Å; I854-L882 HydrophobicContact CG2-CG 3.74Å; L866-L882 HydrophobicContact CD2-CD2 3.65Å; S878-L882 WeakPolarHBondContact O-CG 3.41Å; S878-L882 PolarHBondContact O-N 3.29Å; I879-L882 HydrophobicContact CD1-CD1 4.23Å; I879-L882 PolarHBondContact O-N 3.15Å; L882-S884 PolarHBondContact O-N 2.9Å; L882-T885 PolarHBondContact O-N 3.22Å; L882-T885 PolarHBondContact O-OG1 2.91Å; L882-L888 HydrophobicContact CD2-CD2 4.37Å; L882-L891 HydrophobicContact CD1-CD1 4.3Å; L882-L891 HydrophobicContact CD1-CD2 4.06Å; L882-L891 HydrophobicContact CD2-CD1 4.16Å; L882-L893 HydrophobicContact CD1-CD2 4.09Å; L882-H910 PolarHBondContact O-CD2 3.42Å; L882-H910 PolarHBondContact O-NE2 3.19Å
883	L	87.5	Confident	91.3	Very high	42 Å²	42	28 Å²	28	22%	0.22	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-27.5	173.9	-74.4	171.8	0	0	0	113.5	I879 P880 H881 R909 H910	I879-L883 HydrophobicContact CG2-CD1 4.28Å; I879-L883 HydrophobicContact CG2-CG 4.36Å; I879-L883 WeakPolarHBondContact O-CG 3.3Å; I879-L883 PolarHBondContact O-N 3.42Å; P880-L883 WeakPolarHBondContact O-CB 3.18Å; P880-L883 PolarHBondContact O-N 2.95Å; H881-L883 VanDerWaalsContact C-N 3.34Å; H881-L883 PolarHBondContact O-N 3.29Å; L883-R909 HydrophobicContact CD2-CB 4Å; L883-H910 HydrophobicContact CD2-CB 4.05Å
884	S	87.4	Confident	91.2	Very high	62 Å²	62	25.5 Å²	25.5	43%	0.434	16%	0.158	S	C	.	.	H	α-helix	trans	-78	-15.2	171.2	32.4	0	0	0	0	115.1	P880 H881 L882 T886	P880-S884 PolarHBondContact O-N 2.88Å; P880-S884 PolarHBondContact O-OG 3.47Å; H881-S884 WeakPolarHBondContact CA-OG 3.47Å; H881-S884 PolarHBondContact O-N 3.28Å; H881-S884 PolarHBondContact O-OG 3.15Å; L882-S884 PolarHBondContact O-N 2.9Å; S884-T886 VanDerWaalsContact C-N 3.26Å; S884-T886 PolarHBondContact O-N 2.85Å
885	T	87.7	Confident	91	Very high	5 Å²	5	25.4 Å²	25.4	3%	0.031	16%	0.158	C	C	.	.			trans	-75	68	-179.9	59.8	0	0	0	0	113.2	H881 L882 G887 L888 H910	H881-T885 PolarHBondContact O-N 2.78Å; L882-T885 PolarHBondContact O-N 3.22Å; L882-T885 PolarHBondContact O-OG1 2.91Å; T885-G887 PolarHBondContact O-N 3.22Å; T885-L888 VanDerWaalsContact O-CB 3.23Å; T885-L888 WeakPolarHBondContact O-CB 3.39Å; T885-L888 PolarHBondContact O-N 3.4Å; T885-L888 WeakPolarHBondContact OG1-CB 3.29Å; T885-L888 WeakPolarHBondContact OG1-CD2 3.41Å; T885-H910 PolarHBondContact O-NE2 3.2Å
886	T	81	Confident	90.9	Very high	75 Å²	75	24.3 Å²	24.3	46%	0.46	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-9.6	-172.3	67.8	0	0	0	0	116.3	S884 R912	S884-T886 VanDerWaalsContact C-N 3.26Å; S884-T886 PolarHBondContact O-N 2.85Å; T886-R912 WeakPolarHBondContact O-CD 3.34Å; T886-R912 PolarHBondContact O-NH1 2.87Å
887	G	85.2	Confident	90.6	Very high	17 Å²	17	27.4 Å²	27.4	18%	0.175	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-18.8	169.7	0	0	0	0	0	114.6	L863 T885 S889	L863-G887 CarbonylContact O-C 3.55Å; T885-G887 PolarHBondContact O-N 3.22Å; G887-S889 PolarHBondContact O-N 3.48Å
888	L	92	Very high	90.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.			trans	-71.4	126.2	-165.6	-167.4	68	0	0	0	112.2	L863 L866 L882 T885 Y890 L891 H910 R912 L913	L863-L888 WeakPolarHBondContact O-CA 3.45Å; L863-L888 PolarHBondContact O-N 2.85Å; L866-L888 HydrophobicContact CB-CD1 3.77Å; L882-L888 HydrophobicContact CD2-CD2 4.37Å; T885-L888 VanDerWaalsContact O-CB 3.23Å; T885-L888 WeakPolarHBondContact O-CB 3.39Å; T885-L888 PolarHBondContact O-N 3.4Å; T885-L888 WeakPolarHBondContact OG1-CB 3.29Å; T885-L888 WeakPolarHBondContact OG1-CD2 3.41Å; L888-Y890 WeakPolarHBondContact CD1-O 3.4Å; L888-L891 HydrophobicContact CD2-CB 4.03Å; L888-L891 HydrophobicContact CD2-CD1 4.22Å; L888-L891 HydrophobicContact CD2-CD2 4.3Å; L888-L891 HydrophobicContact CD2-CG 4.4Å; L888-H910 PolarHBondContact O-CE1 3.03Å; L888-R912 CarbonylContact O-C 3.3Å; L888-L913 HydrophobicContact CG-CD1 4.35Å
889	S	92.5	Very high	90.5	Very high	25 Å²	25	32.5 Å²	32.5	18%	0.175	17%	0.17	C	C	.	.			trans	-118.3	-23.6	-176.5	76.9	0	0	0	0	113.2	Q864 G887 N914 Y915	Q864-S889 WeakPolarHBondContact O-CA 3.15Å; Q864-S889 PolarHBondContact O-N 2.9Å; Q864-S889 PolarHBondContact O-OG 2.9Å; G887-S889 PolarHBondContact O-N 3.48Å; S889-N914 CarbonylContact O-C 3.38Å; S889-N914 WeakPolarHBondContact O-CA 3.5Å; S889-N914 WeakPolarHBondContact O-CB 3.45Å; S889-N914 PolarHBondContact O-N 3.21Å; S889-Y915 PolarHBondContact O-N 3.12Å
890	Y	94.2	Very high	90.5	Very high	51 Å²	51	34.3 Å²	34.3	20%	0.2	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	126.4	177.5	179.2	-71.6	0	0	0	108.8	Q864 H865 L866 L888 C892 Y915 E917	Q864-Y890 PolarHBondContact O-N 3.39Å; H865-Y890 WeakPolarHBondContact CA-O 3.22Å; H865-Y890 WeakPolarHBondContact ND1-CB 3.38Å; H865-Y890 AromaticContact ND1-CD1 3.98Å; H865-Y890 AromaticContact ND1-CD2 3.77Å; H865-Y890 AromaticContact ND1-CG 3.39Å; L866-Y890 PolarHBondContact N-O 2.87Å; L888-Y890 WeakPolarHBondContact CD1-O 3.4Å; Y890-C892 HydrophobicContact CE1-CB 4.03Å; Y890-Y915 WeakPolarHBondContact CA-O 3.48Å; Y890-Y915 VanDerWaalsContact CD2-CB 3.48Å; Y890-Y915 HydrophobicContact CD2-CD2 4.48Å; Y890-Y915 AromaticContact CD2-CG 3.98Å; Y890-Y915 HydrophobicContact CD2-CG 3.98Å; Y890-E917 PolarHBondContact OH-OE2 3.13Å
891	L	94.6	Very high	90.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	131.6	175.9	177	57.8	0	0	0	110.1	L866 L882 L888 L893 L907 L913 Y915 L916 E917	L866-L891 HydrophobicContact CB-CD1 4.37Å; L866-L891 HydrophobicContact CD2-CD1 4.34Å; L866-L891 HydrophobicContact CG-CD1 4.45Å; L866-L891 WeakPolarHBondContact O-CA 3.49Å; L882-L891 HydrophobicContact CD1-CD1 4.3Å; L882-L891 HydrophobicContact CD1-CD2 4.06Å; L882-L891 HydrophobicContact CD2-CD1 4.16Å; L888-L891 HydrophobicContact CD2-CB 4.03Å; L888-L891 HydrophobicContact CD2-CD1 4.22Å; L888-L891 HydrophobicContact CD2-CD2 4.3Å; L888-L891 HydrophobicContact CD2-CG 4.4Å; L891-L893 HydrophobicContact CD1-CD2 3.96Å; L891-L893 HydrophobicContact CD1-CG 4.25Å; L891-L893 HydrophobicContact CD2-CD1 4.18Å; L891-L893 HydrophobicContact CD2-CD2 4.44Å; L891-L893 HydrophobicContact CD2-CG 4.21Å; L891-L893 HydrophobicContact CG-CD2 4.28Å; L891-L893 HydrophobicContact CG-CG 4.03Å; L891-L907 HydrophobicContact CD2-CD1 3.86Å; L891-L907 HydrophobicContact CD2-CD2 3.95Å; L891-L913 HydrophobicContact CB-CD1 3.81Å; L891-L913 HydrophobicContact CB-CD2 4.42Å; L891-Y915 PolarHBondContact N-O 3.18Å; L891-L916 HydrophobicContact CB-CD1 4.19Å; L891-L916 HydrophobicContact CD2-CD1 4.24Å; L891-L916 HydrophobicContact CG-CD1 4.18Å; L891-L916 WeakPolarHBondContact O-CA 3.45Å; L891-E917 PolarHBondContact O-N 3.29Å
892	C	93.9	Very high	90.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	115.9	171.2	-170.8	0	0	0	0	111.9	L866 V868 R869 Y890 S894 E917	L866-C892 PolarHBondContact O-N 2.92Å; V868-C892 VanDerWaalsContact CG2-O 3.23Å; V868-C892 WeakPolarHBondContact CG2-O 3.32Å; V868-C892 PolarHBondContact N-O 3.16Å; R869-C892 WeakPolarHBondContact CD-SG 3.4Å; R869-C892 HydrophobicContact CG-CB 4.15Å; R869-C892 WeakPolarHBondContact CG-SG 3.29Å; R869-C892 PolarHBondContact NH1-SG 3.43Å; R869-C892 VanDerWaalsContact NH1-SG 3.37Å; Y890-C892 HydrophobicContact CE1-CB 4.03Å; C892-S894 PolarHBondContact SG-OG 3.25Å; C892-E917 HydrophobicContact CB-CB 3.94Å; C892-E917 HydrophobicContact CB-CG 4.36Å; C892-E917 WeakPolarHBondContact CB-OE2 3.49Å; C892-E917 WeakPolarHBondContact SG-CB 3.49Å; C892-E917 PolarHBondContact SG-OE2 3.12Å
893	L	92.9	Very high	90.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.196	C	C	.	.			trans	-108.4	14	177.1	-60.9	175.1	0	0	0	111.7	V868 I879 L882 L891 G895 C896 I899 L904 L907 E917 L918 L921	V868-L893 HydrophobicContact CG2-CD2 3.77Å; I879-L893 HydrophobicContact CD1-CD1 4.13Å; L882-L893 HydrophobicContact CD1-CD2 4.09Å; L891-L893 HydrophobicContact CD1-CD2 3.96Å; L891-L893 HydrophobicContact CD1-CG 4.25Å; L891-L893 HydrophobicContact CD2-CD1 4.18Å; L891-L893 HydrophobicContact CD2-CD2 4.44Å; L891-L893 HydrophobicContact CD2-CG 4.21Å; L891-L893 HydrophobicContact CG-CD2 4.28Å; L891-L893 HydrophobicContact CG-CG 4.03Å; L893-G895 PolarHBondContact O-N 3.37Å; L893-G895 VanDerWaalsContact O-N 3.13Å; L893-C896 WeakPolarHBondContact O-CB 3.48Å; L893-C896 PolarHBondContact O-N 3.13Å; L893-C896 VanDerWaalsContact O-N 3.11Å; L893-I899 HydrophobicContact CB-CD1 4.21Å; L893-I899 HydrophobicContact CD1-CD1 4.04Å; L893-I899 HydrophobicContact CD2-CD1 4.02Å; L893-I899 HydrophobicContact CG-CD1 4.32Å; L893-L904 HydrophobicContact CD1-CD2 4.24Å; L893-L907 HydrophobicContact CD1-CD2 3.76Å; L893-E917 PolarHBondContact N-O 3.46Å; L893-E917 VanDerWaalsContact N-O 3.09Å; L893-L918 HydrophobicContact CB-CD2 4.33Å; L893-L918 HydrophobicContact CD1-CD2 4.45Å; L893-L921 HydrophobicContact CB-CD1 4.02Å; L893-L921 WeakPolarHBondContact O-CD2 3.25Å; L893-L921 WeakPolarHBondContact O-CG 3.23Å
894	S	92.2	Very high	90.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	116.3	-167.7	-65.6	0	0	0	0	111.7	R869 W870 C892 E917 A919	R869-S894 CarbonylContact C-O 3.6Å; R869-S894 VanDerWaalsContact CA-O 3.26Å; R869-S894 WeakPolarHBondContact CA-O 3.44Å; W870-S894 PolarHBondContact N-O 3.47Å; C892-S894 PolarHBondContact SG-OG 3.25Å; S894-E917 PolarHBondContact N-O 3.49Å; S894-E917 VanDerWaalsContact OG-C 3.3Å; S894-E917 PolarHBondContact OG-O 3.22Å; S894-A919 CarbonylContact C-O 3.39Å; S894-A919 VanDerWaalsContact C-O 3.31Å; S894-A919 WeakPolarHBondContact CA-O 3.44Å; S894-A919 WeakPolarHBondContact CB-O 3.33Å; S894-A919 PolarHBondContact OG-N 3.19Å
895	G	88.9	Confident	90.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	5	-178.5	0	0	0	0	0	116.5	L893 K897 A919	L893-G895 PolarHBondContact O-N 3.37Å; L893-G895 VanDerWaalsContact O-N 3.13Å; G895-K897 VanDerWaalsContact C-N 3.33Å; G895-K897 PolarHBondContact O-N 2.63Å; G895-A919 PolarHBondContact N-O 3.23Å
896	C	91.5	Very high	90.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.			trans	-74.6	77.9	173.7	-67.1	0	0	0	0	112	V868 C871 L893 R898 I899 L921	V868-C896 PolarHBondContact O-SG 3.15Å; C871-C896 PolarHBondContact O-SG 3.34Å; C871-C896 VanDerWaalsContact O-SG 3.35Å; L893-C896 WeakPolarHBondContact O-CB 3.48Å; L893-C896 PolarHBondContact O-N 3.13Å; L893-C896 VanDerWaalsContact O-N 3.11Å; C896-R898 PolarHBondContact O-N 2.89Å; C896-I899 HydrophobicContact CB-CD1 3.55Å; C896-I899 HydrophobicContact CB-CG1 4Å; C896-I899 PolarHBondContact O-N 3.06Å; C896-I899 VanDerWaalsContact O-N 3.15Å; C896-L921 HydrophobicContact CB-CD2 4.06Å; C896-L921 WeakPolarHBondContact O-CD2 3.15Å
897	K	87.7	Confident	90.5	Very high	119 Å²	119	32.3 Å²	32.3	52%	0.517	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-15.1	-165.8	-62.4	-179	-174.4	174.8	0	116.9	G895	G895-K897 VanDerWaalsContact C-N 3.33Å; G895-K897 PolarHBondContact O-N 2.63Å
898	R	91.7	Very high	90.4	Very high	139 Å²	139	32 Å²	32	53%	0.525	16%	0.16	S	C	.	.	B	Isolated β-bridge	trans	-92.2	-3.9	179.8	-49.4	170.5	63	-163	0.9	114	I872 N873 L874 C896	I872-R898 WeakPolarHBondContact O-CD 3.38Å; I872-R898 WeakPolarHBondContact O-CG 3.15Å; N873-R898 PolarHBondContact O-NH1 3.26Å; L874-R898 WeakPolarHBondContact O-CB 3.39Å; C896-R898 PolarHBondContact O-N 2.89Å
899	I	92.1	Very high	90	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.015	19%	0.193	C	C	.	.			trans	-78.5	130.8	175.1	-56.4	179	0	0	0	109	D876 I879 L893 C896 L904 A923	D876-I899 WeakPolarHBondContact OD1-CA 3.21Å; D876-I899 WeakPolarHBondContact OD1-CG2 3.47Å; I879-I899 HydrophobicContact CD1-CD1 4.41Å; I879-I899 HydrophobicContact CD1-CG2 4.28Å; L893-I899 HydrophobicContact CB-CD1 4.21Å; L893-I899 HydrophobicContact CD1-CD1 4.04Å; L893-I899 HydrophobicContact CD2-CD1 4.02Å; L893-I899 HydrophobicContact CG-CD1 4.32Å; C896-I899 HydrophobicContact CB-CD1 3.55Å; C896-I899 HydrophobicContact CB-CG1 4Å; C896-I899 PolarHBondContact O-N 3.06Å; C896-I899 VanDerWaalsContact O-N 3.15Å; I899-L904 HydrophobicContact CG2-CD2 4.13Å; I899-L904 HydrophobicContact CG2-CG 4.03Å; I899-A923 WeakPolarHBondContact O-CB 3.39Å
900	S	91.8	Very high	89.6	Confident	38 Å²	38	40 Å²	40	27%	0.266	19%	0.186	S	C	.	.			trans	-93.9	174.6	-176.6	76	0	0	0	0	113.6	D876 D902 G903 L904 A923	D876-S900 VanDerWaalsContact CG-OG 3.26Å; D876-S900 PolarHBondContact OD1-N 3.47Å; D876-S900 PolarHBondContact OD1-OG 3.29Å; D876-S900 WeakPolarHBondContact OD2-CB 3.41Å; D876-S900 PolarHBondContact OD2-OG 3.09Å; S900-D902 VanDerWaalsContact C-N 3.31Å; S900-D902 PolarHBondContact OG-N 3.03Å; S900-G903 PolarHBondContact O-N 3.32Å; S900-G903 PolarHBondContact OG-N 3.15Å; S900-G903 VanDerWaalsContact OG-N 3.1Å; S900-L904 WeakPolarHBondContact O-CG 3.48Å; S900-L904 PolarHBondContact O-N 3.35Å; S900-L904 VanDerWaalsContact O-N 3.1Å; S900-A923 VanDerWaalsContact C-CB 3.42Å
901	E	90.3	Very high	88.7	Confident	83 Å²	83	41.7 Å²	41.7	39%	0.388	20%	0.204	S	C	.	.	H	α-helix	trans	-64	-38.3	174.1	-59.3	-153.8	139	0	0	111.5	L904 C905 A923 T925 V928	E901-L904 PolarHBondContact O-N 3.44Å; E901-C905 WeakPolarHBondContact O-CB 3.45Å; E901-C905 PolarHBondContact O-N 2.78Å; E901-C905 PolarHBondContact O-SG 3.28Å; E901-A923 HydrophobicContact CG-CB 4.05Å; E901-T925 VanDerWaalsContact OE1-CB 3.31Å; E901-T925 WeakPolarHBondContact OE1-CB 3.45Å; E901-T925 WeakPolarHBondContact OE1-CG2 3.18Å; E901-T925 PolarHBondContact OE1-OG1 2.8Å; E901-V928 HydrophobicContact CB-CG2 3.71Å; E901-V928 HydrophobicContact CG-CG2 3.85Å
902	D	87.8	Confident	88.1	Confident	126 Å²	126	49 Å²	49	67%	0.674	23%	0.231	S	C	*	.	H	α-helix	trans	-68.2	-42.2	176.8	-74.4	-42.3	0	0	0	111.5	S900 L904 C905 T906	S900-D902 VanDerWaalsContact C-N 3.31Å; S900-D902 PolarHBondContact OG-N 3.03Å; D902-L904 PolarHBondContact O-N 3.07Å; D902-C905 CarbonylContact O-C 3.42Å; D902-C905 WeakPolarHBondContact O-CA 3.09Å; D902-C905 PolarHBondContact O-N 3.45Å; D902-T906 WeakPolarHBondContact O-CG2 3.35Å; D902-T906 PolarHBondContact O-N 3.42Å
903	G	89.8	Confident	87.8	Confident	4 Å²	4	49.3 Å²	49.3	4%	0.041	23%	0.233	C	C	.	.	H	α-helix	trans	-54	-53.3	172.5	0	0	0	0	0	111.6	D876 S900 C905 T906 L907	D876-G903 WeakPolarHBondContact OD1-CA 3.37Å; S900-G903 PolarHBondContact O-N 3.32Å; S900-G903 PolarHBondContact OG-N 3.15Å; S900-G903 VanDerWaalsContact OG-N 3.1Å; G903-C905 VanDerWaalsContact C-N 3.3Å; G903-C905 PolarHBondContact O-N 2.99Å; G903-T906 PolarHBondContact O-N 3.25Å; G903-T906 VanDerWaalsContact O-N 3.1Å; G903-T906 PolarHBondContact O-OG1 3.02Å; G903-L907 PolarHBondContact O-N 2.78Å; G903-L907 VanDerWaalsContact O-N 3.15Å
904	L	89.5	Confident	87.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.5	-37.8	173.8	-68.7	176.5	0	0	0	112.7	L893 I899 S900 E901 D902 T906 L907 A908 L918 L921 A923 A924 V928 L932	L893-L904 HydrophobicContact CD1-CD2 4.24Å; I899-L904 HydrophobicContact CG2-CD2 4.13Å; I899-L904 HydrophobicContact CG2-CG 4.03Å; S900-L904 WeakPolarHBondContact O-CG 3.48Å; S900-L904 PolarHBondContact O-N 3.35Å; S900-L904 VanDerWaalsContact O-N 3.1Å; E901-L904 PolarHBondContact O-N 3.44Å; D902-L904 PolarHBondContact O-N 3.07Å; L904-T906 VanDerWaalsContact C-N 3.31Å; L904-T906 PolarHBondContact O-N 3.15Å; L904-L907 WeakPolarHBondContact O-CB 3.49Å; L904-L907 PolarHBondContact O-N 3.44Å; L904-A908 PolarHBondContact O-N 2.82Å; L904-L918 HydrophobicContact CD1-CD1 4.44Å; L904-L918 HydrophobicContact CD2-CD1 4.26Å; L904-L918 HydrophobicContact CD2-CD2 3.79Å; L904-L921 HydrophobicContact CD1-CD1 4.42Å; L904-L921 HydrophobicContact CD2-CD1 4.29Å; L904-A923 HydrophobicContact CD1-CB 3.97Å; L904-A924 HydrophobicContact CD1-CB 4.28Å; L904-V928 HydrophobicContact CB-CG1 3.75Å; L904-V928 HydrophobicContact CD1-CG1 4.01Å; L904-L932 HydrophobicContact CB-CD1 4.44Å
905	C	86.9	Confident	87.5	Confident	29 Å²	29	57 Å²	57	20%	0.196	27%	0.268	C	S	.	.	H	α-helix	trans	-69.3	-23.8	176.3	-70.5	0	0	0	0	113.7	E901 D902 G903 A908 Y931	E901-C905 WeakPolarHBondContact O-CB 3.45Å; E901-C905 PolarHBondContact O-N 2.78Å; E901-C905 PolarHBondContact O-SG 3.28Å; D902-C905 CarbonylContact O-C 3.42Å; D902-C905 WeakPolarHBondContact O-CA 3.09Å; D902-C905 PolarHBondContact O-N 3.45Å; G903-C905 VanDerWaalsContact C-N 3.3Å; G903-C905 PolarHBondContact O-N 2.99Å; C905-A908 WeakPolarHBondContact O-CB 3.22Å; C905-Y931 HydrophobicContact CB-CD1 4.12Å; C905-Y931 HydrophobicContact CB-CE1 3.74Å
906	T	87.1	Confident	87.7	Confident	45 Å²	45	57 Å²	57	28%	0.276	27%	0.268	S	S	.	.	H	α-helix	trans	-76.6	-35.9	169.3	66.7	0	0	0	0	112.5	I879 D902 G903 L904 A908 R909	I879-T906 VanDerWaalsContact CG2-OG1 3.23Å; I879-T906 WeakPolarHBondContact CG2-OG1 3.49Å; D902-T906 WeakPolarHBondContact O-CG2 3.35Å; D902-T906 PolarHBondContact O-N 3.42Å; G903-T906 PolarHBondContact O-N 3.25Å; G903-T906 VanDerWaalsContact O-N 3.1Å; G903-T906 PolarHBondContact O-OG1 3.02Å; L904-T906 VanDerWaalsContact C-N 3.31Å; L904-T906 PolarHBondContact O-N 3.15Å; T906-A908 PolarHBondContact O-N 3.49Å; T906-A908 VanDerWaalsContact O-N 3.1Å; T906-R909 WeakPolarHBondContact O-CB 3.47Å; T906-R909 WeakPolarHBondContact O-CG 3.49Å; T906-R909 PolarHBondContact O-N 3.17Å
907	L	87.8	Confident	87.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.4	-24	176	-172.9	65.5	0	0	0	112.8	I879 L891 L893 G903 L904 R909 H910 L916	I879-L907 HydrophobicContact CG2-CB 3.92Å; I879-L907 HydrophobicContact CG2-CD1 4.26Å; L891-L907 HydrophobicContact CD2-CD1 3.86Å; L891-L907 HydrophobicContact CD2-CD2 3.95Å; L893-L907 HydrophobicContact CD1-CD2 3.76Å; G903-L907 PolarHBondContact O-N 2.78Å; G903-L907 VanDerWaalsContact O-N 3.15Å; L904-L907 WeakPolarHBondContact O-CB 3.49Å; L904-L907 PolarHBondContact O-N 3.44Å; L907-R909 PolarHBondContact O-N 3.24Å; L907-H910 WeakPolarHBondContact O-CB 3.42Å; L907-H910 PolarHBondContact O-N 3.23Å; L907-L916 HydrophobicContact CD2-CD1 3.86Å; L907-L916 HydrophobicContact CD2-CD2 3.95Å
908	A	82.9	Confident	87.7	Confident	10 Å²	10	52.8 Å²	52.8	8%	0.083	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-12	170.7	0	0	0	0	0	114.9	L904 C905 T906 Y931 L932 N935 L936	L904-A908 PolarHBondContact O-N 2.82Å; C905-A908 WeakPolarHBondContact O-CB 3.22Å; T906-A908 PolarHBondContact O-N 3.49Å; T906-A908 VanDerWaalsContact O-N 3.1Å; A908-Y931 HydrophobicContact CB-CD1 4.33Å; A908-Y931 HydrophobicContact CB-CE1 3.77Å; A908-L932 HydrophobicContact CB-CD2 3.83Å; A908-N935 HydrophobicContact CB-CB 4.05Å; A908-L936 WeakPolarHBondContact O-CD2 3.49Å
909	R	83.5	Confident	87.5	Confident	186 Å²	186	47.1 Å²	47.1	70%	0.702	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	-0.5	177.1	-59.2	175.6	-177.7	169.6	2.8	113.9	L883 T906 L907	L883-R909 HydrophobicContact CD2-CB 4Å; T906-R909 WeakPolarHBondContact O-CB 3.47Å; T906-R909 WeakPolarHBondContact O-CG 3.49Å; T906-R909 PolarHBondContact O-N 3.17Å; L907-R909 PolarHBondContact O-N 3.24Å
910	H	85	Confident	87.1	Confident	6 Å²	6	53.1 Å²	53.1	3%	0.028	26%	0.261	C	S	.	.			trans	-65.8	125.6	-174.4	-165.6	-85.6	0	0	0	112.6	L882 L883 T885 L888 L907 R912 L913	L882-H910 PolarHBondContact O-CD2 3.42Å; L882-H910 PolarHBondContact O-NE2 3.19Å; L883-H910 HydrophobicContact CD2-CB 4.05Å; T885-H910 PolarHBondContact O-NE2 3.2Å; L888-H910 PolarHBondContact O-CE1 3.03Å; L907-H910 WeakPolarHBondContact O-CB 3.42Å; L907-H910 PolarHBondContact O-N 3.23Å; H910-R912 PolarHBondContact ND1-N 3.27Å; H910-R912 PolarHBondContact O-N 2.83Å; H910-L913 HydrophobicContact CB-CB 4.13Å; H910-L913 PolarHBondContact ND1-N 3.23Å
911	P	75.9	Confident	86.8	Confident	87 Å²	87	51.9 Å²	51.9	57%	0.565	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-15.6	-164.6	28.7	-37	0	0	0	115.8
912	R	81.4	Confident	86.5	Confident	153 Å²	153	52.1 Å²	52.1	58%	0.577	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140	16	-173.2	-64.1	-164.1	-177.9	130.6	-7.4	115.6	T886 L888 H910 N914	T886-R912 WeakPolarHBondContact O-CD 3.34Å; T886-R912 PolarHBondContact O-NH1 2.87Å; L888-R912 CarbonylContact O-C 3.3Å; H910-R912 PolarHBondContact ND1-N 3.27Å; H910-R912 PolarHBondContact O-N 2.83Å; R912-N914 PolarHBondContact O-N 3.35Å
913	L	87	Confident	86.3	Confident	7 Å²	7	46.6 Å²	46.6	4%	0.037	23%	0.232	C	C	.	.			trans	-73.8	121.7	-174.9	-155.3	66.1	0	0	0	111.2	L888 L891 H910 L916 L936 C939	L888-L913 HydrophobicContact CG-CD1 4.35Å; L891-L913 HydrophobicContact CB-CD1 3.81Å; L891-L913 HydrophobicContact CB-CD2 4.42Å; H910-L913 HydrophobicContact CB-CB 4.13Å; H910-L913 PolarHBondContact ND1-N 3.23Å; L913-L916 HydrophobicContact CD2-CB 3.88Å; L913-L916 HydrophobicContact CD2-CD1 4.09Å; L913-L916 HydrophobicContact CD2-CD2 4.12Å; L913-L916 HydrophobicContact CD2-CG 4.24Å; L913-L936 HydrophobicContact CD2-CD1 4.47Å; L913-C939 WeakPolarHBondContact O-CB 3.38Å
914	N	88.5	Confident	86	Confident	76 Å²	76	46.7 Å²	46.7	41%	0.406	23%	0.232	S	C	.	.			trans	-108.2	-22.7	-178.6	-64.7	-43	0	0	0	112.5	S889 R912 C939 K940	S889-N914 CarbonylContact O-C 3.38Å; S889-N914 WeakPolarHBondContact O-CA 3.5Å; S889-N914 WeakPolarHBondContact O-CB 3.45Å; S889-N914 PolarHBondContact O-N 3.21Å; R912-N914 PolarHBondContact O-N 3.35Å; N914-C939 WeakPolarHBondContact O-CA 3.31Å; N914-K940 PolarHBondContact O-N 2.56Å
915	Y	91	Very high	85.9	Confident	86 Å²	86	48.9 Å²	48.9	34%	0.337	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	130.3	177.1	-68.8	-93.9	0	0	0	110	S889 Y890 L891 K940	S889-Y915 PolarHBondContact O-N 3.12Å; Y890-Y915 WeakPolarHBondContact CA-O 3.48Å; Y890-Y915 VanDerWaalsContact CD2-CB 3.48Å; Y890-Y915 HydrophobicContact CD2-CD2 4.48Å; Y890-Y915 AromaticContact CD2-CG 3.98Å; Y890-Y915 HydrophobicContact CD2-CG 3.98Å; L891-Y915 PolarHBondContact N-O 3.18Å; Y915-K940 WeakPolarHBondContact CA-O 3.34Å; Y915-K940 HydrophobicContact CD1-CB 3.93Å; Y915-K940 HydrophobicContact CD1-CD 4.16Å; Y915-K940 HydrophobicContact CE1-CB 4.02Å; Y915-K940 HydrophobicContact CE1-CD 3.39Å; Y915-K940 HydrophobicContact CE1-CG 4.33Å; Y915-K940 PolarHBondContact OH-NZ 2.79Å; Y915-K940 VanDerWaalsContact OH-NZ 3.07Å
916	L	91.9	Very high	85.7	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	118.8	177.1	179.6	55.8	0	0	0	109.8	L891 L907 L913 L918 L932 L936 C939 K940 L941 L942	L891-L916 HydrophobicContact CB-CD1 4.19Å; L891-L916 HydrophobicContact CD2-CD1 4.24Å; L891-L916 HydrophobicContact CG-CD1 4.18Å; L891-L916 WeakPolarHBondContact O-CA 3.45Å; L907-L916 HydrophobicContact CD2-CD1 3.86Å; L907-L916 HydrophobicContact CD2-CD2 3.95Å; L913-L916 HydrophobicContact CD2-CB 3.88Å; L913-L916 HydrophobicContact CD2-CD1 4.09Å; L913-L916 HydrophobicContact CD2-CD2 4.12Å; L913-L916 HydrophobicContact CD2-CG 4.24Å; L916-L918 HydrophobicContact CD1-CD2 3.7Å; L916-L918 HydrophobicContact CD1-CG 4.38Å; L916-L918 HydrophobicContact CD2-CD1 4.25Å; L916-L918 HydrophobicContact CD2-CD2 4.21Å; L916-L918 HydrophobicContact CD2-CG 4.34Å; L916-L918 HydrophobicContact CG-CD1 4.4Å; L916-L918 HydrophobicContact CG-CD2 3.81Å; L916-L918 HydrophobicContact CG-CG 3.96Å; L916-L932 HydrophobicContact CD2-CD1 4.34Å; L916-L932 HydrophobicContact CD2-CD2 4.33Å; L916-L936 HydrophobicContact CD2-CD1 4.48Å; L916-C939 VanDerWaalsContact CB-SG 3.6Å; L916-K940 PolarHBondContact N-O 3.46Å; L916-L941 CarbonylContact O-C 3.56Å; L916-L941 WeakPolarHBondContact O-CA 3.45Å; L916-L942 PolarHBondContact O-N 2.6Å
917	E	91.6	Very high	85.7	Confident	31 Å²	31	55.8 Å²	55.8	15%	0.145	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	115.7	-180	-60.4	-160.8	112.5	0	0	111.7	R869 Y890 L891 C892 L893 S894 L942	R869-E917 IonicContact NH1-OE1 2.71Å; R869-E917 IonicContact NH1-OE2 2.72Å; R869-E917 PolarHBondContact NH1-OE2 3.2Å; Y890-E917 PolarHBondContact OH-OE2 3.13Å; L891-E917 PolarHBondContact O-N 3.29Å; C892-E917 HydrophobicContact CB-CB 3.94Å; C892-E917 HydrophobicContact CB-CG 4.36Å; C892-E917 WeakPolarHBondContact CB-OE2 3.49Å; C892-E917 WeakPolarHBondContact SG-CB 3.49Å; C892-E917 PolarHBondContact SG-OE2 3.12Å; L893-E917 PolarHBondContact N-O 3.46Å; L893-E917 VanDerWaalsContact N-O 3.09Å; S894-E917 PolarHBondContact N-O 3.49Å; S894-E917 VanDerWaalsContact OG-C 3.3Å; S894-E917 PolarHBondContact OG-O 3.22Å; E917-L942 HydrophobicContact CB-CB 4.47Å; E917-L942 HydrophobicContact CG-CB 4.08Å; E917-L942 HydrophobicContact CG-CD1 3.92Å
918	L	89.1	Confident	85.7	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.281	C	S	.	.			trans	-117.6	19.5	-174.3	-57.4	-174	0	0	0	114	L893 L904 L916 L921 A924 L932 L941 L942	L893-L918 HydrophobicContact CB-CD2 4.33Å; L893-L918 HydrophobicContact CD1-CD2 4.45Å; L904-L918 HydrophobicContact CD1-CD1 4.44Å; L904-L918 HydrophobicContact CD2-CD1 4.26Å; L904-L918 HydrophobicContact CD2-CD2 3.79Å; L916-L918 HydrophobicContact CD1-CD2 3.7Å; L916-L918 HydrophobicContact CD1-CG 4.38Å; L916-L918 HydrophobicContact CD2-CD1 4.25Å; L916-L918 HydrophobicContact CD2-CD2 4.21Å; L916-L918 HydrophobicContact CD2-CG 4.34Å; L916-L918 HydrophobicContact CG-CD1 4.4Å; L916-L918 HydrophobicContact CG-CD2 3.81Å; L916-L918 HydrophobicContact CG-CG 3.96Å; L918-L921 HydrophobicContact CB-CD1 4.02Å; L918-L921 HydrophobicContact CD2-CD1 3.69Å; L918-L921 HydrophobicContact CG-CD1 4.41Å; L918-L921 WeakPolarHBondContact O-CB 3.44Å; L918-L921 PolarHBondContact O-N 3.12Å; L918-A924 HydrophobicContact CB-CB 3.85Å; L918-A924 HydrophobicContact CD1-CB 4.31Å; L918-L932 HydrophobicContact CD1-CD1 3.6Å; L918-L941 HydrophobicContact CD1-CD2 4.13Å; L918-L941 HydrophobicContact CG-CD2 4.43Å; L918-L942 PolarHBondContact N-O 3.21Å
919	A	86.7	Confident	85.8	Confident	20 Å²	20	57.2 Å²	57.2	17%	0.165	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	140.8	-177.7	0	0	0	0	0	111.8	S894 G895 L921	S894-A919 CarbonylContact C-O 3.39Å; S894-A919 VanDerWaalsContact C-O 3.31Å; S894-A919 WeakPolarHBondContact CA-O 3.44Å; S894-A919 WeakPolarHBondContact CB-O 3.33Å; S894-A919 PolarHBondContact OG-N 3.19Å; G895-A919 PolarHBondContact N-O 3.23Å; A919-L921 PolarHBondContact O-N 3.02Å; A919-L921 VanDerWaalsContact O-N 3.12Å
920	H	84.4	Confident	85.8	Confident	129 Å²	129	53.3 Å²	53.3	60%	0.597	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	15.3	-178.4	-46.1	-71.8	0	0	0	116.5	W870	W870-H920 HydrophobicContact CH2-CB 4.03Å; W870-H920 HydrophobicContact CZ2-CB 4.1Å; W870-H920 AromaticContact CZ2-CD2 3.77Å; W870-H920 AromaticContact CZ2-CG 3.98Å
921	L	86	Confident	85.9	Confident	11 Å²	11	57.9 Å²	57.9	6%	0.058	29%	0.294	C	S	.	.			trans	-80.7	125.8	166.5	-78.1	173.6	0	0	0	110.6	L893 C896 L904 L918 A919 A923 A924	L893-L921 HydrophobicContact CB-CD1 4.02Å; L893-L921 WeakPolarHBondContact O-CD2 3.25Å; L893-L921 WeakPolarHBondContact O-CG 3.23Å; C896-L921 HydrophobicContact CB-CD2 4.06Å; C896-L921 WeakPolarHBondContact O-CD2 3.15Å; L904-L921 HydrophobicContact CD1-CD1 4.42Å; L904-L921 HydrophobicContact CD2-CD1 4.29Å; L918-L921 HydrophobicContact CB-CD1 4.02Å; L918-L921 HydrophobicContact CD2-CD1 3.69Å; L918-L921 HydrophobicContact CG-CD1 4.41Å; L918-L921 WeakPolarHBondContact O-CB 3.44Å; L918-L921 PolarHBondContact O-N 3.12Å; A919-L921 PolarHBondContact O-N 3.02Å; A919-L921 VanDerWaalsContact O-N 3.12Å; L921-A923 VanDerWaalsContact C-N 3.29Å; L921-A923 PolarHBondContact O-N 3.31Å; L921-A924 HydrophobicContact CB-CB 3.69Å; L921-A924 PolarHBondContact O-N 2.57Å; L921-A924 VanDerWaalsContact O-N 3.17Å
922	P	82.8	Confident	86.4	Confident	89 Å²	89	53.7 Å²	53.7	58%	0.578	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-32.9	177	27.1	-33.3	0	0	0	112.1	A924	P922-A924 VanDerWaalsContact C-N 3.27Å; P922-A924 PolarHBondContact O-N 2.76Å
923	A	83	Confident	86.6	Confident	9 Å²	9	51 Å²	51	7%	0.074	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-8.3	175	0	0	0	0	0	114.6	I899 S900 E901 L904 L921 T925	I899-A923 WeakPolarHBondContact O-CB 3.39Å; S900-A923 VanDerWaalsContact C-CB 3.42Å; E901-A923 HydrophobicContact CG-CB 4.05Å; L904-A923 HydrophobicContact CD1-CB 3.97Å; L921-A923 VanDerWaalsContact C-N 3.29Å; L921-A923 PolarHBondContact O-N 3.31Å; A923-T925 PolarHBondContact O-N 3.49Å
924	A	84.8	Confident	86.4	Confident	6 Å²	6	58.7 Å²	58.7	5%	0.05	30%	0.298	C	S	.	.			trans	-84.8	53.3	177.8	0	0	0	0	0	111	L904 L918 L921 P922 K929	L904-A924 HydrophobicContact CD1-CB 4.28Å; L918-A924 HydrophobicContact CB-CB 3.85Å; L918-A924 HydrophobicContact CD1-CB 4.31Å; L921-A924 HydrophobicContact CB-CB 3.69Å; L921-A924 PolarHBondContact O-N 2.57Å; L921-A924 VanDerWaalsContact O-N 3.17Å; P922-A924 VanDerWaalsContact C-N 3.27Å; P922-A924 PolarHBondContact O-N 2.76Å; A924-K929 VanDerWaalsContact O-CD 3.26Å; A924-K929 WeakPolarHBondContact O-CD 3.26Å; A924-K929 WeakPolarHBondContact O-CE 3.26Å; A924-K929 PolarHBondContact O-NZ 3.17Å
925	T	85.9	Confident	86.2	Confident	46 Å²	46	58.4 Å²	58.4	28%	0.282	30%	0.296	S	S	.	.			trans	-70.9	165	178.2	66.2	0	0	0	0	111.3	E901 A923 P927 V928 K929	E901-T925 VanDerWaalsContact OE1-CB 3.31Å; E901-T925 WeakPolarHBondContact OE1-CB 3.45Å; E901-T925 WeakPolarHBondContact OE1-CG2 3.18Å; E901-T925 PolarHBondContact OE1-OG1 2.8Å; A923-T925 PolarHBondContact O-N 3.49Å; T925-P927 WeakPolarHBondContact OG1-CD 3.3Å; T925-P927 WeakPolarHBondContact OG1-CG 3.49Å; T925-V928 PolarHBondContact O-N 3.4Å; T925-K929 WeakPolarHBondContact O-CB 3.21Å; T925-K929 WeakPolarHBondContact O-CG 3.43Å; T925-K929 PolarHBondContact O-N 3.42Å
926	Q	84.5	Confident	85.8	Confident	132 Å²	132	55 Å²	55	62%	0.617	28%	0.284	S	S	*	.	H	α-helix	trans	-57.5	-42.7	-178.5	-163.1	65.5	6.3	0	0	114.7	K929 L930	Q926-K929 PolarHBondContact O-N 3.49Å; Q926-L930 HydrophobicContact CG-CD1 4.3Å; Q926-L930 WeakPolarHBondContact O-CB 3.46Å; Q926-L930 VanDerWaalsContact O-CG 3.28Å; Q926-L930 WeakPolarHBondContact O-CG 3.39Å; Q926-L930 PolarHBondContact O-N 3.11Å
927	P	87.1	Confident	84.9	Confident	87 Å²	87	60 Å²	60	57%	0.565	32%	0.316	S	S	*	.	H	α-helix	trans	-63.7	-40.7	174.8	23.7	-33.7	0	0	0	112.9	T925 L930 Y931	T925-P927 WeakPolarHBondContact OG1-CD 3.3Å; T925-P927 WeakPolarHBondContact OG1-CG 3.49Å; P927-L930 PolarHBondContact O-N 3.06Å; P927-Y931 WeakPolarHBondContact O-CB 3.37Å; P927-Y931 PolarHBondContact O-N 2.89Å
928	V	87.5	Confident	84.1	Confident	6 Å²	6	63.5 Å²	63.5	4%	0.036	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-43.7	176.8	178.4	0	0	0	0	111	E901 L904 T925 L930 Y931 L932	E901-V928 HydrophobicContact CB-CG2 3.71Å; E901-V928 HydrophobicContact CG-CG2 3.85Å; L904-V928 HydrophobicContact CB-CG1 3.75Å; L904-V928 HydrophobicContact CD1-CG1 4.01Å; T925-V928 PolarHBondContact O-N 3.4Å; V928-L930 VanDerWaalsContact C-N 3.34Å; V928-L930 PolarHBondContact O-N 3.3Å; V928-Y931 PolarHBondContact O-N 3.18Å; V928-L932 HydrophobicContact CG1-CD1 4.07Å; V928-L932 WeakPolarHBondContact O-CB 3.4Å; V928-L932 PolarHBondContact O-N 2.72Å
929	K	85.4	Confident	83.8	Confident	34 Å²	34	63.9 Å²	63.9	15%	0.148	35%	0.346	C	S	.	.	H	α-helix	trans	-59.6	-40.8	174.2	-78.2	170.7	164.1	159.9	0	112.3	A924 T925 Q926 N933 L941 C943	A924-K929 VanDerWaalsContact O-CD 3.26Å; A924-K929 WeakPolarHBondContact O-CD 3.26Å; A924-K929 WeakPolarHBondContact O-CE 3.26Å; A924-K929 PolarHBondContact O-NZ 3.17Å; T925-K929 WeakPolarHBondContact O-CB 3.21Å; T925-K929 WeakPolarHBondContact O-CG 3.43Å; T925-K929 PolarHBondContact O-N 3.42Å; Q926-K929 PolarHBondContact O-N 3.49Å; K929-N933 WeakPolarHBondContact O-CB 3.21Å; K929-N933 PolarHBondContact O-N 2.97Å; K929-L941 HydrophobicContact CG-CD2 4.32Å; K929-C943 HydrophobicContact CD-CB 4.29Å; K929-C943 VanDerWaalsContact CE-SG 3.57Å; K929-C943 PolarHBondContact NZ-OXT 3.37Å
930	L	83.4	Confident	83.6	Confident	105 Å²	105	69 Å²	69	55%	0.55	36%	0.364	S	S	.	.	H	α-helix	trans	-68.6	-40.2	174.8	-72	169.4	0	0	0	112.6	Q926 P927 V928 K934	Q926-L930 HydrophobicContact CG-CD1 4.3Å; Q926-L930 WeakPolarHBondContact O-CB 3.46Å; Q926-L930 VanDerWaalsContact O-CG 3.28Å; Q926-L930 WeakPolarHBondContact O-CG 3.39Å; Q926-L930 PolarHBondContact O-N 3.11Å; P927-L930 PolarHBondContact O-N 3.06Å; V928-L930 VanDerWaalsContact C-N 3.34Å; V928-L930 PolarHBondContact O-N 3.3Å; L930-K934 WeakPolarHBondContact O-CB 3.41Å; L930-K934 PolarHBondContact O-N 3.43Å
931	Y	86.6	Confident	83.5	Confident	101 Å²	101	64.5 Å²	64.5	40%	0.396	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-44.9	176.1	178	-92.5	0	0	0	111.7	C905 A908 P927 V928 K934 N935	C905-Y931 HydrophobicContact CB-CD1 4.12Å; C905-Y931 HydrophobicContact CB-CE1 3.74Å; A908-Y931 HydrophobicContact CB-CD1 4.33Å; A908-Y931 HydrophobicContact CB-CE1 3.77Å; P927-Y931 WeakPolarHBondContact O-CB 3.37Å; P927-Y931 PolarHBondContact O-N 2.89Å; V928-Y931 PolarHBondContact O-N 3.18Å; Y931-K934 PolarHBondContact O-N 2.66Å; Y931-N935 WeakPolarHBondContact CD1-ND2 3.33Å; Y931-N935 WeakPolarHBondContact CD2-ND2 3.49Å; Y931-N935 VanDerWaalsContact CE1-ND2 3.3Å; Y931-N935 WeakPolarHBondContact CE1-ND2 3.27Å; Y931-N935 WeakPolarHBondContact CE2-ND2 3.49Å; Y931-N935 PolarHBondContact O-N 3.12Å; Y931-N935 VanDerWaalsContact O-N 3.09Å; Y931-N935 PolarHBondContact O-ND2 3.43Å
932	L	86.1	Confident	83.1	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-62.7	-48.2	175.3	-79.4	165.8	0	0	0	112	L904 A908 L916 L918 V928 K934 N935 L936 L941	L904-L932 HydrophobicContact CB-CD1 4.44Å; A908-L932 HydrophobicContact CB-CD2 3.83Å; L916-L932 HydrophobicContact CD2-CD1 4.34Å; L916-L932 HydrophobicContact CD2-CD2 4.33Å; L918-L932 HydrophobicContact CD1-CD1 3.6Å; V928-L932 HydrophobicContact CG1-CD1 4.07Å; V928-L932 WeakPolarHBondContact O-CB 3.4Å; V928-L932 PolarHBondContact O-N 2.72Å; L932-K934 PolarHBondContact O-N 2.88Å; L932-N935 PolarHBondContact O-N 3.25Å; L932-N935 VanDerWaalsContact O-N 3.14Å; L932-L936 HydrophobicContact CD2-CD1 3.97Å; L932-L936 WeakPolarHBondContact O-CB 3.48Å; L932-L936 PolarHBondContact O-N 2.57Å; L932-L941 HydrophobicContact CB-CD1 3.42Å; L932-L941 VanDerWaalsContact CB-CD1 3.42Å; L932-L941 HydrophobicContact CD1-CD1 4.01Å; L932-L941 HydrophobicContact CG-CD1 4.33Å
933	N	84.8	Confident	82.5	Confident	96 Å²	96	68.6 Å²	68.6	51%	0.513	37%	0.367	S	S	.	.	H	α-helix	trans	-62.1	-30.1	178.6	-165.6	18.5	0	0	0	112.5	K929	K929-N933 WeakPolarHBondContact O-CB 3.21Å; K929-N933 PolarHBondContact O-N 2.97Å
934	K	83.2	Confident	82.5	Confident	169 Å²	169	71.6 Å²	71.6	74%	0.735	38%	0.382	S	S	*	.	H	α-helix	trans	-72.8	-37.2	174.5	-176.4	-179.6	177.5	-175.4	0	113.3	L930 Y931 L932	L930-K934 WeakPolarHBondContact O-CB 3.41Å; L930-K934 PolarHBondContact O-N 3.43Å; Y931-K934 PolarHBondContact O-N 2.66Å; L932-K934 PolarHBondContact O-N 2.88Å
935	N	84.1	Confident	82.3	Confident	69 Å²	69	75 Å²	75	37%	0.369	40%	0.399	S	S	.	.	H	α-helix	trans	-96	-23.1	-173.3	-68.1	-49.1	0	0	0	113.9	A908 Y931 L932 P937	A908-N935 HydrophobicContact CB-CB 4.05Å; Y931-N935 WeakPolarHBondContact CD1-ND2 3.33Å; Y931-N935 WeakPolarHBondContact CD2-ND2 3.49Å; Y931-N935 VanDerWaalsContact CE1-ND2 3.3Å; Y931-N935 WeakPolarHBondContact CE1-ND2 3.27Å; Y931-N935 WeakPolarHBondContact CE2-ND2 3.49Å; Y931-N935 PolarHBondContact O-N 3.12Å; Y931-N935 VanDerWaalsContact O-N 3.09Å; Y931-N935 PolarHBondContact O-ND2 3.43Å; L932-N935 PolarHBondContact O-N 3.25Å; L932-N935 VanDerWaalsContact O-N 3.14Å; N935-P937 WeakPolarHBondContact O-CD 3.41Å
936	L	83.3	Confident	82.1	Confident	15 Å²	15	76.6 Å²	76.6	8%	0.079	41%	0.406	C	S	.	.			trans	-114.1	61.7	174	-62.9	175.2	0	0	0	111	A908 L913 L916 L932 C938 C939	A908-L936 WeakPolarHBondContact O-CD2 3.49Å; L913-L936 HydrophobicContact CD2-CD1 4.47Å; L916-L936 HydrophobicContact CD2-CD1 4.48Å; L932-L936 HydrophobicContact CD2-CD1 3.97Å; L932-L936 WeakPolarHBondContact O-CB 3.48Å; L932-L936 PolarHBondContact O-N 2.57Å; L936-C938 PolarHBondContact O-N 3.35Å; L936-C939 HydrophobicContact CB-CB 3.68Å; L936-C939 HydrophobicContact CD1-CB 4.42Å; L936-C939 WeakPolarHBondContact O-CB 3.48Å; L936-C939 PolarHBondContact O-N 3.36Å
937	P	72.7	Confident	82	Confident	104 Å²	104	73.4 Å²	73.4	68%	0.675	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-12.3	-171.8	28.7	-37.9	0	0	0	114.8	N935	N935-P937 WeakPolarHBondContact O-CD 3.41Å
938	C	74.6	Confident	81.7	Confident	105 Å²	105	72.5 Å²	72.5	71%	0.709	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-8.9	173	-61.4	0	0	0	0	113.2	L936	L936-C938 PolarHBondContact O-N 3.35Å
939	C	82	Confident	81.3	Confident	9 Å²	9	76.9 Å²	76.9	6%	0.061	41%	0.406	C	S	.	.			trans	-93.1	123.7	-174.2	-169.5	0	0	0	0	111.3	L913 N914 L916 L936 L941	L913-C939 WeakPolarHBondContact O-CB 3.38Å; N914-C939 WeakPolarHBondContact O-CA 3.31Å; L916-C939 VanDerWaalsContact CB-SG 3.6Å; L936-C939 HydrophobicContact CB-CB 3.68Å; L936-C939 HydrophobicContact CD1-CB 4.42Å; L936-C939 WeakPolarHBondContact O-CB 3.48Å; L936-C939 PolarHBondContact O-N 3.36Å; C939-L941 PolarHBondContact O-N 2.56Å
940	K	84.2	Confident	81	Confident	127 Å²	127	80 Å²	80	55%	0.552	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	112.3	167.7	-74	172	177.8	177.3	0	109.1	N914 Y915 L916	N914-K940 PolarHBondContact O-N 2.56Å; Y915-K940 WeakPolarHBondContact CA-O 3.34Å; Y915-K940 HydrophobicContact CD1-CB 3.93Å; Y915-K940 HydrophobicContact CD1-CD 4.16Å; Y915-K940 HydrophobicContact CE1-CB 4.02Å; Y915-K940 HydrophobicContact CE1-CD 3.39Å; Y915-K940 HydrophobicContact CE1-CG 4.33Å; Y915-K940 PolarHBondContact OH-NZ 2.79Å; Y915-K940 VanDerWaalsContact OH-NZ 3.07Å; L916-K940 PolarHBondContact N-O 3.46Å
941	L	82.1	Confident	80.8	Confident	35 Å²	35	78.1 Å²	78.1	18%	0.183	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	110.7	-177.3	-158.1	161.4	0	0	0	110.1	L916 L918 K929 L932 C939 C943	L916-L941 CarbonylContact O-C 3.56Å; L916-L941 WeakPolarHBondContact O-CA 3.45Å; L918-L941 HydrophobicContact CD1-CD2 4.13Å; L918-L941 HydrophobicContact CG-CD2 4.43Å; K929-L941 HydrophobicContact CG-CD2 4.32Å; L932-L941 HydrophobicContact CB-CD1 3.42Å; L932-L941 VanDerWaalsContact CB-CD1 3.42Å; L932-L941 HydrophobicContact CD1-CD1 4.01Å; L932-L941 HydrophobicContact CG-CD1 4.33Å; C939-L941 PolarHBondContact O-N 2.56Å; L941-C943 WeakPolarHBondContact CD2-SG 3.44Å
942	L	77.5	Confident	80.3	Confident	87 Å²	87	76.2 Å²	76.2	46%	0.455	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.6	179	-68.1	164.2	0	0	0	108.8	L916 E917 L918	L916-L942 PolarHBondContact O-N 2.6Å; E917-L942 HydrophobicContact CB-CB 4.47Å; E917-L942 HydrophobicContact CG-CB 4.08Å; E917-L942 HydrophobicContact CG-CD1 3.92Å; L918-L942 PolarHBondContact N-O 3.21Å
943	C	69.6	Low	79.8	Confident	98 Å²	98	83.1 Å²	83.1	66%	0.662	45%	0.454	S	S	*	.			trans	-112.3	0	-153.3	-76	0	0	0	0	115.4	K929 L941	K929-C943 HydrophobicContact CD-CB 4.29Å; K929-C943 VanDerWaalsContact CE-SG 3.57Å; K929-C943 PolarHBondContact NZ-OXT 3.37Å; L941-C943 WeakPolarHBondContact CD2-SG 3.44Å

Retrieved 943 of 943 residues in 1693.5 ms (Link to these results)

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