A0A2K5LVZ8_CERAT Loading...

Protein Jumonji

Regulator of histone methyltransferase complexes that plays an essential role in embryonic development, including heart and liver development, neural tube fusion process and hematopoiesis. Acts as an accessory subunit for the core PRC2 (Polycomb repressive complex 2) complex, which mediates histone H3K27 (H3K27me3) trimethylation on chromatin. Binds DNA and mediates the recruitment of the PRC2 complex to target genes in embryonic stem cells, thereby playing a key role in stem cell differentiation and normal embryonic development. In cardiac cells, it is required to repress expression of cyclin-D1 (CCND1) by activating methylation of 'Lys-9' of histone H3 (H3K9me) by the GLP1/EHMT1 and G9a/EHMT2 histone methyltransferases. Also acts as a transcriptional repressor of ANF via its interaction with GATA4 and NKX2-5. Participates in the negative regulation of cell proliferation signaling. Does not have histone demethylase activity.

AlphaFold DB , UniProt , Accession A0A2K5LVZ8, Species CERAT (Cercocebus atys, Sooty mangabey), Gene JARID2, Length 1,246 aa.

						>A0A2K5LVZ8_CERAT|A0A2K5LVZ8|JARID2
MSKERPKRNIIQKKYDDSDGIPWSEERVVRKVLYLSLKEFKNAQKRQHGEGLAGSLKTVNGLLGNDQSKGLGPASEQSENEKDDASQVSSTSNDVSSSDFEEGPSRKRPRLQAQRKFAQSQPNSPSTTPVKIVEPLLPPPATQISDLSKRKPKTEDFLTFLCLRGSPALPNSMVYFGSSQDEEEVEEEDDETEDVKTATNNASSSCQSTPRKGKTHKHVHNGHVFNGSSRSTREKEPVQKHKSKEATPAKEKHSDHRADSRREQASANHPAAAPSTGSSAKGPAANHHHPPLHRSAQDLRKQVSKVNGVTRMSSLGAGATSAKKMREVRPSPSKTVKYTATVTKGAVTYTKAKRELVKDTKPNHHKPSSAVNHTISGKTESSNAKTRKQVLSLGGASKSTGPAVNGLKVSGRLNPKSCTKEVGGRQLREGLQLREGLRNSKRRLEEAHQAEKPQSPPKKMKGAAGPAEGPGKKAPAEKGLLNGHVKKEVPERSLERNRPKRATAGKSTPGRQAHGKADGASCENRSTSQPESVHKPQDSGKAEKGGGKAGWAAMDEIPVLRPSAKEFHDPLIYIESVRAQVEKFGMCRVIPPPDWRPECKLNDEMRFVTQIQHIHKLGRRWGPNVQRLACIKKHLKSQGITMDELPLIGGCELDLACFFRLINEMGGMQQVTDLKKWNKLADMLRIPRTAQDRLAKLQEAYCQYLLSYDSLSPEEHRRLEKEVLMEKEILEKRKGPLEGHTENDHHKFHPLPRFEPKNGLIHGVAPRNGFRSKLKEVGQAQLKTGRRRLFAQEKEVVKEEEEDKGVLNDFHKCIYKGRSVSLTTFYRTARNIMSMCFSKEPAPAEIEQEYWRLVEEKDCHVAVHCGKVDTNTHGSGFPVGKSEPFSRHGWNLTVLPNNTGSILRHLGAVPGVTIPWLNIGMVFSTSCWSRDQNHLPYIDYLHTGADCIWYCIPAEEENKLEDVVHTLLQANGTPGLQMLESNVMISPEVLCKEGIKVHRTVQQSGQFVVCFPGSFVSKVCCGYSVSETVHFATTQWTSMGFETAKEMKRRHIAKPFSMEKLLYQIAQAEAKKENGPTLSTISALLDELRDTELRQRRQLFEAGLHSSARYGSHDGSSTVADGKKKPRKWLQLETSERRCQICQHLCYLSMVVQENENVVFCLECALRHVEKQKSCRGLKLMYRYDEEQIISLVNQICGKVSGKNGSIENCLSKPTPKRGPRKRATVDVPPSRLSASGSSKSASSSS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.1	Very low	35.3	Very low	245 Å²	245	174.8 Å²	174.8	100%	1.207	84%	0.84	S	S	*	*				0	129.5	0	-76.7	-59.4	-171.7	0	0	108.8
2	S	37.8	Very low	35.1	Very low	111 Å²	111	175.2 Å²	175.2	78%	0.776	84%	0.839	S	S	*	*			trans	-85.5	164.1	178	-39.1	0	0	0	0	111.5
3	K	29.9	Very low	34.9	Very low	219 Å²	219	176.9 Å²	176.9	95%	0.952	84%	0.841	S	S	*	*				-168.9	158	118.9	-101.1	157.4	-173.8	-179.7	0	112.2
4	E	38.5	Very low	34.7	Very low	144 Å²	144	178.5 Å²	178.5	67%	0.673	84%	0.843	S	S	*	*			trans	-112.6	165	-169.2	-140.9	-163.6	137.9	0	0	110.5
5	R	32.6	Very low	35.3	Very low	200 Å²	200	179.7 Å²	179.7	76%	0.755	84%	0.838	S	S	*	*			trans	72.9	164.2	154.3	-77.4	176.6	-158.8	-172.3	15.5	117.9
6	P	39.2	Very low	35	Very low	120 Å²	120	178.6 Å²	178.6	78%	0.779	84%	0.84	S	S	*	*			cis	-120.3	166.9	10.8	40.6	-27.9	0	0	0	117.7
7	K	46.2	Very low	35.5	Very low	207 Å²	207	176.5 Å²	176.5	90%	0.9	84%	0.835	S	S	*	*			trans	-99.3	132.1	164.7	-64.1	179	179.8	178.7	0	110.1
8	R	33.2	Very low	35.6	Very low	226 Å²	226	172.2 Å²	172.2	85%	0.853	83%	0.828	S	S	*	*			trans	-158.4	149.7	159.3	-76.4	-165.1	169.8	154.4	-4.4	107.5
9	N	33.1	Very low	36.3	Very low	135 Å²	135	172.5 Å²	172.5	72%	0.722	83%	0.834	S	S	*	*			cis	-146.5	139.6	-17	-96.9	-9.5	0	0	0	106.6
10	I	33.7	Very low	36.8	Very low	162 Å²	162	167 Å²	167	83%	0.831	83%	0.825	S	S	*	*			trans	-95	118.4	170	-64.7	175.4	0	0	0	108
11	I	32.4	Very low	37.2	Very low	154 Å²	154	164.2 Å²	164.2	79%	0.79	81%	0.812	S	S	*	*			trans	-86	112.2	166.2	-63	176.3	0	0	0	107.3	K13	I11-K13 PolarHBondContact O-N 3.03Å
12	Q	33	Very low	38.8	Very low	179 Å²	179	155.5 Å²	155.5	84%	0.836	77%	0.774	S	S	*	*			trans	-73.3	114.6	163.9	-72.6	-179	-24.6	0	0	108.6
13	K	31.7	Very low	39	Very low	198 Å²	198	158.4 Å²	158.4	86%	0.861	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-87.6	138.5	148.1	-90.5	-166.3	169.6	-169.1	0	108	I11	I11-K13 PolarHBondContact O-N 3.03Å
14	K	32.9	Very low	39.8	Very low	199 Å²	199	150.3 Å²	150.3	87%	0.865	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-74.8	163.9	172.1	-66.9	-177.6	177.9	-179.3	0	109.8
15	Y	42.9	Very low	40.5	Very low	196 Å²	196	147.3 Å²	147.3	77%	0.769	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-63.5	144.8	168	-79.5	-113.7	0	0	0	110.5	D17	Y15-D17 WeakPolarHBondContact CD1-OD2 3Å
16	D	30.5	Very low	41.7	Very low	162 Å²	162	140.7 Å²	140.7	87%	0.866	70%	0.702	S	S	*	*			trans	-125.8	119.2	142.2	-88.1	-49.3	0	0	0	105.5
17	D	44.5	Very low	42.3	Very low	143 Å²	143	142.4 Å²	142.4	77%	0.765	69%	0.693	S	S	*	*			trans	-100	112.9	171	-81.6	-53.1	0	0	0	108.3	Y15	Y15-D17 WeakPolarHBondContact CD1-OD2 3Å
18	S	37.4	Very low	42.8	Very low	100 Å²	100	135 Å²	135	70%	0.699	67%	0.665	S	S	*	*			trans	-149.6	122	163.1	53.7	0	0	0	0	111.6	G20	S18-G20 VanDerWaalsContact C-N 3.28Å; S18-G20 PolarHBondContact O-N 3.29Å
19	D	47.7	Very low	43.9	Very low	177 Å²	177	127.4 Å²	127.4	95%	0.947	64%	0.644	S	S	*	*	S	Bend	trans	45	34.6	159.2	-54.3	-20.4	0	0	0	118.5
20	G	47.3	Very low	44.9	Very low	63 Å²	63	127.9 Å²	127.9	65%	0.649	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-103.7	127.3	172.3	0	0	0	0	0	113.1	S18	S18-G20 VanDerWaalsContact C-N 3.28Å; S18-G20 PolarHBondContact O-N 3.29Å
21	I	44.1	Very low	46	Very low	109 Å²	109	126.5 Å²	126.5	56%	0.559	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-60.2	127.5	167.8	-65.1	169.8	0	0	0	108.6	W23 E25 E26	I21-W23 PolarHBondContact O-N 2.97Å; I21-E25 HydrophobicContact CG2-CB 3.6Å; I21-E26 HydrophobicContact CG2-CB 4.13Å
22	P	66.8	Low	47.3	Very low	62 Å²	62	120.5 Å²	120.5	40%	0.403	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-52	139.4	178.1	-29.1	35.5	0	0	0	112.6	S24 E25 E26	P22-S24 PolarHBondContact O-N 3.16Å; P22-E25 HydrophobicContact CB-CB 4.48Å; P22-E25 HydrophobicContact CB-CG 4.43Å; P22-E25 CarbonylContact O-C 3.57Å; P22-E25 WeakPolarHBondContact O-CA 3.24Å; P22-E25 WeakPolarHBondContact O-CB 3.14Å; P22-E25 PolarHBondContact O-N 3.12Å; P22-E26 PolarHBondContact O-N 3.45Å
23	W	41.5	Very low	48.3	Very low	171 Å²	171	116.8 Å²	116.8	65%	0.648	58%	0.579	S	S	*	*	H	α-helix	trans	-58.9	-23.8	-175.1	-173.8	77.5	0	0	0	114.3	I21 R27	I21-W23 PolarHBondContact O-N 2.97Å; W23-R27 WeakPolarHBondContact O-CB 3.23Å; W23-R27 PolarHBondContact O-N 2.86Å
24	S	46.2	Very low	50.1	Low	49 Å²	49	115 Å²	115	34%	0.343	57%	0.568	S	S	.	*	H	α-helix	trans	-63.8	-52.6	168	40.8	0	0	0	0	112	P22 R27 V28	P22-S24 PolarHBondContact O-N 3.16Å; S24-R27 PolarHBondContact O-N 3.38Å; S24-V28 WeakPolarHBondContact O-CG2 3.32Å; S24-V28 PolarHBondContact O-N 2.81Å
25	E	52.8	Low	51.3	Low	81 Å²	81	108.1 Å²	108.1	38%	0.379	54%	0.541	S	S	.	.	H	α-helix	trans	-67.2	-44.5	179.3	-69.5	171.1	-150.6	0	0	111.3	I21 P22 R27 V28 V29	I21-E25 HydrophobicContact CG2-CB 3.6Å; P22-E25 HydrophobicContact CB-CB 4.48Å; P22-E25 HydrophobicContact CB-CG 4.43Å; P22-E25 CarbonylContact O-C 3.57Å; P22-E25 WeakPolarHBondContact O-CA 3.24Å; P22-E25 WeakPolarHBondContact O-CB 3.14Å; P22-E25 PolarHBondContact O-N 3.12Å; E25-R27 PolarHBondContact O-N 3.34Å; E25-V28 CarbonylContact O-C 3.59Å; E25-V28 WeakPolarHBondContact O-CA 3.45Å; E25-V28 PolarHBondContact O-N 3Å; E25-V29 WeakPolarHBondContact O-CB 3.15Å; E25-V29 WeakPolarHBondContact O-CG2 3.4Å; E25-V29 PolarHBondContact O-N 3.04Å
26	E	58.2	Low	52	Low	62 Å²	62	101.8 Å²	101.8	29%	0.29	53%	0.525	S	S	.	.	H	α-helix	trans	-55.4	-38	175.5	-164.9	-155.6	-160.7	0	0	111.2	I21 P22 R30	I21-E26 HydrophobicContact CG2-CB 4.13Å; P22-E26 PolarHBondContact O-N 3.45Å; E26-R30 VanDerWaalsContact CD-CZ 3.43Å; E26-R30 WeakPolarHBondContact O-CB 3.48Å; E26-R30 WeakPolarHBondContact O-CG 3.41Å; E26-R30 PolarHBondContact O-N 3.26Å; E26-R30 IonicContact OE1-CZ 3.23Å; E26-R30 IonicContact OE1-NH1 3.27Å; E26-R30 PolarHBondContact OE1-NH1 3.01Å; E26-R30 VanDerWaalsContact OE1-NH1 3.11Å; E26-R30 IonicContact OE1-NH2 2.72Å; E26-R30 PolarHBondContact OE1-NH2 2.7Å; E26-R30 IonicContact OE2-CZ 2.67Å; E26-R30 IonicContact OE2-NH1 3.56Å; E26-R30 PolarHBondContact OE2-NH1 3.36Å; E26-R30 IonicContact OE2-NH2 3.4Å
27	R	52.6	Low	53.3	Low	155 Å²	155	99.2 Å²	99.2	59%	0.585	51%	0.511	S	S	*	.	H	α-helix	trans	-74.8	-34	176.6	-165.5	179.5	-151.3	175.1	8.6	113.2	W23 S24 E25 K31	W23-R27 WeakPolarHBondContact O-CB 3.23Å; W23-R27 PolarHBondContact O-N 2.86Å; S24-R27 PolarHBondContact O-N 3.38Å; E25-R27 PolarHBondContact O-N 3.34Å; R27-K31 WeakPolarHBondContact O-CB 3.47Å; R27-K31 PolarHBondContact O-N 3.5Å; R27-K31 VanDerWaalsContact O-N 3.15Å
28	V	55.9	Low	54.4	Low	51 Å²	51	97.8 Å²	97.8	31%	0.309	50%	0.498	S	S	.	.	H	α-helix	trans	-68.2	-49.9	171.9	170.7	0	0	0	0	109.9	S24 E25 R30 K31 V32	S24-V28 WeakPolarHBondContact O-CG2 3.32Å; S24-V28 PolarHBondContact O-N 2.81Å; E25-V28 CarbonylContact O-C 3.59Å; E25-V28 WeakPolarHBondContact O-CA 3.45Å; E25-V28 PolarHBondContact O-N 3Å; V28-R30 PolarHBondContact O-N 2.75Å; V28-K31 CarbonylContact O-C 3.49Å; V28-K31 WeakPolarHBondContact O-CA 3.47Å; V28-K31 WeakPolarHBondContact O-CB 3.45Å; V28-K31 PolarHBondContact O-N 2.83Å; V28-V32 HydrophobicContact CG1-CG2 4.16Å; V28-V32 VanDerWaalsContact O-CG2 3.25Å; V28-V32 WeakPolarHBondContact O-CG2 2.98Å; V28-V32 PolarHBondContact O-N 3.21Å
29	V	56.5	Low	55.4	Low	68 Å²	68	97 Å²	97	41%	0.412	48%	0.483	S	S	.	.	H	α-helix	trans	-56.9	-47.9	176.7	171.4	0	0	0	0	111.1	E25 K31 V32 L33	E25-V29 WeakPolarHBondContact O-CB 3.15Å; E25-V29 WeakPolarHBondContact O-CG2 3.4Å; E25-V29 PolarHBondContact O-N 3.04Å; V29-K31 VanDerWaalsContact C-N 3.31Å; V29-K31 PolarHBondContact O-N 3.47Å; V29-V32 PolarHBondContact O-N 3.18Å; V29-L33 HydrophobicContact CG1-CD1 3.75Å; V29-L33 HydrophobicContact CG1-CG 4.26Å; V29-L33 WeakPolarHBondContact O-CB 3.31Å; V29-L33 WeakPolarHBondContact O-CG 3.27Å; V29-L33 PolarHBondContact O-N 2.72Å
30	R	55	Low	55.8	Low	144 Å²	144	94.6 Å²	94.6	54%	0.543	47%	0.465	S	S	.	.	H	α-helix	trans	-57.8	-40.6	173.1	-79.5	-173.2	-176.8	114.1	6.5	112.9	E26 V28 Y34	E26-R30 VanDerWaalsContact CD-CZ 3.43Å; E26-R30 WeakPolarHBondContact O-CB 3.48Å; E26-R30 WeakPolarHBondContact O-CG 3.41Å; E26-R30 PolarHBondContact O-N 3.26Å; E26-R30 IonicContact OE1-CZ 3.23Å; E26-R30 IonicContact OE1-NH1 3.27Å; E26-R30 PolarHBondContact OE1-NH1 3.01Å; E26-R30 VanDerWaalsContact OE1-NH1 3.11Å; E26-R30 IonicContact OE1-NH2 2.72Å; E26-R30 PolarHBondContact OE1-NH2 2.7Å; E26-R30 IonicContact OE2-CZ 2.67Å; E26-R30 IonicContact OE2-NH1 3.56Å; E26-R30 PolarHBondContact OE2-NH1 3.36Å; E26-R30 IonicContact OE2-NH2 3.4Å; V28-R30 PolarHBondContact O-N 2.75Å; R30-Y34 VanDerWaalsContact O-CB 3.27Å; R30-Y34 WeakPolarHBondContact O-CB 3.35Å; R30-Y34 PolarHBondContact O-N 3.3Å
31	K	56.5	Low	56.2	Low	134 Å²	134	98.2 Å²	98.2	58%	0.583	46%	0.462	S	S	*	.	H	α-helix	trans	-69.7	-37.6	179	-171.2	-178.3	178.1	-169.9	0	112	R27 V28 V29 L35	R27-K31 WeakPolarHBondContact O-CB 3.47Å; R27-K31 PolarHBondContact O-N 3.5Å; R27-K31 VanDerWaalsContact O-N 3.15Å; V28-K31 CarbonylContact O-C 3.49Å; V28-K31 WeakPolarHBondContact O-CA 3.47Å; V28-K31 WeakPolarHBondContact O-CB 3.45Å; V28-K31 PolarHBondContact O-N 2.83Å; V29-K31 VanDerWaalsContact C-N 3.31Å; V29-K31 PolarHBondContact O-N 3.47Å; K31-L35 HydrophobicContact CG-CD1 4.48Å; K31-L35 VanDerWaalsContact O-CG 3.32Å; K31-L35 WeakPolarHBondContact O-CG 3.28Å; K31-L35 PolarHBondContact O-N 3.02Å; K31-L35 VanDerWaalsContact O-N 3.12Å
32	V	59.7	Low	56.9	Low	28 Å²	28	97 Å²	97	17%	0.17	46%	0.457	C	S	.	.	H	α-helix	trans	-67.8	-53.7	176.6	170.3	0	0	0	0	110	V28 V29 Y34 L35 S36 C702 L706	V28-V32 HydrophobicContact CG1-CG2 4.16Å; V28-V32 VanDerWaalsContact O-CG2 3.25Å; V28-V32 WeakPolarHBondContact O-CG2 2.98Å; V28-V32 PolarHBondContact O-N 3.21Å; V29-V32 PolarHBondContact O-N 3.18Å; V32-Y34 VanDerWaalsContact C-N 3.25Å; V32-Y34 PolarHBondContact O-N 3.35Å; V32-L35 WeakPolarHBondContact O-CA 3.47Å; V32-L35 PolarHBondContact O-N 2.95Å; V32-S36 PolarHBondContact O-N 3.44Å; V32-S36 PolarHBondContact O-OG 2.9Å; V32-C702 HydrophobicContact CG2-CB 4.5Å; V32-L706 HydrophobicContact CB-CD2 4.15Å; V32-L706 HydrophobicContact CG1-CD2 3.72Å; V32-L706 HydrophobicContact CG2-CD2 3.33Å
33	L	54.6	Low	56.4	Low	100 Å²	100	96.5 Å²	96.5	52%	0.524	46%	0.458	S	S	.	.	H	α-helix	trans	-53.8	-41.3	175.3	-72.3	170.5	0	0	0	112.1	V29 S36 L37	V29-L33 HydrophobicContact CG1-CD1 3.75Å; V29-L33 HydrophobicContact CG1-CG 4.26Å; V29-L33 WeakPolarHBondContact O-CB 3.31Å; V29-L33 WeakPolarHBondContact O-CG 3.27Å; V29-L33 PolarHBondContact O-N 2.72Å; L33-S36 PolarHBondContact O-N 3.02Å; L33-L37 WeakPolarHBondContact O-CB 3.3Å; L33-L37 PolarHBondContact O-N 3.5Å
34	Y	68	Low	56.8	Low	161 Å²	161	92.8 Å²	92.8	63%	0.631	45%	0.448	S	S	*	.	H	α-helix	trans	-64	-39.1	175.7	-179.5	-94.4	0	0	0	113.1	R30 V32 K38	R30-Y34 VanDerWaalsContact O-CB 3.27Å; R30-Y34 WeakPolarHBondContact O-CB 3.35Å; R30-Y34 PolarHBondContact O-N 3.3Å; V32-Y34 VanDerWaalsContact C-N 3.25Å; V32-Y34 PolarHBondContact O-N 3.35Å; Y34-K38 VanDerWaalsContact O-CB 3.25Å; Y34-K38 WeakPolarHBondContact O-CB 3.22Å; Y34-K38 PolarHBondContact O-N 2.71Å; Y34-K38 VanDerWaalsContact O-N 3.14Å
35	L	59.5	Low	57.1	Low	55 Å²	55	98.5 Å²	98.5	29%	0.288	47%	0.466	S	S	.	.	H	α-helix	trans	-70.1	-45.9	175.6	-71.1	168.8	0	0	0	111.2	K31 V32 L37 K38 E39	K31-L35 HydrophobicContact CG-CD1 4.48Å; K31-L35 VanDerWaalsContact O-CG 3.32Å; K31-L35 WeakPolarHBondContact O-CG 3.28Å; K31-L35 PolarHBondContact O-N 3.02Å; K31-L35 VanDerWaalsContact O-N 3.12Å; V32-L35 WeakPolarHBondContact O-CA 3.47Å; V32-L35 PolarHBondContact O-N 2.95Å; L35-L37 PolarHBondContact O-N 3.21Å; L35-K38 WeakPolarHBondContact O-CB 3.33Å; L35-K38 PolarHBondContact O-N 3.31Å; L35-K38 VanDerWaalsContact O-N 3.1Å; L35-E39 PolarHBondContact O-N 3.49Å
36	S	57	Low	57.1	Low	62 Å²	62	104.5 Å²	104.5	43%	0.434	49%	0.486	S	S	.	.	H	α-helix	trans	-61.4	-43.1	176.8	-54.9	0	0	0	0	112.5	V32 L33 K38 E39 F40	V32-S36 PolarHBondContact O-N 3.44Å; V32-S36 PolarHBondContact O-OG 2.9Å; L33-S36 PolarHBondContact O-N 3.02Å; S36-K38 VanDerWaalsContact C-N 3.29Å; S36-K38 PolarHBondContact O-N 3.23Å; S36-E39 PolarHBondContact O-N 3.02Å; S36-F40 VanDerWaalsContact O-CB 3.29Å; S36-F40 WeakPolarHBondContact O-CB 3.27Å; S36-F40 PolarHBondContact O-N 3.36Å
37	L	58	Low	56.4	Low	109 Å²	109	109.2 Å²	109.2	57%	0.571	51%	0.507	S	S	*	.	H	α-helix	trans	-62.7	-36	173.3	-106.7	74.9	0	0	0	112.4	L33 L35 K41	L33-L37 WeakPolarHBondContact O-CB 3.3Å; L33-L37 PolarHBondContact O-N 3.5Å; L35-L37 PolarHBondContact O-N 3.21Å; L37-K41 WeakPolarHBondContact O-CB 3.48Å; L37-K41 WeakPolarHBondContact O-CG 3.47Å; L37-K41 PolarHBondContact O-N 3.48Å
38	K	67	Low	56	Low	113 Å²	113	109.7 Å²	109.7	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-69.7	-40.8	178.6	-177.9	-175.9	176.2	-169.8	0	111.2	Y34 L35 S36 N42	Y34-K38 VanDerWaalsContact O-CB 3.25Å; Y34-K38 WeakPolarHBondContact O-CB 3.22Å; Y34-K38 PolarHBondContact O-N 2.71Å; Y34-K38 VanDerWaalsContact O-N 3.14Å; L35-K38 WeakPolarHBondContact O-CB 3.33Å; L35-K38 PolarHBondContact O-N 3.31Å; L35-K38 VanDerWaalsContact O-N 3.1Å; S36-K38 VanDerWaalsContact C-N 3.29Å; S36-K38 PolarHBondContact O-N 3.23Å; K38-N42 WeakPolarHBondContact O-CB 3.44Å; K38-N42 PolarHBondContact O-N 3.47Å; K38-N42 VanDerWaalsContact O-N 3.08Å; K38-N42 PolarHBondContact O-ND2 3.42Å; K38-N42 VanDerWaalsContact O-ND2 3.14Å
39	E	58.2	Low	55.1	Low	82 Å²	82	110 Å²	110	38%	0.383	53%	0.529	S	S	.	.	H	α-helix	trans	-69.1	-43.9	174.2	-69.1	-168.1	128.1	0	0	111.9	L35 S36 K41 N42 A43 Q703	L35-E39 PolarHBondContact O-N 3.49Å; S36-E39 PolarHBondContact O-N 3.02Å; E39-K41 PolarHBondContact O-N 3.47Å; E39-N42 CarbonylContact O-C 3.14Å; E39-N42 WeakPolarHBondContact O-CA 3.43Å; E39-N42 WeakPolarHBondContact O-CB 3.47Å; E39-N42 PolarHBondContact O-N 2.83Å; E39-A43 PolarHBondContact O-N 2.86Å; E39-Q703 PolarHBondContact OE1-NE2 3.48Å
40	F	57	Low	54.3	Low	128 Å²	128	116 Å²	116	56%	0.561	55%	0.553	S	S	*	*	H	α-helix	trans	-57.9	-46.1	175	-174.7	-96.2	0	0	0	112.3	S36 N42 A43 Q44	S36-F40 VanDerWaalsContact O-CB 3.29Å; S36-F40 WeakPolarHBondContact O-CB 3.27Å; S36-F40 PolarHBondContact O-N 3.36Å; F40-N42 VanDerWaalsContact C-N 3.32Å; F40-N42 PolarHBondContact O-N 3.45Å; F40-A43 PolarHBondContact O-N 3.3Å; F40-Q44 HydrophobicContact CD1-CG 4.5Å; F40-Q44 HydrophobicContact CE1-CG 4.13Å; F40-Q44 HydrophobicContact CZ-CG 4.35Å; F40-Q44 PolarHBondContact O-N 2.99Å
41	K	55.9	Low	53.2	Low	139 Å²	139	112.1 Å²	112.1	60%	0.604	56%	0.558	S	S	*	*	H	α-helix	trans	-63.6	-34.5	173.6	-79.5	-171.8	172.3	-175.4	0	113	L37 E39 K45	L37-K41 WeakPolarHBondContact O-CB 3.48Å; L37-K41 WeakPolarHBondContact O-CG 3.47Å; L37-K41 PolarHBondContact O-N 3.48Å; E39-K41 PolarHBondContact O-N 3.47Å; K41-K45 WeakPolarHBondContact O-CB 3.34Å; K41-K45 PolarHBondContact O-N 2.84Å; K41-K45 VanDerWaalsContact O-N 3.08Å
42	N	57.8	Low	52.1	Low	83 Å²	83	114.4 Å²	114.4	44%	0.444	58%	0.575	S	S	.	*	H	α-helix	trans	-71.3	-34.6	175	-73.2	-25.8	0	0	0	112.3	K38 E39 F40 R46	K38-N42 WeakPolarHBondContact O-CB 3.44Å; K38-N42 PolarHBondContact O-N 3.47Å; K38-N42 VanDerWaalsContact O-N 3.08Å; K38-N42 PolarHBondContact O-ND2 3.42Å; K38-N42 VanDerWaalsContact O-ND2 3.14Å; E39-N42 CarbonylContact O-C 3.14Å; E39-N42 WeakPolarHBondContact O-CA 3.43Å; E39-N42 WeakPolarHBondContact O-CB 3.47Å; E39-N42 PolarHBondContact O-N 2.83Å; F40-N42 VanDerWaalsContact C-N 3.32Å; F40-N42 PolarHBondContact O-N 3.45Å; N42-R46 WeakPolarHBondContact O-CG 3.08Å; N42-R46 PolarHBondContact O-N 2.94Å; N42-R46 VanDerWaalsContact O-N 3.14Å
43	A	56.2	Low	50.6	Low	51 Å²	51	118.4 Å²	118.4	42%	0.421	61%	0.611	S	S	.	*	H	α-helix	trans	-67	-50.8	174.7	0	0	0	0	0	111.7	E39 F40 K45 R46 Q47	E39-A43 PolarHBondContact O-N 2.86Å; F40-A43 PolarHBondContact O-N 3.3Å; A43-K45 VanDerWaalsContact C-N 3.27Å; A43-K45 PolarHBondContact O-N 3.14Å; A43-R46 WeakPolarHBondContact O-CB 3.2Å; A43-R46 PolarHBondContact O-N 3.29Å; A43-Q47 PolarHBondContact O-N 3.15Å
44	Q	49.5	Very low	49.3	Very low	94 Å²	94	117.2 Å²	117.2	44%	0.439	62%	0.623	S	S	.	*	H	α-helix	trans	-57.1	-41.2	174.4	-73.6	-169.6	-33.5	0	0	111.9	F40 R46 Q47 H48	F40-Q44 HydrophobicContact CD1-CG 4.5Å; F40-Q44 HydrophobicContact CE1-CG 4.13Å; F40-Q44 HydrophobicContact CZ-CG 4.35Å; F40-Q44 PolarHBondContact O-N 2.99Å; Q44-R46 PolarHBondContact O-N 3.24Å; Q44-Q47 PolarHBondContact O-N 3.28Å; Q44-H48 PolarHBondContact O-N 2.76Å; Q44-H48 PolarHBondContact O-ND1 2.81Å
45	K	53.3	Low	47.4	Very low	168 Å²	168	114.8 Å²	114.8	73%	0.73	63%	0.629	S	S	*	*	H	α-helix	trans	-70.1	-15.7	178	-166.2	166.7	-175.2	174.4	0	114.2	K41 A43	K41-K45 WeakPolarHBondContact O-CB 3.34Å; K41-K45 PolarHBondContact O-N 2.84Å; K41-K45 VanDerWaalsContact O-N 3.08Å; A43-K45 VanDerWaalsContact C-N 3.27Å; A43-K45 PolarHBondContact O-N 3.14Å
46	R	52.1	Low	45.9	Very low	208 Å²	208	119.3 Å²	119.3	79%	0.785	65%	0.653	S	S	*	*	H	α-helix	trans	-82.2	-43.6	166.6	-73.3	173.1	-179.4	-178.2	0.8	111.3	N42 A43 Q44 H48 G49	N42-R46 WeakPolarHBondContact O-CG 3.08Å; N42-R46 PolarHBondContact O-N 2.94Å; N42-R46 VanDerWaalsContact O-N 3.14Å; A43-R46 WeakPolarHBondContact O-CB 3.2Å; A43-R46 PolarHBondContact O-N 3.29Å; Q44-R46 PolarHBondContact O-N 3.24Å; R46-H48 VanDerWaalsContact C-N 3.35Å; R46-H48 PolarHBondContact O-N 2.95Å; R46-G49 PolarHBondContact O-N 3.28Å
47	Q	44.1	Very low	44.5	Very low	160 Å²	160	124.5 Å²	124.5	75%	0.748	67%	0.668	S	S	*	*	H	α-helix	trans	-65.2	-34.7	179	-72.9	-177.8	-28.6	0	0	113.3	A43 Q44 G49	A43-Q47 PolarHBondContact O-N 3.15Å; Q44-Q47 PolarHBondContact O-N 3.28Å; Q47-G49 PolarHBondContact O-N 2.94Å
48	H	44.3	Very low	43.1	Very low	166 Å²	166	124.9 Å²	124.9	77%	0.769	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	9	172.3	-74	50.7	0	0	0	113.5	Q44 R46	Q44-H48 PolarHBondContact O-N 2.76Å; Q44-H48 PolarHBondContact O-ND1 2.81Å; R46-H48 VanDerWaalsContact C-N 3.35Å; R46-H48 PolarHBondContact O-N 2.95Å
49	G	37.4	Very low	41.1	Very low	56 Å²	56	125.5 Å²	125.5	58%	0.577	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-20.9	-177.3	0	0	0	0	0	115.2	R46 Q47	R46-G49 PolarHBondContact O-N 3.28Å; Q47-G49 PolarHBondContact O-N 2.94Å
50	E	38.7	Very low	39.5	Very low	196 Å²	196	129.3 Å²	129.3	92%	0.916	71%	0.711	S	S	*	*	S	Bend	trans	-127.3	70.8	-176.2	-67.6	-165.8	128.5	0	0	111.6
51	G	33.3	Very low	38	Very low	62 Å²	62	126.5 Å²	126.5	64%	0.639	72%	0.718	S	S	*	*	S	Bend	trans	-169.5	138.4	172.6	0	0	0	0	0	112.9
52	L	32.4	Very low	36.6	Very low	181 Å²	181	127.7 Å²	127.7	95%	0.948	73%	0.73	S	S	*	*			trans	60.5	81.8	167	-55.1	176.9	0	0	0	117.5
53	A	28.6	Very low	35.1	Very low	112 Å²	112	131.6 Å²	131.6	93%	0.926	75%	0.75	S	S	*	*			trans	-146.7	82.8	153.7	0	0	0	0	0	110.3
54	G	26.8	Very low	33.5	Very low	75 Å²	75	132.2 Å²	132.2	77%	0.773	76%	0.761	S	S	*	*			trans	-155.1	106.6	-173.1	0	0	0	0	0	115.6
55	S	28.6	Very low	32.4	Very low	110 Å²	110	135 Å²	135	77%	0.769	78%	0.779	S	S	*	*			trans	65.1	93.4	156.6	-176.2	0	0	0	0	119.5
56	L	28.5	Very low	31	Very low	150 Å²	150	133.7 Å²	133.7	79%	0.785	78%	0.78	S	S	*	*				-174.4	152.6	125.1	-115.3	67.4	0	0	0	106.6
57	K	27.8	Very low	29.9	Very low	171 Å²	171	131.8 Å²	131.8	74%	0.743	78%	0.78	S	S	*	*			cis	-156.5	149.6	12.8	-146.8	168.8	-168.9	179.3	0	110.4
58	T	26.9	Very low	29.2	Very low	117 Å²	117	128.9 Å²	128.9	72%	0.718	78%	0.778	S	S	*	*			trans	37.3	107.4	151.1	49.9	0	0	0	0	123.4
59	V	25	Very low	28.4	Very low	126 Å²	126	130.5 Å²	130.5	76%	0.764	78%	0.782	S	S	*	*				43.9	139.5	104.9	-179.3	0	0	0	0	121.3
60	N	25.5	Very low	27.8	Very low	163 Å²	163	131 Å²	131	87%	0.872	79%	0.788	S	S	*	*			trans	73.8	142.4	175.8	-65.1	-14.5	0	0	0	117
61	G	25.2	Very low	27.1	Very low	68 Å²	68	130.2 Å²	130.2	70%	0.701	79%	0.789	S	S	*	*			cis	166.4	152.6	-13.1	0	0	0	0	0	115.4
62	L	26.6	Very low	26.7	Very low	165 Å²	165	130.3 Å²	130.3	86%	0.864	79%	0.79	S	S	*	*			trans	74.7	141.9	158.2	-82.1	162.6	0	0	0	123
63	L	25.4	Very low	27.5	Very low	164 Å²	164	127.9 Å²	127.9	86%	0.859	79%	0.785	S	S	*	*			trans	65.3	143.4	166.5	-56	171	0	0	0	117.5
64	G	23.4	Very low	27.3	Very low	64 Å²	64	127 Å²	127	66%	0.66	78%	0.778	S	S	*	*			cis	104.1	124.5	12	0	0	0	0	0	110
65	N	25.7	Very low	27.5	Very low	153 Å²	153	128.5 Å²	128.5	82%	0.818	78%	0.776	S	S	*	*			cis	-146.9	153.1	24.1	-106.8	11.2	0	0	0	109.7
66	D	25.7	Very low	27.3	Very low	140 Å²	140	132 Å²	132	75%	0.749	78%	0.781	S	S	*	*				84	157.1	71.7	-160.1	18.8	0	0	0	115
67	Q	28	Very low	27.3	Very low	169 Å²	169	133.9 Å²	133.9	79%	0.79	79%	0.785	S	S	*	*			trans	83.2	147.8	177.2	-55.1	-169.2	28.5	0	0	119.9
68	S	29	Very low	27.3	Very low	99 Å²	99	130.2 Å²	130.2	69%	0.692	78%	0.781	S	S	*	*			cis	-162.7	-177.5	-33.1	73.8	0	0	0	0	113.3
69	K	26.9	Very low	27.3	Very low	199 Å²	199	132.2 Å²	132.2	87%	0.865	78%	0.782	S	S	*	*			trans	-43.9	169.3	176.7	-56.6	151.4	-175.8	173.7	0	116.4
70	G	25.5	Very low	27.4	Very low	68 Å²	68	132.3 Å²	132.3	70%	0.701	78%	0.778	S	S	*	*			cis	123.9	147.8	-0.8	0	0	0	0	0	115
71	L	24.3	Very low	27.6	Very low	179 Å²	179	130.8 Å²	130.8	94%	0.937	77%	0.766	S	S	*	*			trans	-151.6	170.4	175.7	-70.7	178.5	0	0	0	109.5
72	G	25	Very low	27.7	Very low	64 Å²	64	134.8 Å²	134.8	66%	0.66	76%	0.764	S	S	*	*			cis	107.8	149.9	2.3	0	0	0	0	0	114.1
73	P	48.7	Very low	27.8	Very low	129 Å²	129	133.3 Å²	133.3	84%	0.838	76%	0.757	S	S	*	*			cis	-138.2	-169.5	-8.5	43.7	-25.9	0	0	0	116
74	A	25.6	Very low	27.8	Very low	94 Å²	94	132.6 Å²	132.6	78%	0.777	76%	0.755	S	S	*	*			trans	79.8	140	162.5	0	0	0	0	0	119.8
75	S	29.9	Very low	28.1	Very low	106 Å²	106	133.1 Å²	133.1	74%	0.741	75%	0.752	S	S	*	*			cis	-165.8	178.3	-11.7	47.6	0	0	0	0	113.1
76	E	25.4	Very low	28.3	Very low	185 Å²	185	130.1 Å²	130.1	86%	0.864	74%	0.744	S	S	*	*			trans	83.9	154.2	167.3	-54	-171.2	150.6	0	0	119.8
77	Q	28.1	Very low	28.4	Very low	189 Å²	189	130.8 Å²	130.8	88%	0.883	74%	0.742	S	S	*	*				-156.2	172.1	-89.4	-123	177.7	-22.1	0	0	112.7
78	S	28.3	Very low	28.3	Very low	93 Å²	93	128.3 Å²	128.3	65%	0.65	74%	0.738	S	S	*	*			trans	70.5	143.4	171.1	149	0	0	0	0	117
79	E	26.3	Very low	28.1	Very low	160 Å²	160	128.4 Å²	128.4	75%	0.748	74%	0.739	S	S	*	*			cis	-160.1	155.2	-9.1	-110.3	161.5	122.7	0	0	111.2
80	N	27	Very low	28.2	Very low	127 Å²	127	123.5 Å²	123.5	68%	0.679	73%	0.73	S	S	*	*			trans	51.1	149.3	148.5	-71.3	20.3	0	0	0	123.1
81	E	29.1	Very low	28.3	Very low	132 Å²	132	126.9 Å²	126.9	62%	0.617	74%	0.737	S	S	*	*			cis	-163.5	164.2	-18.1	-126.6	-170.5	117.6	0	0	111.3
82	K	28	Very low	28.4	Very low	151 Å²	151	122.9 Å²	122.9	66%	0.657	72%	0.724	S	S	*	*			trans	47.1	128.7	157.1	-70	-156.9	171.9	72.5	0	123.4
83	D	28.3	Very low	28.4	Very low	135 Å²	135	126.4 Å²	126.4	72%	0.722	73%	0.728	S	S	*	*				37.4	147.7	104.4	-40.2	-42.5	0	0	0	119
84	D	26.1	Very low	27.3	Very low	149 Å²	149	127 Å²	127	80%	0.797	72%	0.724	S	S	*	*			cis	-165.6	164.9	40.2	-152.3	-5.3	0	0	0	114.9
85	A	29	Very low	27.3	Very low	74 Å²	74	128.6 Å²	128.6	61%	0.612	72%	0.724	S	S	*	*			trans	30.2	156.7	141.5	0	0	0	0	0	125
86	S	30.4	Very low	27.1	Very low	91 Å²	91	129.1 Å²	129.1	64%	0.636	73%	0.727	S	S	*	*			cis	-174.8	-161.6	-19.3	64.4	0	0	0	0	110.6
87	Q	27.1	Very low	27.1	Very low	154 Å²	154	126 Å²	126	72%	0.72	73%	0.725	S	S	*	*			trans	80	116.3	175.7	-49.5	-59.5	-57.4	0	0	115
88	V	25.7	Very low	27	Very low	117 Å²	117	121.4 Å²	121.4	71%	0.709	72%	0.715	S	S	*	*				74.7	131.5	52.2	179.9	0	0	0	0	110.7
89	S	25.8	Very low	27.1	Very low	100 Å²	100	125.2 Å²	125.2	70%	0.699	73%	0.727	S	S	*	*			cis	-137.2	152.9	14.5	5.9	0	0	0	0	111
90	S	29.3	Very low	27.1	Very low	97 Å²	97	126 Å²	126	68%	0.678	73%	0.729	S	S	*	*				74.1	126.3	70.1	-44.2	0	0	0	0	116.5
91	T	26.5	Very low	27.2	Very low	138 Å²	138	129 Å²	129	85%	0.847	74%	0.739	S	S	*	*			trans	65.5	143.9	160.3	51.3	0	0	0	0	119.5
92	S	26.3	Very low	27.2	Very low	95 Å²	95	131.8 Å²	131.8	66%	0.664	75%	0.752	S	S	*	*			cis	-169.6	153.8	-8.3	46.6	0	0	0	0	113.6
93	N	26.7	Very low	27	Very low	139 Å²	139	127.6 Å²	127.6	74%	0.743	75%	0.751	S	S	*	*			trans	68.9	114	153.7	-58.6	7	0	0	0	122.3
94	D	24	Very low	28.2	Very low	142 Å²	142	127 Å²	127	76%	0.759	76%	0.755	S	S	*	*				43.8	121	126.9	-50.3	-55.1	0	0	0	122.9
95	V	26.2	Very low	28.3	Very low	127 Å²	127	125.3 Å²	125.3	77%	0.77	75%	0.754	S	S	*	*				171.2	128.6	94.3	160.9	0	0	0	0	110.5
96	S	25.7	Very low	28.4	Very low	117 Å²	117	132.2 Å²	132.2	82%	0.818	77%	0.765	S	S	*	*			trans	62.1	148.6	164.7	-66.1	0	0	0	0	118.8
97	S	26.1	Very low	28.4	Very low	118 Å²	118	136.7 Å²	136.7	83%	0.825	77%	0.773	S	S	*	*			cis	-157.8	138.5	-18.2	173.8	0	0	0	0	107.1
98	S	26	Very low	28.7	Very low	94 Å²	94	138.4 Å²	138.4	66%	0.657	77%	0.773	S	S	*	*			trans	-142.6	143.2	-174.5	53.9	0	0	0	0	112
99	D	28.6	Very low	29.1	Very low	172 Å²	172	139.1 Å²	139.1	92%	0.92	78%	0.78	S	S	*	*			trans	-148.5	143.7	159.7	-120.3	-36.2	0	0	0	108.8
100	F	27.9	Very low	29.3	Very low	176 Å²	176	143.8 Å²	143.8	77%	0.772	78%	0.782	S	S	*	*			trans	-107.6	150.6	-152.3	-98.4	-106.8	0	0	0	115.8
101	E	29	Very low	29.2	Very low	191 Å²	191	147.9 Å²	147.9	89%	0.893	80%	0.796	S	S	*	*			trans	-86.3	140.7	147.1	-72.8	-128	153.5	0	0	108.9
102	E	28.2	Very low	29.3	Very low	191 Å²	191	148.5 Å²	148.5	89%	0.893	79%	0.789	S	S	*	*			trans	-144.1	132.3	164.2	-169.6	170.9	-171.5	0	0	115.8
103	G	25	Very low	29.4	Very low	62 Å²	62	149.4 Å²	149.4	64%	0.639	80%	0.802	S	S	*	*			trans	-176	168.9	142.9	0	0	0	0	0	108.9
104	P	53.2	Low	29.6	Very low	124 Å²	124	148.8 Å²	148.8	81%	0.805	80%	0.795	S	S	*	*			cis	-137.5	158	-14.2	39.6	-24.6	0	0	0	114.1
105	S	28.4	Very low	30	Very low	112 Å²	112	154.1 Å²	154.1	78%	0.783	80%	0.804	S	S	*	*			trans	-163.9	138.8	152.1	56.8	0	0	0	0	120.2
106	R	30.8	Very low	30.3	Very low	219 Å²	219	155.9 Å²	155.9	83%	0.826	80%	0.802	S	S	*	*			trans	52.3	111.9	135.3	-63.5	178.5	177.7	-158	1.2	124.3
107	K	29	Very low	30.4	Very low	186 Å²	186	159.7 Å²	159.7	81%	0.809	80%	0.804	S	S	*	*				67.4	99.3	123.6	-62.6	-176.8	178.6	-177.2	0	122
108	R	33.5	Very low	30.3	Very low	189 Å²	189	158.8 Å²	158.8	71%	0.713	80%	0.803	S	S	*	*				26.1	139.4	126.5	-78.2	-173.4	-176.7	150.3	3.6	120.8
109	P	34.6	Very low	30.4	Very low	133 Å²	133	163.3 Å²	163.3	86%	0.864	81%	0.814	S	S	*	*				-90.1	165.3	118.7	-19.3	34	0	0	0	113.3
110	R	30.9	Very low	30.4	Very low	197 Å²	197	160.5 Å²	160.5	74%	0.743	81%	0.808	S	S	*	*			trans	-152	112.3	175.3	-158.9	-175.9	-165.8	-170.6	2.9	108.9
111	L	26.1	Very low	30.5	Very low	184 Å²	184	160.9 Å²	160.9	96%	0.963	81%	0.812	S	S	*	*			trans	-98.6	148.4	169.6	-94.8	168.3	0	0	0	110.7
112	Q	29.3	Very low	31.5	Very low	151 Å²	151	156.5 Å²	156.5	71%	0.706	80%	0.8	S	S	*	*			trans	-133.8	97.4	-161.6	-178.8	175.9	-5.9	0	0	110.2	Q114	Q112-Q114 PolarHBondContact O-N 3.11Å
113	A	28	Very low	31.4	Very low	114 Å²	114	155 Å²	155	94%	0.942	80%	0.798	S	S	*	*			trans	-70.7	113	170.3	0	0	0	0	0	109.7
114	Q	31.7	Very low	31.6	Very low	126 Å²	126	157.4 Å²	157.4	59%	0.589	81%	0.806	S	S	*	*			trans	-135.7	123.1	171.8	-173.3	176	99.5	0	0	109	Q112	Q112-Q114 PolarHBondContact O-N 3.11Å
115	R	31.5	Very low	31.2	Very low	253 Å²	253	157.2 Å²	157.2	96%	0.955	80%	0.804	S	S	*	*			trans	-122.6	135.5	158.8	-81.9	-169.5	171	-167.1	-2.2	108.6
116	K	32.6	Very low	31.1	Very low	165 Å²	165	157.3 Å²	157.3	72%	0.717	81%	0.805	S	S	*	*			trans	-110.1	160.8	173.5	-75.2	-178.1	178.4	177	0	109.6
117	F	27.6	Very low	30.9	Very low	196 Å²	196	152.8 Å²	152.8	86%	0.86	80%	0.802	S	S	*	*			trans	-18.6	146.7	164.1	-64.2	-94.2	0	0	0	118.3
118	A	23.6	Very low	30.9	Very low	99 Å²	99	149.9 Å²	149.9	82%	0.818	80%	0.8	S	S	*	*			trans	-122.2	141.2	139.5	0	0	0	0	0	109.3
119	Q	28.6	Very low	31.3	Very low	189 Å²	189	146.1 Å²	146.1	88%	0.883	80%	0.8	S	S	*	*			trans	-134.3	137.1	161.7	-90.6	-169.8	-21.6	0	0	106.9
120	S	28.9	Very low	31	Very low	114 Å²	114	145.3 Å²	145.3	80%	0.797	79%	0.792	S	S	*	*			trans	-146.8	111	177.7	53.8	0	0	0	0	111.2
121	Q	29.2	Very low	30.8	Very low	184 Å²	184	144.9 Å²	144.9	86%	0.86	80%	0.796	S	S	*	*			trans	19.9	144.4	154.6	-60.6	-67.3	-4.8	0	0	121.6
122	P	51.4	Low	31.1	Very low	99 Å²	99	142.8 Å²	142.8	64%	0.643	78%	0.784	S	S	*	*			trans	-91.1	155.6	173.6	38	-33.9	0	0	0	113.6
123	N	25.6	Very low	31.1	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	79%	0.787	S	S	*	*				176.6	155.3	125.1	-89.6	-13.1	0	0	0	111.7
124	S	29.3	Very low	31.1	Very low	113 Å²	113	144.4 Å²	144.4	79%	0.79	78%	0.78	S	S	*	*			trans	-105.7	167.6	169	-43.6	0	0	0	0	109.5
125	P	44.1	Very low	31.7	Very low	120 Å²	120	143.1 Å²	143.1	78%	0.779	78%	0.783	S	S	*	*				-149.7	-178.9	73.5	40.6	-21	0	0	0	116.3
126	S	26.2	Very low	31.5	Very low	113 Å²	113	138.7 Å²	138.7	79%	0.79	78%	0.777	S	S	*	*			trans	18.8	148	147.2	-106.9	0	0	0	0	122.1
127	T	27.5	Very low	31.5	Very low	124 Å²	124	138.3 Å²	138.3	76%	0.761	78%	0.783	S	S	*	*			cis	-148.3	167.5	24.8	54	0	0	0	0	114.7
128	T	29.2	Very low	32.6	Very low	125 Å²	125	134.7 Å²	134.7	77%	0.767	78%	0.779	S	S	*	*			trans	-67.5	170.9	157.4	39.1	0	0	0	0	112.1
129	P	40.9	Very low	34	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	77%	0.773	S	S	*	*			cis	-157.6	155.1	42.5	42.9	-19.2	0	0	0	123.5
130	V	29.9	Very low	34.4	Very low	117 Å²	117	132.3 Å²	132.3	71%	0.709	77%	0.771	S	S	*	*			trans	53.7	122.4	130.9	-176.1	0	0	0	0	123.7	I132	V130-I132 HydrophobicContact CG1-CD1 3.96Å
131	K	26.8	Very low	34.8	Very low	188 Å²	188	131.3 Å²	131.3	82%	0.817	77%	0.77	S	S	*	*				-178.1	144.3	119.6	-92.1	-175	-177.7	-179.9	0	109
132	I	31.5	Very low	34.9	Very low	139 Å²	139	129 Å²	129	71%	0.713	77%	0.768	S	S	*	*			cis	81.4	122.8	42.1	-64.7	171.3	0	0	0	111.1	V130	V130-I132 HydrophobicContact CG1-CD1 3.96Å
133	V	28.6	Very low	34	Very low	129 Å²	129	132.7 Å²	132.7	78%	0.782	78%	0.777	S	S	*	*			cis	-158.2	176.5	3	105.2	0	0	0	0	113.7
134	E	27.8	Very low	34.8	Very low	170 Å²	170	132.7 Å²	132.7	79%	0.794	78%	0.776	S	S	*	*			trans	-52.3	-172.5	165.8	-104.1	174.7	107.7	0	0	117.8
135	P	45.2	Very low	35	Very low	100 Å²	100	132.6 Å²	132.6	65%	0.649	78%	0.775	S	S	*	*			cis	-135.7	-172.4	-9.9	32.6	-10.5	0	0	0	115.3
136	L	26.8	Very low	34.3	Very low	159 Å²	159	132.4 Å²	132.4	83%	0.832	77%	0.767	S	S	*	*				166.1	162.9	127.6	-89.6	169.3	0	0	0	116.6
137	L	32.5	Very low	35	Very low	158 Å²	158	134.8 Å²	134.8	83%	0.827	77%	0.77	S	S	*	*			trans	-156.3	172.5	176.6	-69.4	175.2	0	0	0	108.7
138	P	51.4	Low	35.8	Very low	120 Å²	120	132.7 Å²	132.7	78%	0.779	76%	0.761	S	S	*	*			cis	-122.9	-107.4	-19.6	20.5	5.8	0	0	0	115.9
139	P	52.5	Low	36.7	Very low	107 Å²	107	135.6 Å²	135.6	70%	0.695	76%	0.763	S	S	*	*				-115.8	179.7	-126.1	44.2	-29.2	0	0	0	115.8
140	P	38.2	Very low	37	Very low	131 Å²	131	141.1 Å²	141.1	85%	0.851	77%	0.769	S	S	*	*				-146.6	-160.6	92.5	40.1	-21.7	0	0	0	113.9
141	A	35.3	Very low	38.2	Very low	93 Å²	93	145.3 Å²	145.3	77%	0.769	78%	0.778	S	S	*	*			trans	-145.2	149.4	-172.5	0	0	0	0	0	115.1
142	T	31.9	Very low	39.6	Very low	134 Å²	134	140.1 Å²	140.1	82%	0.822	76%	0.763	S	S	*	*			trans	-159.2	135.2	159.6	17.4	0	0	0	0	114.5
143	Q	32.9	Very low	41.3	Very low	178 Å²	178	139.6 Å²	139.6	83%	0.832	76%	0.756	S	S	*	*			trans	46.4	111.5	147.3	-58.3	-173.2	13.3	0	0	124.6
144	I	42.2	Very low	43	Very low	159 Å²	159	138.7 Å²	138.7	82%	0.815	75%	0.751	S	S	*	*			trans	23.8	143	130.4	-21	-176.5	0	0	0	121.8
145	S	33.5	Very low	45	Very low	111 Å²	111	136.7 Å²	136.7	78%	0.776	74%	0.742	S	S	*	*			trans	116.4	66	141	-57.4	0	0	0	0	120
146	D	30.2	Very low	46.2	Very low	116 Å²	116	134.3 Å²	134.3	62%	0.62	72%	0.723	S	S	*	*			trans	-161.7	134.2	135.3	-162.1	-19.7	0	0	0	110.3	S148	D146-S148 WeakPolarHBondContact OD1-CB 3.43Å; D146-S148 PolarHBondContact OD1-N 3.43Å; D146-S148 PolarHBondContact OD1-OG 3.34Å; D146-S148 PolarHBondContact OD2-OG 3.05Å
147	L	40.8	Very low	48.2	Very low	163 Å²	163	131.3 Å²	131.3	85%	0.853	70%	0.704	S	S	*	*			trans	-136.8	29	173.8	-79.5	-179.1	0	0	0	113.1
148	S	44.5	Very low	50.1	Low	80 Å²	80	128.5 Å²	128.5	56%	0.559	69%	0.689	S	S	*	*	S	Bend	trans	-86.3	-17.3	179.5	61	0	0	0	0	115.3	D146	D146-S148 WeakPolarHBondContact OD1-CB 3.43Å; D146-S148 PolarHBondContact OD1-N 3.43Å; D146-S148 PolarHBondContact OD1-OG 3.34Å; D146-S148 PolarHBondContact OD2-OG 3.05Å
149	K	47.2	Very low	51.2	Low	185 Å²	185	125.4 Å²	125.4	80%	0.804	67%	0.668	S	S	*	*	S	Bend	trans	-133.9	50.3	-163.2	-70.9	169.8	-172.1	167.6	0	115.5
150	R	46.9	Very low	52.4	Low	226 Å²	226	121 Å²	121	85%	0.853	64%	0.638	S	S	*	*			trans	-128.9	123.6	165.5	-75.8	-171.6	174.5	-176.1	0.3	111.8
151	K	55.9	Low	54.1	Low	205 Å²	205	119.4 Å²	119.4	89%	0.891	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-65.5	129.9	167.1	-72.5	-173.7	175.3	-177.5	0	109.1
152	P	56.3	Low	55.8	Low	79 Å²	79	120.1 Å²	120.1	51%	0.513	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-62.3	154.4	177.8	-23.3	33.8	0	0	0	112.7	D156 F176	P152-D156 HydrophobicContact CB-CB 4.45Å; P152-F176 HydrophobicContact CB-CE1 4.3Å; P152-F176 HydrophobicContact CB-CE2 4.07Å; P152-F176 HydrophobicContact CB-CZ 3.41Å; P152-F176 VanDerWaalsContact CB-CZ 3.41Å; P152-F176 HydrophobicContact CG-CE1 3.97Å; P152-F176 HydrophobicContact CG-CE2 4.17Å; P152-F176 HydrophobicContact CG-CZ 3.47Å; P152-F176 VanDerWaalsContact CG-CZ 3.47Å
153	K	67.2	Low	57.6	Low	128 Å²	128	116.3 Å²	116.3	56%	0.557	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-83	159.7	171.2	-58.2	178.4	178	180	0	111	E155 D156 F157	K153-E155 HydrophobicContact CB-CB 4.4Å; K153-E155 WeakPolarHBondContact CD-OE2 3.36Å; K153-E155 IonicContact NZ-OE2 2.74Å; K153-E155 PolarHBondContact O-N 3.24Å; K153-D156 VanDerWaalsContact CB-OD2 3.26Å; K153-D156 WeakPolarHBondContact CB-OD2 3.33Å; K153-D156 PolarHBondContact N-OD2 3.16Å; K153-D156 WeakPolarHBondContact O-CB 3.38Å; K153-D156 PolarHBondContact O-N 2.6Å; K153-D156 VanDerWaalsContact O-N 3.1Å; K153-F157 PolarHBondContact O-N 2.93Å; K153-F157 VanDerWaalsContact O-N 3.11Å
154	T	64.3	Low	59.4	Low	111 Å²	111	116.4 Å²	116.4	68%	0.681	59%	0.587	S	S	*	*	H	α-helix	trans	-57	-32.9	170.9	-29.8	0	0	0	0	112.1	L158	T154-L158 HydrophobicContact CG2-CD1 4.41Å; T154-L158 WeakPolarHBondContact O-CB 3.41Å; T154-L158 WeakPolarHBondContact O-CD1 3.42Å; T154-L158 VanDerWaalsContact O-CG 3.23Å; T154-L158 WeakPolarHBondContact O-CG 3.46Å; T154-L158 PolarHBondContact O-N 3.08Å
155	E	69.8	Low	60.3	Low	127 Å²	127	112.9 Å²	112.9	59%	0.593	59%	0.59	S	S	*	*	H	α-helix	trans	-65.2	-43.1	176.5	-64.9	156.9	166.4	0	0	111.6	K153 T159	K153-E155 HydrophobicContact CB-CB 4.4Å; K153-E155 WeakPolarHBondContact CD-OE2 3.36Å; K153-E155 IonicContact NZ-OE2 2.74Å; K153-E155 PolarHBondContact O-N 3.24Å; E155-T159 WeakPolarHBondContact O-CB 3.35Å; E155-T159 PolarHBondContact O-N 2.83Å; E155-T159 PolarHBondContact O-OG1 3.03Å
156	D	69.9	Low	62.3	Low	50 Å²	50	110 Å²	110	27%	0.267	57%	0.57	S	S	.	*	H	α-helix	trans	-65.4	-44.2	177.3	-53.2	-44.3	0	0	0	110.6	P152 K153 T159 F160 M173	P152-D156 HydrophobicContact CB-CB 4.45Å; K153-D156 VanDerWaalsContact CB-OD2 3.26Å; K153-D156 WeakPolarHBondContact CB-OD2 3.33Å; K153-D156 PolarHBondContact N-OD2 3.16Å; K153-D156 WeakPolarHBondContact O-CB 3.38Å; K153-D156 PolarHBondContact O-N 2.6Å; K153-D156 VanDerWaalsContact O-N 3.1Å; D156-T159 WeakPolarHBondContact O-CB 3.23Å; D156-T159 PolarHBondContact O-N 3.49Å; D156-F160 WeakPolarHBondContact O-CB 3.33Å; D156-F160 PolarHBondContact O-N 2.68Å; D156-M173 HydrophobicContact CB-CE 3.88Å
157	F	68.8	Low	63.8	Low	97 Å²	97	111.2 Å²	111.2	43%	0.425	58%	0.584	S	S	.	*	H	α-helix	trans	-66.9	-39.9	179	-172.2	-109.9	0	0	0	112.8	K153 T159 F160 L161 F176	K153-F157 PolarHBondContact O-N 2.93Å; K153-F157 VanDerWaalsContact O-N 3.11Å; F157-T159 VanDerWaalsContact C-N 3.34Å; F157-F160 PolarHBondContact O-N 3.45Å; F157-L161 HydrophobicContact CD1-CD1 3.91Å; F157-L161 HydrophobicContact CE1-CD1 3.6Å; F157-L161 HydrophobicContact CE1-CG 4.27Å; F157-L161 HydrophobicContact CZ-CD1 4.16Å; F157-L161 HydrophobicContact CZ-CG 4.43Å; F157-L161 WeakPolarHBondContact O-CG 3.32Å; F157-L161 PolarHBondContact O-N 3.12Å; F157-F176 HydrophobicContact CB-CZ 4.32Å; F157-F176 HydrophobicContact CD2-CD1 4.29Å; F157-F176 AromaticContact CD2-CE1 3.72Å; F157-F176 HydrophobicContact CD2-CE1 3.72Å; F157-F176 AromaticContact CD2-CZ 3.99Å; F157-F176 HydrophobicContact CD2-CZ 3.99Å; F157-F176 HydrophobicContact CE2-CE1 4.35Å
158	L	72.1	Confident	65.3	Low	99 Å²	99	106.5 Å²	106.5	52%	0.518	57%	0.568	S	S	.	*	H	α-helix	trans	-65.8	-37.6	173	-73.3	167.8	0	0	0	111.8	T154 L161 C162	T154-L158 HydrophobicContact CG2-CD1 4.41Å; T154-L158 WeakPolarHBondContact O-CB 3.41Å; T154-L158 WeakPolarHBondContact O-CD1 3.42Å; T154-L158 VanDerWaalsContact O-CG 3.23Å; T154-L158 WeakPolarHBondContact O-CG 3.46Å; T154-L158 PolarHBondContact O-N 3.08Å; L158-L161 PolarHBondContact O-N 2.89Å; L158-C162 PolarHBondContact O-N 3.32Å; L158-C162 PolarHBondContact O-SG 3.03Å
159	T	74.8	Confident	66.6	Low	54 Å²	54	104.1 Å²	104.1	33%	0.331	55%	0.55	S	S	.	.	H	α-helix	trans	-65.3	-44.5	175.4	-57.6	0	0	0	0	111.1	E155 D156 F157 C162 L163 M173	E155-T159 WeakPolarHBondContact O-CB 3.35Å; E155-T159 PolarHBondContact O-N 2.83Å; E155-T159 PolarHBondContact O-OG1 3.03Å; D156-T159 WeakPolarHBondContact O-CB 3.23Å; D156-T159 PolarHBondContact O-N 3.49Å; F157-T159 VanDerWaalsContact C-N 3.34Å; T159-C162 PolarHBondContact O-N 3.2Å; T159-L163 HydrophobicContact CG2-CD1 3.88Å; T159-L163 WeakPolarHBondContact O-CB 3.44Å; T159-L163 PolarHBondContact O-N 3.41Å; T159-M173 HydrophobicContact CG2-CE 4.4Å; T159-M173 HydrophobicContact CG2-SD 4.07Å
160	F	77.1	Confident	67.9	Low	14 Å²	14	97.9 Å²	97.9	6%	0.061	53%	0.528	C	S	.	.	H	α-helix	trans	-58.6	-47.9	172.2	174.2	-100.9	0	0	0	111.8	D156 F157 C162 L163 R164 L169 F176	D156-F160 WeakPolarHBondContact O-CB 3.33Å; D156-F160 PolarHBondContact O-N 2.68Å; F157-F160 PolarHBondContact O-N 3.45Å; F160-C162 VanDerWaalsContact C-N 3.27Å; F160-C162 PolarHBondContact O-N 3.43Å; F160-L163 PolarHBondContact O-N 2.68Å; F160-R164 HydrophobicContact CZ-CB 4.49Å; F160-R164 HydrophobicContact CZ-CG 4.47Å; F160-R164 WeakPolarHBondContact O-CA 3.32Å; F160-R164 WeakPolarHBondContact O-CB 3.43Å; F160-R164 PolarHBondContact O-N 2.91Å; F160-L169 HydrophobicContact CD2-CD1 4.05Å; F160-L169 HydrophobicContact CD2-CD2 4.03Å; F160-L169 HydrophobicContact CE2-CD2 4.17Å; F160-F176 HydrophobicContact CB-CD2 4.24Å; F160-F176 HydrophobicContact CD1-CB 3.98Å; F160-F176 HydrophobicContact CD1-CG 4.35Å; F160-F176 HydrophobicContact CD2-CB 3.69Å; F160-F176 HydrophobicContact CD2-CD2 4.29Å; F160-F176 HydrophobicContact CD2-CG 4.37Å; F160-F176 HydrophobicContact CE1-CB 3.79Å; F160-F176 HydrophobicContact CE2-CB 3.49Å; F160-F176 VanDerWaalsContact CE2-CB 3.49Å; F160-F176 HydrophobicContact CG-CB 3.94Å; F160-F176 HydrophobicContact CG-CD2 4.15Å; F160-F176 HydrophobicContact CG-CG 4.25Å; F160-F176 HydrophobicContact CZ-CB 3.54Å
161	L	75.1	Confident	68.3	Low	98 Å²	98	94.3 Å²	94.3	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-60.7	-33.4	177.6	-75.1	173.9	0	0	0	113.5	F157 L158	F157-L161 HydrophobicContact CD1-CD1 3.91Å; F157-L161 HydrophobicContact CE1-CD1 3.6Å; F157-L161 HydrophobicContact CE1-CG 4.27Å; F157-L161 HydrophobicContact CZ-CD1 4.16Å; F157-L161 HydrophobicContact CZ-CG 4.43Å; F157-L161 WeakPolarHBondContact O-CG 3.32Å; F157-L161 PolarHBondContact O-N 3.12Å; L158-L161 PolarHBondContact O-N 2.89Å
162	C	71.3	Confident	68.5	Low	108 Å²	108	89.4 Å²	89.4	73%	0.73	52%	0.517	S	S	*	.	H	α-helix	trans	-81.4	-23.1	178.4	-63.2	0	0	0	0	114	L158 T159 F160	L158-C162 PolarHBondContact O-N 3.32Å; L158-C162 PolarHBondContact O-SG 3.03Å; T159-C162 PolarHBondContact O-N 3.2Å; F160-C162 VanDerWaalsContact C-N 3.27Å; F160-C162 PolarHBondContact O-N 3.43Å
163	L	69.6	Low	69	Low	54 Å²	54	86.8 Å²	86.8	28%	0.283	50%	0.498	S	S	.	.	H	α-helix	trans	-117	-3.7	-173.7	-61.6	178.1	0	0	0	114.4	T159 F160 G165 S166 L169	T159-L163 HydrophobicContact CG2-CD1 3.88Å; T159-L163 WeakPolarHBondContact O-CB 3.44Å; T159-L163 PolarHBondContact O-N 3.41Å; F160-L163 PolarHBondContact O-N 2.68Å; L163-G165 PolarHBondContact O-N 3.05Å; L163-S166 VanDerWaalsContact O-CB 3.28Å; L163-S166 WeakPolarHBondContact O-CB 3.17Å; L163-S166 PolarHBondContact O-N 3.27Å; L163-L169 HydrophobicContact CB-CB 4.32Å; L163-L169 HydrophobicContact CB-CD1 3.86Å
164	R	70.4	Confident	68.8	Low	180 Å²	180	84.3 Å²	84.3	68%	0.679	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	118.1	174.6	165.9	179.2	153.3	120.2	-1.6	110.6	F160	F160-R164 HydrophobicContact CZ-CB 4.49Å; F160-R164 HydrophobicContact CZ-CG 4.47Å; F160-R164 WeakPolarHBondContact O-CA 3.32Å; F160-R164 WeakPolarHBondContact O-CB 3.43Å; F160-R164 PolarHBondContact O-N 2.91Å
165	G	60.6	Low	68.8	Low	85 Å²	85	87.1 Å²	87.1	88%	0.876	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.6	-2	-176.9	0	0	0	0	0	115	L163	L163-G165 PolarHBondContact O-N 3.05Å
166	S	75.9	Confident	68.5	Low	51 Å²	51	84.5 Å²	84.5	36%	0.357	48%	0.48	S	S	.	.	S	Bend	trans	-96.4	142.5	171	-180	0	0	0	0	111.1	L163 A168 L169	L163-S166 VanDerWaalsContact O-CB 3.28Å; L163-S166 WeakPolarHBondContact O-CB 3.17Å; L163-S166 PolarHBondContact O-N 3.27Å; S166-A168 PolarHBondContact O-N 2.73Å; S166-A168 PolarHBondContact OG-N 3.42Å; S166-L169 PolarHBondContact O-N 3.21Å
167	P	60.3	Low	67.9	Low	141 Å²	141	84.7 Å²	84.7	92%	0.916	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-2.8	171.3	30	-36.7	0	0	0	113.7
168	A	73.3	Confident	66.7	Low	64 Å²	64	83.6 Å²	83.6	53%	0.529	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	0	173.9	0	0	0	0	0	114.3	S166	S166-A168 PolarHBondContact O-N 2.73Å; S166-A168 PolarHBondContact OG-N 3.42Å
169	L	72.7	Confident	65	Low	31 Å²	31	83.8 Å²	83.8	16%	0.162	51%	0.507	C	S	.	.	S	Bend	trans	-69.2	128.1	176	-174.7	71	0	0	0	110.7	F160 L163 S166 M173	F160-L169 HydrophobicContact CD2-CD1 4.05Å; F160-L169 HydrophobicContact CD2-CD2 4.03Å; F160-L169 HydrophobicContact CE2-CD2 4.17Å; L163-L169 HydrophobicContact CB-CB 4.32Å; L163-L169 HydrophobicContact CB-CD1 3.86Å; S166-L169 PolarHBondContact O-N 3.21Å; L169-M173 HydrophobicContact CD1-CB 4.15Å; L169-M173 HydrophobicContact CG-CB 4.43Å
170	P	73.3	Confident	63.1	Low	53 Å²	53	87.3 Å²	87.3	34%	0.344	52%	0.52	S	S	.	.			trans	-64.2	138	177.9	-22.9	34.3	0	0	0	112.9	S172 M173	P170-S172 PolarHBondContact O-N 2.8Å; P170-M173 HydrophobicContact CG-SD 4.3Å; P170-M173 PolarHBondContact O-N 3.39Å
171	N	55.4	Low	61	Low	152 Å²	152	93.7 Å²	93.7	81%	0.813	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-54.3	-30.2	-179.7	-71.9	3.9	0	0	0	113.8	M173 V174	N171-M173 PolarHBondContact O-N 3.14Å; N171-V174 WeakPolarHBondContact O-CG2 3.47Å; N171-V174 PolarHBondContact O-N 2.81Å
172	S	61.3	Low	59	Low	101 Å²	101	96.4 Å²	96.4	71%	0.706	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-69.8	-12.4	176.2	52	0	0	0	0	114.7	P170	P170-S172 PolarHBondContact O-N 2.8Å
173	M	65.2	Low	57.2	Low	25 Å²	25	100.4 Å²	100.4	12%	0.123	57%	0.573	C	S	.	*	G	3₁₀ helix	trans	-104	-0.1	178.6	-63.2	-175.6	177.4	0	0	113.1	D156 T159 L169 P170 N171 Y175 F176	D156-M173 HydrophobicContact CB-CE 3.88Å; T159-M173 HydrophobicContact CG2-CE 4.4Å; T159-M173 HydrophobicContact CG2-SD 4.07Å; L169-M173 HydrophobicContact CD1-CB 4.15Å; L169-M173 HydrophobicContact CG-CB 4.43Å; P170-M173 HydrophobicContact CG-SD 4.3Å; P170-M173 PolarHBondContact O-N 3.39Å; N171-M173 PolarHBondContact O-N 3.14Å; M173-Y175 VanDerWaalsContact C-N 3.29Å; M173-Y175 PolarHBondContact O-N 2.74Å; M173-F176 PolarHBondContact O-N 3.43Å
174	V	63.7	Low	55.2	Low	75 Å²	75	106.5 Å²	106.5	46%	0.455	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-65.9	-30.4	-177.9	175.6	0	0	0	0	112.3	N171 F176 G177	N171-V174 WeakPolarHBondContact O-CG2 3.47Å; N171-V174 PolarHBondContact O-N 2.81Å; V174-F176 PolarHBondContact O-N 2.9Å; V174-F176 VanDerWaalsContact O-N 3.14Å; V174-G177 PolarHBondContact O-N 3Å
175	Y	64.3	Low	53.3	Low	171 Å²	171	102.7 Å²	102.7	67%	0.671	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-57	-27.8	178	179.4	-107	0	0	0	113.9	M173 G177 S178	M173-Y175 VanDerWaalsContact C-N 3.29Å; M173-Y175 PolarHBondContact O-N 2.74Å; Y175-G177 PolarHBondContact O-N 2.66Å; Y175-G177 VanDerWaalsContact O-N 3.12Å; Y175-S178 PolarHBondContact O-N 2.84Å; Y175-S178 VanDerWaalsContact O-N 3.11Å
176	F	63	Low	51.8	Low	72 Å²	72	107 Å²	107	32%	0.316	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-63.1	-13.5	171.9	-82.8	-67.3	0	0	0	114.3	P152 F157 F160 M173 V174	P152-F176 HydrophobicContact CB-CE1 4.3Å; P152-F176 HydrophobicContact CB-CE2 4.07Å; P152-F176 HydrophobicContact CB-CZ 3.41Å; P152-F176 VanDerWaalsContact CB-CZ 3.41Å; P152-F176 HydrophobicContact CG-CE1 3.97Å; P152-F176 HydrophobicContact CG-CE2 4.17Å; P152-F176 HydrophobicContact CG-CZ 3.47Å; P152-F176 VanDerWaalsContact CG-CZ 3.47Å; F157-F176 HydrophobicContact CB-CZ 4.32Å; F157-F176 HydrophobicContact CD2-CD1 4.29Å; F157-F176 AromaticContact CD2-CE1 3.72Å; F157-F176 HydrophobicContact CD2-CE1 3.72Å; F157-F176 AromaticContact CD2-CZ 3.99Å; F157-F176 HydrophobicContact CD2-CZ 3.99Å; F157-F176 HydrophobicContact CE2-CE1 4.35Å; F160-F176 HydrophobicContact CB-CD2 4.24Å; F160-F176 HydrophobicContact CD1-CB 3.98Å; F160-F176 HydrophobicContact CD1-CG 4.35Å; F160-F176 HydrophobicContact CD2-CB 3.69Å; F160-F176 HydrophobicContact CD2-CD2 4.29Å; F160-F176 HydrophobicContact CD2-CG 4.37Å; F160-F176 HydrophobicContact CE1-CB 3.79Å; F160-F176 HydrophobicContact CE2-CB 3.49Å; F160-F176 VanDerWaalsContact CE2-CB 3.49Å; F160-F176 HydrophobicContact CG-CB 3.94Å; F160-F176 HydrophobicContact CG-CD2 4.15Å; F160-F176 HydrophobicContact CG-CG 4.25Å; F160-F176 HydrophobicContact CZ-CB 3.54Å; M173-F176 PolarHBondContact O-N 3.43Å; V174-F176 PolarHBondContact O-N 2.9Å; V174-F176 VanDerWaalsContact O-N 3.14Å
177	G	57.7	Low	49.6	Very low	54 Å²	54	112.5 Å²	112.5	56%	0.557	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-98.4	-3.5	175.6	0	0	0	0	0	114.6	V174 Y175	V174-G177 PolarHBondContact O-N 3Å; Y175-G177 PolarHBondContact O-N 2.66Å; Y175-G177 VanDerWaalsContact O-N 3.12Å
178	S	44.8	Very low	48.1	Very low	74 Å²	74	113.6 Å²	113.6	52%	0.517	61%	0.607	S	S	.	*			trans	-94.7	111	-177.4	-59	0	0	0	0	110.9	Y175	Y175-S178 PolarHBondContact O-N 2.84Å; Y175-S178 VanDerWaalsContact O-N 3.11Å
179	S	36.1	Very low	45.9	Very low	102 Å²	102	117.1 Å²	117.1	71%	0.713	62%	0.616	S	S	*	*			trans	-76	118.5	161.2	48.6	0	0	0	0	108.7
180	Q	34.3	Very low	43.8	Very low	129 Å²	129	122.7 Å²	122.7	60%	0.603	65%	0.646	S	S	*	*			trans	-113.9	84.4	168.3	-173.4	174.2	3	0	0	106.4	E182	Q180-E182 HydrophobicContact CG-CG 3.83Å; Q180-E182 PolarHBondContact NE2-OE1 3.08Å
181	D	32.4	Very low	41.8	Very low	147 Å²	147	127 Å²	127	79%	0.786	66%	0.662	S	S	*	*			trans	-82.2	113.6	169.3	-58.8	-60.5	0	0	0	106.7
182	E	33	Very low	40.6	Very low	155 Å²	155	125.1 Å²	125.1	72%	0.724	66%	0.656	S	S	*	*			trans	-116.4	97.1	172.4	-53	-145.2	161.4	0	0	108.2	Q180	Q180-E182 HydrophobicContact CG-CG 3.83Å; Q180-E182 PolarHBondContact NE2-OE1 3.08Å
183	E	34	Very low	39.1	Very low	193 Å²	193	128.8 Å²	128.8	90%	0.902	66%	0.662	S	S	*	*			trans	-108.1	110.1	164.5	-69.8	-173.4	143	0	0	107.6
184	E	27.8	Very low	37.5	Very low	182 Å²	182	134.4 Å²	134.4	85%	0.85	69%	0.693	S	S	*	*			trans	-138.4	128.6	160.5	-89.6	-161.6	123.5	0	0	109.8
185	V	30.8	Very low	36.2	Very low	99 Å²	99	135.8 Å²	135.8	60%	0.6	70%	0.701	S	S	*	*			trans	66.7	111.9	135.6	177.7	0	0	0	0	115.9
186	E	28.7	Very low	34.6	Very low	177 Å²	177	136.2 Å²	136.2	83%	0.827	71%	0.706	S	S	*	*				65.7	148	66.4	-58.4	176.2	169.9	0	0	110.4
187	E	29.4	Very low	33.2	Very low	166 Å²	166	138.5 Å²	138.5	78%	0.776	73%	0.726	S	S	*	*			cis	-128.7	179.5	39.2	-62	148.1	149.6	0	0	111
188	E	30.3	Very low	32	Very low	164 Å²	164	140.4 Å²	140.4	77%	0.766	74%	0.737	S	S	*	*			cis	-156.8	-173.4	8.8	-144.6	162.5	-172.6	0	0	111.4
189	D	26.8	Very low	31.5	Very low	137 Å²	137	142.2 Å²	142.2	73%	0.733	75%	0.745	S	S	*	*			trans	80.6	76.8	158.8	-64.9	-4.7	0	0	0	123.1
190	D	28.9	Very low	31.4	Very low	148 Å²	148	144.2 Å²	144.2	79%	0.791	75%	0.748	S	S	*	*				89.5	150.2	104.7	-119.1	-8.3	0	0	0	127.2
191	E	30.4	Very low	31.4	Very low	143 Å²	143	145.1 Å²	145.1	67%	0.668	76%	0.757	S	S	*	*			trans	62	101	152.7	-68.9	-98.2	67.4	0	0	123.2
192	T	29.3	Very low	31.2	Very low	114 Å²	114	143.1 Å²	143.1	70%	0.699	76%	0.761	S	S	*	*				49.2	151.6	116.4	61.6	0	0	0	0	122.7
193	E	29.6	Very low	31.1	Very low	178 Å²	178	141.1 Å²	141.1	83%	0.832	76%	0.764	S	S	*	*			cis	-140.2	153.7	-1.1	-85.7	-150.3	137.9	0	0	112.9
194	D	33.2	Very low	31	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	76%	0.759	S	S	*	*			trans	11.8	159.9	136.1	-112.8	-19.9	0	0	0	123.7
195	V	36	Very low	31.3	Very low	104 Å²	104	134 Å²	134	63%	0.63	76%	0.756	S	S	*	*			cis	-160.6	167.4	14.4	72.7	0	0	0	0	115.2
196	K	30.7	Very low	31.3	Very low	179 Å²	179	134.8 Å²	134.8	78%	0.778	76%	0.764	S	S	*	*			trans	108.5	74.2	149.9	-101	161.2	-167.4	159.7	0	124
197	T	33.3	Very low	31.7	Very low	120 Å²	120	135.2 Å²	135.2	74%	0.736	77%	0.766	S	S	*	*				38.9	128.6	119.7	-14.7	0	0	0	0	123.5
198	A	31.5	Very low	31.8	Very low	95 Å²	95	132.6 Å²	132.6	79%	0.785	77%	0.766	S	S	*	*				-177.4	78.7	124.8	0	0	0	0	0	116.2
199	T	36	Very low	31.8	Very low	111 Å²	111	131.4 Å²	131.4	68%	0.681	77%	0.77	S	S	*	*			trans	7.3	134.6	143.1	55.4	0	0	0	0	123
200	N	33.9	Very low	33.2	Very low	145 Å²	145	130.5 Å²	130.5	78%	0.775	77%	0.772	S	S	*	*				-175.8	127.5	100.8	-101	-39.8	0	0	0	118.1
201	N	34.4	Very low	33.4	Very low	148 Å²	148	135.8 Å²	135.8	79%	0.791	78%	0.781	S	S	*	*			trans	3.3	137.9	156.1	-57	-14	0	0	0	124.6
202	A	28.1	Very low	33.7	Very low	105 Å²	105	139.2 Å²	139.2	87%	0.868	79%	0.793	S	S	*	*				-155.6	155.4	129.8	0	0	0	0	0	110.4
203	S	29.7	Very low	33.7	Very low	113 Å²	113	137.4 Å²	137.4	79%	0.79	80%	0.797	S	S	*	*			trans	-125.9	161.9	-160.5	-57.1	0	0	0	0	117.9
204	S	31.4	Very low	33.7	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	80%	0.799	S	S	*	*			trans	-49.3	175.3	156.7	42.4	0	0	0	0	115
205	S	34.3	Very low	33.3	Very low	111 Å²	111	137.5 Å²	137.5	78%	0.776	80%	0.799	S	S	*	*			cis	-178.6	177.8	-15.2	172.6	0	0	0	0	107.4
206	C	30.9	Very low	33	Very low	115 Å²	115	140.3 Å²	140.3	78%	0.777	81%	0.805	S	S	*	*				156.4	163.2	120.7	76.3	0	0	0	0	117.4
207	Q	37.6	Very low	32.9	Very low	187 Å²	187	139.8 Å²	139.8	87%	0.874	80%	0.802	S	S	*	*			trans	-141.7	153.7	165.3	-63.4	179.2	-8.4	0	0	108.4
208	S	32.1	Very low	32.6	Very low	110 Å²	110	141.6 Å²	141.6	77%	0.769	80%	0.802	S	S	*	*			trans	-170	120.6	154.9	9.1	0	0	0	0	116.8
209	T	29.3	Very low	32.5	Very low	139 Å²	139	142.7 Å²	142.7	85%	0.853	80%	0.799	S	S	*	*				28.9	162.1	124	44.2	0	0	0	0	125.6
210	P	56.7	Low	32.3	Very low	119 Å²	119	145.1 Å²	145.1	77%	0.773	80%	0.802	S	S	*	*			trans	-117.7	177.3	-166.4	44.1	-33.6	0	0	0	116.7
211	R	33.5	Very low	32.1	Very low	259 Å²	259	145.8 Å²	145.8	98%	0.977	81%	0.805	S	S	*	*			trans	-157.2	167.6	163.4	-107.8	175.8	-170.4	-157.9	2.3	113.3
212	K	36.4	Very low	31.9	Very low	215 Å²	215	142 Å²	142	94%	0.935	80%	0.802	S	S	*	*			trans	-155.1	123.8	-179.3	-168.1	177.8	-172.8	178.2	0	112.5
213	G	29.1	Very low	31.9	Very low	75 Å²	75	145.5 Å²	145.5	77%	0.773	80%	0.8	S	S	*	*			trans	165.6	111.6	170.4	0	0	0	0	0	119.6
214	K	29	Very low	31.7	Very low	200 Å²	200	144.9 Å²	144.9	87%	0.87	79%	0.791	S	S	*	*			trans	56	104.4	146.5	-73.2	-172.8	176.2	-178.4	0	124.1
215	T	26.2	Very low	31.5	Very low	124 Å²	124	147.3 Å²	147.3	76%	0.761	79%	0.787	S	S	*	*				59.1	107.1	122.3	59.9	0	0	0	0	124.5
216	H	27.7	Very low	31.2	Very low	163 Å²	163	149.2 Å²	149.2	76%	0.755	79%	0.789	S	S	*	*				-169	136.8	116.4	-112.6	-139.5	0	0	0	109.1
217	K	29.2	Very low	30.8	Very low	167 Å²	167	147.5 Å²	147.5	73%	0.726	79%	0.79	S	S	*	*				52.3	134.9	91.2	-68.7	-170.2	175.1	-177.5	0	113.8
218	H	27.8	Very low	30.3	Very low	158 Å²	158	144.3 Å²	144.3	73%	0.731	79%	0.789	S	S	*	*			cis	-164.6	170.8	22.4	-151.9	-139.5	0	0	0	114.5
219	V	29	Very low	30.1	Very low	119 Å²	119	145.1 Å²	145.1	72%	0.721	80%	0.795	S	S	*	*			trans	70.6	157.4	162	-168.1	0	0	0	0	120
220	H	31.8	Very low	30.1	Very low	162 Å²	162	150.2 Å²	150.2	75%	0.75	80%	0.798	S	S	*	*				-172.7	177.8	-71.7	-122.8	58.6	0	0	0	114
221	N	30.4	Very low	28.9	Very low	158 Å²	158	149.7 Å²	149.7	85%	0.845	80%	0.797	S	S	*	*			trans	80.4	137.2	173.5	-59.9	-6.2	0	0	0	116.2
222	G	29.7	Very low	28.7	Very low	69 Å²	69	143.2 Å²	143.2	71%	0.711	79%	0.787	S	S	*	*			cis	-176.4	143.6	-8.9	0	0	0	0	0	108
223	H	28.8	Very low	28.8	Very low	179 Å²	179	142.9 Å²	142.9	83%	0.829	78%	0.78	S	S	*	*			cis	69.9	126.1	43.4	-146.6	45.4	0	0	0	112.2
224	V	25.2	Very low	29.1	Very low	100 Å²	100	145 Å²	145	61%	0.606	77%	0.769	S	S	*	*			cis	-113.1	-127.6	1.9	-151.2	0	0	0	0	110.4
225	F	26.5	Very low	29.3	Very low	165 Å²	165	142.6 Å²	142.6	72%	0.724	76%	0.759	S	S	*	*			cis	-158.2	148.2	-11.1	-130.4	-39	0	0	0	111.4
226	N	27.3	Very low	29.5	Very low	151 Å²	151	143.6 Å²	143.6	81%	0.807	76%	0.755	S	S	*	*			trans	47.9	146	146.2	-87.9	1.1	0	0	0	124.6
227	G	24.3	Very low	30.6	Very low	78 Å²	78	141 Å²	141	80%	0.804	75%	0.752	S	S	*	*			trans	144.4	104.3	140	0	0	0	0	0	117.8
228	S	27.1	Very low	30.6	Very low	121 Å²	121	138.7 Å²	138.7	85%	0.846	75%	0.752	S	S	*	*			trans	-77.2	146	169.7	-55	0	0	0	0	113
229	S	26.5	Very low	30.8	Very low	127 Å²	127	137.8 Å²	137.8	89%	0.888	75%	0.748	S	S	*	*			trans	175.5	174.4	137.2	-84.6	0	0	0	0	114.2
230	R	29.7	Very low	31	Very low	245 Å²	245	140.7 Å²	140.7	93%	0.925	75%	0.751	S	S	*	*			trans	-103.2	166.6	-176.8	-80.4	172.3	147.9	178.2	-7.4	113.3
231	S	32.1	Very low	31.4	Very low	109 Å²	109	141.8 Å²	141.8	76%	0.762	76%	0.756	S	S	*	*			trans	82.4	146.3	172.2	-148.3	0	0	0	0	114.3
232	T	29.7	Very low	31.6	Very low	122 Å²	122	143.9 Å²	143.9	75%	0.748	76%	0.758	S	S	*	*			cis	-147.7	179.1	18	-37.9	0	0	0	0	113
233	R	38.1	Very low	31.9	Very low	209 Å²	209	146.4 Å²	146.4	79%	0.789	77%	0.765	S	S	*	*			trans	-44.3	163.1	172.2	-71.2	167.6	162.4	-128.7	-1.6	116.2
234	E	34.9	Very low	32.2	Very low	118 Å²	118	146.3 Å²	146.3	55%	0.551	76%	0.762	S	S	*	*			cis	-154.2	-162.7	1	-122.8	170.3	81.3	0	0	108.4
235	K	34	Very low	32.4	Very low	151 Å²	151	149 Å²	149	66%	0.657	77%	0.768	S	S	*	*			cis	-145.3	-100.2	12.2	-153.2	178	170.5	62.7	0	117.8
236	E	29.6	Very low	32.5	Very low	145 Å²	145	146 Å²	146	68%	0.678	77%	0.773	S	S	*	*			trans	-156.8	175.2	-151.2	-94.2	-165.6	103.2	0	0	113.5
237	P	51.2	Low	32.6	Very low	107 Å²	107	145.4 Å²	145.4	70%	0.695	78%	0.775	S	S	*	*			cis	-132.2	165	-0.1	15.1	10.7	0	0	0	119
238	V	29.8	Very low	33.2	Very low	120 Å²	120	147.1 Å²	147.1	73%	0.727	77%	0.772	S	S	*	*			trans	101.1	-154.7	144.3	158.7	0	0	0	0	120.5
239	Q	31.2	Very low	33.1	Very low	138 Å²	138	145.9 Å²	145.9	65%	0.645	77%	0.769	S	S	*	*			trans	-160	165.1	-134.8	-59.3	-172	98.9	0	0	112.8
240	K	32.6	Very low	33.2	Very low	181 Å²	181	147.7 Å²	147.7	79%	0.787	76%	0.761	S	S	*	*			cis	-165.7	-169.5	-16.3	-104.1	169.6	-168.4	164.2	0	109.7
241	H	40.6	Very low	33	Very low	185 Å²	185	142 Å²	142	86%	0.856	75%	0.745	S	S	*	*			trans	-149.6	148.3	-170.7	-138.5	-129.7	0	0	0	110.9
242	K	35.4	Very low	32.8	Very low	202 Å²	202	144.4 Å²	144.4	88%	0.878	74%	0.742	S	S	*	*			trans	170.8	168.1	153	-102	175.5	-179	-173.9	0	113
243	S	34.4	Very low	32.7	Very low	122 Å²	122	145.5 Å²	145.5	85%	0.853	74%	0.738	S	S	*	*				-163.7	174.6	56.3	-67.5	0	0	0	0	115.6
244	K	36.6	Very low	32.1	Very low	176 Å²	176	141.2 Å²	141.2	77%	0.765	74%	0.74	S	S	*	*			trans	-153.8	139.7	178.3	-169.9	-170.7	-170.2	-108.2	0	111
245	E	29.2	Very low	31.8	Very low	158 Å²	158	141 Å²	141	74%	0.738	74%	0.742	S	S	*	*			trans	54.5	148.2	163.5	-92.2	173.3	111.8	0	0	123.2
246	A	29.1	Very low	31.5	Very low	101 Å²	101	141.2 Å²	141.2	84%	0.835	75%	0.746	S	S	*	*			trans	72.9	150.7	158	0	0	0	0	0	122
247	T	28.7	Very low	31.6	Very low	138 Å²	138	144.8 Å²	144.8	85%	0.847	75%	0.753	S	S	*	*			trans	-83	171.3	176.7	35.8	0	0	0	0	112.1
248	P	36.8	Very low	30.7	Very low	114 Å²	114	143.8 Å²	143.8	74%	0.74	75%	0.754	S	S	*	*			cis	-149.5	-171.8	30.5	44.8	-23.9	0	0	0	118.8
249	A	24.6	Very low	30.6	Very low	95 Å²	95	144.7 Å²	144.7	79%	0.785	75%	0.754	S	S	*	*			trans	66.2	174.9	151.4	0	0	0	0	0	119.4
250	K	28.1	Very low	30.4	Very low	166 Å²	166	142.9 Å²	142.9	72%	0.722	76%	0.757	S	S	*	*			cis	-174.2	119.7	-46.4	175.4	175	178.9	-77.1	0	110.2
251	E	25.9	Very low	30.5	Very low	126 Å²	126	145.1 Å²	145.1	59%	0.589	76%	0.761	S	S	*	*			trans	62.9	164.8	167.6	-67.5	-179.3	110.3	0	0	116.6
252	K	27.8	Very low	29.9	Very low	158 Å²	158	145.8 Å²	145.8	69%	0.687	76%	0.756	S	S	*	*			cis	-162.2	164.4	-17	-118.1	172.9	176.9	155.6	0	111.6
253	H	28.6	Very low	29.7	Very low	145 Å²	145	142.1 Å²	142.1	67%	0.671	74%	0.742	S	S	*	*			trans	53.1	124.6	154.9	-89.1	-88.4	0	0	0	122.8	D255	H253-D255 IonicContact CE1-OD2 3.42Å; H253-D255 IonicContact ND1-OD2 2.73Å; H253-D255 PolarHBondContact ND1-OD2 3.45Å
254	S	25	Very low	29.3	Very low	119 Å²	119	143.8 Å²	143.8	83%	0.832	74%	0.736	S	S	*	*				167.6	166.7	110.8	45.1	0	0	0	0	110.5
255	D	29.1	Very low	28.8	Very low	113 Å²	113	139.4 Å²	139.4	60%	0.604	73%	0.732	S	S	*	*				-167.8	-178.4	-56.7	-120.5	-76.6	0	0	0	107.2	H253	H253-D255 IonicContact CE1-OD2 3.42Å; H253-D255 IonicContact ND1-OD2 2.73Å; H253-D255 PolarHBondContact ND1-OD2 3.45Å
256	H	28.3	Very low	28.8	Very low	156 Å²	156	137.4 Å²	137.4	72%	0.722	74%	0.736	S	S	*	*			trans	71.6	152.5	171	-61.3	-31.4	0	0	0	119.1
257	R	31.4	Very low	28.6	Very low	221 Å²	221	136.7 Å²	136.7	83%	0.834	73%	0.73	S	S	*	*			cis	-170.4	147.9	-31.2	-121.7	180	-177.8	178.6	1	110.9
258	A	31.8	Very low	28.4	Very low	86 Å²	86	137.9 Å²	137.9	71%	0.711	73%	0.731	S	S	*	*			trans	62.7	170.6	148.9	0	0	0	0	0	118.6
259	D	28	Very low	27.9	Very low	138 Å²	138	141.2 Å²	141.2	74%	0.738	74%	0.736	S	S	*	*			cis	-155.1	160.6	-1	-146.8	-54.1	0	0	0	112.6
260	S	27.3	Very low	28.9	Very low	101 Å²	101	142.1 Å²	142.1	71%	0.706	73%	0.734	S	S	*	*			trans	59.8	163.3	149.8	-76.8	0	0	0	0	122.8
261	R	33.7	Very low	28.8	Very low	228 Å²	228	139 Å²	139	86%	0.86	74%	0.739	S	S	*	*			cis	-172.7	156.7	-36.5	-163	178.6	-176.7	-162.3	1.2	109.9
262	R	29	Very low	28.8	Very low	199 Å²	199	137.8 Å²	137.8	75%	0.751	75%	0.751	S	S	*	*			trans	101.3	113.3	139.6	-156.9	174.4	-173.2	-171.4	-5.8	122.4
263	E	29.6	Very low	28.9	Very low	125 Å²	125	134.5 Å²	134.5	58%	0.584	75%	0.753	S	S	*	*			trans	58.9	161.8	146.6	-63.3	-173.3	85.3	0	0	120.3
264	Q	26.2	Very low	29.7	Very low	157 Å²	157	133.4 Å²	133.4	73%	0.734	76%	0.759	S	S	*	*			cis	-156	167.7	6	-137.3	167.2	46	0	0	113.2
265	A	27.6	Very low	30	Very low	83 Å²	83	132.6 Å²	132.6	69%	0.686	75%	0.753	S	S	*	*			trans	11.3	159.4	149.7	0	0	0	0	0	124
266	S	27.3	Very low	30	Very low	117 Å²	117	134.5 Å²	134.5	82%	0.818	77%	0.769	S	S	*	*			cis	-173.8	156.1	-14.5	-92.3	0	0	0	0	113.1
267	A	26.2	Very low	30.1	Very low	85 Å²	85	130.5 Å²	130.5	70%	0.702	77%	0.77	S	S	*	*			trans	46.8	126	148.9	0	0	0	0	0	124.3
268	N	25	Very low	30	Very low	164 Å²	164	125.4 Å²	125.4	88%	0.877	77%	0.769	S	S	*	*				176.1	158.2	107	-92.5	-36	0	0	0	116
269	H	25.6	Very low	30.1	Very low	184 Å²	184	126.7 Å²	126.7	85%	0.852	77%	0.772	S	S	*	*			trans	-97.8	-172.1	169	-75.5	-69.4	0	0	0	110.1
270	P	46.1	Very low	30.4	Very low	113 Å²	113	124.2 Å²	124.2	73%	0.734	77%	0.771	S	S	*	*			cis	-142.6	-178.8	5	45.5	-27.2	0	0	0	118.3
271	A	24.8	Very low	30.5	Very low	101 Å²	101	129 Å²	129	84%	0.835	78%	0.779	S	S	*	*			trans	65.3	160.9	148	0	0	0	0	0	119.8
272	A	27.1	Very low	30.1	Very low	100 Å²	100	121.3 Å²	121.3	83%	0.826	77%	0.771	S	S	*	*			cis	-143	163.7	5.1	0	0	0	0	0	113.2
273	A	30.1	Very low	30.6	Very low	89 Å²	89	117.8 Å²	117.8	74%	0.736	77%	0.774	S	S	*	*			trans	-106.1	177.6	163.2	0	0	0	0	0	109.4
274	P	43.8	Very low	30.5	Very low	123 Å²	123	116.5 Å²	116.5	80%	0.799	78%	0.784	S	S	*	*				-139.9	-168.1	59	25.6	-0.8	0	0	0	114.3
275	S	31.7	Very low	30.6	Very low	101 Å²	101	113.1 Å²	113.1	71%	0.706	78%	0.784	S	S	*	*				-178.6	122.7	-61.7	59.7	0	0	0	0	111.5
276	T	30	Very low	30.6	Very low	153 Å²	153	115.4 Å²	115.4	94%	0.939	78%	0.784	S	S	*	*			trans	-161	165	168.1	23.6	0	0	0	0	108.3
277	G	29.1	Very low	30.6	Very low	72 Å²	72	117.1 Å²	117.1	74%	0.742	78%	0.779	S	S	*	*			cis	142.3	122.2	-1.6	0	0	0	0	0	110.4
278	S	30.6	Very low	30.6	Very low	115 Å²	115	121.2 Å²	121.2	80%	0.804	78%	0.783	S	S	*	*			cis	-141.5	153.3	2.4	-167.5	0	0	0	0	112.3
279	S	33.4	Very low	30.7	Very low	112 Å²	112	121.9 Å²	121.9	78%	0.783	78%	0.781	S	S	*	*			trans	-3.6	154.1	155.4	-68.5	0	0	0	0	121.1
280	A	33.2	Very low	31.3	Very low	86 Å²	86	118.8 Å²	118.8	71%	0.711	78%	0.777	S	S	*	*			cis	-172	-170.2	-7.6	0	0	0	0	0	107.4
281	K	29.7	Very low	31.3	Very low	201 Å²	201	118.1 Å²	118.1	87%	0.874	77%	0.773	S	S	*	*			cis	-150.3	172.8	16.7	-57.5	174.9	-179.9	179.5	0	110.9
282	G	25	Very low	31.3	Very low	67 Å²	67	120.3 Å²	120.3	69%	0.691	77%	0.77	S	S	*	*			trans	-105	-151.5	156.4	0	0	0	0	0	111.8
283	P	41.5	Very low	31.3	Very low	125 Å²	125	122.5 Å²	122.5	81%	0.812	76%	0.762	S	S	*	*			cis	-142.4	-174.7	17.4	44	-25.8	0	0	0	117.2
284	A	26.7	Very low	31.2	Very low	98 Å²	98	128.3 Å²	128.3	81%	0.81	77%	0.765	S	S	*	*			trans	74.2	143.5	148.9	0	0	0	0	0	120.4
285	A	28.3	Very low	30.3	Very low	87 Å²	87	127.2 Å²	127.2	72%	0.719	76%	0.761	S	S	*	*			cis	-166.7	174.8	-15.5	0	0	0	0	0	112.9
286	N	26.5	Very low	30.2	Very low	131 Å²	131	127 Å²	127	70%	0.701	77%	0.765	S	S	*	*			trans	79.7	95.3	153.3	-68	3	0	0	0	122.8
287	H	28.3	Very low	30.1	Very low	152 Å²	152	128.8 Å²	128.8	70%	0.704	76%	0.762	S	S	*	*				83.7	150.3	113.4	-70.6	-51.6	0	0	0	124.3
288	H	27	Very low	30.2	Very low	171 Å²	171	132.2 Å²	132.2	79%	0.792	76%	0.764	S	S	*	*			trans	74.4	92.9	155.6	-61	-49.1	0	0	0	122.3
289	H	26.7	Very low	30.1	Very low	178 Å²	178	134.1 Å²	134.1	82%	0.824	76%	0.764	S	S	*	*				-65.3	162.8	122.4	-70.6	-54.2	0	0	0	109.8
290	P	38.4	Very low	29.9	Very low	119 Å²	119	138.3 Å²	138.3	77%	0.773	76%	0.763	S	S	*	*			cis	-140.1	-125.7	37.2	32.6	-3.6	0	0	0	116.2
291	P	44.7	Very low	29.6	Very low	100 Å²	100	142.8 Å²	142.8	65%	0.649	77%	0.766	S	S	*	*				-143.2	-168.8	-107	48.5	-30.1	0	0	0	118.5
292	L	25.8	Very low	29.4	Very low	147 Å²	147	141.8 Å²	141.8	77%	0.77	77%	0.765	S	S	*	*			trans	82	138.6	150.1	-69.3	170.5	0	0	0	123
293	H	27.3	Very low	29.4	Very low	145 Å²	145	144.9 Å²	144.9	67%	0.671	77%	0.77	S	S	*	*			trans	75.1	104.1	139.3	-89.5	-147.5	0	0	0	125
294	R	27.1	Very low	28.7	Very low	211 Å²	211	144.1 Å²	144.1	80%	0.796	77%	0.768	S	S	*	*				65.5	143	98.3	-149.6	175.8	-163.6	176.3	3.2	121.6
295	S	26.1	Very low	28.8	Very low	101 Å²	101	148.8 Å²	148.8	71%	0.706	77%	0.77	S	S	*	*			trans	73.9	96.8	156.3	39	0	0	0	0	122.1
296	A	28.8	Very low	28.6	Very low	96 Å²	96	150.5 Å²	150.5	79%	0.793	77%	0.771	S	S	*	*				51	147.5	103.7	0	0	0	0	0	123.9
297	Q	27.4	Very low	28.5	Very low	190 Å²	190	151.5 Å²	151.5	89%	0.888	78%	0.776	S	S	*	*			trans	94.6	122.9	159	-75.5	-171.2	-27	0	0	121.5
298	D	32	Very low	28.3	Very low	145 Å²	145	147.5 Å²	147.5	78%	0.775	78%	0.776	S	S	*	*			trans	-51.8	154	177.8	-54.8	-102	0	0	0	117.7
299	L	29.3	Very low	28.3	Very low	155 Å²	155	145.7 Å²	145.7	81%	0.812	78%	0.777	S	S	*	*				-179.8	154.2	102.4	-100.5	169.8	0	0	0	116.1
300	R	27.5	Very low	28.2	Very low	200 Å²	200	142.6 Å²	142.6	76%	0.755	77%	0.771	S	S	*	*			trans	83	109	151.2	-74.4	166.5	178.4	-170.8	1.2	122.5
301	K	27.3	Very low	27.5	Very low	179 Å²	179	147.1 Å²	147.1	78%	0.778	77%	0.772	S	S	*	*				103.7	149.8	116	-78.9	-178.8	174.5	-171.7	0	121.1
302	Q	26.7	Very low	26.5	Very low	180 Å²	180	149.2 Å²	149.2	84%	0.841	78%	0.775	S	S	*	*			trans	70	114.6	175.4	-47	-159.6	34.7	0	0	114.8
303	V	24	Very low	26.4	Very low	133 Å²	133	146.9 Å²	146.9	81%	0.806	77%	0.771	S	S	*	*			cis	93	99.8	16.6	-170.3	0	0	0	0	116.6
304	S	27.2	Very low	26.3	Very low	109 Å²	109	144.6 Å²	144.6	76%	0.762	77%	0.772	S	S	*	*			trans	-161.9	122.2	147.5	-78.5	0	0	0	0	107
305	K	27.3	Very low	26.2	Very low	195 Å²	195	142.8 Å²	142.8	85%	0.848	78%	0.777	S	S	*	*				60.8	128.1	78	-74	-173.9	176.9	-179.6	0	113.4
306	V	25.5	Very low	26.1	Very low	124 Å²	124	141.2 Å²	141.2	75%	0.752	78%	0.777	S	S	*	*			cis	-160.6	169.7	-9.8	92	0	0	0	0	112.1
307	N	24.1	Very low	26	Very low	151 Å²	151	142.2 Å²	142.2	81%	0.807	79%	0.785	S	S	*	*			trans	-36.8	159.3	176.4	-41.3	-25.5	0	0	0	119.1
308	G	24.9	Very low	25.8	Very low	68 Å²	68	136.7 Å²	136.7	70%	0.701	78%	0.779	S	S	*	*			trans	154.1	88.3	135.1	0	0	0	0	0	123
309	V	25.4	Very low	25.6	Very low	134 Å²	134	134 Å²	134	81%	0.812	78%	0.776	S	S	*	*				55.2	101.7	116.7	175.8	0	0	0	0	121.5
310	T	24.5	Very low	25.4	Very low	112 Å²	112	133 Å²	133	69%	0.687	78%	0.777	S	S	*	*				78.3	115.4	114.9	-53.3	0	0	0	0	124.4
311	R	24.6	Very low	25.4	Very low	214 Å²	214	128.8 Å²	128.8	81%	0.808	78%	0.778	S	S	*	*			trans	73.1	123.2	141.6	-76.9	178.9	173.4	-176.4	-1.2	125
312	M	22.7	Very low	25.5	Very low	145 Å²	145	124.6 Å²	124.6	71%	0.714	78%	0.777	S	S	*	*				74.9	124.3	121.2	-67.5	176.3	62.9	0	0	124.2
313	S	23.9	Very low	25.5	Very low	98 Å²	98	126 Å²	126	69%	0.685	78%	0.78	S	S	*	*				62.1	148.6	129.3	71.5	0	0	0	0	121.5
314	S	26.1	Very low	25.7	Very low	97 Å²	97	127.5 Å²	127.5	68%	0.678	78%	0.776	S	S	*	*			cis	-176.2	-172.4	-12.1	52.3	0	0	0	0	109.7
315	L	24.8	Very low	25.6	Very low	173 Å²	173	131.4 Å²	131.4	91%	0.906	78%	0.784	S	S	*	*			trans	82.3	142.7	170.7	-50.4	168.1	0	0	0	116.8
316	G	24.9	Very low	25.7	Very low	68 Å²	68	132.7 Å²	132.7	70%	0.701	78%	0.784	S	S	*	*			cis	160.7	138.5	-15.8	0	0	0	0	0	116.6
317	A	25	Very low	25.6	Very low	116 Å²	116	135.3 Å²	135.3	96%	0.959	79%	0.788	S	S	*	*			trans	61.4	155.9	167.5	0	0	0	0	0	117.7
318	G	24.7	Very low	25.7	Very low	74 Å²	74	133.3 Å²	133.3	76%	0.763	78%	0.781	S	S	*	*			cis	170.3	-177.7	-1.1	0	0	0	0	0	108.9
319	A	26.3	Very low	25.7	Very low	88 Å²	88	139.5 Å²	139.5	73%	0.727	78%	0.783	S	S	*	*			cis	-172.4	-176.3	-16.1	0	0	0	0	0	109
320	T	25.6	Very low	25.8	Very low	134 Å²	134	139.3 Å²	139.3	82%	0.822	79%	0.785	S	S	*	*			trans	77.8	148.7	167.8	78.2	0	0	0	0	118
321	S	27.7	Very low	25.7	Very low	112 Å²	112	138.9 Å²	138.9	78%	0.783	79%	0.786	S	S	*	*			cis	-170.3	165	-22	-96.1	0	0	0	0	110.4
322	A	29.6	Very low	26	Very low	91 Å²	91	134.5 Å²	134.5	75%	0.752	79%	0.786	S	S	*	*			cis	167.2	95.3	-47.1	0	0	0	0	0	110.2
323	K	26.8	Very low	26.2	Very low	209 Å²	209	133 Å²	133	91%	0.909	79%	0.789	S	S	*	*			trans	-150.1	144.8	172.4	-85.2	178.9	176.8	168.1	0	113.3
324	K	28.6	Very low	26.2	Very low	165 Å²	165	138.1 Å²	138.1	72%	0.717	80%	0.799	S	S	*	*			cis	-174.6	114.4	-20.9	176.9	-179	177	-174.2	0	111.4
325	M	25	Very low	26.3	Very low	191 Å²	191	138.9 Å²	138.9	94%	0.941	80%	0.8	S	S	*	*			trans	-179.1	92.4	146.8	-104.5	178.7	74.6	0	0	107.3
326	R	28.5	Very low	26.3	Very low	222 Å²	222	136.1 Å²	136.1	84%	0.838	79%	0.79	S	S	*	*				91.5	68.8	57.6	-160.2	-171.6	-157.9	-171.3	5.8	113.8
327	E	24.6	Very low	26.3	Very low	180 Å²	180	141.2 Å²	141.2	84%	0.841	79%	0.793	S	S	*	*			trans	-62.9	159.3	152.6	-177.7	-172.1	-131.7	0	0	111.8
328	V	25	Very low	26.4	Very low	109 Å²	109	146.2 Å²	146.2	66%	0.661	79%	0.789	S	S	*	*			trans	-172.3	128.5	145.8	131.1	0	0	0	0	113.8
329	R	24.6	Very low	26.6	Very low	197 Å²	197	148 Å²	148	74%	0.743	79%	0.785	S	S	*	*			trans	51.5	124.6	154.1	-67.3	-175.2	179.5	93.3	2.1	122.2
330	P	27.7	Very low	26.7	Very low	130 Å²	130	148.8 Å²	148.8	84%	0.844	79%	0.791	S	S	*	*			trans	-65.7	159.8	143	-14	30.1	0	0	0	112.2
331	S	24.1	Very low	26.8	Very low	103 Å²	103	148.3 Å²	148.3	72%	0.72	79%	0.788	S	S	*	*			trans	-151.7	160.6	174.9	-79.5	0	0	0	0	110.4
332	P	29.6	Very low	26.9	Very low	123 Å²	123	149.6 Å²	149.6	80%	0.799	79%	0.791	S	S	*	*			trans	-83.4	164	-134.7	29.7	-37.3	0	0	0	117.1
333	S	27.1	Very low	26.8	Very low	112 Å²	112	151.5 Å²	151.5	78%	0.783	79%	0.794	S	S	*	*			trans	-50.7	135.1	-179.7	-44.2	0	0	0	0	114.5	T335	S333-T335 PolarHBondContact O-N 3.42Å
334	K	24.7	Very low	27	Very low	206 Å²	206	151.8 Å²	151.8	90%	0.896	80%	0.795	S	S	*	*			trans	-95.8	81.8	167.4	-72.7	-174.6	177.3	179.1	0	111.1	V336	K334-V336 PolarHBondContact O-N 3.18Å
335	T	28.3	Very low	26.9	Very low	114 Å²	114	147.6 Å²	147.6	70%	0.699	80%	0.799	S	S	*	*			trans	-73.3	115.5	166.4	-54.6	0	0	0	0	109.6	S333 K337	S333-T335 PolarHBondContact O-N 3.42Å; T335-K337 HydrophobicContact CG2-CG 4.45Å; T335-K337 PolarHBondContact O-N 3Å
336	V	24.8	Very low	27	Very low	115 Å²	115	143 Å²	143	70%	0.697	79%	0.792	S	S	*	*			trans	-77.1	103.9	172.5	179.7	0	0	0	0	108.9	K334 Y338	K334-V336 PolarHBondContact O-N 3.18Å; V336-Y338 HydrophobicContact CG1-CD2 3.96Å; V336-Y338 HydrophobicContact CG1-CE2 3.69Å
337	K	24.5	Very low	26.9	Very low	174 Å²	174	138.6 Å²	138.6	76%	0.757	79%	0.789	S	S	*	*			trans	-88.8	122.9	169.2	-68.1	-177.3	177.8	-178.9	0	109.5	T335	T335-K337 HydrophobicContact CG2-CG 4.45Å; T335-K337 PolarHBondContact O-N 3Å
338	Y	26.3	Very low	27	Very low	222 Å²	222	136.1 Å²	136.1	87%	0.871	79%	0.786	S	S	*	*			trans	-94.2	107.8	160.9	-85.1	-82.5	0	0	0	109.7	V336	V336-Y338 HydrophobicContact CG1-CD2 3.96Å; V336-Y338 HydrophobicContact CG1-CE2 3.69Å
339	T	28.5	Very low	27	Very low	111 Å²	111	141.7 Å²	141.7	68%	0.681	80%	0.797	S	S	*	*			trans	-100.7	113.1	172.2	48.7	0	0	0	0	109.6	T341	T339-T341 PolarHBondContact O-N 2.97Å
340	A	28.4	Very low	27.3	Very low	105 Å²	105	139 Å²	139	87%	0.868	80%	0.802	S	S	*	*			trans	-73.5	111.5	173.9	0	0	0	0	0	110.5
341	T	28.6	Very low	27.3	Very low	123 Å²	123	142.7 Å²	142.7	76%	0.755	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.3	118.7	176.3	48	0	0	0	0	111.1	T339	T339-T341 PolarHBondContact O-N 2.97Å
342	V	29.1	Very low	27.5	Very low	140 Å²	140	142.6 Å²	142.6	85%	0.848	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-79.9	118.3	175	177.7	0	0	0	0	110.1
343	T	28.4	Very low	27.3	Very low	130 Å²	130	145.8 Å²	145.8	80%	0.798	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-88.4	123.2	171.2	42.2	0	0	0	0	110.9
344	K	30.4	Very low	27.2	Very low	215 Å²	215	150.4 Å²	150.4	94%	0.935	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77.8	131.5	165	-78.9	-175.8	174.7	-178.8	0	109.5
345	G	27	Very low	27.2	Very low	78 Å²	78	146.6 Å²	146.6	80%	0.804	80%	0.798	S	S	*	*			trans	-138.4	148	164.1	0	0	0	0	0	109.1
346	A	26.8	Very low	27.2	Very low	95 Å²	95	148 Å²	148	79%	0.785	80%	0.8	S	S	*	*			trans	-148.5	-177.5	-177.4	0	0	0	0	0	110.3
347	V	25.9	Very low	27.3	Very low	128 Å²	128	147.9 Å²	147.9	78%	0.776	80%	0.799	S	S	*	*			trans	97.2	104	165	-175.2	0	0	0	0	117
348	T	27.3	Very low	27.3	Very low	129 Å²	129	147.7 Å²	147.7	79%	0.791	80%	0.799	S	S	*	*			trans	65.8	138	148.8	56.1	0	0	0	0	124.2
349	Y	25.9	Very low	27.3	Very low	226 Å²	226	143.1 Å²	143.1	89%	0.886	79%	0.789	S	S	*	*			trans	-80.6	147.4	153.1	-99.7	-105.4	0	0	0	111.3
350	T	30.1	Very low	27.2	Very low	140 Å²	140	144.3 Å²	144.3	86%	0.859	80%	0.797	S	S	*	*			trans	-136.1	161.1	153.5	45.3	0	0	0	0	110.4
351	K	27.6	Very low	27.1	Very low	208 Å²	208	147.7 Å²	147.7	90%	0.904	79%	0.792	S	S	*	*			trans	-135.2	111.8	-159.5	174.5	-169.1	175.8	-173.9	0	112.3
352	A	28.7	Very low	27.5	Very low	101 Å²	101	146.8 Å²	146.8	84%	0.835	79%	0.788	S	S	*	*			trans	-165.6	167.4	167.4	0	0	0	0	0	110.2
353	K	24.4	Very low	27.3	Very low	190 Å²	190	146.8 Å²	146.8	83%	0.826	78%	0.783	S	S	*	*			cis	-169.5	115.4	-42.6	175.7	-176.5	174.9	-170.1	0	106.1
354	R	26.1	Very low	27.3	Very low	208 Å²	208	147.3 Å²	147.3	79%	0.785	78%	0.776	S	S	*	*			trans	26.4	131.5	152	-96.8	176.4	164.6	-143.9	12.7	121
355	E	23.9	Very low	27.1	Very low	126 Å²	126	145 Å²	145	59%	0.589	77%	0.768	S	S	*	*				113.6	143.3	125	-85.3	173	-135.8	0	0	122.8
356	L	27.6	Very low	27.2	Very low	143 Å²	143	150.1 Å²	150.1	75%	0.749	77%	0.769	S	S	*	*			trans	65.9	139.2	151.4	-89.2	39.6	0	0	0	120.2
357	V	27	Very low	27.4	Very low	113 Å²	113	151.9 Å²	151.9	69%	0.685	77%	0.772	S	S	*	*			cis	-171.1	164.6	-13.1	88.2	0	0	0	0	113.4
358	K	25.1	Very low	27.4	Very low	171 Å²	171	151.4 Å²	151.4	74%	0.743	77%	0.774	S	S	*	*			trans	64.3	113.5	158.5	-74.4	172.6	-176.9	180	0	122.5
359	D	27.2	Very low	27.2	Very low	125 Å²	125	151 Å²	151	67%	0.668	78%	0.777	S	S	*	*				47.1	141	104.4	-59.7	-63.5	0	0	0	120
360	T	26.1	Very low	27.2	Very low	137 Å²	137	144.7 Å²	144.7	84%	0.84	77%	0.771	S	S	*	*				-153.5	156.3	55	-53	0	0	0	0	115.8
361	K	25.6	Very low	27	Very low	176 Å²	176	143.9 Å²	143.9	77%	0.765	77%	0.766	S	S	*	*			trans	-63.3	-177.5	174.6	-73.1	179	179.4	172.7	0	113.9
362	P	38.2	Very low	26.8	Very low	103 Å²	103	140.1 Å²	140.1	67%	0.669	76%	0.756	S	S	*	*			cis	-150.6	-175.4	20.4	48.3	-28.1	0	0	0	120.6
363	N	23	Very low	26.8	Very low	140 Å²	140	142.9 Å²	142.9	75%	0.749	75%	0.751	S	S	*	*			trans	73.4	146.4	152.2	-69.1	5.2	0	0	0	120.9
364	H	29.3	Very low	27	Very low	141 Å²	141	139.4 Å²	139.4	65%	0.653	75%	0.746	S	S	*	*			cis	-163	169.1	-27.5	-141.3	-90	0	0	0	111.4
365	H	26.7	Very low	27.1	Very low	167 Å²	167	137 Å²	137	77%	0.773	75%	0.747	S	S	*	*			trans	69.4	135.9	162.2	-71.6	-66.4	0	0	0	123
366	K	27.7	Very low	27.2	Very low	186 Å²	186	136.5 Å²	136.5	81%	0.809	76%	0.757	S	S	*	*			trans	-92	172	150.3	-59.1	176.3	-179.8	175.1	0	108.9
367	P	31.4	Very low	27.2	Very low	132 Å²	132	133 Å²	133	86%	0.857	76%	0.756	S	S	*	*				-131.9	-179.5	104	38.8	-32.8	0	0	0	114.1
368	S	25.6	Very low	27.2	Very low	118 Å²	118	136.8 Å²	136.8	83%	0.825	76%	0.763	S	S	*	*			trans	-129.5	135.2	176.7	167.5	0	0	0	0	109.3
369	S	24.9	Very low	27.6	Very low	121 Å²	121	134 Å²	134	85%	0.846	76%	0.761	S	S	*	*			trans	-162.4	171.2	160.8	52.7	0	0	0	0	109.8
370	A	24.9	Very low	27.5	Very low	92 Å²	92	136.4 Å²	136.4	76%	0.76	77%	0.768	S	S	*	*			trans	-134.8	-143.8	-169.9	0	0	0	0	0	110.7
371	V	25.1	Very low	27.7	Very low	123 Å²	123	134.7 Å²	134.7	75%	0.745	76%	0.762	S	S	*	*			trans	90.4	93.5	158.4	-172.6	0	0	0	0	117.5
372	N	24.8	Very low	28	Very low	130 Å²	130	130.7 Å²	130.7	70%	0.695	76%	0.756	S	S	*	*				76.9	138.9	126.1	-65.7	1.6	0	0	0	125.4
373	H	27.8	Very low	27.5	Very low	158 Å²	158	133.4 Å²	133.4	73%	0.731	77%	0.765	S	S	*	*			trans	65.2	108.6	133.2	-74.5	-53.4	0	0	0	124.5
374	T	28.7	Very low	28.2	Very low	118 Å²	118	131.2 Å²	131.2	72%	0.724	77%	0.766	S	S	*	*				60.5	168.1	120.6	-5.9	0	0	0	0	121.9
375	I	28.4	Very low	28.4	Very low	157 Å²	157	134.2 Å²	134.2	81%	0.805	78%	0.777	S	S	*	*			trans	77.4	138.6	177.5	-51	172.7	0	0	0	113
376	S	25.8	Very low	28.6	Very low	115 Å²	115	132.5 Å²	132.5	80%	0.804	78%	0.778	S	S	*	*			cis	135	114.4	-20.4	-174.4	0	0	0	0	111.6
377	G	28.1	Very low	28.7	Very low	71 Å²	71	135.3 Å²	135.3	73%	0.732	78%	0.784	S	S	*	*			trans	86	162.8	177.8	0	0	0	0	0	115
378	K	27.9	Very low	28.7	Very low	191 Å²	191	138 Å²	138	83%	0.83	78%	0.782	S	S	*	*			cis	-169.7	138.5	-7.1	-135.1	-176.4	-176.1	-175.9	0	110.2
379	T	31.5	Very low	28.9	Very low	114 Å²	114	141.1 Å²	141.1	70%	0.699	78%	0.784	S	S	*	*			trans	59.9	163.2	157.1	41.2	0	0	0	0	117
380	E	27.1	Very low	29	Very low	175 Å²	175	141.3 Å²	141.3	82%	0.818	78%	0.779	S	S	*	*			cis	-147.1	-174.5	1.6	-142.3	146.8	-138.6	0	0	113.2
381	S	30.2	Very low	29.1	Very low	101 Å²	101	144.5 Å²	144.5	71%	0.706	78%	0.783	S	S	*	*			trans	-51.6	162.4	-177.5	71	0	0	0	0	116.8
382	S	31	Very low	29.1	Very low	92 Å²	92	143.7 Å²	143.7	64%	0.643	78%	0.783	S	S	*	*				-178.9	165.2	71.6	53.4	0	0	0	0	116.9
383	N	27.3	Very low	29.3	Very low	160 Å²	160	146 Å²	146	86%	0.856	79%	0.794	S	S	*	*			trans	73.8	123.5	152.7	-65.4	-33.2	0	0	0	122.1
384	A	37.6	Very low	29.1	Very low	93 Å²	93	142.4 Å²	142.4	77%	0.769	80%	0.799	S	S	*	*			trans	-136.6	129.8	159	0	0	0	0	0	110.1
385	K	33.8	Very low	29	Very low	204 Å²	204	140.5 Å²	140.5	89%	0.887	80%	0.804	S	S	*	*			trans	171.2	149.9	170.6	-97.8	154.5	-174	177.6	0	105.7
386	T	31.5	Very low	28.9	Very low	131 Å²	131	137.6 Å²	137.6	80%	0.804	80%	0.803	S	S	*	*			cis	-159.2	161.8	24.5	-26.4	0	0	0	0	113
387	R	28.9	Very low	29.1	Very low	245 Å²	245	137.3 Å²	137.3	93%	0.925	80%	0.801	S	S	*	*			trans	88.6	165	145	-127.7	172.7	-175.1	171.6	0.9	120.3
388	K	31.9	Very low	29.2	Very low	188 Å²	188	143.9 Å²	143.9	82%	0.817	81%	0.809	S	S	*	*			trans	-104.7	174.4	-162.1	-58.2	177.8	176.4	-179.5	0	112.7
389	Q	29.7	Very low	29.2	Very low	184 Å²	184	140 Å²	140	86%	0.86	81%	0.807	S	S	*	*			trans	111.4	119.1	164.6	-65.8	170.9	-60.5	0	0	111.5
390	V	27.5	Very low	29	Very low	125 Å²	125	141.6 Å²	141.6	76%	0.758	82%	0.816	S	S	*	*			cis	76.1	83	40.9	-170.8	0	0	0	0	113
391	L	26.9	Very low	29	Very low	160 Å²	160	136.5 Å²	136.5	84%	0.838	81%	0.811	S	S	*	*			trans	68	146.6	145.3	-60.2	175.4	0	0	0	121.7
392	S	25	Very low	29.6	Very low	105 Å²	105	137.8 Å²	137.8	73%	0.734	82%	0.816	S	S	*	*			trans	91.6	88	152.6	-59	0	0	0	0	120.9
393	L	28	Very low	29.5	Very low	180 Å²	180	137.7 Å²	137.7	94%	0.942	82%	0.821	S	S	*	*				53.3	119.4	114.6	-83.4	156.4	0	0	0	121.6
394	G	24	Very low	29.6	Very low	81 Å²	81	136.8 Å²	136.8	84%	0.835	82%	0.821	S	S	*	*			trans	173.5	129.9	150.2	0	0	0	0	0	111.5
395	G	26	Very low	29.3	Very low	79 Å²	79	140.2 Å²	140.2	81%	0.814	83%	0.827	S	S	*	*			cis	162.5	130.7	-12.5	0	0	0	0	0	112.3
396	A	27.7	Very low	29	Very low	95 Å²	95	134.3 Å²	134.3	79%	0.785	82%	0.824	S	S	*	*			trans	-160.3	116.5	168.1	0	0	0	0	0	112.4
397	S	29.5	Very low	28.7	Very low	110 Å²	110	135.7 Å²	135.7	77%	0.769	83%	0.825	S	S	*	*			trans	33.3	139.7	152.7	58.9	0	0	0	0	122.1
398	K	29.2	Very low	28.6	Very low	209 Å²	209	132.2 Å²	132.2	91%	0.909	82%	0.817	S	S	*	*			cis	-160.9	156.1	-3.9	-112.9	172.8	-176.2	178.9	0	107.6
399	S	27.9	Very low	28.4	Very low	110 Å²	110	129.5 Å²	129.5	77%	0.769	82%	0.816	S	S	*	*			trans	-106.7	134.8	-168.7	53.4	0	0	0	0	114.8
400	T	28.9	Very low	28.3	Very low	147 Å²	147	125.5 Å²	125.5	90%	0.902	81%	0.808	S	S	*	*			trans	-168.8	141.7	139.2	22.6	0	0	0	0	110.2
401	G	26.2	Very low	28.3	Very low	68 Å²	68	122.5 Å²	122.5	70%	0.701	80%	0.802	S	S	*	*			trans	-94	-159.6	162	0	0	0	0	0	111.4
402	P	42.7	Very low	28.4	Very low	127 Å²	127	125.4 Å²	125.4	83%	0.825	80%	0.802	S	S	*	*			cis	-137.4	170	4.5	42.7	-26.4	0	0	0	116.5
403	A	28.9	Very low	28.6	Very low	91 Å²	91	129.1 Å²	129.1	75%	0.752	81%	0.813	S	S	*	*			trans	56.2	163.8	142.3	0	0	0	0	0	124.2
404	V	30.4	Very low	28.8	Very low	140 Å²	140	125.9 Å²	125.9	85%	0.848	80%	0.796	S	S	*	*			trans	84.9	148.5	162.2	-165.7	0	0	0	0	118.5
405	N	30.1	Very low	29.7	Very low	166 Å²	166	127.6 Å²	127.6	89%	0.888	79%	0.793	S	S	*	*			trans	-68.9	149.1	-176.3	-56.5	-56.6	0	0	0	114.1
406	G	27.4	Very low	30.1	Very low	80 Å²	80	131.5 Å²	131.5	83%	0.825	79%	0.787	S	S	*	*			trans	-166.3	129.5	171.5	0	0	0	0	0	117.7
407	L	25.3	Very low	30.3	Very low	159 Å²	159	131.2 Å²	131.2	83%	0.832	78%	0.779	S	S	*	*			trans	-68.7	164.7	160	-105.6	66.1	0	0	0	110.8
408	K	26.4	Very low	30	Very low	173 Å²	173	132.4 Å²	132.4	75%	0.752	79%	0.787	S	S	*	*			cis	-177.9	177.6	-8.2	-145.2	179.4	-172.4	174	0	108.2
409	V	28.2	Very low	29.9	Very low	130 Å²	130	127.9 Å²	127.9	79%	0.788	78%	0.777	S	S	*	*			trans	71.4	146	151.2	158.9	0	0	0	0	115.9
410	S	27.8	Very low	30	Very low	100 Å²	100	131.3 Å²	131.3	70%	0.699	78%	0.778	S	S	*	*			cis	-149.7	179.6	-1.6	-128.2	0	0	0	0	109.4
411	G	26.8	Very low	30	Very low	62 Å²	62	131.8 Å²	131.8	64%	0.639	77%	0.769	S	S	*	*			cis	-163.1	159.1	5.2	0	0	0	0	0	111.6
412	R	30.2	Very low	30.2	Very low	222 Å²	222	134.2 Å²	134.2	84%	0.838	77%	0.771	S	S	*	*				91.6	103.1	89.9	-87.3	-165.4	-178.4	-103.7	7.7	115.2
413	L	29.3	Very low	29.4	Very low	183 Å²	183	131.9 Å²	131.9	96%	0.958	77%	0.769	S	S	*	*				-139	168.7	125.7	-81.7	-173.5	0	0	0	109
414	N	32.4	Very low	29.3	Very low	111 Å²	111	131.1 Å²	131.1	59%	0.594	77%	0.771	S	S	*	*			trans	-147.5	174.3	-170.3	-130	-10.4	0	0	0	107.8
415	P	43.1	Very low	29.2	Very low	117 Å²	117	135.5 Å²	135.5	76%	0.76	77%	0.772	S	S	*	*			cis	-107.9	161.9	21.7	8.7	16.8	0	0	0	113.2
416	K	34.3	Very low	29.1	Very low	162 Å²	162	135.4 Å²	135.4	70%	0.704	77%	0.766	S	S	*	*				66.9	144	54	-78.1	-168.4	174.6	-170.4	0	114.7
417	S	31.4	Very low	29	Very low	88 Å²	88	138.6 Å²	138.6	62%	0.615	76%	0.763	S	S	*	*			cis	-176.1	162.5	-13.2	47.5	0	0	0	0	112
418	C	22.4	Very low	29	Very low	136 Å²	136	141.1 Å²	141.1	92%	0.919	76%	0.762	S	S	*	*			trans	-134.4	135.1	137	-165.4	0	0	0	0	108.4
419	T	27.5	Very low	28.9	Very low	114 Å²	114	140.4 Å²	140.4	70%	0.699	76%	0.761	S	S	*	*			trans	-128.4	142.4	-162.8	37.1	0	0	0	0	113.9
420	K	30.7	Very low	28.8	Very low	182 Å²	182	137.8 Å²	137.8	79%	0.791	76%	0.761	S	S	*	*			trans	-79.6	171.1	159.3	-70.2	-179	173.2	-178.6	0	111.2
421	E	29.4	Very low	28.6	Very low	156 Å²	156	140.2 Å²	140.2	73%	0.729	77%	0.765	S	S	*	*				154.7	154.8	122.3	-79.2	-57.5	96.1	0	0	109.1
422	V	29	Very low	28.5	Very low	120 Å²	120	144.9 Å²	144.9	73%	0.727	77%	0.77	S	S	*	*			cis	-165.5	151.5	-42.6	114.8	0	0	0	0	109.6
423	G	26.1	Very low	28.2	Very low	77 Å²	77	142.2 Å²	142.2	79%	0.794	77%	0.772	S	S	*	*			trans	90.1	151.6	165	0	0	0	0	0	117.3
424	G	26.5	Very low	28	Very low	76 Å²	76	144.2 Å²	144.2	78%	0.784	77%	0.766	S	S	*	*			cis	177.3	143.4	-11	0	0	0	0	0	116.3
425	R	29.1	Very low	27.6	Very low	231 Å²	231	148.4 Å²	148.4	87%	0.872	78%	0.782	S	S	*	*			trans	73.9	134.3	163.9	-67.5	-171.8	175.9	-130.2	0.4	121.8
426	Q	27.3	Very low	26.8	Very low	165 Å²	165	146.2 Å²	146.2	77%	0.771	78%	0.781	S	S	*	*			trans	88.8	134.9	144.2	-79.8	173.9	-44.3	0	0	123.6
427	L	26.4	Very low	26.4	Very low	146 Å²	146	145.5 Å²	145.5	76%	0.764	79%	0.785	S	S	*	*			trans	20.6	117.1	165	-83.3	73.9	0	0	0	124.4
428	R	25.7	Very low	26.2	Very low	212 Å²	212	151.3 Å²	151.3	80%	0.8	79%	0.793	S	S	*	*				66	139.6	117.2	-123.8	-172	-172.5	-144	8.5	122.6
429	E	24	Very low	26.4	Very low	159 Å²	159	151.9 Å²	151.9	74%	0.743	79%	0.787	S	S	*	*			trans	72	147.5	156.9	-81	161.8	-138.4	0	0	119.9
430	G	24.7	Very low	26.5	Very low	75 Å²	75	151.8 Å²	151.8	77%	0.773	79%	0.791	S	S	*	*			trans	145.3	106.9	171.8	0	0	0	0	0	117.1
431	L	23.8	Very low	26.4	Very low	151 Å²	151	152.6 Å²	152.6	79%	0.791	79%	0.794	S	S	*	*			trans	-25.3	143.2	153.9	-67.9	145.8	0	0	0	116
432	Q	24.2	Very low	26.4	Very low	160 Å²	160	156.4 Å²	156.4	75%	0.748	80%	0.802	S	S	*	*				84.6	144.6	55.9	-170.3	-178.1	81.5	0	0	114
433	L	25.2	Very low	26.6	Very low	166 Å²	166	160.7 Å²	160.7	87%	0.869	81%	0.805	S	S	*	*			trans	76.9	164.9	174.5	-82.6	153.4	0	0	0	119
434	R	25.8	Very low	26.8	Very low	225 Å²	225	162.1 Å²	162.1	85%	0.849	79%	0.794	S	S	*	*			trans	-164.7	112.1	-158.5	174.5	-154.1	-168.2	-139.8	7.2	112
435	E	23.6	Very low	27	Very low	198 Å²	198	165.6 Å²	165.6	93%	0.925	79%	0.79	S	S	*	*			trans	177.5	164.8	152.6	-106.8	167.4	-176.8	0	0	110.2
436	G	26.4	Very low	27.1	Very low	72 Å²	72	163 Å²	163	74%	0.742	79%	0.788	S	S	*	*			trans	138.4	134.3	171.5	0	0	0	0	0	116
437	L	25.9	Very low	27.5	Very low	147 Å²	147	158.3 Å²	158.3	77%	0.77	78%	0.777	S	S	*	*			trans	-108.6	148.7	-163.8	-103.7	67.3	0	0	0	115.9
438	R	26.8	Very low	27.9	Very low	210 Å²	210	158.9 Å²	158.9	79%	0.792	78%	0.775	S	S	*	*			trans	87.6	149.7	132.7	-84.9	-177.7	-177.7	-177.3	1.3	124.3
439	N	27.5	Very low	28.3	Very low	147 Å²	147	156.4 Å²	156.4	79%	0.786	77%	0.773	S	S	*	*			trans	70.3	124.3	162.4	-57.9	-14.3	0	0	0	115.8
440	S	27.5	Very low	28.8	Very low	113 Å²	113	152.5 Å²	152.5	79%	0.79	77%	0.768	S	S	*	*			cis	-145.4	-171.2	9.2	-141.4	0	0	0	0	109.5
441	K	30.2	Very low	29.1	Very low	198 Å²	198	155.6 Å²	155.6	86%	0.861	76%	0.762	S	S	*	*			cis	-149.3	-140.8	17.5	-150.4	165.1	-176	175.5	0	111.5
442	R	29.5	Very low	29.2	Very low	237 Å²	237	156 Å²	156	89%	0.894	76%	0.757	S	S	*	*			trans	-108.9	163.7	177.6	-65.5	175.1	169.4	164.2	-4.2	110.2
443	R	31.5	Very low	30.3	Very low	209 Å²	209	153.4 Å²	153.4	79%	0.789	75%	0.754	S	S	*	*			cis	-124.1	173.9	-5	-85.6	-168.1	153.6	-116.8	2.3	106.2
444	L	30.8	Very low	30.6	Very low	108 Å²	108	154.2 Å²	154.2	57%	0.565	75%	0.754	S	S	*	*			cis	-167	167.7	2.2	-129	43.4	0	0	0	103.7
445	E	31.3	Very low	30.8	Very low	149 Å²	149	147.7 Å²	147.7	70%	0.696	74%	0.743	S	S	*	*			cis	-168.8	-171	-12.8	-137.9	66.8	-40.3	0	0	105.2
446	E	31	Very low	32	Very low	176 Å²	176	143.8 Å²	143.8	82%	0.822	73%	0.734	S	S	*	*			cis	-150.5	-86.7	-0.1	-170.8	-162.3	90.2	0	0	111.5
447	A	35.8	Very low	33.7	Very low	66 Å²	66	145.5 Å²	145.5	55%	0.545	73%	0.733	S	S	.	*			trans	-142.8	152.6	-163.9	0	0	0	0	0	113
448	H	35.6	Very low	34.1	Very low	158 Å²	158	147.9 Å²	147.9	73%	0.731	74%	0.737	S	S	*	*			cis	-172.4	167.9	-0.1	-116.6	29.3	0	0	0	110.3
449	Q	33.4	Very low	34.4	Very low	161 Å²	161	147.2 Å²	147.2	75%	0.752	74%	0.74	S	S	*	*			cis	-148.4	-80.9	-8.1	-149.9	-167.4	65.9	0	0	117.6
450	A	34.7	Very low	34.3	Very low	76 Å²	76	148 Å²	148	63%	0.628	74%	0.741	S	S	*	*			trans	-158	179.5	-144.4	0	0	0	0	0	115.5
451	E	30.7	Very low	34.3	Very low	141 Å²	141	152.5 Å²	152.5	66%	0.659	75%	0.746	S	S	*	*			cis	-149.5	-83.6	-0.3	-132.6	-81.1	103.7	0	0	116.9
452	K	25.8	Very low	34	Very low	159 Å²	159	146.7 Å²	146.7	69%	0.691	74%	0.742	S	S	*	*			trans	-154.6	177.3	-151.4	-105.1	-167.4	-155.1	84.4	0	116.5
453	P	47.3	Very low	33.8	Very low	105 Å²	105	140.3 Å²	140.3	68%	0.682	74%	0.74	S	S	*	*			cis	-142.3	171.5	-16	33.5	-12.1	0	0	0	120.4
454	Q	31.2	Very low	33.6	Very low	183 Å²	183	135.4 Å²	135.4	86%	0.855	74%	0.744	S	S	*	*			trans	78.5	163.1	151.1	-87.4	-164.4	46.8	0	0	122.5
455	S	30.4	Very low	33.3	Very low	89 Å²	89	133.9 Å²	133.9	62%	0.622	75%	0.754	S	S	*	*			cis	-156.1	-59.8	-8.6	37.8	0	0	0	0	122.9
456	P	48.7	Very low	34.2	Very low	115 Å²	115	132.8 Å²	132.8	75%	0.747	76%	0.76	S	S	*	*			trans	-103	173.3	-136.9	6.7	12.6	0	0	0	121.5
457	P	62.5	Low	34	Very low	109 Å²	109	129 Å²	129	71%	0.708	76%	0.759	S	S	*	*			trans	-146.8	157	-153.3	43.2	-22.8	0	0	0	124
458	K	34.3	Very low	33.5	Very low	197 Å²	197	135.8 Å²	135.8	86%	0.857	78%	0.779	S	S	*	*			trans	40.1	143.6	133.3	-58.5	174.3	178.5	171.9	0	124.7
459	K	32	Very low	33	Very low	196 Å²	196	131.4 Å²	131.4	85%	0.852	78%	0.777	S	S	*	*				166.2	-154.4	95.1	-136.3	171.3	-174.7	-178.5	0	115.5
460	M	26.4	Very low	33.5	Very low	163 Å²	163	130.4 Å²	130.4	80%	0.803	79%	0.785	S	S	*	*			trans	-134.4	168.6	-157.1	-56.3	158.8	56.9	0	0	116.1
461	K	26.9	Very low	33.2	Very low	208 Å²	208	130 Å²	130	90%	0.904	79%	0.788	S	S	*	*			trans	83.1	142.3	144.7	-163.3	-174.1	-178.3	-171.8	0	118.5
462	G	23.9	Very low	33.2	Very low	75 Å²	75	133 Å²	133	77%	0.773	80%	0.799	S	S	*	*			trans	152.8	163.7	167.7	0	0	0	0	0	115
463	A	26	Very low	33.1	Very low	104 Å²	104	135.6 Å²	135.6	86%	0.86	81%	0.81	S	S	*	*			trans	-154.4	154.5	178.3	0	0	0	0	0	114.5
464	A	26.5	Very low	32.3	Very low	105 Å²	105	134.9 Å²	134.9	87%	0.868	81%	0.813	S	S	*	*			trans	67.8	100	154.2	0	0	0	0	0	122.7
465	G	25.3	Very low	32.9	Very low	76 Å²	76	132 Å²	132	78%	0.784	81%	0.81	S	S	*	*			trans	82.5	178	138.3	0	0	0	0	0	119.5
466	P	49.7	Very low	32.9	Very low	126 Å²	126	132.1 Å²	132.1	82%	0.818	82%	0.817	S	S	*	*			cis	-139.6	175.6	-15	42.2	-26.1	0	0	0	116.1
467	A	26.6	Very low	31.8	Very low	97 Å²	97	133.9 Å²	133.9	80%	0.802	82%	0.815	S	S	*	*			trans	60	130.2	147	0	0	0	0	0	123.1
468	E	24.8	Very low	30.3	Very low	208 Å²	208	136.9 Å²	136.9	97%	0.972	82%	0.817	S	S	*	*				-158.4	164.8	117.5	-129.8	-176.2	-170.9	0	0	112.2
469	G	26.8	Very low	29.8	Very low	67 Å²	67	130.4 Å²	130.4	69%	0.691	81%	0.806	S	S	*	*			trans	154.2	143.4	169.8	0	0	0	0	0	116.6
470	P	43.4	Very low	29.5	Very low	139 Å²	139	128.2 Å²	128.2	90%	0.903	80%	0.803	S	S	*	*			trans	-138.5	173	148.9	36.9	-21.6	0	0	0	112.7
471	G	27.3	Very low	29.7	Very low	67 Å²	67	127.4 Å²	127.4	69%	0.691	80%	0.801	S	S	*	*			cis	170.2	128.7	-10	0	0	0	0	0	114.7
472	K	31.1	Very low	29.7	Very low	205 Å²	205	123.7 Å²	123.7	89%	0.891	79%	0.791	S	S	*	*			trans	32.3	126.2	153	-54.7	175.4	-178.1	175.4	0	121.7
473	K	24.9	Very low	30	Very low	214 Å²	214	123 Å²	123	93%	0.93	78%	0.783	S	S	*	*				174.3	162.3	106.3	-96.9	-179	-179.8	-178.5	0	114.1
474	A	29	Very low	30.2	Very low	89 Å²	89	125.3 Å²	125.3	74%	0.736	78%	0.776	S	S	*	*			trans	-129.9	168.5	163.1	0	0	0	0	0	108.2
475	P	44.7	Very low	30.4	Very low	122 Å²	122	125.3 Å²	125.3	79%	0.792	77%	0.765	S	S	*	*				-159.1	172.6	88.4	42.9	-23.9	0	0	0	118.1
476	A	29.8	Very low	30.5	Very low	93 Å²	93	129.7 Å²	129.7	77%	0.769	76%	0.763	S	S	*	*			trans	58.4	160.3	147.9	0	0	0	0	0	120.6
477	E	26.5	Very low	29.4	Very low	152 Å²	152	130.9 Å²	130.9	71%	0.71	76%	0.755	S	S	*	*			cis	-137.7	-171.4	15.9	-108.3	-146.1	118.7	0	0	115.9
478	K	29.3	Very low	29.3	Very low	171 Å²	171	132.7 Å²	132.7	74%	0.743	75%	0.747	S	S	*	*			trans	-69	176.9	-169.2	-55.4	150.8	-170.5	146.8	0	114.8
479	G	24.1	Very low	29.5	Very low	61 Å²	61	128.9 Å²	128.9	63%	0.629	74%	0.738	S	S	*	*			cis	-162.4	165	9	0	0	0	0	0	113.9
480	L	26.9	Very low	30.3	Very low	150 Å²	150	130.7 Å²	130.7	79%	0.785	74%	0.737	S	S	*	*				80.9	128.7	90.1	-69.6	172.3	0	0	0	113.1
481	L	30.1	Very low	29.4	Very low	147 Å²	147	131.9 Å²	131.9	77%	0.77	73%	0.731	S	S	*	*			cis	-145.4	178.9	3.8	-95.6	169.5	0	0	0	108.8
482	N	27.4	Very low	29.4	Very low	129 Å²	129	139.9 Å²	139.9	69%	0.69	74%	0.74	S	S	*	*			cis	-127.1	-130.1	3.8	-161.1	-6.5	0	0	0	109.8
483	G	30.6	Very low	29.1	Very low	60 Å²	60	134.3 Å²	134.3	62%	0.619	73%	0.727	S	S	*	*			cis	131	140.2	-3	0	0	0	0	0	112.7
484	H	29.8	Very low	29.1	Very low	154 Å²	154	131.4 Å²	131.4	71%	0.713	72%	0.721	S	S	*	*			cis	-134.3	129.1	-8.7	-113.5	-125.2	0	0	0	107.4
485	V	29.8	Very low	28.8	Very low	104 Å²	104	133.1 Å²	133.1	63%	0.63	71%	0.713	S	S	*	*				84	131.8	69.2	164.8	0	0	0	0	111.1
486	K	27.4	Very low	27.9	Very low	169 Å²	169	136 Å²	136	74%	0.735	71%	0.709	S	S	*	*			cis	-167.3	146.6	43.4	-147.8	151.4	-159.9	177.4	0	115.3
487	K	27	Very low	27.6	Very low	150 Å²	150	138 Å²	138	65%	0.652	71%	0.706	S	S	*	*			trans	50.7	162.9	141	-71.5	-177.1	154.7	-128	0	121.7
488	E	25.4	Very low	27.8	Very low	135 Å²	135	141.7 Å²	141.7	63%	0.631	71%	0.714	S	S	*	*			cis	-162.2	135.3	-16.9	-110.4	165.9	176.8	0	0	111
489	V	28.2	Very low	28.5	Very low	129 Å²	129	137.8 Å²	137.8	78%	0.782	71%	0.706	S	S	*	*				90.6	-169.6	96.4	-173.8	0	0	0	0	112
490	P	44.8	Very low	28.9	Very low	105 Å²	105	144.2 Å²	144.2	68%	0.682	72%	0.717	S	S	*	*				-120.3	-173	-110.9	41.8	-23.8	0	0	0	116
491	E	23.7	Very low	29.1	Very low	163 Å²	163	147.7 Å²	147.7	76%	0.762	72%	0.719	S	S	*	*				176	167	129.4	-99.2	-87.6	86.7	0	0	114.5
492	R	27.5	Very low	29.5	Very low	235 Å²	235	144.9 Å²	144.9	89%	0.887	72%	0.717	S	S	*	*			trans	-141.9	123.5	166.7	-96.1	-177.8	164.5	-171	-1.6	109.2
493	S	23.8	Very low	29.9	Very low	88 Å²	88	145.2 Å²	145.2	62%	0.615	72%	0.724	S	S	*	*			trans	-163.1	139.9	166.8	37	0	0	0	0	113.9
494	L	26.3	Very low	30.2	Very low	154 Å²	154	147.3 Å²	147.3	81%	0.806	74%	0.735	S	S	*	*			trans	52.5	143.4	140.6	-59.6	176.4	0	0	0	120.3
495	E	22.7	Very low	30.2	Very low	124 Å²	124	143.9 Å²	143.9	58%	0.579	74%	0.742	S	S	*	*			cis	-144.2	162.9	-15.3	-85.5	-70	68.5	0	0	105
496	R	24.6	Very low	30.5	Very low	183 Å²	183	148.5 Å²	148.5	69%	0.691	75%	0.753	S	S	*	*			cis	108.8	125	13.6	-161.2	-172.7	173.4	-161.7	9.8	113
497	N	24.8	Very low	30.4	Very low	134 Å²	134	145.7 Å²	145.7	72%	0.717	76%	0.755	S	S	*	*			trans	69.8	133.2	176.8	-61	-43.9	0	0	0	118.1
498	R	29.6	Very low	30.6	Very low	230 Å²	230	145 Å²	145	87%	0.868	76%	0.763	S	S	*	*			cis	84.7	153.7	49.1	-108.6	-171.7	165.5	165.7	-1.6	113.3
499	P	44.8	Very low	31.6	Very low	90 Å²	90	144.8 Å²	144.8	58%	0.584	77%	0.774	S	S	*	*			cis	-149.5	179.7	9.8	43.8	-23.8	0	0	0	120.7
500	K	31.4	Very low	31.5	Very low	196 Å²	196	142 Å²	142	85%	0.852	77%	0.771	S	S	*	*			trans	68.5	167.7	150.7	-73.3	159.9	-173.8	178.2	0	119.5
501	R	30.9	Very low	30.9	Very low	223 Å²	223	148 Å²	148	84%	0.842	78%	0.78	S	S	*	*			cis	-174	112.8	-38.7	-176.2	-173.2	-164.3	-152.4	7.4	113.6
502	A	38.5	Very low	31.3	Very low	87 Å²	87	147 Å²	147	72%	0.719	78%	0.775	S	S	*	*			trans	61.1	160.3	146.4	0	0	0	0	0	125.8
503	T	35.6	Very low	31.4	Very low	136 Å²	136	140 Å²	140	83%	0.834	77%	0.768	S	S	*	*			trans	89.8	105	147	27.9	0	0	0	0	125.9
504	A	36.7	Very low	31.7	Very low	104 Å²	104	145.2 Å²	145.2	86%	0.86	78%	0.782	S	S	*	*				80.1	132.6	118.5	0	0	0	0	0	127
505	G	30.3	Very low	31.8	Very low	82 Å²	82	141.1 Å²	141.1	85%	0.845	78%	0.778	S	S	*	*			trans	100.6	159.2	150.3	0	0	0	0	0	118.8
506	K	36.1	Very low	32.1	Very low	202 Å²	202	145.5 Å²	145.5	88%	0.878	80%	0.795	S	S	*	*			cis	-170.3	161.2	-26	-162.1	178.2	179.4	-176.6	0	110.5
507	S	25.8	Very low	32.3	Very low	110 Å²	110	140 Å²	140	77%	0.769	79%	0.788	S	S	*	*			trans	97.9	161.3	158.1	-48.6	0	0	0	0	121.8
508	T	32	Very low	32.4	Very low	135 Å²	135	141.5 Å²	141.5	83%	0.828	80%	0.796	S	S	*	*			trans	-121.8	-173.1	-171.5	49.4	0	0	0	0	111.1
509	P	45.3	Very low	32.2	Very low	130 Å²	130	133.9 Å²	133.9	84%	0.844	79%	0.789	S	S	*	*			cis	-150.2	-168.6	20.6	46	-23.2	0	0	0	119.8
510	G	26	Very low	31.5	Very low	71 Å²	71	134.6 Å²	134.6	73%	0.732	80%	0.803	S	S	*	*			trans	123.7	120.8	165.5	0	0	0	0	0	114.7
511	R	33.1	Very low	31.2	Very low	232 Å²	232	130.9 Å²	130.9	88%	0.875	80%	0.801	S	S	*	*				74.9	140.5	58.5	-89	-154.2	166.7	-154	-4.1	115.5
512	Q	32.2	Very low	30.9	Very low	141 Å²	141	125.4 Å²	125.4	66%	0.659	80%	0.796	S	S	*	*			cis	-172.7	-179.6	-22.3	-141.9	176.8	-9.4	0	0	111.8
513	A	29.3	Very low	30.3	Very low	89 Å²	89	129.1 Å²	129.1	74%	0.736	80%	0.799	S	S	*	*			trans	76.4	168	157	0	0	0	0	0	120.4
514	H	30.6	Very low	29.9	Very low	196 Å²	196	128.6 Å²	128.6	91%	0.907	79%	0.791	S	S	*	*				-169.1	163.4	-59.1	-113.4	-26.8	0	0	0	112.3
515	G	27.3	Very low	29.5	Very low	69 Å²	69	135.7 Å²	135.7	71%	0.711	80%	0.796	S	S	*	*			trans	120.7	136.1	175.5	0	0	0	0	0	112.9
516	K	29.1	Very low	29.4	Very low	215 Å²	215	137 Å²	137	94%	0.935	79%	0.791	S	S	*	*			cis	72.1	138.2	28.9	-72.5	-161.8	172.4	-168.9	0	115.5
517	A	28.1	Very low	29	Very low	67 Å²	67	133.9 Å²	133.9	55%	0.554	79%	0.789	S	S	*	*			cis	-166.9	176.3	-13.6	0	0	0	0	0	110.8
518	D	26.8	Very low	29	Very low	166 Å²	166	133.7 Å²	133.7	89%	0.888	79%	0.788	S	S	*	*			trans	64.5	163.3	160.1	-47.9	-43.7	0	0	0	118.2
519	G	27	Very low	28.7	Very low	70 Å²	70	134.6 Å²	134.6	72%	0.722	78%	0.783	S	S	*	*			cis	174.9	133.7	-13.4	0	0	0	0	0	115
520	A	29.2	Very low	28	Very low	105 Å²	105	134.4 Å²	134.4	87%	0.868	78%	0.782	S	S	*	*			trans	57.8	143.1	151.9	0	0	0	0	0	125.2
521	S	24.4	Very low	27.9	Very low	118 Å²	118	138.8 Å²	138.8	83%	0.825	78%	0.783	S	S	*	*			trans	84.2	134.1	141	-151.9	0	0	0	0	123.8
522	C	25.4	Very low	27.6	Very low	109 Å²	109	133 Å²	133	74%	0.736	78%	0.779	S	S	*	*			trans	-64.2	156.6	172.3	-41.7	0	0	0	0	115
523	E	26.8	Very low	27.2	Very low	165 Å²	165	131.8 Å²	131.8	77%	0.771	78%	0.78	S	S	*	*				174.1	147.5	99.3	-86.3	-136.5	125.6	0	0	115.4
524	N	27.3	Very low	27	Very low	125 Å²	125	136.4 Å²	136.4	67%	0.668	79%	0.787	S	S	*	*			trans	29.4	113.8	145.9	-53.3	-36.4	0	0	0	122.9
525	R	27.4	Very low	26.8	Very low	253 Å²	253	135.2 Å²	135.2	96%	0.955	78%	0.779	S	S	*	*				-160.5	161.5	124	-122.9	-177.9	-178.7	-158.5	-0.5	113.1
526	S	28.3	Very low	26.9	Very low	108 Å²	108	137.8 Å²	137.8	76%	0.755	78%	0.783	S	S	*	*			trans	-121.1	178.5	-168.3	-53.9	0	0	0	0	114.1
527	T	26.7	Very low	26.7	Very low	137 Å²	137	135 Å²	135	84%	0.84	77%	0.773	S	S	*	*			trans	94.7	150.2	151.6	10.4	0	0	0	0	121.5
528	S	27.1	Very low	26.5	Very low	107 Å²	107	138.7 Å²	138.7	75%	0.748	78%	0.783	S	S	*	*			trans	61.5	105	175.9	39.1	0	0	0	0	117.9
529	Q	24.4	Very low	26.4	Very low	154 Å²	154	135.7 Å²	135.7	72%	0.72	78%	0.776	S	S	*	*				53.5	128.9	77.9	-76.4	-75.3	-4.1	0	0	113.4
530	P	31.5	Very low	26.3	Very low	125 Å²	125	136 Å²	136	81%	0.812	78%	0.779	S	S	*	*				-133.3	179.4	62	40.8	-27.3	0	0	0	116.8
531	E	24.7	Very low	26.2	Very low	163 Å²	163	141.5 Å²	141.5	76%	0.762	78%	0.783	S	S	*	*			trans	-86.2	179.1	179.5	-64.4	-169.5	104.3	0	0	115.3
532	S	25.2	Very low	26.4	Very low	112 Å²	112	140.9 Å²	140.9	78%	0.783	79%	0.785	S	S	*	*			trans	92.3	143.4	156.6	90.3	0	0	0	0	116.8
533	V	24.7	Very low	26.6	Very low	114 Å²	114	144.7 Å²	144.7	69%	0.691	79%	0.792	S	S	*	*			cis	-163.6	171.4	-12.5	112.2	0	0	0	0	111
534	H	24.8	Very low	27	Very low	187 Å²	187	146.2 Å²	146.2	87%	0.866	80%	0.796	S	S	*	*			trans	84.2	153.7	164.9	-73.1	-36.2	0	0	0	122.1
535	K	26	Very low	26.9	Very low	171 Å²	171	144 Å²	144	74%	0.743	80%	0.803	S	S	*	*			trans	-121.8	157.8	178.7	-156.8	-172.1	-174.5	-175.3	0	105.9
536	P	29.6	Very low	27.3	Very low	123 Å²	123	136.1 Å²	136.1	80%	0.799	80%	0.801	S	S	*	*				-148.4	-165.3	98.1	38.6	-20.5	0	0	0	114
537	Q	25.5	Very low	27.8	Very low	156 Å²	156	134.2 Å²	134.2	73%	0.729	80%	0.798	S	S	*	*			trans	-94	165.4	-178.9	-57.9	150.3	-123.8	0	0	111.4
538	D	23.1	Very low	28.4	Very low	144 Å²	144	137.8 Å²	137.8	77%	0.77	80%	0.802	S	S	*	*				-170.4	-160.7	94.3	-159	50.7	0	0	0	113.4
539	S	25.9	Very low	29	Very low	104 Å²	104	136.9 Å²	136.9	73%	0.727	80%	0.801	S	S	*	*			trans	-104	170.5	-141.8	62.8	0	0	0	0	115.6
540	G	24.1	Very low	30.1	Very low	77 Å²	77	130.8 Å²	130.8	79%	0.794	78%	0.779	S	S	*	*			trans	-168.5	121.3	168.8	0	0	0	0	0	112.3
541	K	27.4	Very low	31.1	Very low	220 Å²	220	128.5 Å²	128.5	96%	0.957	76%	0.755	S	S	*	*			trans	-93.5	152.8	178.2	-70.4	179.9	178.9	175.1	0	112
542	A	28.3	Very low	32.4	Very low	104 Å²	104	125 Å²	125	86%	0.86	75%	0.753	S	S	*	*			trans	-142.6	154.7	158.6	0	0	0	0	0	110.2
543	E	29.1	Very low	34.1	Very low	190 Å²	190	123.4 Å²	123.4	89%	0.888	75%	0.747	S	S	*	*			trans	-99.1	176.5	-169.2	-84.8	-150	93.8	0	0	115.9
544	K	36.4	Very low	36.8	Very low	196 Å²	196	119 Å²	119	85%	0.852	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-60.3	136.7	-167.6	-62.3	167	180	167.1	0	115.1
545	G	25.1	Very low	39.7	Very low	79 Å²	79	114.9 Å²	114.9	81%	0.814	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-104	125.1	145.6	0	0	0	0	0	109.8
546	G	36.2	Very low	42.9	Very low	88 Å²	88	113.3 Å²	113.3	91%	0.907	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-91.5	123.3	-175.4	0	0	0	0	0	114
547	G	37.4	Very low	46	Very low	67 Å²	67	107.6 Å²	107.6	69%	0.691	66%	0.661	S	S	*	*	S	Bend	trans	132.3	123	168.6	0	0	0	0	0	113.7
548	K	39.7	Very low	49.3	Very low	213 Å²	213	101.3 Å²	101.3	93%	0.926	63%	0.634	S	S	*	*			trans	69.4	70.1	-173.2	-53.5	-178.2	177.9	-175.9	0	115
549	A	40.1	Very low	52.9	Low	88 Å²	88	96.3 Å²	96.3	73%	0.727	61%	0.609	S	S	*	*			trans	-139.9	38.2	178.7	0	0	0	0	0	114
550	G	47	Very low	56.3	Low	26 Å²	26	92.7 Å²	92.7	27%	0.268	58%	0.581	S	S	.	*	S	Bend	trans	-87.4	-85.4	170.9	0	0	0	0	0	111.1	A552 A553 E988	G550-A552 PolarHBondContact O-N 2.9Å; G550-A553 PolarHBondContact O-N 2.82Å; G550-E988 WeakPolarHBondContact CA-OE1 3.46Å
551	W	54	Low	59.7	Low	77 Å²	77	97 Å²	97	29%	0.292	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-56.6	-13.9	179	-51.6	105.7	0	0	0	117	A553 M554 E847 W851 P987 E988	W551-A553 PolarHBondContact O-N 3.2Å; W551-M554 HydrophobicContact CE3-CE 3.81Å; W551-M554 HydrophobicContact CE3-SD 4.19Å; W551-M554 HydrophobicContact CZ3-CE 3.82Å; W551-M554 HydrophobicContact CZ3-SD 4.45Å; W551-E847 HydrophobicContact CH2-CG 4.3Å; W551-E847 HydrophobicContact CZ2-CG 4.38Å; W551-E847 HydrophobicContact CZ3-CG 4.32Å; W551-W851 HydrophobicContact CH2-CB 4.35Å; W551-W851 AromaticContact CH2-CD1 3.2Å; W551-W851 AromaticContact CH2-CG 3.83Å; W551-W851 HydrophobicContact CH2-CG 3.83Å; W551-W851 AromaticContact CH2-NE1 3.68Å; W551-W851 AromaticContact CZ2-CD1 3.85Å; W551-W851 HydrophobicContact CZ2-CG 4.41Å; W551-W851 AromaticContact CZ3-CD1 3.99Å; W551-P987 HydrophobicContact CZ3-CG 4.25Å; W551-E988 HydrophobicContact CE3-CG 4.39Å; W551-E988 HydrophobicContact CH2-CG 4.32Å; W551-E988 HydrophobicContact CZ3-CG 4.19Å; W551-E988 PolarHBondContact N-OE1 3.09Å
552	A	51.2	Low	63	Low	89 Å²	89	86.9 Å²	86.9	74%	0.736	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-77.5	-0.5	-176.9	0	0	0	0	0	114.4	G550	G550-A552 PolarHBondContact O-N 2.9Å
553	A	59.6	Low	66.2	Low	78 Å²	78	84.6 Å²	84.6	65%	0.645	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-97.1	1.5	178.5	0	0	0	0	0	114.2	G550 W551	G550-A553 PolarHBondContact O-N 2.82Å; W551-A553 PolarHBondContact O-N 3.2Å
554	M	82.9	Confident	69.3	Low	21 Å²	21	78.8 Å²	78.8	10%	0.103	49%	0.492	C	S	.	.	S	Bend	trans	-101.7	131.8	178.5	-64	172	-157.8	0	0	110.9	W551 P987 E988 R999	W551-M554 HydrophobicContact CE3-CE 3.81Å; W551-M554 HydrophobicContact CE3-SD 4.19Å; W551-M554 HydrophobicContact CZ3-CE 3.82Å; W551-M554 HydrophobicContact CZ3-SD 4.45Å; M554-P987 HydrophobicContact CE-CB 3.78Å; M554-P987 HydrophobicContact CE-CG 3.86Å; M554-P987 HydrophobicContact SD-CB 4.11Å; M554-P987 HydrophobicContact SD-CG 4.24Å; M554-E988 HydrophobicContact CE-CB 4.19Å; M554-E988 HydrophobicContact CE-CG 3.66Å; M554-E988 VanDerWaalsContact CE-N 3.31Å; M554-R999 HydrophobicContact CB-CB 4.39Å
555	D	85.7	Confident	71.9	Confident	101 Å²	101	78.4 Å²	78.4	54%	0.54	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	138.3	173.8	-78.4	-36.3	0	0	0	111.1	H998 R999	D555-H998 VanDerWaalsContact CB-ND1 3.32Å; D555-H998 WeakPolarHBondContact CB-ND1 3.25Å; D555-H998 VanDerWaalsContact O-CA 3.32Å; D555-H998 WeakPolarHBondContact O-CA 3.4Å; D555-H998 IonicContact OD2-CE1 3.27Å; D555-R999 PolarHBondContact O-N 3.2Å
556	E	91.9	Very high	75.2	Confident	139 Å²	139	79.4 Å²	79.4	65%	0.65	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	137.2	172.2	-70.7	-154.8	155.1	0	0	111.8
557	I	94.9	Very high	78.1	Confident	2 Å²	2	75.5 Å²	75.5	1%	0.01	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-65.2	138.3	174.2	-69.2	171.3	0	0	0	110.7	V559 M586 C951 H998 R999 T1000	I557-V559 WeakPolarHBondContact O-CG2 3.23Å; I557-V559 PolarHBondContact O-N 3.02Å; I557-M586 HydrophobicContact CD1-CB 4.27Å; I557-M586 HydrophobicContact CD1-CE 3.26Å; I557-M586 HydrophobicContact CD1-CG 4.35Å; I557-M586 HydrophobicContact CG2-CB 4.49Å; I557-M586 WeakPolarHBondContact CG2-O 3.43Å; I557-C951 HydrophobicContact CD1-CB 4.45Å; I557-H998 HydrophobicContact CD1-CB 4.22Å; I557-H998 HydrophobicContact CG1-CB 3.5Å; I557-R999 PolarHBondContact N-O 2.83Å; I557-T1000 HydrophobicContact CB-CG2 4.48Å; I557-T1000 HydrophobicContact CD1-CG2 4Å
558	P	96	Very high	80.7	Confident	25 Å²	25	78.8 Å²	78.8	16%	0.162	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-56.3	133.1	-179.5	21.6	-34.2	0	0	0	113.2	V581 F584 C587 R588	P558-V581 HydrophobicContact CB-CG1 3.88Å; P558-V581 HydrophobicContact CG-CB 3.9Å; P558-V581 HydrophobicContact CG-CG1 3.71Å; P558-F584 HydrophobicContact CG-CB 4.28Å; P558-F584 HydrophobicContact CG-CD2 3.68Å; P558-F584 HydrophobicContact CG-CE2 4.09Å; P558-F584 HydrophobicContact CG-CG 4.06Å; P558-C587 HydrophobicContact CG-CB 4.07Å; P558-R588 PolarHBondContact O-N 3.46Å
559	V	97.1	Very high	83.2	Confident	39 Å²	39	70 Å²	70	24%	0.236	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	99.4	-174.4	-170.3	0	0	0	0	110.6	I557 R561 R588 I590	I557-V559 WeakPolarHBondContact O-CG2 3.23Å; I557-V559 PolarHBondContact O-N 3.02Å; V559-R561 PolarHBondContact O-NH1 2.84Å; V559-R588 CarbonylContact C-O 3.52Å; V559-R588 WeakPolarHBondContact CA-O 3.5Å; V559-R588 VanDerWaalsContact CG2-NH2 3.3Å; V559-I590 HydrophobicContact CG1-CD1 3.56Å; V559-I590 HydrophobicContact CG1-CG1 4.01Å
560	L	97.4	Very high	85.9	Confident	27 Å²	27	65.8 Å²	65.8	14%	0.141	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	143.2	-177.9	-59.2	-177.3	0	0	0	111.7	Y573 V577 V581 C587 R588 V589 I590	L560-Y573 HydrophobicContact CB-CE1 4.41Å; L560-Y573 HydrophobicContact CD1-CE1 4.15Å; L560-V577 HydrophobicContact CD1-CB 4.18Å; L560-V577 HydrophobicContact CD1-CG1 4.31Å; L560-V577 HydrophobicContact CD1-CG2 3.65Å; L560-V581 HydrophobicContact CD1-CG1 4.4Å; L560-V581 HydrophobicContact CD2-CG1 4.21Å; L560-C587 HydrophobicContact CD1-CB 4.25Å; L560-R588 PolarHBondContact N-O 2.88Å; L560-V589 HydrophobicContact CB-CG1 4.35Å; L560-V589 HydrophobicContact CB-CG2 4.25Å; L560-V589 HydrophobicContact CD1-CG2 4.25Å; L560-I590 PolarHBondContact O-N 3.22Å
561	R	96.9	Very high	88.1	Confident	167 Å²	167	64.8 Å²	64.8	63%	0.63	35%	0.346	S	S	*	.			trans	-138.3	74.9	180	-70	-179.5	-178	81.4	-4.9	109.7	V559 I590	V559-R561 PolarHBondContact O-NH1 2.84Å; R561-I590 HydrophobicContact CG-CB 4.23Å
562	P	96.8	Very high	90	Very high	9 Å²	9	66.8 Å²	66.8	6%	0.058	36%	0.361	C	S	.	.			trans	-59.2	144	178.2	22	-32	0	0	0	111.9	E566 F567 Y573 V589	P562-E566 HydrophobicContact CB-CB 3.87Å; P562-F567 HydrophobicContact CB-CB 4.12Å; P562-F567 HydrophobicContact CB-CD2 4.48Å; P562-F567 HydrophobicContact CG-CB 4.21Å; P562-F567 HydrophobicContact CG-CD2 3.71Å; P562-F567 HydrophobicContact CG-CG 4.38Å; P562-Y573 HydrophobicContact CB-CD1 4.37Å; P562-Y573 HydrophobicContact CB-CD2 4.3Å; P562-Y573 HydrophobicContact CB-CE1 3.9Å; P562-Y573 HydrophobicContact CB-CE2 3.82Å; P562-Y573 HydrophobicContact CG-CD1 4.49Å; P562-Y573 HydrophobicContact CG-CE1 3.92Å; P562-V589 HydrophobicContact CG-CG1 3.85Å
563	S	95.3	Very high	92.1	Very high	56 Å²	56	63.4 Å²	63.4	39%	0.392	33%	0.33	S	S	.	.			trans	-67	163.8	162.9	70	0	0	0	0	111	K565 E566 F567	S563-K565 PolarHBondContact O-N 3.29Å; S563-E566 WeakPolarHBondContact CB-OE2 3.44Å; S563-E566 PolarHBondContact N-OE2 3.03Å; S563-E566 PolarHBondContact O-N 2.95Å; S563-E566 VanDerWaalsContact O-N 3.1Å; S563-E566 PolarHBondContact OG-N 2.93Å; S563-E566 PolarHBondContact OG-OE2 3.1Å; S563-F567 WeakPolarHBondContact O-CB 3.48Å; S563-F567 PolarHBondContact O-N 3.39Å
564	A	92.8	Very high	93.8	Very high	67 Å²	67	59.9 Å²	59.9	55%	0.554	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-17.2	176.9	0	0	0	0	0	114.4
565	K	92.8	Very high	94.2	Very high	188 Å²	188	62.1 Å²	62.1	82%	0.817	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-47.6	172.2	-68.8	-174.8	178.1	-178.1	0	111.7	S563 F567 H568	S563-K565 PolarHBondContact O-N 3.29Å; K565-F567 VanDerWaalsContact C-N 3.29Å; K565-F567 PolarHBondContact O-N 3.01Å; K565-H568 WeakPolarHBondContact O-CB 3.37Å; K565-H568 PolarHBondContact O-N 3.47Å
566	E	94.6	Very high	94.6	Very high	100 Å²	100	61.3 Å²	61.3	47%	0.467	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-66.1	-33.7	178.6	-68.6	159.3	116.5	0	0	111.6	P562 S563 H568 Y573	P562-E566 HydrophobicContact CB-CB 3.87Å; S563-E566 WeakPolarHBondContact CB-OE2 3.44Å; S563-E566 PolarHBondContact N-OE2 3.03Å; S563-E566 PolarHBondContact O-N 2.95Å; S563-E566 VanDerWaalsContact O-N 3.1Å; S563-E566 PolarHBondContact OG-N 2.93Å; S563-E566 PolarHBondContact OG-OE2 3.1Å; E566-H568 PolarHBondContact O-N 2.83Å; E566-H568 VanDerWaalsContact O-N 3.13Å; E566-Y573 HydrophobicContact CB-CD2 3.74Å; E566-Y573 HydrophobicContact CB-CE2 3.97Å; E566-Y573 HydrophobicContact CG-CD2 4.4Å; E566-Y573 HydrophobicContact CG-CE2 4.47Å
567	F	95.5	Very high	94.7	Very high	7 Å²	7	55.3 Å²	55.3	3%	0.031	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-71.2	1.2	177.4	-164.7	-111.1	0	0	0	114	P562 S563 K565 P591 P592 W595 H888 W890 F1007	P562-F567 HydrophobicContact CB-CB 4.12Å; P562-F567 HydrophobicContact CB-CD2 4.48Å; P562-F567 HydrophobicContact CG-CB 4.21Å; P562-F567 HydrophobicContact CG-CD2 3.71Å; P562-F567 HydrophobicContact CG-CG 4.38Å; S563-F567 WeakPolarHBondContact O-CB 3.48Å; S563-F567 PolarHBondContact O-N 3.39Å; K565-F567 VanDerWaalsContact C-N 3.29Å; K565-F567 PolarHBondContact O-N 3.01Å; F567-P591 HydrophobicContact CD2-CB 4.32Å; F567-P591 HydrophobicContact CE1-CB 4.1Å; F567-P591 HydrophobicContact CE2-CB 3.56Å; F567-P591 HydrophobicContact CZ-CB 3.44Å; F567-P591 VanDerWaalsContact CZ-CB 3.44Å; F567-P592 HydrophobicContact CB-CG 3.74Å; F567-P592 HydrophobicContact CD1-CG 3.87Å; F567-P592 HydrophobicContact CG-CG 3.79Å; F567-W595 HydrophobicContact CE1-CB 4Å; F567-W595 AromaticContact CE1-CD2 3.65Å; F567-W595 HydrophobicContact CE1-CD2 3.65Å; F567-W595 AromaticContact CE1-CE3 3.65Å; F567-W595 HydrophobicContact CE1-CE3 3.65Å; F567-W595 AromaticContact CE1-CG 3.85Å; F567-W595 HydrophobicContact CE1-CG 3.85Å; F567-W595 HydrophobicContact CE1-CZ3 4.33Å; F567-W595 HydrophobicContact CZ-CB 4.42Å; F567-W595 AromaticContact CZ-CD2 3.84Å; F567-W595 HydrophobicContact CZ-CD2 3.84Å; F567-W595 HydrophobicContact CZ-CE3 4.21Å; F567-W595 AromaticContact CZ-CG 3.95Å; F567-W595 HydrophobicContact CZ-CG 3.95Å; F567-H888 AromaticContact CD1-CE1 3.65Å; F567-H888 AromaticContact CE1-CE1 3.61Å; F567-H888 PolarHBondContact O-CE1 3.47Å; F567-H888 VanDerWaalsContact O-CE1 3.26Å; F567-W890 AromaticContact CD2-CD1 3.82Å; F567-W890 AromaticContact CD2-CD2 3.94Å; F567-W890 HydrophobicContact CD2-CD2 3.94Å; F567-W890 AromaticContact CD2-CE2 3.43Å; F567-W890 VanDerWaalsContact CD2-CE2 3.43Å; F567-W890 HydrophobicContact CD2-CG 4.17Å; F567-W890 AromaticContact CD2-CZ2 3.85Å; F567-W890 HydrophobicContact CD2-CZ2 3.85Å; F567-W890 AromaticContact CD2-NE1 3.35Å; F567-W890 HydrophobicContact CE1-CB 4.41Å; F567-W890 AromaticContact CE1-CD1 3.98Å; F567-W890 HydrophobicContact CE1-CG 4.14Å; F567-W890 HydrophobicContact CE2-CB 4.32Å; F567-W890 AromaticContact CE2-CD1 3.64Å; F567-W890 AromaticContact CE2-CD2 3.31Å; F567-W890 HydrophobicContact CE2-CD2 3.31Å; F567-W890 AromaticContact CE2-CE2 3.32Å; F567-W890 AromaticContact CE2-CE3 3.89Å; F567-W890 HydrophobicContact CE2-CE3 3.89Å; F567-W890 AromaticContact CE2-CG 3.53Å; F567-W890 HydrophobicContact CE2-CG 3.53Å; F567-W890 HydrophobicContact CE2-CH2 4.43Å; F567-W890 AromaticContact CE2-CZ2 3.91Å; F567-W890 HydrophobicContact CE2-CZ2 3.91Å; F567-W890 HydrophobicContact CE2-CZ3 4.42Å; F567-W890 AromaticContact CE2-NE1 3.51Å; F567-W890 AromaticContact CG-NE1 3.8Å; F567-W890 HydrophobicContact CZ-CB 3.84Å; F567-W890 AromaticContact CZ-CD1 3.71Å; F567-W890 AromaticContact CZ-CD2 3.79Å; F567-W890 HydrophobicContact CZ-CD2 3.79Å; F567-W890 HydrophobicContact CZ-CE3 4.44Å; F567-W890 AromaticContact CZ-CG 3.5Å; F567-W890 HydrophobicContact CZ-CG 3.5Å; F567-W890 VanDerWaalsContact CZ-CG 3.5Å; F567-W890 PolarHBondContact O-NE1 3.44Å; F567-F1007 HydrophobicContact CE2-CE2 4.1Å; F567-F1007 AromaticContact CZ-CE2 3.91Å; F567-F1007 HydrophobicContact CZ-CE2 3.91Å; F567-F1007 HydrophobicContact CZ-CZ 4.41Å
568	H	92.1	Very high	94.6	Very high	136 Å²	136	56.8 Å²	56.8	63%	0.63	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-70.9	-49.2	-178.4	-169.8	66	0	0	0	113.4	K565 E566	K565-H568 WeakPolarHBondContact O-CB 3.37Å; K565-H568 PolarHBondContact O-N 3.47Å; E566-H568 PolarHBondContact O-N 2.83Å; E566-H568 VanDerWaalsContact O-N 3.13Å
569	D	93.2	Very high	94.4	Very high	28 Å²	28	60.1 Å²	60.1	15%	0.15	32%	0.32	C	S	.	.			trans	-115.9	112.6	174.7	-171.6	-20.9	0	0	0	110.1	L571 I572 Y573 N898	D569-L571 PolarHBondContact O-N 2.68Å; D569-L571 PolarHBondContact OD1-N 2.96Å; D569-I572 HydrophobicContact CB-CB 4.25Å; D569-I572 HydrophobicContact CB-CD1 4.04Å; D569-I572 HydrophobicContact CB-CG1 4.16Å; D569-I572 WeakPolarHBondContact OD2-CD1 3.46Å; D569-Y573 PolarHBondContact O-N 3.15Å; D569-N898 PolarHBondContact OD1-ND2 3.14Å
570	P	95.4	Very high	94.2	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-58.7	-34.8	178.8	21.2	-31.6	0	0	0	113.4	Y573 I574 G889 W890 L895	P570-Y573 PolarHBondContact O-N 3.27Å; P570-I574 HydrophobicContact CB-CD1 4.43Å; P570-I574 VanDerWaalsContact O-CB 3.32Å; P570-I574 WeakPolarHBondContact O-CB 3.43Å; P570-I574 WeakPolarHBondContact O-CD1 3.47Å; P570-I574 WeakPolarHBondContact O-CG1 3.33Å; P570-I574 PolarHBondContact O-N 3.12Å; P570-G889 WeakPolarHBondContact CG-O 3.4Å; P570-W890 HydrophobicContact CB-CD2 3.71Å; P570-W890 VanDerWaalsContact CB-CE2 3.47Å; P570-W890 HydrophobicContact CB-CE3 4.18Å; P570-W890 HydrophobicContact CB-CG 4.1Å; P570-W890 HydrophobicContact CB-CH2 4.23Å; P570-W890 HydrophobicContact CB-CZ2 3.78Å; P570-W890 HydrophobicContact CB-CZ3 4.42Å; P570-W890 HydrophobicContact CG-CD2 4.45Å; P570-W890 HydrophobicContact CG-CG 4.35Å; P570-L895 HydrophobicContact CB-CD1 3.99Å; P570-L895 HydrophobicContact CG-CD1 3.44Å; P570-L895 VanDerWaalsContact CG-CD1 3.44Å
571	L	94.4	Very high	94.1	Very high	5 Å²	5	63.5 Å²	63.5	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-78.4	-39.3	-169.8	-60.6	-179.1	0	0	0	111.1	D569 Y573 E575 L895 N898 G900 S901 F1031	D569-L571 PolarHBondContact O-N 2.68Å; D569-L571 PolarHBondContact OD1-N 2.96Å; L571-Y573 VanDerWaalsContact C-N 3.32Å; L571-E575 VanDerWaalsContact O-CB 3.27Å; L571-E575 WeakPolarHBondContact O-CB 3.37Å; L571-E575 PolarHBondContact O-N 3.33Å; L571-L895 HydrophobicContact CD2-CD1 3.87Å; L571-L895 HydrophobicContact CG-CD1 4.17Å; L571-N898 HydrophobicContact CD1-CB 3.9Å; L571-N898 WeakPolarHBondContact CD1-ND2 3.28Å; L571-G900 VanDerWaalsContact CD1-C 3.42Å; L571-S901 VanDerWaalsContact CD1-N 3.26Å; L571-F1031 HydrophobicContact CD2-CB 4.15Å; L571-F1031 HydrophobicContact CD2-CD2 3.36Å; L571-F1031 HydrophobicContact CD2-CE2 3.91Å; L571-F1031 HydrophobicContact CD2-CG 3.91Å
572	I	93.8	Very high	93.8	Very high	119 Å²	119	58.7 Å²	58.7	61%	0.61	32%	0.317	S	S	*	.	H	α-helix	trans	-64.4	-40.3	171.9	-60.3	176.1	0	0	0	110.2	D569 S576	D569-I572 HydrophobicContact CB-CB 4.25Å; D569-I572 HydrophobicContact CB-CD1 4.04Å; D569-I572 HydrophobicContact CB-CG1 4.16Å; D569-I572 WeakPolarHBondContact OD2-CD1 3.46Å; I572-S576 PolarHBondContact O-N 3.44Å; I572-S576 VanDerWaalsContact O-N 3.07Å
573	Y	95.2	Very high	93.7	Very high	17 Å²	17	63.9 Å²	63.9	7%	0.067	34%	0.339	C	S	.	.	H	α-helix	trans	-67.8	-46.1	178	-176.7	-110.7	0	0	0	113.3	L560 P562 E566 D569 P570 L571 E575 S576 V577 V589 W890	L560-Y573 HydrophobicContact CB-CE1 4.41Å; L560-Y573 HydrophobicContact CD1-CE1 4.15Å; P562-Y573 HydrophobicContact CB-CD1 4.37Å; P562-Y573 HydrophobicContact CB-CD2 4.3Å; P562-Y573 HydrophobicContact CB-CE1 3.9Å; P562-Y573 HydrophobicContact CB-CE2 3.82Å; P562-Y573 HydrophobicContact CG-CD1 4.49Å; P562-Y573 HydrophobicContact CG-CE1 3.92Å; E566-Y573 HydrophobicContact CB-CD2 3.74Å; E566-Y573 HydrophobicContact CB-CE2 3.97Å; E566-Y573 HydrophobicContact CG-CD2 4.4Å; E566-Y573 HydrophobicContact CG-CE2 4.47Å; D569-Y573 PolarHBondContact O-N 3.15Å; P570-Y573 PolarHBondContact O-N 3.27Å; L571-Y573 VanDerWaalsContact C-N 3.32Å; Y573-E575 VanDerWaalsContact C-N 3.3Å; Y573-E575 PolarHBondContact O-N 3.38Å; Y573-S576 PolarHBondContact O-N 3.42Å; Y573-S576 PolarHBondContact O-OG 3.37Å; Y573-V577 HydrophobicContact CE1-CG1 4.47Å; Y573-V577 HydrophobicContact CE2-CG1 3.99Å; Y573-V577 WeakPolarHBondContact O-CG2 3.38Å; Y573-V577 PolarHBondContact O-N 2.85Å; Y573-V589 HydrophobicContact CE1-CG1 4.33Å; Y573-W890 HydrophobicContact CD1-CH2 4.27Å; Y573-W890 AromaticContact CD1-CZ2 3.96Å; Y573-W890 HydrophobicContact CD1-CZ2 3.96Å
574	I	94.8	Very high	93.6	Very high	4 Å²	4	63.5 Å²	63.5	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-37.6	179.1	-70.6	164	0	0	0	110.6	P570 V577 R578 W890 I938 V1009 F1011 F1031	P570-I574 HydrophobicContact CB-CD1 4.43Å; P570-I574 VanDerWaalsContact O-CB 3.32Å; P570-I574 WeakPolarHBondContact O-CB 3.43Å; P570-I574 WeakPolarHBondContact O-CD1 3.47Å; P570-I574 WeakPolarHBondContact O-CG1 3.33Å; P570-I574 PolarHBondContact O-N 3.12Å; I574-V577 WeakPolarHBondContact O-CG2 3.38Å; I574-R578 WeakPolarHBondContact O-CB 3.35Å; I574-R578 PolarHBondContact O-N 3.32Å; I574-W890 HydrophobicContact CD1-CH2 4.35Å; I574-W890 HydrophobicContact CG1-CH2 4.46Å; I574-I938 HydrophobicContact CD1-CD1 3.56Å; I574-V1009 HydrophobicContact CD1-CG1 4.13Å; I574-V1009 HydrophobicContact CD1-CG2 4.03Å; I574-V1009 HydrophobicContact CG1-CG2 4.47Å; I574-V1009 HydrophobicContact CG2-CG1 4.33Å; I574-F1011 HydrophobicContact CG2-CE1 4.18Å; I574-F1011 HydrophobicContact CG2-CZ 4.19Å; I574-F1031 HydrophobicContact CD1-CZ 4.14Å; I574-F1031 HydrophobicContact CG2-CE2 4.33Å; I574-F1031 HydrophobicContact CG2-CZ 4.11Å
575	E	92.3	Very high	93.7	Very high	69 Å²	69	60.3 Å²	60.3	32%	0.322	30%	0.304	S	S	.	.	H	α-helix	trans	-67.9	-39	176.6	-159	68.2	-126.6	0	0	111.9	L571 Y573 V577 R578 T1033	L571-E575 VanDerWaalsContact O-CB 3.27Å; L571-E575 WeakPolarHBondContact O-CB 3.37Å; L571-E575 PolarHBondContact O-N 3.33Å; Y573-E575 VanDerWaalsContact C-N 3.3Å; Y573-E575 PolarHBondContact O-N 3.38Å; E575-V577 VanDerWaalsContact C-N 3.34Å; E575-V577 PolarHBondContact O-N 3.33Å; E575-R578 WeakPolarHBondContact O-CB 3.47Å; E575-R578 PolarHBondContact O-N 3.02Å; E575-R578 IonicContact OE1-CZ 3.86Å; E575-R578 IonicContact OE1-NE 3.9Å; E575-R578 PolarHBondContact OE1-NE 3.24Å; E575-R578 IonicContact OE1-NH2 2.71Å; E575-R578 PolarHBondContact OE1-NH2 2.84Å; E575-R578 IonicContact OE2-CZ 2.64Å; E575-R578 IonicContact OE2-NE 2.65Å; E575-R578 IonicContact OE2-NH2 3.34Å; E575-R578 PolarHBondContact OE2-NH2 3.35Å; E575-T1033 WeakPolarHBondContact OE2-CG2 3.37Å; E575-T1033 PolarHBondContact OE2-OG1 3.23Å
576	S	93.8	Very high	93.9	Very high	83 Å²	83	51.3 Å²	51.3	58%	0.58	27%	0.265	S	S	*	.	H	α-helix	trans	-70.4	-26.5	-179.9	74.4	0	0	0	0	114.1	I572 Y573	I572-S576 PolarHBondContact O-N 3.44Å; I572-S576 VanDerWaalsContact O-N 3.07Å; Y573-S576 PolarHBondContact O-N 3.42Å; Y573-S576 PolarHBondContact O-OG 3.37Å
577	V	94.2	Very high	94	Very high	13 Å²	13	46.6 Å²	46.6	8%	0.079	24%	0.243	C	C	.	.	H	α-helix	trans	-93.3	-16.2	174.5	-56.9	0	0	0	0	113.6	L560 Y573 I574 E575 A579 Q580 V581	L560-V577 HydrophobicContact CD1-CB 4.18Å; L560-V577 HydrophobicContact CD1-CG1 4.31Å; L560-V577 HydrophobicContact CD1-CG2 3.65Å; Y573-V577 HydrophobicContact CE1-CG1 4.47Å; Y573-V577 HydrophobicContact CE2-CG1 3.99Å; Y573-V577 WeakPolarHBondContact O-CG2 3.38Å; Y573-V577 PolarHBondContact O-N 2.85Å; I574-V577 WeakPolarHBondContact O-CG2 3.38Å; E575-V577 VanDerWaalsContact C-N 3.34Å; E575-V577 PolarHBondContact O-N 3.33Å; V577-A579 PolarHBondContact O-N 2.92Å; V577-Q580 WeakPolarHBondContact O-CB 3.33Å; V577-Q580 PolarHBondContact O-N 3.03Å; V577-V581 HydrophobicContact CG2-CG2 4.15Å; V577-V581 PolarHBondContact O-N 3.03Å
578	R	93.2	Very high	94.1	Very high	34 Å²	34	47.8 Å²	47.8	13%	0.128	25%	0.247	C	C	.	.	H	α-helix	trans	-42.2	-58	-170.3	-178.1	-166.1	-69	-92.2	6	112.8	I574 E575 Q580 V581 E582 F1011 T1033	I574-R578 WeakPolarHBondContact O-CB 3.35Å; I574-R578 PolarHBondContact O-N 3.32Å; E575-R578 WeakPolarHBondContact O-CB 3.47Å; E575-R578 PolarHBondContact O-N 3.02Å; E575-R578 IonicContact OE1-CZ 3.86Å; E575-R578 IonicContact OE1-NE 3.9Å; E575-R578 PolarHBondContact OE1-NE 3.24Å; E575-R578 IonicContact OE1-NH2 2.71Å; E575-R578 PolarHBondContact OE1-NH2 2.84Å; E575-R578 IonicContact OE2-CZ 2.64Å; E575-R578 IonicContact OE2-NE 2.65Å; E575-R578 IonicContact OE2-NH2 3.34Å; E575-R578 PolarHBondContact OE2-NH2 3.35Å; R578-Q580 PolarHBondContact O-N 3.07Å; R578-V581 PolarHBondContact O-N 3.46Å; R578-E582 WeakPolarHBondContact CD-OE2 3.14Å; R578-E582 HydrophobicContact CG-CB 4Å; R578-E582 VanDerWaalsContact CG-CD 3.46Å; R578-E582 HydrophobicContact CG-CG 4.34Å; R578-E582 WeakPolarHBondContact CG-OE2 3.32Å; R578-E582 IonicContact CZ-OE1 2.81Å; R578-E582 IonicContact NH1-OE1 2.76Å; R578-E582 PolarHBondContact NH1-OE1 3.35Å; R578-E582 VanDerWaalsContact O-CB 3.28Å; R578-E582 WeakPolarHBondContact O-CB 3.34Å; R578-E582 PolarHBondContact O-N 2.89Å; R578-F1011 HydrophobicContact CG-CE1 4.12Å; R578-T1033 PolarHBondContact NH2-OG1 3.43Å
579	A	91.9	Very high	94.4	Very high	94 Å²	94	41.3 Å²	41.3	78%	0.777	22%	0.217	S	C	*	.	H	α-helix	trans	-59.2	-17.5	-175.5	0	0	0	0	0	114.8	V577	V577-A579 PolarHBondContact O-N 2.92Å
580	Q	91.9	Very high	94.6	Very high	135 Å²	135	41.8 Å²	41.8	63%	0.631	22%	0.219	S	C	*	.	H	α-helix	trans	-91	-27.8	176.4	-56.5	179.8	49	0	0	112.7	V577 R578 K583	V577-Q580 WeakPolarHBondContact O-CB 3.33Å; V577-Q580 PolarHBondContact O-N 3.03Å; R578-Q580 PolarHBondContact O-N 3.07Å; Q580-K583 WeakPolarHBondContact O-CE 3.36Å
581	V	94.4	Very high	94.7	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-115.3	-25.2	-168.2	-58.3	0	0	0	0	114.9	P558 L560 V577 R578 K583 F584 C587 F1011	P558-V581 HydrophobicContact CB-CG1 3.88Å; P558-V581 HydrophobicContact CG-CB 3.9Å; P558-V581 HydrophobicContact CG-CG1 3.71Å; L560-V581 HydrophobicContact CD1-CG1 4.4Å; L560-V581 HydrophobicContact CD2-CG1 4.21Å; V577-V581 HydrophobicContact CG2-CG2 4.15Å; V577-V581 PolarHBondContact O-N 3.03Å; R578-V581 PolarHBondContact O-N 3.46Å; V581-K583 VanDerWaalsContact C-N 3.26Å; V581-K583 PolarHBondContact O-N 2.91Å; V581-F584 WeakPolarHBondContact O-CB 3.43Å; V581-F584 PolarHBondContact O-N 2.73Å; V581-C587 HydrophobicContact CB-CB 3.98Å; V581-C587 HydrophobicContact CG1-CB 4.19Å; V581-C587 HydrophobicContact CG2-CB 4.21Å; V581-F1011 HydrophobicContact CG2-CE1 4.47Å; V581-F1011 HydrophobicContact CG2-CE2 3.67Å; V581-F1011 HydrophobicContact CG2-CZ 3.51Å
582	E	92.4	Very high	94.8	Very high	65 Å²	65	42.8 Å²	42.8	30%	0.304	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-61.8	-33.2	-174.7	-172.3	162.3	-117.1	0	0	112.4	R578 F584 G585 F1011	R578-E582 WeakPolarHBondContact CD-OE2 3.14Å; R578-E582 HydrophobicContact CG-CB 4Å; R578-E582 VanDerWaalsContact CG-CD 3.46Å; R578-E582 HydrophobicContact CG-CG 4.34Å; R578-E582 WeakPolarHBondContact CG-OE2 3.32Å; R578-E582 IonicContact CZ-OE1 2.81Å; R578-E582 IonicContact NH1-OE1 2.76Å; R578-E582 PolarHBondContact NH1-OE1 3.35Å; R578-E582 VanDerWaalsContact O-CB 3.28Å; R578-E582 WeakPolarHBondContact O-CB 3.34Å; R578-E582 PolarHBondContact O-N 2.89Å; E582-F584 PolarHBondContact O-N 3.22Å; E582-F584 VanDerWaalsContact O-N 3.09Å; E582-G585 WeakPolarHBondContact O-CA 3.32Å; E582-G585 PolarHBondContact O-N 3.14Å; E582-F1011 HydrophobicContact CB-CD1 4.08Å; E582-F1011 HydrophobicContact CB-CE1 4.4Å; E582-F1011 HydrophobicContact CB-CG 4.3Å; E582-F1011 HydrophobicContact CG-CB 4.12Å; E582-F1011 HydrophobicContact CG-CD1 3.84Å; E582-F1011 HydrophobicContact CG-CG 4.05Å; E582-F1011 WeakPolarHBondContact OE1-CD1 3.22Å
583	K	93	Very high	94.7	Very high	119 Å²	119	42.1 Å²	42.1	52%	0.517	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-61.6	-10.8	172.1	71.4	-177.5	-175.3	-176.3	0	115.8	Q580 V581 P953	Q580-K583 WeakPolarHBondContact O-CE 3.36Å; V581-K583 VanDerWaalsContact C-N 3.26Å; V581-K583 PolarHBondContact O-N 2.91Å; K583-P953 WeakPolarHBondContact O-CG 3.2Å
584	F	94.6	Very high	94.6	Very high	47 Å²	47	46.2 Å²	46.2	21%	0.206	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-100.9	-0.2	172.5	-63	-90.2	0	0	0	111.8	P558 V581 E582 M586 H998	P558-F584 HydrophobicContact CG-CB 4.28Å; P558-F584 HydrophobicContact CG-CD2 3.68Å; P558-F584 HydrophobicContact CG-CE2 4.09Å; P558-F584 HydrophobicContact CG-CG 4.06Å; V581-F584 WeakPolarHBondContact O-CB 3.43Å; V581-F584 PolarHBondContact O-N 2.73Å; E582-F584 PolarHBondContact O-N 3.22Å; E582-F584 VanDerWaalsContact O-N 3.09Å; F584-M586 PolarHBondContact O-N 3.15Å; F584-H998 AromaticContact CD1-CE1 3.64Å; F584-H998 AromaticContact CD1-CG 4Å; F584-H998 AromaticContact CD1-ND1 3.72Å; F584-H998 AromaticContact CD1-NE2 3.85Å; F584-H998 PolarHBondContact O-CD2 3.17Å
585	G	94.8	Very high	94.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	67	-16	-175	0	0	0	0	0	116.3	E582 F1011 S1014	E582-G585 WeakPolarHBondContact O-CA 3.32Å; E582-G585 PolarHBondContact O-N 3.14Å; G585-F1011 WeakPolarHBondContact O-CB 3.33Å; G585-F1011 PolarHBondContact O-N 2.92Å; G585-S1014 WeakPolarHBondContact CA-OG 3.38Å; G585-S1014 PolarHBondContact O-OG 2.84Å
586	M	96.1	Very high	94.6	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	155	-173.8	-170.3	151.6	69.8	0	0	111	I557 F584 W949 C951 V1008 V1009 C1010 V1016	I557-M586 HydrophobicContact CD1-CB 4.27Å; I557-M586 HydrophobicContact CD1-CE 3.26Å; I557-M586 HydrophobicContact CD1-CG 4.35Å; I557-M586 HydrophobicContact CG2-CB 4.49Å; I557-M586 WeakPolarHBondContact CG2-O 3.43Å; F584-M586 PolarHBondContact O-N 3.15Å; M586-W949 HydrophobicContact CE-CB 3.63Å; M586-W949 HydrophobicContact CE-CD2 4.45Å; M586-W949 HydrophobicContact CE-CE3 4.17Å; M586-W949 HydrophobicContact CE-CG 4.33Å; M586-W949 HydrophobicContact SD-CE3 4Å; M586-W949 HydrophobicContact SD-CZ3 4.47Å; M586-C951 HydrophobicContact CB-CB 3.9Å; M586-C951 HydrophobicContact CE-CB 3.56Å; M586-C951 HydrophobicContact SD-CB 4.32Å; M586-V1008 HydrophobicContact CE-CG1 4.42Å; M586-V1008 HydrophobicContact CG-CG1 3.58Å; M586-V1008 HydrophobicContact SD-CG1 3.32Å; M586-V1008 WeakPolarHBondContact SD-CG1 3.39Å; M586-V1009 CarbonylContact C-O 3.55Å; M586-V1009 VanDerWaalsContact CA-O 3.3Å; M586-V1009 WeakPolarHBondContact CA-O 3.29Å; M586-V1009 WeakPolarHBondContact CG-O 3.27Å; M586-C1010 PolarHBondContact SD-SG 2.89Å; M586-V1016 HydrophobicContact SD-CG1 4.07Å
587	C	97.4	Very high	94.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	155	165.3	76.3	0	0	0	0	112.1	P558 L560 V581 V1008 V1009 F1011	P558-C587 HydrophobicContact CG-CB 4.07Å; L560-C587 HydrophobicContact CD1-CB 4.25Å; V581-C587 HydrophobicContact CB-CB 3.98Å; V581-C587 HydrophobicContact CG1-CB 4.19Å; V581-C587 HydrophobicContact CG2-CB 4.21Å; C587-V1008 WeakPolarHBondContact O-CA 3.39Å; C587-V1009 PolarHBondContact N-O 3.31Å; C587-V1009 PolarHBondContact O-N 3.32Å; C587-F1011 HydrophobicContact CB-CE2 4.47Å
588	R	98	Very high	94.2	Very high	32 Å²	32	53.7 Å²	53.7	12%	0.121	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	121.1	175.9	-178	175	62.6	147.8	-6.2	109.4	P558 V559 L560 T1000 V1001 F1007	P558-R588 PolarHBondContact O-N 3.46Å; V559-R588 CarbonylContact C-O 3.52Å; V559-R588 WeakPolarHBondContact CA-O 3.5Å; V559-R588 VanDerWaalsContact CG2-NH2 3.3Å; L560-R588 PolarHBondContact N-O 2.88Å; R588-T1000 HydrophobicContact CB-CG2 4.43Å; R588-T1000 PolarHBondContact NE-OG1 3.25Å; R588-V1001 WeakPolarHBondContact CD-O 3.31Å; R588-V1001 PolarHBondContact NH1-O 3.1Å; R588-F1007 CarbonylContact C-O 3.56Å; R588-F1007 WeakPolarHBondContact CA-O 3.28Å
589	V	98.1	Very high	94.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	117.4	178.7	-166.7	0	0	0	0	109.6	L560 P562 Y573 W890 F1007 V1009	L560-V589 HydrophobicContact CB-CG1 4.35Å; L560-V589 HydrophobicContact CB-CG2 4.25Å; L560-V589 HydrophobicContact CD1-CG2 4.25Å; P562-V589 HydrophobicContact CG-CG1 3.85Å; Y573-V589 HydrophobicContact CE1-CG1 4.33Å; V589-W890 HydrophobicContact CB-CH2 4.34Å; V589-W890 HydrophobicContact CB-CZ3 4.44Å; V589-W890 HydrophobicContact CG1-CH2 3.96Å; V589-W890 HydrophobicContact CG1-CZ3 4.39Å; V589-W890 HydrophobicContact CG2-CH2 4.19Å; V589-W890 HydrophobicContact CG2-CZ3 4.47Å; V589-F1007 HydrophobicContact CB-CB 4.2Å; V589-F1007 PolarHBondContact N-O 2.9Å; V589-F1007 PolarHBondContact O-N 3.18Å; V589-V1009 HydrophobicContact CG2-CG2 4.01Å
590	I	97.8	Very high	93.7	Very high	39 Å²	39	55.1 Å²	55.1	20%	0.2	27%	0.265	C	S	.	.			trans	-93.4	113	171.4	-56.7	178.9	0	0	0	106.9	V559 L560 R561 Q1006	V559-I590 HydrophobicContact CG1-CD1 3.56Å; V559-I590 HydrophobicContact CG1-CG1 4.01Å; L560-I590 PolarHBondContact O-N 3.22Å; R561-I590 HydrophobicContact CG-CB 4.23Å; I590-Q1006 HydrophobicContact CG1-CG 4.19Å
591	P	97.2	Very high	93.7	Very high	16 Å²	16	50.2 Å²	50.2	10%	0.104	24%	0.243	C	C	.	.			trans	-74.7	166.1	-175.6	32.1	-36.3	0	0	0	112.4	F567 W595 G1005 F1007	F567-P591 HydrophobicContact CD2-CB 4.32Å; F567-P591 HydrophobicContact CE1-CB 4.1Å; F567-P591 HydrophobicContact CE2-CB 3.56Å; F567-P591 HydrophobicContact CZ-CB 3.44Å; F567-P591 VanDerWaalsContact CZ-CB 3.44Å; P591-W595 HydrophobicContact CB-CB 3.9Å; P591-W595 HydrophobicContact CB-CG 3.89Å; P591-W595 HydrophobicContact CG-CB 4.26Å; P591-W595 VanDerWaalsContact CG-CD1 3.44Å; P591-W595 HydrophobicContact CG-CG 4.09Å; P591-G1005 WeakPolarHBondContact CD-O 3.18Å; P591-G1005 WeakPolarHBondContact CG-O 3.3Å; P591-F1007 HydrophobicContact CB-CD2 4.48Å; P591-F1007 HydrophobicContact CB-CE2 4.09Å; P591-F1007 HydrophobicContact CG-CD2 4.34Å; P591-F1007 HydrophobicContact CG-CE2 4.09Å
592	P	96.3	Very high	93.4	Very high	9 Å²	9	54.7 Å²	54.7	6%	0.058	27%	0.267	C	S	.	.			trans	-52.9	147.8	174.3	-28.7	36.9	0	0	0	113.5	F567 D594 W595	F567-P592 HydrophobicContact CB-CG 3.74Å; F567-P592 HydrophobicContact CD1-CG 3.87Å; F567-P592 HydrophobicContact CG-CG 3.79Å; P592-D594 WeakPolarHBondContact CB-OD1 3.45Å; P592-D594 PolarHBondContact O-N 3.03Å; P592-W595 WeakPolarHBondContact O-CB 3.44Å; P592-W595 PolarHBondContact O-N 3.47Å
593	P	92.3	Very high	93.1	Very high	105 Å²	105	56.5 Å²	56.5	68%	0.682	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.7	-173.1	-24.6	35.3	0	0	0	116.3	R596	P593-R596 PolarHBondContact O-NE 2.85Å; P593-R596 PolarHBondContact O-NH2 3.01Å
594	D	91.7	Very high	92.9	Very high	103 Å²	103	58.3 Å²	58.3	55%	0.551	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-19.1	174.2	53.9	-65.4	0	0	0	113.6	P592 R596 F885	P592-D594 WeakPolarHBondContact CB-OD1 3.45Å; P592-D594 PolarHBondContact O-N 3.03Å; D594-R596 PolarHBondContact O-N 3.07Å; D594-F885 WeakPolarHBondContact O-CZ 3.47Å
595	W	94.4	Very high	92.8	Very high	14 Å²	14	56.3 Å²	56.3	5%	0.053	28%	0.28	C	S	.	.			trans	-69.8	100.6	172.7	178.1	-100.4	0	0	0	110.9	F567 P591 P592 P597 F877 F885 H888 W890 Y940 F1007	F567-W595 HydrophobicContact CE1-CB 4Å; F567-W595 AromaticContact CE1-CD2 3.65Å; F567-W595 HydrophobicContact CE1-CD2 3.65Å; F567-W595 AromaticContact CE1-CE3 3.65Å; F567-W595 HydrophobicContact CE1-CE3 3.65Å; F567-W595 AromaticContact CE1-CG 3.85Å; F567-W595 HydrophobicContact CE1-CG 3.85Å; F567-W595 HydrophobicContact CE1-CZ3 4.33Å; F567-W595 HydrophobicContact CZ-CB 4.42Å; F567-W595 AromaticContact CZ-CD2 3.84Å; F567-W595 HydrophobicContact CZ-CD2 3.84Å; F567-W595 HydrophobicContact CZ-CE3 4.21Å; F567-W595 AromaticContact CZ-CG 3.95Å; F567-W595 HydrophobicContact CZ-CG 3.95Å; P591-W595 HydrophobicContact CB-CB 3.9Å; P591-W595 HydrophobicContact CB-CG 3.89Å; P591-W595 HydrophobicContact CG-CB 4.26Å; P591-W595 VanDerWaalsContact CG-CD1 3.44Å; P591-W595 HydrophobicContact CG-CG 4.09Å; P592-W595 WeakPolarHBondContact O-CB 3.44Å; P592-W595 PolarHBondContact O-N 3.47Å; W595-P597 HydrophobicContact CD2-CG 4.45Å; W595-P597 HydrophobicContact CZ2-CG 3.96Å; W595-F877 HydrophobicContact CH2-CE1 4.48Å; W595-F877 AromaticContact CZ2-CE1 3.82Å; W595-F877 HydrophobicContact CZ2-CE1 3.82Å; W595-F885 HydrophobicContact CE3-CB 4.41Å; W595-F885 AromaticContact CE3-CD1 3.43Å; W595-F885 HydrophobicContact CE3-CD1 3.43Å; W595-F885 VanDerWaalsContact CE3-CD1 3.43Å; W595-F885 AromaticContact CE3-CE1 3.88Å; W595-F885 HydrophobicContact CE3-CE1 3.88Å; W595-F885 HydrophobicContact CE3-CG 4.01Å; W595-F885 HydrophobicContact CH2-CB 4.11Å; W595-F885 HydrophobicContact CZ3-CB 3.7Å; W595-F885 AromaticContact CZ3-CD1 3.46Å; W595-F885 HydrophobicContact CZ3-CD1 3.46Å; W595-F885 VanDerWaalsContact CZ3-CD1 3.46Å; W595-F885 HydrophobicContact CZ3-CE1 4.36Å; W595-F885 AromaticContact CZ3-CG 3.8Å; W595-F885 HydrophobicContact CZ3-CG 3.8Å; W595-H888 AromaticContact CE3-ND1 3.88Å; W595-H888 HydrophobicContact CH2-CB 4.08Å; W595-H888 AromaticContact CH2-ND1 3.73Å; W595-H888 HydrophobicContact CZ3-CB 3.7Å; W595-H888 AromaticContact CZ3-CE1 3.96Å; W595-H888 AromaticContact CZ3-CG 3.53Å; W595-H888 AromaticContact CZ3-ND1 3.17Å; W595-H888 WeakPolarHBondContact CZ3-ND1 3.42Å; W595-W890 HydrophobicContact CH2-CB 3.88Å; W595-W890 HydrophobicContact CZ2-CB 3.97Å; W595-W890 HydrophobicContact CZ3-CB 4.5Å; W595-Y940 AromaticContact NE1-CE2 3.57Å; W595-Y940 AromaticContact NE1-CZ 3.69Å; W595-Y940 PolarHBondContact NE1-OH 2.84Å; W595-F1007 AromaticContact CE2-CZ 3.81Å; W595-F1007 HydrophobicContact CZ2-CE2 4.5Å; W595-F1007 AromaticContact CZ2-CZ 3.75Å; W595-F1007 HydrophobicContact CZ2-CZ 3.75Å; W595-F1007 AromaticContact NE1-CE2 3.59Å; W595-F1007 AromaticContact NE1-CZ 3.58Å
596	R	92.2	Very high	92.7	Very high	180 Å²	180	63.7 Å²	63.7	68%	0.679	31%	0.308	S	S	*	.			trans	-141.3	66.3	-179.3	-59.6	-174.7	-170.4	-128.1	-7.5	111.8	P593 D594 E598	P593-R596 PolarHBondContact O-NE 2.85Å; P593-R596 PolarHBondContact O-NH2 3.01Å; D594-R596 PolarHBondContact O-N 3.07Å; R596-E598 PolarHBondContact O-N 3.42Å
597	P	93.3	Very high	92.6	Very high	13 Å²	13	64 Å²	64	8%	0.084	31%	0.31	C	S	.	.			trans	-63.8	129.2	173	27.9	-34.5	0	0	0	110.7	W595 F877 P878 F885 Y940	W595-P597 HydrophobicContact CD2-CG 4.45Å; W595-P597 HydrophobicContact CZ2-CG 3.96Å; P597-F877 HydrophobicContact CB-CD1 4.05Å; P597-F877 HydrophobicContact CB-CE1 4.31Å; P597-F877 HydrophobicContact CG-CD1 4.21Å; P597-F877 HydrophobicContact CG-CE1 3.95Å; P597-P878 HydrophobicContact CB-CG 4.3Å; P597-F885 HydrophobicContact CB-CB 4.42Å; P597-F885 HydrophobicContact CB-CD2 4.19Å; P597-Y940 HydrophobicContact CG-CE1 4.16Å; P597-Y940 WeakPolarHBondContact CG-OH 3.48Å
598	E	88.1	Confident	92.5	Very high	120 Å²	120	67.6 Å²	67.6	56%	0.561	33%	0.331	S	S	*	.			trans	-74.1	127.4	178.3	-63.3	-177.6	136.6	0	0	110.9	R596 K600	R596-E598 PolarHBondContact O-N 3.42Å; E598-K600 HydrophobicContact CB-CG 4.37Å; E598-K600 PolarHBondContact O-N 3.41Å; E598-K600 WeakPolarHBondContact OE2-CE 3.49Å; E598-K600 IonicContact OE2-NZ 3.91Å; E598-K600 PolarHBondContact OE2-NZ 2.82Å
599	C	90.9	Very high	92.3	Very high	47 Å²	47	66.3 Å²	66.3	32%	0.318	33%	0.327	S	S	.	.			trans	-82.4	106	176	-168.6	0	0	0	0	111	G876 H942 T943	C599-G876 WeakPolarHBondContact CA-O 3.43Å; C599-H942 HydrophobicContact CB-CB 4.02Å; C599-T943 HydrophobicContact CB-CG2 4.48Å
600	K	83.9	Confident	92.1	Very high	111 Å²	111	70.6 Å²	70.6	48%	0.483	35%	0.347	S	S	.	.			trans	-113.5	59.8	-174.1	-68.2	177.1	-175.8	163.2	0	112.8	E598 E883	E598-K600 HydrophobicContact CB-CG 4.37Å; E598-K600 PolarHBondContact O-N 3.41Å; E598-K600 WeakPolarHBondContact OE2-CE 3.49Å; E598-K600 IonicContact OE2-NZ 3.91Å; E598-K600 PolarHBondContact OE2-NZ 2.82Å; K600-E883 IonicContact NZ-OE1 2.68Å; K600-E883 PolarHBondContact NZ-OE1 3.49Å
601	L	90.1	Very high	91.9	Very high	32 Å²	32	70 Å²	70	17%	0.168	34%	0.344	C	S	.	.			trans	-77.7	152.2	169.7	-61.9	178.6	0	0	0	111.2	M605 L822 L917 V1025	L601-M605 HydrophobicContact CD1-CE 4.36Å; L601-L822 HydrophobicContact CB-CD2 4.05Å; L601-L822 HydrophobicContact CD1-CD2 4.29Å; L601-L917 HydrophobicContact CD1-CD1 4.2Å; L601-L917 HydrophobicContact CD1-CD2 3.84Å; L601-L917 HydrophobicContact CD2-CD1 4.49Å; L601-L917 HydrophobicContact CD2-CD2 3.71Å; L601-L917 HydrophobicContact CG-CD2 4.46Å; L601-V1025 HydrophobicContact CD1-CG1 3.61Å
602	N	88.4	Confident	91.7	Very high	96 Å²	96	69.5 Å²	69.5	51%	0.513	34%	0.34	S	S	.	.			trans	-80.4	123.8	172.6	-178.9	-1.4	0	0	0	110.3	E604 M605	N602-E604 PolarHBondContact O-N 2.78Å; N602-E604 PolarHBondContact OD1-N 3.35Å; N602-M605 HydrophobicContact CB-CB 4.35Å; N602-M605 WeakPolarHBondContact O-CB 3.33Å; N602-M605 PolarHBondContact O-N 3.01Å
603	D	87	Confident	91.6	Very high	104 Å²	104	69.8 Å²	69.8	56%	0.556	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-31.5	175.6	-88.7	-31.7	0	0	0	113.4	M605 L822 T823	D603-M605 VanDerWaalsContact C-N 3.28Å; D603-M605 PolarHBondContact O-N 2.71Å; D603-L822 PolarHBondContact O-N 2.97Å; D603-T823 WeakPolarHBondContact CB-OG1 3.31Å; D603-T823 PolarHBondContact O-N 3.2Å; D603-T823 PolarHBondContact O-OG1 3.24Å; D603-T823 VanDerWaalsContact O-OG1 3.12Å
604	E	88.4	Confident	91.7	Very high	156 Å²	156	64.8 Å²	64.8	73%	0.729	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-4.5	176.1	-58.6	-164.6	161.1	0	0	113.5	N602 R606	N602-E604 PolarHBondContact O-N 2.78Å; N602-E604 PolarHBondContact OD1-N 3.35Å; E604-R606 PolarHBondContact O-N 3.4Å; E604-R606 VanDerWaalsContact O-N 3.13Å
605	M	92	Very high	91.6	Very high	6 Å²	6	60 Å²	60	3%	0.03	28%	0.283	C	S	.	.			trans	-51.7	119.1	176.3	177.9	-178.9	68	0	0	110.4	L601 N602 D603 F607 S821 L822 H873 L917 I919	L601-M605 HydrophobicContact CD1-CE 4.36Å; N602-M605 HydrophobicContact CB-CB 4.35Å; N602-M605 WeakPolarHBondContact O-CB 3.33Å; N602-M605 PolarHBondContact O-N 3.01Å; D603-M605 VanDerWaalsContact C-N 3.28Å; D603-M605 PolarHBondContact O-N 2.71Å; M605-F607 HydrophobicContact CE-CD1 4.18Å; M605-F607 HydrophobicContact CE-CE1 4.37Å; M605-S821 CarbonylContact O-C 3.53Å; M605-S821 VanDerWaalsContact O-CA 3.27Å; M605-S821 WeakPolarHBondContact O-CA 3.26Å; M605-L822 HydrophobicContact CE-CB 4.36Å; M605-L822 HydrophobicContact CE-CD1 3.92Å; M605-L822 HydrophobicContact CE-CD2 4.19Å; M605-L822 HydrophobicContact CE-CG 4.39Å; M605-L822 PolarHBondContact O-N 2.94Å; M605-H873 HydrophobicContact CG-CB 4.02Å; M605-H873 HydrophobicContact SD-CB 3.7Å; M605-L917 HydrophobicContact CE-CD2 4.02Å; M605-L917 HydrophobicContact SD-CD2 4.17Å; M605-I919 HydrophobicContact CE-CD1 3.66Å
606	R	93.1	Very high	91.4	Very high	154 Å²	154	59.7 Å²	59.7	58%	0.581	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.1	178.3	-77.1	175.3	173.6	-88.5	-0.2	111.2	E604 V820 H873	E604-R606 PolarHBondContact O-N 3.4Å; E604-R606 VanDerWaalsContact O-N 3.13Å; R606-V820 VanDerWaalsContact CA-O 3.27Å; R606-V820 WeakPolarHBondContact CA-O 3.25Å; R606-H873 PolarHBondContact O-CE1 2.9Å; R606-H873 PolarHBondContact O-NE2 2.78Å
607	F	94.3	Very high	91.2	Very high	8 Å²	8	51.1 Å²	51.1	4%	0.035	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	156.9	175.9	58.2	-85.9	0	0	0	110.7	M605 T609 S819 V820 L822 F825 V868 I919	M605-F607 HydrophobicContact CE-CD1 4.18Å; M605-F607 HydrophobicContact CE-CE1 4.37Å; F607-T609 HydrophobicContact CD2-CG2 4.41Å; F607-T609 HydrophobicContact CE2-CG2 3.98Å; F607-S819 VanDerWaalsContact O-CA 3.27Å; F607-S819 WeakPolarHBondContact O-CA 3.33Å; F607-V820 HydrophobicContact CE2-CG2 4.35Å; F607-V820 HydrophobicContact CZ-CG2 4.26Å; F607-V820 PolarHBondContact N-O 3.14Å; F607-V820 VanDerWaalsContact N-O 3.07Å; F607-V820 PolarHBondContact O-N 3.05Å; F607-L822 HydrophobicContact CE1-CB 4.49Å; F607-L822 HydrophobicContact CE1-CD1 4.01Å; F607-F825 HydrophobicContact CE1-CB 4.47Å; F607-F825 AromaticContact CE2-CD2 3.8Å; F607-F825 HydrophobicContact CE2-CD2 3.8Å; F607-F825 HydrophobicContact CE2-CE2 4.17Å; F607-F825 HydrophobicContact CE2-CG 4.36Å; F607-F825 HydrophobicContact CZ-CB 3.82Å; F607-F825 HydrophobicContact CZ-CD1 4.46Å; F607-F825 AromaticContact CZ-CD2 3.63Å; F607-F825 HydrophobicContact CZ-CD2 3.63Å; F607-F825 HydrophobicContact CZ-CE2 4.29Å; F607-F825 AromaticContact CZ-CG 3.72Å; F607-F825 HydrophobicContact CZ-CG 3.72Å; F607-V868 HydrophobicContact CB-CG2 3.55Å; F607-V868 HydrophobicContact CD2-CG2 4.34Å; F607-V868 HydrophobicContact CG-CG2 3.94Å; F607-I919 HydrophobicContact CD1-CD1 3.85Å; F607-I919 HydrophobicContact CD2-CD1 4.43Å; F607-I919 HydrophobicContact CE1-CD1 3.54Å; F607-I919 HydrophobicContact CE2-CD1 4.15Å; F607-I919 HydrophobicContact CG-CD1 4.29Å; F607-I919 HydrophobicContact CZ-CB 4.3Å; F607-I919 HydrophobicContact CZ-CD1 3.7Å; F607-I919 HydrophobicContact CZ-CG2 4.01Å
608	V	94.2	Very high	90.8	Very high	75 Å²	75	50.9 Å²	50.9	46%	0.455	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	127.1	173.3	179.2	0	0	0	0	108.3	K816 G817	V608-K816 HydrophobicContact CG1-CG 4.11Å; V608-G817 WeakPolarHBondContact CG1-O 3.29Å
609	T	94.4	Very high	90.5	Very high	4 Å²	4	50 Å²	50	3%	0.025	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	156.8	174.9	48.4	0	0	0	0	111.9	F607 G817 R818 V820 F825 H864 C865	F607-T609 HydrophobicContact CD2-CG2 4.41Å; F607-T609 HydrophobicContact CE2-CG2 3.98Å; T609-G817 VanDerWaalsContact O-CA 3.25Å; T609-G817 WeakPolarHBondContact O-CA 3.39Å; T609-G817 PolarHBondContact O-N 2.83Å; T609-R818 PolarHBondContact N-O 3.26Å; T609-R818 PolarHBondContact OG1-N 3.26Å; T609-R818 PolarHBondContact OG1-O 3.48Å; T609-V820 HydrophobicContact CG2-CG2 3.65Å; T609-F825 HydrophobicContact CG2-CD2 3.92Å; T609-F825 HydrophobicContact CG2-CE2 4.18Å; T609-H864 HydrophobicContact CG2-CB 4.11Å; T609-C865 CarbonylContact C-O 3.57Å; T609-C865 VanDerWaalsContact CA-O 3.27Å; T609-C865 WeakPolarHBondContact CA-O 3.44Å
610	Q	94.4	Very high	90.2	Very high	90 Å²	90	48.2 Å²	48.2	42%	0.421	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135	159	-69.5	174.9	-23.5	0	0	107.8	I814 Y815 H864 C865	Q610-I814 HydrophobicContact CB-CG2 4.08Å; Q610-Y815 CarbonylContact C-O 3.58Å; Q610-Y815 WeakPolarHBondContact CA-O 3.45Å; Q610-H864 CarbonylContact O-C 3.57Å; Q610-H864 VanDerWaalsContact O-CA 3.28Å; Q610-H864 WeakPolarHBondContact O-CA 3.35Å; Q610-C865 PolarHBondContact N-O 3.12Å; Q610-C865 PolarHBondContact O-N 2.81Å
611	I	92.9	Very high	90.1	Very high	27 Å²	27	45 Å²	45	14%	0.138	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	129.7	176.7	-40.6	-173.2	0	0	0	107.9	I814 Y815 A862 V863	I611-I814 CarbonylContact O-C 3.56Å; I611-I814 VanDerWaalsContact O-CA 3.23Å; I611-I814 WeakPolarHBondContact O-CA 3.39Å; I611-Y815 PolarHBondContact N-O 3.23Å; I611-Y815 PolarHBondContact O-N 2.67Å; I611-A862 HydrophobicContact CG2-CB 4Å; I611-V863 CarbonylContact C-O 3.1Å; I611-V863 WeakPolarHBondContact CA-O 3.33Å
612	Q	94.1	Very high	89.9	Confident	5 Å²	5	43.9 Å²	43.9	2%	0.023	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	120.7	-176.9	-56.8	-172.3	-49.1	0	0	110.3	I614 I814 A862 V863 C865 T925	Q612-I614 HydrophobicContact CB-CD1 4.23Å; Q612-I614 PolarHBondContact O-N 3.48Å; Q612-I814 HydrophobicContact CG-CD1 4.45Å; Q612-I814 HydrophobicContact CG-CG1 4.22Å; Q612-I814 HydrophobicContact CG-CG2 4.36Å; Q612-A862 WeakPolarHBondContact O-CA 3.46Å; Q612-V863 HydrophobicContact CB-CG2 4.06Å; Q612-V863 PolarHBondContact N-O 3.38Å; Q612-V863 PolarHBondContact O-N 3.09Å; Q612-C865 VanDerWaalsContact CD-SG 3.57Å; Q612-T925 PolarHBondContact NE2-O 2.79Å; Q612-T925 PolarHBondContact OE1-O 2.97Å
613	H	93.3	Very high	89.9	Confident	16 Å²	16	42.9 Å²	42.9	7%	0.074	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	90.2	-178	-71.4	-145.8	0	0	0	108.4	H615 K616 L617 E652 C813 Y815 H860 V861	H613-H615 VanDerWaalsContact C-N 3.34Å; H613-H615 AromaticContact ND1-CE1 3.99Å; H613-H615 PolarHBondContact O-N 2.82Å; H613-K616 HydrophobicContact CB-CB 4.27Å; H613-K616 HydrophobicContact CB-CD 4.1Å; H613-K616 HydrophobicContact CB-CG 4.15Å; H613-K616 WeakPolarHBondContact O-CA 3.43Å; H613-K616 WeakPolarHBondContact O-CB 3.41Å; H613-K616 PolarHBondContact O-N 3.44Å; H613-L617 PolarHBondContact O-N 3.32Å; H613-E652 IonicContact CE1-OE2 3.42Å; H613-E652 IonicContact NE2-OE2 2.93Å; H613-C813 PolarHBondContact N-O 2.86Å; H613-Y815 AromaticContact CD2-CD2 3.72Å; H613-Y815 AromaticContact CD2-CE2 3.77Å; H613-Y815 AromaticContact CE1-CD2 3.98Å; H613-Y815 AromaticContact CE1-CE2 3.56Å; H613-Y815 AromaticContact CG-CE2 3.92Å; H613-Y815 AromaticContact ND1-CE2 3.79Å; H613-Y815 AromaticContact NE2-CD2 3.47Å; H613-Y815 WeakPolarHBondContact NE2-CD2 3.14Å; H613-Y815 AromaticContact NE2-CE2 3.52Å; H613-H860 AromaticContact CE1-CE1 3.86Å; H613-H860 AromaticContact ND1-CE1 3.81Å; H613-V861 CarbonylContact C-O 3.56Å; H613-V861 WeakPolarHBondContact CA-O 3.31Å
614	I	93.7	Very high	90	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-56.2	-46.5	-166.8	-56.8	-52.8	0	0	0	112.2	Q612 K616 L617 Y850 L853 V854 V861 V863 F923	Q612-I614 HydrophobicContact CB-CD1 4.23Å; Q612-I614 PolarHBondContact O-N 3.48Å; I614-K616 PolarHBondContact O-N 2.83Å; I614-L617 HydrophobicContact CD1-CD1 3.69Å; I614-L617 WeakPolarHBondContact O-CB 3.43Å; I614-L617 PolarHBondContact O-N 3.34Å; I614-Y850 HydrophobicContact CD1-CE2 4.4Å; I614-Y850 HydrophobicContact CG2-CD2 4.01Å; I614-Y850 HydrophobicContact CG2-CE2 3.8Å; I614-L853 HydrophobicContact CG2-CB 4.11Å; I614-V854 HydrophobicContact CG2-CG2 3.82Å; I614-V861 HydrophobicContact CB-CB 4.5Å; I614-V861 HydrophobicContact CG1-CG1 4.27Å; I614-V861 PolarHBondContact N-O 2.86Å; I614-V863 HydrophobicContact CD1-CG2 3.71Å; I614-V863 HydrophobicContact CG1-CG1 4.35Å; I614-V863 HydrophobicContact CG1-CG2 4.08Å; I614-F923 HydrophobicContact CD1-CB 4.16Å; I614-F923 VanDerWaalsContact CD1-O 3.31Å; I614-F923 WeakPolarHBondContact CD1-O 3.5Å; I614-F923 HydrophobicContact CG1-CB 4.01Å
615	H	90.4	Very high	90	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.009	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-56.9	-14	173.8	66.5	-70.7	0	0	0	116	H613 L853 K857 C859 H860 V861	H613-H615 VanDerWaalsContact C-N 3.34Å; H613-H615 AromaticContact ND1-CE1 3.99Å; H613-H615 PolarHBondContact O-N 2.82Å; H615-L853 WeakPolarHBondContact CA-O 3.25Å; H615-K857 VanDerWaalsContact O-CG 3.3Å; H615-K857 WeakPolarHBondContact O-CG 3.07Å; H615-C859 VanDerWaalsContact CB-O 3.29Å; H615-C859 WeakPolarHBondContact CB-O 3.48Å; H615-H860 AromaticContact CE1-CE1 3.83Å; H615-H860 AromaticContact CE1-CG 3.72Å; H615-H860 AromaticContact CE1-ND1 3.16Å; H615-H860 PolarHBondContact CE1-ND1 3.21Å; H615-H860 AromaticContact NE2-ND1 3.52Å; H615-V861 PolarHBondContact ND1-N 2.9Å; H615-V861 PolarHBondContact ND1-O 2.9Å
616	K	89.5	Confident	89.9	Confident	8 Å²	8	32.4 Å²	32.4	4%	0.035	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-100.5	-13.3	172.7	-64.9	-171.2	178.2	-172.4	0	113.8	H613 I614 G618 R620 V625 F810 K812 C813 Y815	H613-K616 HydrophobicContact CB-CB 4.27Å; H613-K616 HydrophobicContact CB-CD 4.1Å; H613-K616 HydrophobicContact CB-CG 4.15Å; H613-K616 WeakPolarHBondContact O-CA 3.43Å; H613-K616 WeakPolarHBondContact O-CB 3.41Å; H613-K616 PolarHBondContact O-N 3.44Å; I614-K616 PolarHBondContact O-N 2.83Å; K616-G618 VanDerWaalsContact C-N 3.26Å; K616-G618 PolarHBondContact O-N 3.15Å; K616-R620 WeakPolarHBondContact O-CD 3.35Å; K616-R620 PolarHBondContact O-NH1 3.01Å; K616-V625 HydrophobicContact CG-CG2 4.21Å; K616-F810 WeakPolarHBondContact CE-O 3.19Å; K616-F810 PolarHBondContact NZ-O 3.36Å; K616-K812 VanDerWaalsContact CD-O 3.25Å; K616-K812 WeakPolarHBondContact CD-O 3.37Å; K616-K812 PolarHBondContact NZ-O 2.86Å; K616-C813 HydrophobicContact CB-CB 3.67Å; K616-C813 HydrophobicContact CD-CB 4.29Å; K616-Y815 PolarHBondContact NZ-OH 3.48Å
617	L	88.7	Confident	89.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	-63.7	-30.1	-169.2	-69.5	179.1	0	0	0	113.2	H613 I614 R620 C813 I814 T925 V983 M984	H613-L617 PolarHBondContact O-N 3.32Å; I614-L617 HydrophobicContact CD1-CD1 3.69Å; I614-L617 WeakPolarHBondContact O-CB 3.43Å; I614-L617 PolarHBondContact O-N 3.34Å; L617-R620 VanDerWaalsContact C-NH1 3.32Å; L617-R620 PolarHBondContact O-NH1 3.41Å; L617-C813 HydrophobicContact CD2-CB 4.3Å; L617-I814 HydrophobicContact CD2-CG1 4.47Å; L617-T925 HydrophobicContact CD1-CG2 4.13Å; L617-V983 CarbonylContact O-C 3.54Å; L617-V983 WeakPolarHBondContact O-CA 3.48Å; L617-M984 HydrophobicContact CB-CB 3.99Å; L617-M984 HydrophobicContact CB-CG 3.93Å; L617-M984 HydrophobicContact CD1-CG 4.3Å; L617-M984 PolarHBondContact O-N 3.22Å
618	G	85.4	Confident	89.7	Confident	8 Å²	8	29.3 Å²	29.3	8%	0.082	14%	0.144	C	C	.	.	S	Bend	trans	-75	-125.3	168	0	0	0	0	0	111.5	K616 R620 M984	K616-G618 VanDerWaalsContact C-N 3.26Å; K616-G618 PolarHBondContact O-N 3.15Å; G618-R620 PolarHBondContact O-NH1 3.49Å; G618-R620 VanDerWaalsContact O-NH1 3.13Å; G618-M984 WeakPolarHBondContact CA-O 3.46Å
619	R	82.1	Confident	89.5	Confident	102 Å²	102	25.8 Å²	25.8	39%	0.385	12%	0.122	S	C	.	.	S	Bend	trans	-66.8	135.7	166.4	-61.3	-166.3	-170	-86.3	-2.9	110.2	W621 L737 K857 L967	R619-W621 VanDerWaalsContact C-N 3.31Å; R619-W621 PolarHBondContact O-N 2.95Å; R619-L737 HydrophobicContact CB-CD2 3.91Å; R619-L737 HydrophobicContact CG-CD2 4.15Å; R619-K857 WeakPolarHBondContact O-CD 3.34Å; R619-K857 WeakPolarHBondContact O-CE 3.29Å; R619-L967 PolarHBondContact NH1-O 2.97Å; R619-L967 PolarHBondContact NH2-O 3.08Å
620	R	83.6	Confident	89.4	Confident	9 Å²	9	25.6 Å²	25.6	3%	0.034	12%	0.122	C	C	.	.	S	Bend	trans	-65.8	-29.9	-176.7	-55.6	-59.6	177.6	-124.2	3.2	113.4	K616 L617 G618 L737 H811 S981 N982	K616-R620 WeakPolarHBondContact O-CD 3.35Å; K616-R620 PolarHBondContact O-NH1 3.01Å; L617-R620 VanDerWaalsContact C-NH1 3.32Å; L617-R620 PolarHBondContact O-NH1 3.41Å; G618-R620 PolarHBondContact O-NH1 3.49Å; G618-R620 VanDerWaalsContact O-NH1 3.13Å; R620-L737 HydrophobicContact CB-CD2 4.45Å; R620-L737 HydrophobicContact CG-CD2 4.09Å; R620-H811 VanDerWaalsContact CD-O 3.25Å; R620-H811 WeakPolarHBondContact CD-O 3.3Å; R620-H811 PolarHBondContact NE-O 3.49Å; R620-S981 PolarHBondContact NH2-O 2.62Å; R620-N982 PolarHBondContact NH1-O 2.86Å; R620-N982 PolarHBondContact NH2-O 2.72Å
621	W	82.9	Confident	89.2	Confident	43 Å²	43	21.3 Å²	21.3	16%	0.163	10%	0.101	C	C	.	.			trans	-93.6	145.9	177	-162.8	-91.8	0	0	0	112.5	R619 V625 Q626 A629 V723 K727 L807 K857	R619-W621 VanDerWaalsContact C-N 3.31Å; R619-W621 PolarHBondContact O-N 2.95Å; W621-V625 HydrophobicContact CD2-CG1 3.98Å; W621-V625 HydrophobicContact CE3-CG1 3.62Å; W621-V625 HydrophobicContact CZ3-CG1 3.95Å; W621-Q626 HydrophobicContact CZ2-CB 3.62Å; W621-Q626 HydrophobicContact CZ2-CG 3.89Å; W621-A629 HydrophobicContact CH2-CB 4.15Å; W621-V723 HydrophobicContact CH2-CG1 3.81Å; W621-V723 HydrophobicContact CZ2-CG1 4.16Å; W621-K727 VanDerWaalsContact CD1-CE 3.42Å; W621-K727 HydrophobicContact CD2-CD 3.75Å; W621-K727 HydrophobicContact CD2-CG 4.31Å; W621-K727 HydrophobicContact CE3-CD 4.2Å; W621-K727 HydrophobicContact CE3-CG 4.26Å; W621-K727 HydrophobicContact CG-CD 4.16Å; W621-K727 HydrophobicContact CH2-CB 4.28Å; W621-K727 HydrophobicContact CH2-CD 4.27Å; W621-K727 HydrophobicContact CH2-CG 4.4Å; W621-K727 HydrophobicContact CZ2-CD 3.81Å; W621-K727 HydrophobicContact CZ2-CG 4.44Å; W621-K727 HydrophobicContact CZ3-CB 4.48Å; W621-K727 HydrophobicContact CZ3-CD 4.45Å; W621-K727 HydrophobicContact CZ3-CG 4.32Å; W621-L807 HydrophobicContact CH2-CD1 4.49Å; W621-L807 HydrophobicContact CH2-CD2 4.21Å; W621-L807 HydrophobicContact CZ3-CD1 4.46Å; W621-L807 HydrophobicContact CZ3-CD2 4.2Å; W621-K857 WeakPolarHBondContact O-CD 3.3Å
622	G	85.7	Confident	89.1	Confident	8 Å²	8	21.7 Å²	21.7	8%	0.082	10%	0.102	C	C	.	.			trans	-173.2	176.1	177.5	0	0	0	0	0	112	N624 V625 Q626	G622-N624 VanDerWaalsContact C-N 3.31Å; G622-N624 PolarHBondContact O-N 3.48Å; G622-V625 PolarHBondContact O-N 2.98Å; G622-V625 VanDerWaalsContact O-N 3.14Å; G622-Q626 PolarHBondContact O-N 3.48Å
623	P	87.4	Confident	89	Confident	76 Å²	76	23.3 Å²	23.3	49%	0.494	11%	0.109	S	C	.	.	H	α-helix	trans	-58.1	-37.7	-173.7	-26.2	35.4	0	0	0	114.2	R627	P623-R627 PolarHBondContact O-N 2.88Å
624	N	89.5	Confident	88.9	Confident	4 Å²	4	23.6 Å²	23.6	2%	0.021	11%	0.11	C	C	.	.	H	α-helix	trans	-65.6	-48.8	176.2	-165.9	-79.9	0	0	0	111.7	G622 Q626 R627 L628 D654 K857 D858 H860	G622-N624 VanDerWaalsContact C-N 3.31Å; G622-N624 PolarHBondContact O-N 3.48Å; N624-Q626 PolarHBondContact O-N 2.92Å; N624-R627 PolarHBondContact O-N 3.45Å; N624-L628 WeakPolarHBondContact O-CB 3.47Å; N624-L628 PolarHBondContact O-N 3.25Å; N624-D654 VanDerWaalsContact ND2-CG 3.35Å; N624-D654 PolarHBondContact ND2-OD1 3.47Å; N624-D654 PolarHBondContact ND2-OD2 2.97Å; N624-D654 VanDerWaalsContact ND2-OD2 3.15Å; N624-K857 WeakPolarHBondContact CB-O 3.38Å; N624-K857 PolarHBondContact N-O 2.99Å; N624-K857 VanDerWaalsContact N-O 3.14Å; N624-D858 WeakPolarHBondContact CB-O 3.49Å; N624-D858 PolarHBondContact ND2-O 3.48Å; N624-H860 PolarHBondContact ND2-N 3.5Å
625	V	89.1	Confident	88.7	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.012	11%	0.11	C	C	.	.	H	α-helix	trans	-60.3	-43.5	179.8	160.8	0	0	0	0	111.7	K616 W621 G622 R627 L628 A629 F810	K616-V625 HydrophobicContact CG-CG2 4.21Å; W621-V625 HydrophobicContact CD2-CG1 3.98Å; W621-V625 HydrophobicContact CE3-CG1 3.62Å; W621-V625 HydrophobicContact CZ3-CG1 3.95Å; G622-V625 PolarHBondContact O-N 2.98Å; G622-V625 VanDerWaalsContact O-N 3.14Å; V625-R627 PolarHBondContact O-N 3.18Å; V625-L628 PolarHBondContact O-N 3.19Å; V625-A629 WeakPolarHBondContact O-CB 3.48Å; V625-A629 PolarHBondContact O-N 3.18Å; V625-F810 HydrophobicContact CG1-CD1 3.74Å; V625-F810 HydrophobicContact CG1-CE1 4.39Å; V625-F810 HydrophobicContact CG1-CG 4.48Å
626	Q	89.9	Confident	88.7	Confident	39 Å²	39	29 Å²	29	18%	0.182	13%	0.134	C	C	.	.	H	α-helix	trans	-58.7	-46.7	175.6	178.5	165.3	-40.5	0	0	112.2	W621 G622 N624 A629 C630 E720	W621-Q626 HydrophobicContact CZ2-CB 3.62Å; W621-Q626 HydrophobicContact CZ2-CG 3.89Å; G622-Q626 PolarHBondContact O-N 3.48Å; N624-Q626 PolarHBondContact O-N 2.92Å; Q626-A629 PolarHBondContact O-N 3.43Å; Q626-C630 PolarHBondContact O-N 3.38Å; Q626-C630 PolarHBondContact O-SG 3.21Å; Q626-E720 PolarHBondContact NE2-OE1 2.95Å
627	R	90.8	Very high	88.6	Confident	85 Å²	85	32.6 Å²	32.6	32%	0.321	16%	0.16	S	C	.	.	H	α-helix	trans	-70.2	-38	179.4	-171.8	152.3	-66.4	134.7	8.7	112.4	P623 N624 V625 A629 C630 I631 A656	P623-R627 PolarHBondContact O-N 2.88Å; N624-R627 PolarHBondContact O-N 3.45Å; V625-R627 PolarHBondContact O-N 3.18Å; R627-A629 VanDerWaalsContact C-N 3.32Å; R627-A629 PolarHBondContact O-N 2.84Å; R627-C630 WeakPolarHBondContact O-CB 3.46Å; R627-C630 PolarHBondContact O-N 2.91Å; R627-I631 HydrophobicContact CG-CD1 4.21Å; R627-I631 WeakPolarHBondContact O-CG1 3.39Å; R627-I631 PolarHBondContact O-N 3.48Å; R627-A656 HydrophobicContact CB-CB 3.85Å; R627-A656 HydrophobicContact CG-CB 3.96Å
628	L	90.9	Very high	88.6	Confident	13 Å²	13	37.7 Å²	37.7	7%	0.068	18%	0.184	C	C	.	.	H	α-helix	trans	-65.4	-34.4	173.2	-178.7	59.1	0	0	0	112.2	N624 V625 I631 K632 M642 L645 L655 F810	N624-L628 WeakPolarHBondContact O-CB 3.47Å; N624-L628 PolarHBondContact O-N 3.25Å; V625-L628 PolarHBondContact O-N 3.19Å; L628-I631 PolarHBondContact O-N 2.81Å; L628-K632 WeakPolarHBondContact O-CB 3.35Å; L628-K632 PolarHBondContact O-N 3.35Å; L628-M642 HydrophobicContact CD1-CE 4.06Å; L628-L645 HydrophobicContact CD1-CD2 4.08Å; L628-L645 HydrophobicContact CD2-CD1 4.44Å; L628-L645 HydrophobicContact CD2-CD2 4.42Å; L628-L655 HydrophobicContact CD1-CB 4.39Å; L628-L655 HydrophobicContact CD1-CD1 4.23Å; L628-F810 HydrophobicContact CB-CE1 4.26Å; L628-F810 HydrophobicContact CD2-CE1 4.1Å; L628-F810 HydrophobicContact CG-CE1 4Å; L628-F810 HydrophobicContact CG-CZ 4.25Å
629	A	89.8	Confident	88.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.4	-41	172.6	0	0	0	0	0	112.1	W621 V625 Q626 R627 K632 K633 V723 L807 F810	W621-A629 HydrophobicContact CH2-CB 4.15Å; V625-A629 WeakPolarHBondContact O-CB 3.48Å; V625-A629 PolarHBondContact O-N 3.18Å; Q626-A629 PolarHBondContact O-N 3.43Å; R627-A629 VanDerWaalsContact C-N 3.32Å; R627-A629 PolarHBondContact O-N 2.84Å; A629-K632 PolarHBondContact O-N 2.59Å; A629-K633 WeakPolarHBondContact O-CB 3.31Å; A629-K633 PolarHBondContact O-N 2.96Å; A629-V723 HydrophobicContact CB-CG1 3.81Å; A629-L807 HydrophobicContact CB-CD2 3.67Å; A629-F810 HydrophobicContact CB-CE1 4.26Å; A629-F810 HydrophobicContact CB-CE2 4.25Å; A629-F810 HydrophobicContact CB-CZ 3.92Å
630	C	92.4	Very high	88.8	Confident	1 Å²	1	38 Å²	38	1%	0.007	21%	0.206	C	C	.	.	H	α-helix	trans	-59.3	-48.3	171.5	-61.1	0	0	0	0	111.3	Q626 R627 K633 H634 Y708 L719	Q626-C630 PolarHBondContact O-N 3.38Å; Q626-C630 PolarHBondContact O-SG 3.21Å; R627-C630 WeakPolarHBondContact O-CB 3.46Å; R627-C630 PolarHBondContact O-N 2.91Å; C630-K633 PolarHBondContact O-N 2.75Å; C630-H634 PolarHBondContact O-N 3.4Å; C630-Y708 HydrophobicContact CB-CE2 4Å; C630-L719 HydrophobicContact CB-CD2 4.22Å; C630-L719 HydrophobicContact CB-CG 4.22Å
631	I	91.5	Very high	88.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-49.5	176.9	-66.7	159.9	0	0	0	110.9	R627 L628 K633 H634 L635 M642 L655 L705 Y708	R627-I631 HydrophobicContact CG-CD1 4.21Å; R627-I631 WeakPolarHBondContact O-CG1 3.39Å; R627-I631 PolarHBondContact O-N 3.48Å; L628-I631 PolarHBondContact O-N 2.81Å; I631-K633 PolarHBondContact O-N 2.94Å; I631-H634 PolarHBondContact O-N 3.41Å; I631-L635 HydrophobicContact CG2-CD1 3.79Å; I631-L635 HydrophobicContact CG2-CG 4.39Å; I631-L635 WeakPolarHBondContact O-CB 3.49Å; I631-L635 VanDerWaalsContact O-CG 3.3Å; I631-L635 WeakPolarHBondContact O-CG 3.49Å; I631-L635 PolarHBondContact O-N 2.89Å; I631-M642 HydrophobicContact CG2-CE 4.31Å; I631-L655 HydrophobicContact CD1-CB 4.33Å; I631-L705 HydrophobicContact CD1-CD2 3.78Å; I631-L705 HydrophobicContact CG1-CD2 4.23Å; I631-L705 HydrophobicContact CG2-CD2 4.27Å; I631-Y708 HydrophobicContact CD1-CE1 4.48Å; I631-Y708 HydrophobicContact CG1-CD1 3.87Å; I631-Y708 HydrophobicContact CG1-CD2 4.04Å; I631-Y708 HydrophobicContact CG1-CE1 3.84Å; I631-Y708 HydrophobicContact CG1-CE2 3.99Å; I631-Y708 HydrophobicContact CG1-CG 3.99Å
632	K	90.9	Very high	88.5	Confident	34 Å²	34	40.8 Å²	40.8	15%	0.148	23%	0.229	C	C	.	.	H	α-helix	trans	-59.5	-41.6	176.7	-81.1	-151.7	-179.2	-155.1	0	112.5	L628 A629 L635 K636 M642 D643 V806 F810	L628-K632 WeakPolarHBondContact O-CB 3.35Å; L628-K632 PolarHBondContact O-N 3.35Å; A629-K632 PolarHBondContact O-N 2.59Å; K632-L635 PolarHBondContact O-N 2.77Å; K632-K636 WeakPolarHBondContact O-CB 3.32Å; K632-K636 PolarHBondContact O-N 3.25Å; K632-M642 HydrophobicContact CD-CE 4.5Å; K632-M642 WeakPolarHBondContact CE-O 3.41Å; K632-M642 HydrophobicContact CG-CE 3.6Å; K632-M642 PolarHBondContact NZ-O 2.94Å; K632-D643 PolarHBondContact NZ-O 2.94Å; K632-V806 HydrophobicContact CB-CG1 3.79Å; K632-F810 HydrophobicContact CD-CE2 4.12Å; K632-F810 HydrophobicContact CD-CZ 3.97Å; K632-F810 HydrophobicContact CG-CZ 4.3Å
633	K	90.6	Very high	88	Confident	39 Å²	39	46.7 Å²	46.7	17%	0.17	26%	0.258	C	S	.	.	H	α-helix	trans	-67.9	-41.2	179.8	-178	173.3	173.8	-179.7	0	112.1	A629 C630 I631 K636 S637 L719 E722 V723 E726	A629-K633 WeakPolarHBondContact O-CB 3.31Å; A629-K633 PolarHBondContact O-N 2.96Å; C630-K633 PolarHBondContact O-N 2.75Å; I631-K633 PolarHBondContact O-N 2.94Å; K633-K636 PolarHBondContact O-N 3.03Å; K633-S637 PolarHBondContact O-N 3.09Å; K633-S637 VanDerWaalsContact O-N 3.09Å; K633-L719 HydrophobicContact CB-CD1 4.13Å; K633-L719 HydrophobicContact CD-CD1 3.77Å; K633-L719 HydrophobicContact CG-CD1 3.87Å; K633-E722 WeakPolarHBondContact CE-OE2 2.5Å; K633-E722 IonicContact NZ-OE2 2.7Å; K633-E722 PolarHBondContact NZ-OE2 2.98Å; K633-V723 HydrophobicContact CB-CG2 4.38Å; K633-V723 HydrophobicContact CD-CG2 3.97Å; K633-E726 WeakPolarHBondContact CE-OE1 3.31Å; K633-E726 IonicContact NZ-OE1 2.73Å; K633-E726 PolarHBondContact NZ-OE1 3.44Å
634	H	91.4	Very high	87.6	Confident	22 Å²	22	49.9 Å²	49.9	10%	0.102	27%	0.267	C	S	.	.	H	α-helix	trans	-62.2	-48.4	172.2	176.5	70.7	0	0	0	111.9	C630 I631 K636 S637 Q638 S707 Y708 L711 L719	C630-H634 PolarHBondContact O-N 3.4Å; I631-H634 PolarHBondContact O-N 3.41Å; H634-K636 VanDerWaalsContact C-N 3.31Å; H634-K636 PolarHBondContact O-N 2.73Å; H634-S637 PolarHBondContact O-N 3.26Å; H634-S637 PolarHBondContact O-OG 3.41Å; H634-Q638 PolarHBondContact O-N 3Å; H634-Q638 VanDerWaalsContact O-N 3.1Å; H634-S707 WeakPolarHBondContact NE2-CA 3.45Å; H634-S707 WeakPolarHBondContact NE2-CB 3.42Å; H634-S707 PolarHBondContact NE2-O 2.67Å; H634-S707 PolarHBondContact NE2-OG 2.8Å; H634-Y708 HydrophobicContact CB-CD2 3.86Å; H634-Y708 PolarHBondContact NE2-N 3.28Å; H634-L711 VanDerWaalsContact CE1-CD2 3.41Å; H634-L711 WeakPolarHBondContact CE1-CD2 3.5Å; H634-L719 HydrophobicContact CB-CD2 3.89Å
635	L	91	Very high	87.4	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-41.8	178.2	-69.3	170.5	0	0	0	111.7	I631 K632 S637 Q638 G639 I640 M642 Y704	I631-L635 HydrophobicContact CG2-CD1 3.79Å; I631-L635 HydrophobicContact CG2-CG 4.39Å; I631-L635 WeakPolarHBondContact O-CB 3.49Å; I631-L635 VanDerWaalsContact O-CG 3.3Å; I631-L635 WeakPolarHBondContact O-CG 3.49Å; I631-L635 PolarHBondContact O-N 2.89Å; K632-L635 PolarHBondContact O-N 2.77Å; L635-S637 VanDerWaalsContact C-N 3.31Å; L635-S637 PolarHBondContact O-N 3.26Å; L635-Q638 CarbonylContact O-C 3.53Å; L635-Q638 WeakPolarHBondContact O-CA 3.34Å; L635-Q638 PolarHBondContact O-N 3.14Å; L635-G639 PolarHBondContact O-N 3.24Å; L635-I640 CarbonylContact C-O 3.26Å; L635-I640 HydrophobicContact CB-CB 4.15Å; L635-I640 HydrophobicContact CB-CG2 4.4Å; L635-I640 WeakPolarHBondContact CB-O 3.31Å; L635-I640 HydrophobicContact CD2-CB 4.24Å; L635-I640 HydrophobicContact CD2-CD1 4.03Å; L635-I640 HydrophobicContact CD2-CG2 4.21Å; L635-I640 WeakPolarHBondContact O-CA 3.44Å; L635-I640 PolarHBondContact O-N 2.92Å; L635-I640 VanDerWaalsContact O-O 3.14Å; L635-M642 HydrophobicContact CD1-CB 4.45Å; L635-M642 HydrophobicContact CD1-CE 3.83Å; L635-M642 HydrophobicContact CD1-SD 4.18Å; L635-Y704 HydrophobicContact CD1-CD1 4.03Å
636	K	88.9	Confident	87.3	Confident	114 Å²	114	51.5 Å²	51.5	50%	0.496	28%	0.276	S	S	.	.	H	α-helix	trans	-60.6	-36.4	173.7	-168.6	175.9	-178.8	-179	0	112.3	K632 K633 H634 Q638 G639 I640 V806	K632-K636 WeakPolarHBondContact O-CB 3.32Å; K632-K636 PolarHBondContact O-N 3.25Å; K633-K636 PolarHBondContact O-N 3.03Å; H634-K636 VanDerWaalsContact C-N 3.31Å; H634-K636 PolarHBondContact O-N 2.73Å; K636-Q638 VanDerWaalsContact C-N 3.29Å; K636-Q638 PolarHBondContact O-N 2.84Å; K636-G639 PolarHBondContact O-N 2.98Å; K636-G639 VanDerWaalsContact O-N 3.14Å; K636-I640 PolarHBondContact N-O 2.9Å; K636-V806 HydrophobicContact CD-CG2 3.71Å
637	S	88.7	Confident	87.2	Confident	84 Å²	84	52.5 Å²	52.5	59%	0.587	28%	0.283	S	S	*	.	H	α-helix	trans	-69.7	-24.8	175.3	83	0	0	0	0	113.4	K633 H634 L635 G639	K633-S637 PolarHBondContact O-N 3.09Å; K633-S637 VanDerWaalsContact O-N 3.09Å; H634-S637 PolarHBondContact O-N 3.26Å; H634-S637 PolarHBondContact O-OG 3.41Å; L635-S637 VanDerWaalsContact C-N 3.31Å; L635-S637 PolarHBondContact O-N 3.26Å; S637-G639 VanDerWaalsContact C-N 3.3Å
638	Q	87.7	Confident	86.9	Confident	108 Å²	108	48.8 Å²	48.8	51%	0.505	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	4.5	171.5	-57.7	-57.5	-67.3	0	0	113.4	H634 L635 K636 I640	H634-Q638 PolarHBondContact O-N 3Å; H634-Q638 VanDerWaalsContact O-N 3.1Å; L635-Q638 CarbonylContact O-C 3.53Å; L635-Q638 WeakPolarHBondContact O-CA 3.34Å; L635-Q638 PolarHBondContact O-N 3.14Å; K636-Q638 VanDerWaalsContact C-N 3.29Å; K636-Q638 PolarHBondContact O-N 2.84Å; Q638-I640 VanDerWaalsContact C-N 3.27Å; Q638-I640 HydrophobicContact CB-CD1 4.39Å; Q638-I640 HydrophobicContact CB-CG1 4.39Å; Q638-I640 PolarHBondContact O-N 2.94Å
639	G	85.8	Confident	86.2	Confident	66 Å²	66	49.6 Å²	49.6	68%	0.68	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	9.1	-175.8	0	0	0	0	0	115	L635 K636 S637	L635-G639 PolarHBondContact O-N 3.24Å; K636-G639 PolarHBondContact O-N 2.98Å; K636-G639 VanDerWaalsContact O-N 3.14Å; S637-G639 VanDerWaalsContact C-N 3.3Å
640	I	86.2	Confident	85.6	Confident	50 Å²	50	50.9 Å²	50.9	26%	0.256	29%	0.293	S	S	.	.			trans	-92.8	107.5	178.4	-57.7	174	0	0	0	108.8	L635 K636 Q638	L635-I640 CarbonylContact C-O 3.26Å; L635-I640 HydrophobicContact CB-CB 4.15Å; L635-I640 HydrophobicContact CB-CG2 4.4Å; L635-I640 WeakPolarHBondContact CB-O 3.31Å; L635-I640 HydrophobicContact CD2-CB 4.24Å; L635-I640 HydrophobicContact CD2-CD1 4.03Å; L635-I640 HydrophobicContact CD2-CG2 4.21Å; L635-I640 WeakPolarHBondContact O-CA 3.44Å; L635-I640 PolarHBondContact O-N 2.92Å; L635-I640 VanDerWaalsContact O-O 3.14Å; K636-I640 PolarHBondContact N-O 2.9Å; Q638-I640 VanDerWaalsContact C-N 3.27Å; Q638-I640 HydrophobicContact CB-CD1 4.39Å; Q638-I640 HydrophobicContact CB-CG1 4.39Å; Q638-I640 PolarHBondContact O-N 2.94Å
641	T	79.6	Confident	85.2	Confident	100 Å²	100	51.2 Å²	51.2	61%	0.613	30%	0.296	S	S	*	.			trans	-80.2	134.9	170.8	59.6	0	0	0	0	110.4
642	M	81	Confident	85.1	Confident	11 Å²	11	52.9 Å²	52.9	5%	0.054	30%	0.304	C	S	.	.			trans	-128.1	90.9	175.9	-178.6	172.1	62.2	0	0	108.7	L628 I631 K632 L635 L645 L655 Y704	L628-M642 HydrophobicContact CD1-CE 4.06Å; I631-M642 HydrophobicContact CG2-CE 4.31Å; K632-M642 HydrophobicContact CD-CE 4.5Å; K632-M642 WeakPolarHBondContact CE-O 3.41Å; K632-M642 HydrophobicContact CG-CE 3.6Å; K632-M642 PolarHBondContact NZ-O 2.94Å; L635-M642 HydrophobicContact CD1-CB 4.45Å; L635-M642 HydrophobicContact CD1-CE 3.83Å; L635-M642 HydrophobicContact CD1-SD 4.18Å; M642-L645 HydrophobicContact CE-CD2 4.37Å; M642-L645 HydrophobicContact SD-CD2 4.25Å; M642-L655 HydrophobicContact CE-CD1 3.62Å; M642-L655 HydrophobicContact SD-CD1 3.49Å; M642-L655 WeakPolarHBondContact SD-CD1 3.33Å; M642-Y704 HydrophobicContact CB-CE1 4.32Å; M642-Y704 HydrophobicContact CG-CD1 4.29Å; M642-Y704 HydrophobicContact CG-CE1 4.07Å; M642-Y704 HydrophobicContact SD-CD1 3.61Å; M642-Y704 HydrophobicContact SD-CE1 3.93Å; M642-Y704 HydrophobicContact SD-CG 4.06Å
643	D	74.5	Confident	85	Confident	132 Å²	132	51.6 Å²	51.6	71%	0.706	30%	0.298	S	S	*	.			trans	-83.2	-61.9	-175.3	-47.9	-44.8	0	0	0	109.5	K632	K632-D643 PolarHBondContact NZ-O 2.94Å
644	E	79.3	Confident	85.1	Confident	142 Å²	142	50.3 Å²	50.3	66%	0.664	29%	0.293	S	S	*	.	S	Bend	trans	-88.9	153.2	168.8	-63.3	-170.7	170.4	0	0	112.1
645	L	85.8	Confident	85.1	Confident	19 Å²	19	49.3 Å²	49.3	10%	0.099	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-81.3	146.7	171.4	-73.6	175.2	0	0	0	111.5	L628 M642 L647 E652 L655 H860	L628-L645 HydrophobicContact CD1-CD2 4.08Å; L628-L645 HydrophobicContact CD2-CD1 4.44Å; L628-L645 HydrophobicContact CD2-CD2 4.42Å; M642-L645 HydrophobicContact CE-CD2 4.37Å; M642-L645 HydrophobicContact SD-CD2 4.25Å; L645-L647 PolarHBondContact O-N 2.83Å; L645-E652 HydrophobicContact CB-CB 4.29Å; L645-E652 HydrophobicContact CB-CG 4.32Å; L645-E652 HydrophobicContact CD1-CB 4.48Å; L645-L655 HydrophobicContact CD2-CD1 3.89Å; L645-L655 HydrophobicContact CD2-CG 4.38Å; L645-H860 VanDerWaalsContact CD1-CE1 3.45Å; L645-H860 WeakPolarHBondContact CD1-CE1 3.5Å
646	P	87.4	Confident	85.1	Confident	21 Å²	21	49.5 Å²	49.5	14%	0.136	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-64.9	128.6	-179.3	21.9	-29.5	0	0	0	112.2	L653 L655 A700 Y704	P646-L653 HydrophobicContact CG-CB 4.16Å; P646-L653 HydrophobicContact CG-CD2 4.19Å; P646-L653 WeakPolarHBondContact O-CB 3.47Å; P646-L653 PolarHBondContact O-N 2.97Å; P646-L655 HydrophobicContact CG-CD2 4.21Å; P646-A700 HydrophobicContact CB-CB 4.37Å; P646-A700 HydrophobicContact CG-CB 4.3Å; P646-Y704 HydrophobicContact CB-CD2 4.44Å; P646-Y704 HydrophobicContact CB-CE2 3.94Å; P646-Y704 HydrophobicContact CG-CD2 3.87Å; P646-Y704 HydrophobicContact CG-CE2 3.8Å
647	L	86.8	Confident	85.2	Confident	61 Å²	61	44.7 Å²	44.7	32%	0.319	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	114.3	-173	-74.4	165.6	0	0	0	112.3	L645 C651 E652	L645-L647 PolarHBondContact O-N 2.83Å; L647-C651 CarbonylContact C-O 3.57Å; L647-C651 WeakPolarHBondContact CA-O 3.41Å; L647-E652 HydrophobicContact CD2-CB 4.4Å; L647-E652 HydrophobicContact CD2-CG 3.49Å; L647-E652 VanDerWaalsContact CD2-CG 3.49Å; L647-E652 HydrophobicContact CG-CG 4.42Å
648	I	85.3	Confident	85.4	Confident	7 Å²	7	40.7 Å²	40.7	4%	0.036	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	118.2	176.3	-53	-178.9	0	0	0	109.5	G650 C651 L653 I686 A690 R693 K696 L697	I648-G650 PolarHBondContact O-N 2.85Å; I648-C651 PolarHBondContact N-O 3.03Å; I648-C651 PolarHBondContact O-N 3.4Å; I648-L653 HydrophobicContact CD1-CD2 4.18Å; I648-I686 HydrophobicContact CB-CG2 4.17Å; I648-I686 HydrophobicContact CD1-CD1 4.32Å; I648-I686 HydrophobicContact CG2-CG2 3.56Å; I648-A690 HydrophobicContact CG2-CB 4.16Å; I648-R693 HydrophobicContact CG2-CB 4.1Å; I648-K696 HydrophobicContact CD1-CB 4.16Å; I648-K696 HydrophobicContact CG1-CB 4.24Å; I648-L697 HydrophobicContact CD1-CB 4.2Å; I648-L697 HydrophobicContact CD1-CD1 4.27Å
649	G	75.5	Confident	85.6	Confident	30 Å²	30	36.8 Å²	36.8	31%	0.309	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	10.7	-178.8	0	0	0	0	0	115.5	A690 N831	G649-A690 VanDerWaalsContact CA-CB 3.45Å; G649-N831 PolarHBondContact O-ND2 3.01Å
650	G	78.4	Confident	85.9	Confident	26 Å²	26	37.4 Å²	37.4	27%	0.268	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	15.3	-171.9	0	0	0	0	0	114	I648	I648-G650 PolarHBondContact O-N 2.85Å
651	C	82.9	Confident	86.2	Confident	9 Å²	9	35.6 Å²	35.6	6%	0.061	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	141.5	-179.3	-51.7	0	0	0	0	109.1	L647 I648 M835	L647-C651 CarbonylContact C-O 3.57Å; L647-C651 WeakPolarHBondContact CA-O 3.41Å; I648-C651 PolarHBondContact N-O 3.03Å; I648-C651 PolarHBondContact O-N 3.4Å; C651-M835 HydrophobicContact CB-CE 3.98Å; C651-M835 HydrophobicContact CB-SD 3.87Å; C651-M835 PolarHBondContact SG-SD 3.45Å
652	E	89.4	Confident	86.8	Confident	35 Å²	35	30.9 Å²	30.9	16%	0.164	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	140.9	179.8	-70.2	175.4	-141.5	0	0	111.3	H613 L645 L647 H860 A862	H613-E652 IonicContact CE1-OE2 3.42Å; H613-E652 IonicContact NE2-OE2 2.93Å; L645-E652 HydrophobicContact CB-CB 4.29Å; L645-E652 HydrophobicContact CB-CG 4.32Å; L645-E652 HydrophobicContact CD1-CB 4.48Å; L647-E652 HydrophobicContact CD2-CB 4.4Å; L647-E652 HydrophobicContact CD2-CG 3.49Å; L647-E652 VanDerWaalsContact CD2-CG 3.49Å; L647-E652 HydrophobicContact CG-CG 4.42Å; E652-H860 WeakPolarHBondContact CB-NE2 3.48Å; E652-H860 IonicContact OE2-CE1 2.6Å; E652-H860 IonicContact OE2-NE2 3.23Å; E652-A862 HydrophobicContact CB-CB 4.18Å; E652-A862 HydrophobicContact CG-CB 4.25Å
653	L	89.8	Confident	87.3	Confident	7 Å²	7	33.9 Å²	33.9	4%	0.037	18%	0.184	C	C	.	.			trans	-86.9	121.1	-178	-177.1	62.8	0	0	0	111.5	P646 I648 L655 F658 L684 I686 L697 A700	P646-L653 HydrophobicContact CG-CB 4.16Å; P646-L653 HydrophobicContact CG-CD2 4.19Å; P646-L653 WeakPolarHBondContact O-CB 3.47Å; P646-L653 PolarHBondContact O-N 2.97Å; I648-L653 HydrophobicContact CD1-CD2 4.18Å; L653-L655 HydrophobicContact CD2-CD2 3.93Å; L653-L655 HydrophobicContact CG-CD2 4.17Å; L653-L655 PolarHBondContact O-N 3.23Å; L653-F658 HydrophobicContact CD1-CD1 4.49Å; L653-F658 HydrophobicContact CD2-CD1 3.79Å; L653-F658 HydrophobicContact CD2-CE1 3.89Å; L653-F658 HydrophobicContact CG-CD1 4.27Å; L653-L684 HydrophobicContact CD1-CD1 4.3Å; L653-I686 HydrophobicContact CD1-CD1 3.86Å; L653-I686 HydrophobicContact CD1-CG1 4.49Å; L653-L697 HydrophobicContact CD1-CD1 3.91Å; L653-L697 HydrophobicContact CD2-CD1 4.02Å; L653-A700 HydrophobicContact CD2-CB 3.78Å
654	D	91.3	Very high	88.1	Confident	11 Å²	11	33.8 Å²	33.8	6%	0.059	18%	0.179	C	C	.	.			trans	-70.7	86.7	172.3	-173.2	-13	0	0	0	111.2	N624 A656 C657 F658 C859 H860	N624-D654 VanDerWaalsContact ND2-CG 3.35Å; N624-D654 PolarHBondContact ND2-OD1 3.47Å; N624-D654 PolarHBondContact ND2-OD2 2.97Å; N624-D654 VanDerWaalsContact ND2-OD2 3.15Å; D654-A656 VanDerWaalsContact C-N 3.27Å; D654-A656 PolarHBondContact O-N 2.9Å; D654-A656 PolarHBondContact OD1-N 3.01Å; D654-C657 HydrophobicContact CB-CB 3.95Å; D654-C657 PolarHBondContact O-N 2.85Å; D654-C657 WeakPolarHBondContact OD1-CB 3.42Å; D654-C657 PolarHBondContact OD1-N 2.99Å; D654-C657 WeakPolarHBondContact OD2-CB 3.39Å; D654-F658 VanDerWaalsContact O-CB 3.27Å; D654-F658 WeakPolarHBondContact O-CB 3.44Å; D654-F658 PolarHBondContact O-N 3.01Å; D654-C859 WeakPolarHBondContact OD2-CA 3.3Å; D654-C859 PolarHBondContact OD2-SG 3.14Å; D654-C859 VanDerWaalsContact OD2-SG 3.33Å; D654-H860 HydrophobicContact CB-CB 3.86Å; D654-H860 PolarHBondContact OD2-N 2.91Å
655	L	92.1	Very high	88.6	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-60.8	-33.3	179.8	-64	178.4	0	0	0	113	L628 I631 M642 L645 P646 L653 F658 F659 L705	L628-L655 HydrophobicContact CD1-CB 4.39Å; L628-L655 HydrophobicContact CD1-CD1 4.23Å; I631-L655 HydrophobicContact CD1-CB 4.33Å; M642-L655 HydrophobicContact CE-CD1 3.62Å; M642-L655 HydrophobicContact SD-CD1 3.49Å; M642-L655 WeakPolarHBondContact SD-CD1 3.33Å; L645-L655 HydrophobicContact CD2-CD1 3.89Å; L645-L655 HydrophobicContact CD2-CG 4.38Å; P646-L655 HydrophobicContact CG-CD2 4.21Å; L653-L655 HydrophobicContact CD2-CD2 3.93Å; L653-L655 HydrophobicContact CG-CD2 4.17Å; L653-L655 PolarHBondContact O-N 3.23Å; L655-F658 HydrophobicContact CD2-CD1 4.2Å; L655-F658 PolarHBondContact O-N 2.86Å; L655-F659 WeakPolarHBondContact O-CB 3.41Å; L655-F659 PolarHBondContact O-N 3.14Å; L655-L705 HydrophobicContact CB-CD2 4.33Å; L655-L705 HydrophobicContact CD2-CD1 4.47Å; L655-L705 HydrophobicContact CD2-CG 4.38Å
656	A	91.3	Very high	88.7	Confident	5 Å²	5	28.9 Å²	28.9	4%	0.041	17%	0.168	C	C	.	.	H	α-helix	trans	-71.6	-37.9	179.5	0	0	0	0	0	112	R627 D654 R660	R627-A656 HydrophobicContact CB-CB 3.85Å; R627-A656 HydrophobicContact CG-CB 3.96Å; D654-A656 VanDerWaalsContact C-N 3.27Å; D654-A656 PolarHBondContact O-N 2.9Å; D654-A656 PolarHBondContact OD1-N 3.01Å; A656-R660 PolarHBondContact O-N 3.45Å
657	C	91.1	Very high	88.7	Confident	12 Å²	12	28.5 Å²	28.5	8%	0.081	17%	0.168	C	C	.	.	H	α-helix	trans	-73.4	-35.7	171	-168.3	0	0	0	0	112	D654 R660 L661 L684	D654-C657 HydrophobicContact CB-CB 3.95Å; D654-C657 PolarHBondContact O-N 2.85Å; D654-C657 WeakPolarHBondContact OD1-CB 3.42Å; D654-C657 PolarHBondContact OD1-N 2.99Å; D654-C657 WeakPolarHBondContact OD2-CB 3.39Å; C657-R660 PolarHBondContact O-N 2.92Å; C657-R660 PolarHBondContact SG-NH2 2.86Å; C657-L661 WeakPolarHBondContact O-CB 3.24Å; C657-L661 VanDerWaalsContact O-CG 3.28Å; C657-L661 WeakPolarHBondContact O-CG 3.2Å; C657-L661 PolarHBondContact O-N 3.41Å; C657-L684 HydrophobicContact CB-CD2 4.22Å
658	F	93.2	Very high	88.8	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.2	-46.2	177.5	-174.6	-165.2	0	0	0	112	L653 D654 L655 L661 I662 W677 L680 L684 L697 Y701 L705	L653-F658 HydrophobicContact CD1-CD1 4.49Å; L653-F658 HydrophobicContact CD2-CD1 3.79Å; L653-F658 HydrophobicContact CD2-CE1 3.89Å; L653-F658 HydrophobicContact CG-CD1 4.27Å; D654-F658 VanDerWaalsContact O-CB 3.27Å; D654-F658 WeakPolarHBondContact O-CB 3.44Å; D654-F658 PolarHBondContact O-N 3.01Å; L655-F658 HydrophobicContact CD2-CD1 4.2Å; L655-F658 PolarHBondContact O-N 2.86Å; F658-L661 PolarHBondContact O-N 3.39Å; F658-I662 HydrophobicContact CD2-CD1 3.74Å; F658-I662 HydrophobicContact CD2-CG1 4.21Å; F658-I662 HydrophobicContact CE2-CD1 3.41Å; F658-I662 VanDerWaalsContact CE2-CD1 3.41Å; F658-I662 HydrophobicContact CE2-CG1 4.21Å; F658-I662 HydrophobicContact CZ-CD1 4.23Å; F658-I662 PolarHBondContact O-N 3.15Å; F658-W677 HydrophobicContact CE2-CZ3 4.23Å; F658-W677 HydrophobicContact CZ-CZ3 4.25Å; F658-L680 HydrophobicContact CD2-CD1 4.29Å; F658-L680 HydrophobicContact CD2-CD2 4.3Å; F658-L680 HydrophobicContact CD2-CG 4.47Å; F658-L680 HydrophobicContact CE2-CD2 3.86Å; F658-L680 HydrophobicContact CE2-CG 4.31Å; F658-L684 HydrophobicContact CB-CD1 4.03Å; F658-L684 HydrophobicContact CB-CD2 3.93Å; F658-L684 HydrophobicContact CD2-CD1 3.54Å; F658-L684 HydrophobicContact CE2-CD1 4.11Å; F658-L684 HydrophobicContact CG-CD1 3.86Å; F658-L697 HydrophobicContact CD1-CD1 4.14Å; F658-L697 HydrophobicContact CD2-CD1 4.29Å; F658-L697 HydrophobicContact CE1-CD1 3.57Å; F658-L697 HydrophobicContact CE1-CG 4.36Å; F658-L697 HydrophobicContact CE2-CD1 3.68Å; F658-L697 HydrophobicContact CE2-CD2 4.47Å; F658-L697 HydrophobicContact CE2-CG 3.97Å; F658-L697 HydrophobicContact CG-CD1 4.49Å; F658-L697 HydrophobicContact CZ-CD1 3.29Å; F658-L697 HydrophobicContact CZ-CG 3.64Å; F658-L697 WeakPolarHBondContact CZ-O 3.02Å; F658-Y701 HydrophobicContact CE1-CD2 4.06Å; F658-Y701 HydrophobicContact CE2-CD2 4.05Å; F658-Y701 AromaticContact CZ-CD2 3.72Å; F658-Y701 HydrophobicContact CZ-CD2 3.72Å; F658-Y701 HydrophobicContact CZ-CG 4.24Å; F658-L705 HydrophobicContact CB-CD1 3.87Å; F658-L705 HydrophobicContact CD1-CD1 3.32Å; F658-L705 HydrophobicContact CD1-CG 4.45Å; F658-L705 HydrophobicContact CD2-CD1 4.38Å; F658-L705 HydrophobicContact CE1-CD1 3.92Å; F658-L705 HydrophobicContact CG-CD1 3.59Å
659	F	91.8	Very high	88.8	Confident	27 Å²	27	29.2 Å²	29.2	12%	0.118	17%	0.17	C	C	.	.	H	α-helix	trans	-58.7	-48.4	171.3	173.9	-98.7	0	0	0	112.5	L655 L661 I662 N663 L705 Y708 D709 H716	L655-F659 WeakPolarHBondContact O-CB 3.41Å; L655-F659 PolarHBondContact O-N 3.14Å; F659-L661 PolarHBondContact O-N 3.23Å; F659-I662 PolarHBondContact O-N 3.2Å; F659-N663 WeakPolarHBondContact CE2-ND2 3.36Å; F659-N663 PolarHBondContact O-N 3.03Å; F659-N663 PolarHBondContact O-ND2 3.1Å; F659-L705 HydrophobicContact CB-CD1 4.29Å; F659-L705 HydrophobicContact CB-CD2 4.23Å; F659-Y708 HydrophobicContact CD1-CE1 4.3Å; F659-Y708 AromaticContact CD2-CD1 3.79Å; F659-Y708 HydrophobicContact CD2-CD1 3.79Å; F659-Y708 AromaticContact CD2-CE1 3.92Å; F659-Y708 HydrophobicContact CD2-CE1 3.92Å; F659-Y708 HydrophobicContact CE1-CE1 4.1Å; F659-Y708 AromaticContact CE2-CD1 3.72Å; F659-Y708 HydrophobicContact CE2-CD1 3.72Å; F659-Y708 AromaticContact CE2-CE1 3.7Å; F659-Y708 HydrophobicContact CE2-CE1 3.7Å; F659-Y708 HydrophobicContact CG-CD1 4.41Å; F659-Y708 HydrophobicContact CG-CE1 4.2Å; F659-Y708 HydrophobicContact CZ-CD1 4.28Å; F659-Y708 AromaticContact CZ-CE1 3.79Å; F659-Y708 HydrophobicContact CZ-CE1 3.79Å; F659-D709 HydrophobicContact CD2-CB 4.38Å; F659-D709 HydrophobicContact CE2-CB 4.2Å; F659-D709 VanDerWaalsContact CE2-OD1 3.29Å; F659-D709 WeakPolarHBondContact CE2-OD1 3.46Å; F659-H716 AromaticContact CZ-CE1 3.86Å; F659-H716 AromaticContact CZ-NE2 3.86Å
660	R	91.4	Very high	89.5	Confident	78 Å²	78	31.9 Å²	31.9	29%	0.294	17%	0.174	S	C	.	.	H	α-helix	trans	-56.2	-51.3	176.8	169.8	174	61.9	-179.5	-1.3	111.6	A656 C657 I662 N663 E664 D858	A656-R660 PolarHBondContact O-N 3.45Å; C657-R660 PolarHBondContact O-N 2.92Å; C657-R660 PolarHBondContact SG-NH2 2.86Å; R660-I662 PolarHBondContact O-N 2.93Å; R660-N663 PolarHBondContact O-N 3.03Å; R660-E664 WeakPolarHBondContact CD-OE1 3.05Å; R660-E664 HydrophobicContact CG-CG 4.49Å; R660-E664 WeakPolarHBondContact CG-OE1 3.46Å; R660-E664 WeakPolarHBondContact O-CG 3.33Å; R660-E664 PolarHBondContact O-N 3.28Å; R660-D858 IonicContact CZ-OD2 2.83Å; R660-D858 IonicContact NH1-OD2 3.21Å; R660-D858 PolarHBondContact NH1-OD2 3.44Å; R660-D858 IonicContact NH2-OD2 2.78Å; R660-D858 PolarHBondContact NH2-OD2 2.7Å
661	L	92.3	Very high	90.1	Very high	13 Å²	13	30.6 Å²	30.6	7%	0.068	16%	0.161	C	C	.	.	H	α-helix	trans	-70.1	-28.6	-175.1	-71.4	178.4	0	0	0	114	C657 F658 F659 M665 L680 M683 L684	C657-L661 WeakPolarHBondContact O-CB 3.24Å; C657-L661 VanDerWaalsContact O-CG 3.28Å; C657-L661 WeakPolarHBondContact O-CG 3.2Å; C657-L661 PolarHBondContact O-N 3.41Å; F658-L661 PolarHBondContact O-N 3.39Å; F659-L661 PolarHBondContact O-N 3.23Å; L661-M665 WeakPolarHBondContact O-CB 3.36Å; L661-M665 VanDerWaalsContact O-CE 3.27Å; L661-M665 WeakPolarHBondContact O-CE 3.44Å; L661-M665 WeakPolarHBondContact O-CG 3.48Å; L661-M665 PolarHBondContact O-N 2.79Å; L661-L680 HydrophobicContact CB-CD1 3.71Å; L661-L680 HydrophobicContact CD1-CD1 4.35Å; L661-M683 HydrophobicContact CD1-CB 3.87Å; L661-M683 HydrophobicContact CD2-CE 3.65Å; L661-L684 HydrophobicContact CD1-CD2 3.86Å; L661-L684 HydrophobicContact CD1-CG 3.91Å
662	I	92.7	Very high	90.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.9	-45.9	172.4	-82.7	178.1	0	0	0	110.6	F658 F659 R660 M665 G666 G667 V671 L680 Y701	F658-I662 HydrophobicContact CD2-CD1 3.74Å; F658-I662 HydrophobicContact CD2-CG1 4.21Å; F658-I662 HydrophobicContact CE2-CD1 3.41Å; F658-I662 VanDerWaalsContact CE2-CD1 3.41Å; F658-I662 HydrophobicContact CE2-CG1 4.21Å; F658-I662 HydrophobicContact CZ-CD1 4.23Å; F658-I662 PolarHBondContact O-N 3.15Å; F659-I662 PolarHBondContact O-N 3.2Å; R660-I662 PolarHBondContact O-N 2.93Å; I662-M665 CarbonylContact O-C 3.55Å; I662-M665 WeakPolarHBondContact O-CA 3.49Å; I662-M665 PolarHBondContact O-N 2.96Å; I662-G666 PolarHBondContact O-N 3.26Å; I662-G667 PolarHBondContact O-N 3.15Å; I662-V671 HydrophobicContact CG1-CG2 4.48Å; I662-L680 HydrophobicContact CD1-CD2 3.83Å; I662-L680 HydrophobicContact CG1-CD1 4.39Å; I662-L680 HydrophobicContact CG1-CD2 3.48Å; I662-L680 VanDerWaalsContact CG1-CD2 3.48Å; I662-Y701 HydrophobicContact CD1-CD2 3.35Å; I662-Y701 HydrophobicContact CD1-CE2 3.15Å; I662-Y701 HydrophobicContact CD1-CG 4.27Å; I662-Y701 HydrophobicContact CG1-CE2 4.41Å; I662-Y701 HydrophobicContact CG2-CE2 4.4Å
663	N	90.2	Very high	90.4	Very high	75 Å²	75	35.4 Å²	35.4	40%	0.401	19%	0.189	S	C	.	.	H	α-helix	trans	-68.8	-37.5	-179.9	-77.3	-57.8	0	0	0	112.4	F659 R660 M665 G666 D709	F659-N663 WeakPolarHBondContact CE2-ND2 3.36Å; F659-N663 PolarHBondContact O-N 3.03Å; F659-N663 PolarHBondContact O-ND2 3.1Å; R660-N663 PolarHBondContact O-N 3.03Å; N663-M665 PolarHBondContact O-N 3.38Å; N663-M665 VanDerWaalsContact O-N 3.15Å; N663-G666 PolarHBondContact O-N 2.87Å; N663-G666 VanDerWaalsContact O-N 3.14Å; N663-D709 PolarHBondContact ND2-OD1 3.25Å
664	E	91.6	Very high	90.4	Very high	129 Å²	129	40.3 Å²	40.3	60%	0.603	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.2	167.5	-74.3	174.2	-161.4	0	0	114	R660	R660-E664 WeakPolarHBondContact CD-OE1 3.05Å; R660-E664 HydrophobicContact CG-CG 4.49Å; R660-E664 WeakPolarHBondContact CG-OE1 3.46Å; R660-E664 WeakPolarHBondContact O-CG 3.33Å; R660-E664 PolarHBondContact O-N 3.28Å
665	M	90.9	Very high	90.4	Very high	15 Å²	15	48 Å²	48	7%	0.074	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	11.1	177.7	-76.4	-165.8	-73.9	0	0	114.8	L661 I662 N663 Q670 V671 K676 K679 L680 M683	L661-M665 WeakPolarHBondContact O-CB 3.36Å; L661-M665 VanDerWaalsContact O-CE 3.27Å; L661-M665 WeakPolarHBondContact O-CE 3.44Å; L661-M665 WeakPolarHBondContact O-CG 3.48Å; L661-M665 PolarHBondContact O-N 2.79Å; I662-M665 CarbonylContact O-C 3.55Å; I662-M665 WeakPolarHBondContact O-CA 3.49Å; I662-M665 PolarHBondContact O-N 2.96Å; N663-M665 PolarHBondContact O-N 3.38Å; N663-M665 VanDerWaalsContact O-N 3.15Å; M665-Q670 PolarHBondContact O-OE1 2.9Å; M665-V671 HydrophobicContact CB-CG2 3.7Å; M665-V671 HydrophobicContact CE-CG2 4.33Å; M665-K676 HydrophobicContact CB-CD 4.24Å; M665-K676 HydrophobicContact CG-CD 4.42Å; M665-K676 PolarHBondContact O-NZ 3.46Å; M665-K676 HydrophobicContact SD-CB 4.28Å; M665-K676 HydrophobicContact SD-CD 3.93Å; M665-K679 HydrophobicContact SD-CD 4.24Å; M665-L680 HydrophobicContact CE-CB 3.73Å; M665-L680 HydrophobicContact CE-CD1 3.61Å; M665-L680 HydrophobicContact CE-CD2 4.23Å; M665-L680 HydrophobicContact CE-CG 4.04Å; M665-M683 HydrophobicContact SD-SD 4.5Å
666	G	86.6	Confident	90.3	Very high	43 Å²	43	50.1 Å²	50.1	44%	0.443	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	27	177.1	0	0	0	0	0	114.5	I662 N663 Q670	I662-G666 PolarHBondContact O-N 3.26Å; N663-G666 PolarHBondContact O-N 2.87Å; N663-G666 VanDerWaalsContact O-N 3.14Å; G666-Q670 WeakPolarHBondContact O-CB 3.41Å
667	G	88.6	Confident	90.3	Very high	14 Å²	14	50.5 Å²	50.5	14%	0.144	26%	0.257	C	S	.	.	H	α-helix	trans	82.9	170.8	173.8	0	0	0	0	0	115.1	I662 Q669 Q670 V671	I662-G667 PolarHBondContact O-N 3.15Å; G667-Q669 VanDerWaalsContact C-N 3.31Å; G667-Q669 PolarHBondContact O-N 3.46Å; G667-Q670 PolarHBondContact O-N 3.09Å; G667-V671 WeakPolarHBondContact O-CG2 3.5Å; G667-V671 PolarHBondContact O-N 3.13Å
668	M	87.8	Confident	90.3	Very high	29 Å²	29	53.8 Å²	53.8	14%	0.143	27%	0.274	C	S	.	.	H	α-helix	trans	-52.2	-44.1	-175.5	176.8	59.7	171.6	0	0	113.6	V671 T672 W677 Y701	M668-V671 PolarHBondContact O-N 3.25Å; M668-T672 WeakPolarHBondContact O-CB 3.09Å; M668-T672 PolarHBondContact O-N 2.82Å; M668-T672 VanDerWaalsContact O-N 3.07Å; M668-T672 PolarHBondContact O-OG1 3.16Å; M668-W677 HydrophobicContact CE-CH2 4Å; M668-W677 HydrophobicContact CE-CZ2 3.68Å; M668-W677 HydrophobicContact SD-CH2 3.65Å; M668-W677 HydrophobicContact SD-CZ2 3.43Å; M668-W677 WeakPolarHBondContact SD-CZ2 3.3Å; M668-Y701 HydrophobicContact CB-CE1 3.83Å; M668-Y701 HydrophobicContact CE-CD1 3.62Å; M668-Y701 HydrophobicContact CE-CE1 4.13Å; M668-Y701 HydrophobicContact CE-CG 4.39Å; M668-Y701 HydrophobicContact CG-CD1 4.12Å; M668-Y701 HydrophobicContact CG-CE1 3.63Å; M668-Y701 HydrophobicContact SD-CD1 3.43Å; M668-Y701 WeakPolarHBondContact SD-CD1 3.34Å; M668-Y701 HydrophobicContact SD-CE1 3.49Å; M668-Y701 WeakPolarHBondContact SD-CE1 3.35Å; M668-Y701 HydrophobicContact SD-CG 4.08Å
669	Q	86.1	Confident	90.2	Very high	53 Å²	53	59.7 Å²	59.7	25%	0.248	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-50.1	-178.1	-171.2	55.9	28	0	0	110.8	G667 V671 T672 D673	G667-Q669 VanDerWaalsContact C-N 3.31Å; G667-Q669 PolarHBondContact O-N 3.46Å; Q669-V671 VanDerWaalsContact C-N 3.33Å; Q669-V671 PolarHBondContact O-N 3.47Å; Q669-T672 PolarHBondContact O-N 2.87Å; Q669-D673 PolarHBondContact NE2-OD1 3.34Å; Q669-D673 PolarHBondContact NE2-OD2 2.93Å; Q669-D673 PolarHBondContact O-N 3.27Å
670	Q	89.6	Confident	90.2	Very high	86 Å²	86	58.4 Å²	58.4	40%	0.402	29%	0.294	S	S	.	.	H	α-helix	trans	-65.7	-33.5	178.8	-160.1	-171	119.8	0	0	113	M665 G666 G667 T672 L674	M665-Q670 PolarHBondContact O-OE1 2.9Å; G666-Q670 WeakPolarHBondContact O-CB 3.41Å; G667-Q670 PolarHBondContact O-N 3.09Å; Q670-T672 VanDerWaalsContact C-N 3.28Å; Q670-T672 PolarHBondContact O-N 2.87Å; Q670-L674 HydrophobicContact CG-CD1 3.8Å; Q670-L674 HydrophobicContact CG-CG 4.29Å; Q670-L674 WeakPolarHBondContact O-CB 3.3Å; Q670-L674 PolarHBondContact O-N 2.81Å
671	V	90.6	Very high	90.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.5	-35.2	172.7	167.9	0	0	0	0	111.6	I662 M665 G667 M668 Q669 K675 K676 W677 L680	I662-V671 HydrophobicContact CG1-CG2 4.48Å; M665-V671 HydrophobicContact CB-CG2 3.7Å; M665-V671 HydrophobicContact CE-CG2 4.33Å; G667-V671 WeakPolarHBondContact O-CG2 3.5Å; G667-V671 PolarHBondContact O-N 3.13Å; M668-V671 PolarHBondContact O-N 3.25Å; Q669-V671 VanDerWaalsContact C-N 3.33Å; Q669-V671 PolarHBondContact O-N 3.47Å; V671-K675 CarbonylContact O-C 3.48Å; V671-K675 PolarHBondContact O-N 3.36Å; V671-K676 HydrophobicContact CG1-CB 4.22Å; V671-K676 PolarHBondContact O-N 2.85Å; V671-W677 HydrophobicContact CG1-CD2 3.95Å; V671-W677 HydrophobicContact CG1-CE3 4.41Å; V671-W677 HydrophobicContact CG1-CG 4.21Å; V671-W677 HydrophobicContact CG1-CZ2 4.21Å; V671-L680 HydrophobicContact CG1-CD2 3.84Å
672	T	89.3	Confident	89.9	Confident	49 Å²	49	56.8 Å²	56.8	30%	0.301	29%	0.291	S	S	.	.	H	α-helix	trans	-77.6	-51.5	-179.3	-61.8	0	0	0	0	112.3	M668 Q669 Q670 L674 K675 W677	M668-T672 WeakPolarHBondContact O-CB 3.09Å; M668-T672 PolarHBondContact O-N 2.82Å; M668-T672 VanDerWaalsContact O-N 3.07Å; M668-T672 PolarHBondContact O-OG1 3.16Å; Q669-T672 PolarHBondContact O-N 2.87Å; Q670-T672 VanDerWaalsContact C-N 3.28Å; Q670-T672 PolarHBondContact O-N 2.87Å; T672-L674 PolarHBondContact O-N 3.03Å; T672-K675 WeakPolarHBondContact O-CA 3.36Å; T672-K675 PolarHBondContact O-N 3.24Å; T672-W677 PolarHBondContact OG1-NE1 3.38Å
673	D	90.1	Very high	89.7	Confident	95 Å²	95	60.5 Å²	60.5	51%	0.508	31%	0.31	S	S	.	.	H	α-helix	trans	-64.1	-43.3	-176.9	-65.5	-26.3	0	0	0	112	Q669 K675	Q669-D673 PolarHBondContact NE2-OD1 3.34Å; Q669-D673 PolarHBondContact NE2-OD2 2.93Å; Q669-D673 PolarHBondContact O-N 3.27Å; D673-K675 PolarHBondContact O-N 3.42Å
674	L	90.9	Very high	89.5	Confident	110 Å²	110	57.9 Å²	57.9	58%	0.576	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	9.3	175.6	-57	-176.6	0	0	0	113.1	Q670 T672 K676	Q670-L674 HydrophobicContact CG-CD1 3.8Å; Q670-L674 HydrophobicContact CG-CG 4.29Å; Q670-L674 WeakPolarHBondContact O-CB 3.3Å; Q670-L674 PolarHBondContact O-N 2.81Å; T672-L674 PolarHBondContact O-N 3.03Å; L674-K676 HydrophobicContact CB-CD 4.41Å; L674-K676 HydrophobicContact CB-CG 3.97Å; L674-K676 PolarHBondContact O-N 3.39Å
675	K	89.6	Confident	89.1	Confident	173 Å²	173	55.7 Å²	55.7	75%	0.752	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	28.8	175.9	-58.8	175.8	-175.7	173	0	113.9	V671 T672 D673 W677	V671-K675 CarbonylContact O-C 3.48Å; V671-K675 PolarHBondContact O-N 3.36Å; T672-K675 WeakPolarHBondContact O-CA 3.36Å; T672-K675 PolarHBondContact O-N 3.24Å; D673-K675 PolarHBondContact O-N 3.42Å; K675-W677 PolarHBondContact O-N 3.37Å; K675-W677 VanDerWaalsContact O-N 3.1Å
676	K	91.2	Very high	88.9	Confident	46 Å²	46	55.5 Å²	55.5	20%	0.2	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-8.1	-175.9	-61.8	179.7	-169.5	171	0	113.6	M665 V671 L674 N678 K679 L680	M665-K676 HydrophobicContact CB-CD 4.24Å; M665-K676 HydrophobicContact CG-CD 4.42Å; M665-K676 PolarHBondContact O-NZ 3.46Å; M665-K676 HydrophobicContact SD-CB 4.28Å; M665-K676 HydrophobicContact SD-CD 3.93Å; V671-K676 HydrophobicContact CG1-CB 4.22Å; V671-K676 PolarHBondContact O-N 2.85Å; L674-K676 HydrophobicContact CB-CD 4.41Å; L674-K676 HydrophobicContact CB-CG 3.97Å; L674-K676 PolarHBondContact O-N 3.39Å; K676-N678 PolarHBondContact O-N 2.85Å; K676-K679 WeakPolarHBondContact O-CA 3.09Å; K676-K679 WeakPolarHBondContact O-CB 3.28Å; K676-K679 PolarHBondContact O-N 3.45Å; K676-L680 PolarHBondContact O-N 2.86Å
677	W	90.9	Very high	88.7	Confident	13 Å²	13	53.9 Å²	53.9	5%	0.049	26%	0.263	C	S	.	.	H	α-helix	trans	-45	-36.6	179.4	-74.6	104.1	0	0	0	115.5	F658 M668 V671 T672 K675 L680 A681 L694 L697 Q698	F658-W677 HydrophobicContact CE2-CZ3 4.23Å; F658-W677 HydrophobicContact CZ-CZ3 4.25Å; M668-W677 HydrophobicContact CE-CH2 4Å; M668-W677 HydrophobicContact CE-CZ2 3.68Å; M668-W677 HydrophobicContact SD-CH2 3.65Å; M668-W677 HydrophobicContact SD-CZ2 3.43Å; M668-W677 WeakPolarHBondContact SD-CZ2 3.3Å; V671-W677 HydrophobicContact CG1-CD2 3.95Å; V671-W677 HydrophobicContact CG1-CE3 4.41Å; V671-W677 HydrophobicContact CG1-CG 4.21Å; V671-W677 HydrophobicContact CG1-CZ2 4.21Å; T672-W677 PolarHBondContact OG1-NE1 3.38Å; K675-W677 PolarHBondContact O-N 3.37Å; K675-W677 VanDerWaalsContact O-N 3.1Å; W677-L680 HydrophobicContact CE3-CD2 4.1Å; W677-L680 HydrophobicContact CZ3-CD2 4.05Å; W677-A681 WeakPolarHBondContact O-CB 3.3Å; W677-A681 PolarHBondContact O-N 3.38Å; W677-L694 HydrophobicContact CB-CD2 4.4Å; W677-L697 HydrophobicContact CE3-CD2 4.1Å; W677-L697 HydrophobicContact CE3-CG 4.28Å; W677-L697 HydrophobicContact CZ3-CD2 4.33Å; W677-L697 HydrophobicContact CZ3-CG 4.08Å; W677-Q698 HydrophobicContact CD2-CG 3.76Å; W677-Q698 HydrophobicContact CE3-CG 3.79Å; W677-Q698 HydrophobicContact CH2-CG 3.74Å; W677-Q698 HydrophobicContact CZ2-CG 3.69Å; W677-Q698 HydrophobicContact CZ3-CG 3.79Å
678	N	90.9	Very high	88.4	Confident	82 Å²	82	62.4 Å²	62.4	44%	0.439	29%	0.291	S	S	.	.	H	α-helix	trans	-70	-40.6	174.4	-96	-56.1	0	0	0	113.3	K676 L680 A681 D682 R693	K676-N678 PolarHBondContact O-N 2.85Å; N678-L680 VanDerWaalsContact C-N 3.34Å; N678-A681 PolarHBondContact O-N 2.88Å; N678-D682 VanDerWaalsContact O-CG 3.3Å; N678-D682 PolarHBondContact O-N 2.89Å; N678-R693 PolarHBondContact O-NH2 3.43Å; N678-R693 PolarHBondContact OD1-NH2 3.49Å
679	K	90.8	Very high	88	Confident	124 Å²	124	65.3 Å²	65.3	54%	0.539	31%	0.31	S	S	.	.	H	α-helix	trans	-63.8	-42.8	174.1	-170	-167.6	177.8	-163.2	0	110.1	M665 K676 D682 M683	M665-K679 HydrophobicContact SD-CD 4.24Å; K676-K679 WeakPolarHBondContact O-CA 3.09Å; K676-K679 WeakPolarHBondContact O-CB 3.28Å; K676-K679 PolarHBondContact O-N 3.45Å; K679-D682 PolarHBondContact O-N 2.99Å; K679-M683 HydrophobicContact CD-SD 4.15Å; K679-M683 HydrophobicContact CG-CG 4.4Å; K679-M683 HydrophobicContact CG-SD 3.96Å; K679-M683 WeakPolarHBondContact O-CB 3.21Å; K679-M683 VanDerWaalsContact O-CG 3.27Å; K679-M683 WeakPolarHBondContact O-CG 3.34Å; K679-M683 PolarHBondContact O-N 3.25Å
680	L	91.7	Very high	87.8	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.3	-48.4	176	-177.2	47.2	0	0	0	112.1	F658 L661 I662 M665 V671 K676 W677 N678 D682 M683 L684 L697	F658-L680 HydrophobicContact CD2-CD1 4.29Å; F658-L680 HydrophobicContact CD2-CD2 4.3Å; F658-L680 HydrophobicContact CD2-CG 4.47Å; F658-L680 HydrophobicContact CE2-CD2 3.86Å; F658-L680 HydrophobicContact CE2-CG 4.31Å; L661-L680 HydrophobicContact CB-CD1 3.71Å; L661-L680 HydrophobicContact CD1-CD1 4.35Å; I662-L680 HydrophobicContact CD1-CD2 3.83Å; I662-L680 HydrophobicContact CG1-CD1 4.39Å; I662-L680 HydrophobicContact CG1-CD2 3.48Å; I662-L680 VanDerWaalsContact CG1-CD2 3.48Å; M665-L680 HydrophobicContact CE-CB 3.73Å; M665-L680 HydrophobicContact CE-CD1 3.61Å; M665-L680 HydrophobicContact CE-CD2 4.23Å; M665-L680 HydrophobicContact CE-CG 4.04Å; V671-L680 HydrophobicContact CG1-CD2 3.84Å; K676-L680 PolarHBondContact O-N 2.86Å; W677-L680 HydrophobicContact CE3-CD2 4.1Å; W677-L680 HydrophobicContact CZ3-CD2 4.05Å; N678-L680 VanDerWaalsContact C-N 3.34Å; L680-D682 VanDerWaalsContact C-N 3.3Å; L680-D682 PolarHBondContact O-N 3.26Å; L680-M683 PolarHBondContact O-N 2.76Å; L680-L684 HydrophobicContact CD1-CD1 3.76Å; L680-L684 HydrophobicContact CD1-CG 4.17Å; L680-L684 HydrophobicContact CG-CD1 4.05Å; L680-L684 WeakPolarHBondContact O-CB 3.39Å; L680-L684 WeakPolarHBondContact O-CG 3.3Å; L680-L684 PolarHBondContact O-N 3Å; L680-L697 HydrophobicContact CG-CD2 4.36Å
681	A	89.9	Confident	87.4	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-35.9	176.6	0	0	0	0	0	112.7	W677 N678 R685 I686 L694 L697	W677-A681 WeakPolarHBondContact O-CB 3.3Å; W677-A681 PolarHBondContact O-N 3.38Å; N678-A681 PolarHBondContact O-N 2.88Å; A681-R685 PolarHBondContact O-N 2.93Å; A681-I686 HydrophobicContact CB-CD1 4.41Å; A681-I686 WeakPolarHBondContact O-CB 3.42Å; A681-I686 PolarHBondContact O-N 2.66Å; A681-L694 HydrophobicContact CB-CD2 3.91Å; A681-L697 HydrophobicContact CB-CD2 3.84Å
682	D	88.4	Confident	87.2	Confident	56 Å²	56	71 Å²	71	30%	0.299	34%	0.342	S	S	.	.	H	α-helix	trans	-72.6	-36	174.2	-69.7	-19.6	0	0	0	112.6	N678 K679 L680 R685 R688 R693	N678-D682 VanDerWaalsContact O-CG 3.3Å; N678-D682 PolarHBondContact O-N 2.89Å; K679-D682 PolarHBondContact O-N 2.99Å; L680-D682 VanDerWaalsContact C-N 3.3Å; L680-D682 PolarHBondContact O-N 3.26Å; D682-R685 WeakPolarHBondContact O-CA 3.25Å; D682-R685 PolarHBondContact O-N 2.7Å; D682-R688 IonicContact OD1-CZ 3.87Å; D682-R688 IonicContact OD1-NE 2.71Å; D682-R688 PolarHBondContact OD1-NE 3.17Å; D682-R688 IonicContact OD1-NH2 2.83Å; D682-R688 IonicContact OD2-CZ 3.66Å; D682-R688 IonicContact OD2-NE 3.21Å; D682-R688 PolarHBondContact OD2-NE 3.47Å; D682-R688 IonicContact OD2-NH2 3.34Å; D682-R688 PolarHBondContact OD2-NH2 3.11Å; D682-R693 IonicContact OD1-CZ 2.9Å; D682-R693 VanDerWaalsContact OD1-CZ 3.23Å; D682-R693 IonicContact OD1-NH1 3.56Å; D682-R693 PolarHBondContact OD1-NH1 2.81Å; D682-R693 IonicContact OD1-NH2 3.77Å; D682-R693 PolarHBondContact OD1-NH2 2.97Å; D682-R693 IonicContact OD2-NH2 3.75Å
683	M	87.7	Confident	87.2	Confident	79 Å²	79	69.6 Å²	69.6	39%	0.389	33%	0.331	S	S	.	.	H	α-helix	trans	-70.5	-33.6	175.8	-72	176.2	76.1	0	0	112.4	L661 M665 K679 L680 R685	L661-M683 HydrophobicContact CD1-CB 3.87Å; L661-M683 HydrophobicContact CD2-CE 3.65Å; M665-M683 HydrophobicContact SD-SD 4.5Å; K679-M683 HydrophobicContact CD-SD 4.15Å; K679-M683 HydrophobicContact CG-CG 4.4Å; K679-M683 HydrophobicContact CG-SD 3.96Å; K679-M683 WeakPolarHBondContact O-CB 3.21Å; K679-M683 VanDerWaalsContact O-CG 3.27Å; K679-M683 WeakPolarHBondContact O-CG 3.34Å; K679-M683 PolarHBondContact O-N 3.25Å; L680-M683 PolarHBondContact O-N 2.76Å; M683-R685 PolarHBondContact O-N 3.11Å
684	L	86.8	Confident	87.3	Confident	19 Å²	19	67.5 Å²	67.5	10%	0.099	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	9.1	166.6	-71.3	165.7	0	0	0	113.3	L653 C657 F658 L661 L680 I686 L697	L653-L684 HydrophobicContact CD1-CD1 4.3Å; C657-L684 HydrophobicContact CB-CD2 4.22Å; F658-L684 HydrophobicContact CB-CD1 4.03Å; F658-L684 HydrophobicContact CB-CD2 3.93Å; F658-L684 HydrophobicContact CD2-CD1 3.54Å; F658-L684 HydrophobicContact CE2-CD1 4.11Å; F658-L684 HydrophobicContact CG-CD1 3.86Å; L661-L684 HydrophobicContact CD1-CD2 3.86Å; L661-L684 HydrophobicContact CD1-CG 3.91Å; L680-L684 HydrophobicContact CD1-CD1 3.76Å; L680-L684 HydrophobicContact CD1-CG 4.17Å; L680-L684 HydrophobicContact CG-CD1 4.05Å; L680-L684 WeakPolarHBondContact O-CB 3.39Å; L680-L684 WeakPolarHBondContact O-CG 3.3Å; L680-L684 PolarHBondContact O-N 3Å; L684-I686 HydrophobicContact CB-CD1 3.92Å; L684-I686 HydrophobicContact CB-CG1 3.81Å; L684-I686 HydrophobicContact CD1-CD1 4.29Å; L684-I686 PolarHBondContact O-N 3.18Å; L684-L697 HydrophobicContact CD1-CD1 3.94Å; L684-L697 HydrophobicContact CD1-CD2 4.33Å
685	R	83.6	Confident	87.3	Confident	83 Å²	83	64.9 Å²	64.9	31%	0.313	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	15.1	-179.6	-54.9	-178.9	173.7	-175	-5	114.3	A681 D682 M683 M835 E849	A681-R685 PolarHBondContact O-N 2.93Å; D682-R685 WeakPolarHBondContact O-CA 3.25Å; D682-R685 PolarHBondContact O-N 2.7Å; M683-R685 PolarHBondContact O-N 3.11Å; R685-M835 HydrophobicContact CB-CB 4.06Å; R685-M835 HydrophobicContact CB-CE 4.27Å; R685-M835 VanDerWaalsContact O-CB 3.3Å; R685-M835 WeakPolarHBondContact O-CB 3.1Å; R685-M835 VanDerWaalsContact O-CE 3.3Å; R685-M835 WeakPolarHBondContact O-CE 3.45Å; R685-M835 WeakPolarHBondContact O-CG 3.43Å; R685-E849 IonicContact CZ-OE1 2.76Å; R685-E849 IonicContact NH1-OE1 3.23Å; R685-E849 PolarHBondContact NH1-OE1 3.07Å; R685-E849 IonicContact NH2-OE1 3.84Å; R685-E849 PolarHBondContact NH2-OE1 3.3Å
686	I	85.9	Confident	87.4	Confident	11 Å²	11	60.1 Å²	60.1	6%	0.056	29%	0.294	C	S	.	.			trans	-65.7	127.9	-171.2	-59.6	174.5	0	0	0	111.1	I648 L653 A681 L684 R688 R693 L697	I648-I686 HydrophobicContact CB-CG2 4.17Å; I648-I686 HydrophobicContact CD1-CD1 4.32Å; I648-I686 HydrophobicContact CG2-CG2 3.56Å; L653-I686 HydrophobicContact CD1-CD1 3.86Å; L653-I686 HydrophobicContact CD1-CG1 4.49Å; A681-I686 HydrophobicContact CB-CD1 4.41Å; A681-I686 WeakPolarHBondContact O-CB 3.42Å; A681-I686 PolarHBondContact O-N 2.66Å; L684-I686 HydrophobicContact CB-CD1 3.92Å; L684-I686 HydrophobicContact CB-CG1 3.81Å; L684-I686 HydrophobicContact CD1-CD1 4.29Å; L684-I686 PolarHBondContact O-N 3.18Å; I686-R688 PolarHBondContact O-N 3.11Å; I686-R693 HydrophobicContact CG2-CB 4.19Å; I686-R693 PolarHBondContact O-NH1 3.31Å; I686-L697 HydrophobicContact CD1-CD1 3.71Å; I686-L697 HydrophobicContact CD1-CD2 4.02Å; I686-L697 HydrophobicContact CD1-CG 4.37Å
687	P	81.6	Confident	87.5	Confident	10 Å²	10	58 Å²	58	7%	0.065	28%	0.284	C	S	.	.			trans	-52.8	125.3	-174.6	-26.3	32.2	0	0	0	113.4	T689 A690 N831 M835	P687-T689 WeakPolarHBondContact CB-OG1 3.29Å; P687-T689 PolarHBondContact O-N 2.67Å; P687-T689 VanDerWaalsContact O-N 3.12Å; P687-A690 HydrophobicContact CB-CB 4.4Å; P687-A690 WeakPolarHBondContact O-CB 3.13Å; P687-A690 PolarHBondContact O-N 3.34Å; P687-N831 HydrophobicContact CB-CB 4.49Å; P687-N831 HydrophobicContact CG-CB 4.25Å; P687-M835 HydrophobicContact CG-CG 3.74Å; P687-M835 HydrophobicContact CG-SD 3.6Å
688	R	82.6	Confident	87.5	Confident	193 Å²	193	60.5 Å²	60.5	73%	0.728	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-13.7	172	-71	179.1	173.4	-173.8	-1.6	113.2	D682 I686	D682-R688 IonicContact OD1-CZ 3.87Å; D682-R688 IonicContact OD1-NE 2.71Å; D682-R688 PolarHBondContact OD1-NE 3.17Å; D682-R688 IonicContact OD1-NH2 2.83Å; D682-R688 IonicContact OD2-CZ 3.66Å; D682-R688 IonicContact OD2-NE 3.21Å; D682-R688 PolarHBondContact OD2-NE 3.47Å; D682-R688 IonicContact OD2-NH2 3.34Å; D682-R688 PolarHBondContact OD2-NH2 3.11Å; I686-R688 PolarHBondContact O-N 3.11Å
689	T	79.8	Confident	87.5	Confident	89 Å²	89	62.1 Å²	62.1	55%	0.546	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-12.5	172.4	49.4	0	0	0	0	113.7	P687 Q691 N831	P687-T689 WeakPolarHBondContact CB-OG1 3.29Å; P687-T689 PolarHBondContact O-N 2.67Å; P687-T689 VanDerWaalsContact O-N 3.12Å; T689-Q691 PolarHBondContact O-N 3.05Å; T689-N831 PolarHBondContact OG1-OD1 3.44Å
690	A	82.3	Confident	87.6	Confident	12 Å²	12	56.4 Å²	56.4	10%	0.099	28%	0.277	C	S	.	.	S	Bend	trans	-71.9	124.1	-177.6	0	0	0	0	0	111.7	I648 G649 P687 D692 R693	I648-A690 HydrophobicContact CG2-CB 4.16Å; G649-A690 VanDerWaalsContact CA-CB 3.45Å; P687-A690 HydrophobicContact CB-CB 4.4Å; P687-A690 WeakPolarHBondContact O-CB 3.13Å; P687-A690 PolarHBondContact O-N 3.34Å; A690-D692 PolarHBondContact O-N 2.98Å; A690-R693 HydrophobicContact CB-CB 3.96Å; A690-R693 PolarHBondContact O-N 3.43Å
691	Q	81.6	Confident	87.7	Confident	144 Å²	144	56.4 Å²	56.4	67%	0.673	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	133.5	176.3	-59.9	-57.8	-73.1	0	0	110.3	T689 R693 K696	T689-Q691 PolarHBondContact O-N 3.05Å; Q691-R693 PolarHBondContact O-N 3.3Å; Q691-K696 PolarHBondContact O-NZ 2.95Å
692	D	86.6	Confident	87.7	Confident	103 Å²	103	58 Å²	58	55%	0.551	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	28.7	179.4	-33	-62.5	0	0	0	115.1	A690 L694 A695 K696	A690-D692 PolarHBondContact O-N 2.98Å; D692-L694 PolarHBondContact O-N 3Å; D692-A695 HydrophobicContact CB-CB 4.3Å; D692-A695 PolarHBondContact O-N 2.31Å; D692-K696 HydrophobicContact CB-CD 4.3Å; D692-K696 PolarHBondContact O-N 3.29Å; D692-K696 IonicContact OD2-NZ 2.74Å; D692-K696 PolarHBondContact OD2-NZ 2.79Å
693	R	89	Confident	87.8	Confident	19 Å²	19	57.8 Å²	57.8	7%	0.072	29%	0.285	C	S	.	.	H	α-helix	trans	-50.3	-35.3	-171.2	83.6	174	-173.2	153.3	2.4	114.3	I648 N678 D682 I686 A690 Q691 L697	I648-R693 HydrophobicContact CG2-CB 4.1Å; N678-R693 PolarHBondContact O-NH2 3.43Å; N678-R693 PolarHBondContact OD1-NH2 3.49Å; D682-R693 IonicContact OD1-CZ 2.9Å; D682-R693 VanDerWaalsContact OD1-CZ 3.23Å; D682-R693 IonicContact OD1-NH1 3.56Å; D682-R693 PolarHBondContact OD1-NH1 2.81Å; D682-R693 IonicContact OD1-NH2 3.77Å; D682-R693 PolarHBondContact OD1-NH2 2.97Å; D682-R693 IonicContact OD2-NH2 3.75Å; I686-R693 HydrophobicContact CG2-CB 4.19Å; I686-R693 PolarHBondContact O-NH1 3.31Å; A690-R693 HydrophobicContact CB-CB 3.96Å; A690-R693 PolarHBondContact O-N 3.43Å; Q691-R693 PolarHBondContact O-N 3.3Å; R693-L697 WeakPolarHBondContact O-CB 3.34Å; R693-L697 PolarHBondContact O-N 2.88Å
694	L	91.3	Very high	87.9	Confident	51 Å²	51	55.7 Å²	55.7	27%	0.267	27%	0.273	S	S	.	.	H	α-helix	trans	-77.1	-40	-178.6	-55.9	178.5	0	0	0	112.4	W677 A681 D692 L697 Q698	W677-L694 HydrophobicContact CB-CD2 4.4Å; A681-L694 HydrophobicContact CB-CD2 3.91Å; D692-L694 PolarHBondContact O-N 3Å; L694-L697 PolarHBondContact O-N 3.49Å; L694-Q698 WeakPolarHBondContact O-CB 3.43Å; L694-Q698 VanDerWaalsContact O-CG 3.32Å; L694-Q698 WeakPolarHBondContact O-CG 3.48Å; L694-Q698 PolarHBondContact O-N 2.59Å
695	A	90.8	Very high	88.2	Confident	56 Å²	56	54.8 Å²	54.8	46%	0.463	27%	0.268	S	S	.	.	H	α-helix	trans	-66.9	-43.7	177.1	0	0	0	0	0	110.6	D692 L697 Q698 E699	D692-A695 HydrophobicContact CB-CB 4.3Å; D692-A695 PolarHBondContact O-N 2.31Å; A695-L697 VanDerWaalsContact C-N 3.33Å; A695-L697 PolarHBondContact O-N 2.85Å; A695-Q698 PolarHBondContact O-N 3.26Å; A695-E699 VanDerWaalsContact O-CB 3.29Å; A695-E699 WeakPolarHBondContact O-CB 3.12Å; A695-E699 PolarHBondContact O-N 3.42Å
696	K	91.9	Very high	88.5	Confident	73 Å²	73	52.2 Å²	52.2	32%	0.317	26%	0.261	S	S	.	.	H	α-helix	trans	-66.1	-33.7	176.4	-70.6	165.7	-172.6	148.3	0	112.6	I648 Q691 D692 A700	I648-K696 HydrophobicContact CD1-CB 4.16Å; I648-K696 HydrophobicContact CG1-CB 4.24Å; Q691-K696 PolarHBondContact O-NZ 2.95Å; D692-K696 HydrophobicContact CB-CD 4.3Å; D692-K696 PolarHBondContact O-N 3.29Å; D692-K696 IonicContact OD2-NZ 2.74Å; D692-K696 PolarHBondContact OD2-NZ 2.79Å; K696-A700 VanDerWaalsContact O-CB 3.29Å; K696-A700 WeakPolarHBondContact O-CB 3.42Å; K696-A700 PolarHBondContact O-N 2.72Å
697	L	92.6	Very high	88.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-69.3	-40.8	173.5	-173.4	62.7	0	0	0	111.9	I648 L653 F658 W677 L680 A681 L684 I686 R693 L694 A695 Y701	I648-L697 HydrophobicContact CD1-CB 4.2Å; I648-L697 HydrophobicContact CD1-CD1 4.27Å; L653-L697 HydrophobicContact CD1-CD1 3.91Å; L653-L697 HydrophobicContact CD2-CD1 4.02Å; F658-L697 HydrophobicContact CD1-CD1 4.14Å; F658-L697 HydrophobicContact CD2-CD1 4.29Å; F658-L697 HydrophobicContact CE1-CD1 3.57Å; F658-L697 HydrophobicContact CE1-CG 4.36Å; F658-L697 HydrophobicContact CE2-CD1 3.68Å; F658-L697 HydrophobicContact CE2-CD2 4.47Å; F658-L697 HydrophobicContact CE2-CG 3.97Å; F658-L697 HydrophobicContact CG-CD1 4.49Å; F658-L697 HydrophobicContact CZ-CD1 3.29Å; F658-L697 HydrophobicContact CZ-CG 3.64Å; F658-L697 WeakPolarHBondContact CZ-O 3.02Å; W677-L697 HydrophobicContact CE3-CD2 4.1Å; W677-L697 HydrophobicContact CE3-CG 4.28Å; W677-L697 HydrophobicContact CZ3-CD2 4.33Å; W677-L697 HydrophobicContact CZ3-CG 4.08Å; L680-L697 HydrophobicContact CG-CD2 4.36Å; A681-L697 HydrophobicContact CB-CD2 3.84Å; L684-L697 HydrophobicContact CD1-CD1 3.94Å; L684-L697 HydrophobicContact CD1-CD2 4.33Å; I686-L697 HydrophobicContact CD1-CD1 3.71Å; I686-L697 HydrophobicContact CD1-CD2 4.02Å; I686-L697 HydrophobicContact CD1-CG 4.37Å; R693-L697 WeakPolarHBondContact O-CB 3.34Å; R693-L697 PolarHBondContact O-N 2.88Å; L694-L697 PolarHBondContact O-N 3.49Å; A695-L697 VanDerWaalsContact C-N 3.33Å; A695-L697 PolarHBondContact O-N 2.85Å; L697-Y701 PolarHBondContact O-N 3.46Å
698	Q	91.2	Very high	89.3	Confident	67 Å²	67	53.4 Å²	53.4	31%	0.313	27%	0.269	S	S	.	.	H	α-helix	trans	-66.5	-39.9	173.8	-74.5	173.4	-10	0	0	112.3	W677 L694 A695 Y701 C702	W677-Q698 HydrophobicContact CD2-CG 3.76Å; W677-Q698 HydrophobicContact CE3-CG 3.79Å; W677-Q698 HydrophobicContact CH2-CG 3.74Å; W677-Q698 HydrophobicContact CZ2-CG 3.69Å; W677-Q698 HydrophobicContact CZ3-CG 3.79Å; L694-Q698 WeakPolarHBondContact O-CB 3.43Å; L694-Q698 VanDerWaalsContact O-CG 3.32Å; L694-Q698 WeakPolarHBondContact O-CG 3.48Å; L694-Q698 PolarHBondContact O-N 2.59Å; A695-Q698 PolarHBondContact O-N 3.26Å; Q698-Y701 WeakPolarHBondContact O-CB 3.38Å; Q698-Y701 PolarHBondContact O-N 3.41Å; Q698-C702 PolarHBondContact O-N 2.96Å; Q698-C702 VanDerWaalsContact O-N 3.1Å; Q698-C702 PolarHBondContact O-SG 2.95Å
699	E	92.1	Very high	89.7	Confident	116 Å²	116	45.9 Å²	45.9	54%	0.542	24%	0.243	S	C	.	.	H	α-helix	trans	-61.9	-51.2	175.2	-175.6	168.1	-141.7	0	0	111	A695 Y701 C702 Q703	A695-E699 VanDerWaalsContact O-CB 3.29Å; A695-E699 WeakPolarHBondContact O-CB 3.12Å; A695-E699 PolarHBondContact O-N 3.42Å; E699-Y701 PolarHBondContact O-N 2.96Å; E699-C702 PolarHBondContact O-N 3.34Å; E699-Q703 WeakPolarHBondContact O-CB 3.38Å; E699-Q703 PolarHBondContact O-N 2.82Å
700	A	92.4	Very high	90.1	Very high	4 Å²	4	45.9 Å²	45.9	3%	0.033	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-31.4	175.1	0	0	0	0	0	113.1	P646 L653 K696 Y704	P646-A700 HydrophobicContact CB-CB 4.37Å; P646-A700 HydrophobicContact CG-CB 4.3Å; L653-A700 HydrophobicContact CD2-CB 3.78Å; K696-A700 VanDerWaalsContact O-CB 3.29Å; K696-A700 WeakPolarHBondContact O-CB 3.42Å; K696-A700 PolarHBondContact O-N 2.72Å; A700-Y704 HydrophobicContact CB-CD2 4.25Å; A700-Y704 WeakPolarHBondContact O-CB 3.42Å; A700-Y704 WeakPolarHBondContact O-CD2 3.5Å; A700-Y704 PolarHBondContact O-N 3.13Å
701	Y	92.8	Very high	90.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.4	-55.5	172.7	-167.4	-98.1	0	0	0	111.9	F658 I662 M668 L697 Q698 E699 Q703 L705 L706 D709	F658-Y701 HydrophobicContact CE1-CD2 4.06Å; F658-Y701 HydrophobicContact CE2-CD2 4.05Å; F658-Y701 AromaticContact CZ-CD2 3.72Å; F658-Y701 HydrophobicContact CZ-CD2 3.72Å; F658-Y701 HydrophobicContact CZ-CG 4.24Å; I662-Y701 HydrophobicContact CD1-CD2 3.35Å; I662-Y701 HydrophobicContact CD1-CE2 3.15Å; I662-Y701 HydrophobicContact CD1-CG 4.27Å; I662-Y701 HydrophobicContact CG1-CE2 4.41Å; I662-Y701 HydrophobicContact CG2-CE2 4.4Å; M668-Y701 HydrophobicContact CB-CE1 3.83Å; M668-Y701 HydrophobicContact CE-CD1 3.62Å; M668-Y701 HydrophobicContact CE-CE1 4.13Å; M668-Y701 HydrophobicContact CE-CG 4.39Å; M668-Y701 HydrophobicContact CG-CD1 4.12Å; M668-Y701 HydrophobicContact CG-CE1 3.63Å; M668-Y701 HydrophobicContact SD-CD1 3.43Å; M668-Y701 WeakPolarHBondContact SD-CD1 3.34Å; M668-Y701 HydrophobicContact SD-CE1 3.49Å; M668-Y701 WeakPolarHBondContact SD-CE1 3.35Å; M668-Y701 HydrophobicContact SD-CG 4.08Å; L697-Y701 PolarHBondContact O-N 3.46Å; Q698-Y701 WeakPolarHBondContact O-CB 3.38Å; Q698-Y701 PolarHBondContact O-N 3.41Å; E699-Y701 PolarHBondContact O-N 2.96Å; Y701-Q703 PolarHBondContact O-N 3.49Å; Y701-L705 HydrophobicContact CD2-CB 3.71Å; Y701-L705 HydrophobicContact CD2-CD1 3.92Å; Y701-L705 HydrophobicContact CD2-CG 4.43Å; Y701-L705 HydrophobicContact CE2-CB 3.65Å; Y701-L705 HydrophobicContact CE2-CD1 4.03Å; Y701-L705 HydrophobicContact CG-CB 4.4Å; Y701-L705 PolarHBondContact O-N 2.94Å; Y701-L706 HydrophobicContact CD1-CB 4.17Å; Y701-L706 HydrophobicContact CE1-CB 4.05Å; Y701-L706 HydrophobicContact CE1-CD1 3.98Å; Y701-L706 PolarHBondContact O-N 2.85Å; Y701-D709 WeakPolarHBondContact OH-CB 3.19Å; Y701-D709 PolarHBondContact OH-OD2 2.57Å
702	C	90.9	Very high	91	Very high	32 Å²	32	41.5 Å²	41.5	22%	0.216	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-30.1	-177.8	-66.7	0	0	0	0	112.7	V32 Q698 E699	V32-C702 HydrophobicContact CG2-CB 4.5Å; Q698-C702 PolarHBondContact O-N 2.96Å; Q698-C702 VanDerWaalsContact O-N 3.1Å; Q698-C702 PolarHBondContact O-SG 2.95Å; E699-C702 PolarHBondContact O-N 3.34Å
703	Q	90	Very high	91.1	Very high	53 Å²	53	40.7 Å²	40.7	25%	0.248	23%	0.23	C	C	.	.	H	α-helix	trans	-85.2	-39.9	-177.8	-165.9	178.2	24.8	0	0	113.5	E39 E699 Y701	E39-Q703 PolarHBondContact OE1-NE2 3.48Å; E699-Q703 WeakPolarHBondContact O-CB 3.38Å; E699-Q703 PolarHBondContact O-N 2.82Å; Y701-Q703 PolarHBondContact O-N 3.49Å
704	Y	91.1	Very high	91.2	Very high	34 Å²	34	45.9 Å²	45.9	13%	0.133	25%	0.254	C	S	.	.	H	α-helix	trans	-119.1	-16.6	-168.6	-57.5	-65.3	0	0	0	116	L635 M642 P646 A700	L635-Y704 HydrophobicContact CD1-CD1 4.03Å; M642-Y704 HydrophobicContact CB-CE1 4.32Å; M642-Y704 HydrophobicContact CG-CD1 4.29Å; M642-Y704 HydrophobicContact CG-CE1 4.07Å; M642-Y704 HydrophobicContact SD-CD1 3.61Å; M642-Y704 HydrophobicContact SD-CE1 3.93Å; M642-Y704 HydrophobicContact SD-CG 4.06Å; P646-Y704 HydrophobicContact CB-CD2 4.44Å; P646-Y704 HydrophobicContact CB-CE2 3.94Å; P646-Y704 HydrophobicContact CG-CD2 3.87Å; P646-Y704 HydrophobicContact CG-CE2 3.8Å; A700-Y704 HydrophobicContact CB-CD2 4.25Å; A700-Y704 WeakPolarHBondContact O-CB 3.42Å; A700-Y704 WeakPolarHBondContact O-CD2 3.5Å; A700-Y704 PolarHBondContact O-N 3.13Å
705	L	92.1	Very high	91.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-32	-176.3	-71.3	-176.3	0	0	0	114.3	I631 L655 F658 F659 Y701 S707 Y708 D709	I631-L705 HydrophobicContact CD1-CD2 3.78Å; I631-L705 HydrophobicContact CG1-CD2 4.23Å; I631-L705 HydrophobicContact CG2-CD2 4.27Å; L655-L705 HydrophobicContact CB-CD2 4.33Å; L655-L705 HydrophobicContact CD2-CD1 4.47Å; L655-L705 HydrophobicContact CD2-CG 4.38Å; F658-L705 HydrophobicContact CB-CD1 3.87Å; F658-L705 HydrophobicContact CD1-CD1 3.32Å; F658-L705 HydrophobicContact CD1-CG 4.45Å; F658-L705 HydrophobicContact CD2-CD1 4.38Å; F658-L705 HydrophobicContact CE1-CD1 3.92Å; F658-L705 HydrophobicContact CG-CD1 3.59Å; F659-L705 HydrophobicContact CB-CD1 4.29Å; F659-L705 HydrophobicContact CB-CD2 4.23Å; Y701-L705 HydrophobicContact CD2-CB 3.71Å; Y701-L705 HydrophobicContact CD2-CD1 3.92Å; Y701-L705 HydrophobicContact CD2-CG 4.43Å; Y701-L705 HydrophobicContact CE2-CB 3.65Å; Y701-L705 HydrophobicContact CE2-CD1 4.03Å; Y701-L705 HydrophobicContact CG-CB 4.4Å; Y701-L705 PolarHBondContact O-N 2.94Å; L705-S707 VanDerWaalsContact C-N 3.34Å; L705-S707 PolarHBondContact O-N 2.9Å; L705-Y708 CarbonylContact O-C 3.57Å; L705-Y708 WeakPolarHBondContact O-CA 3.27Å; L705-Y708 WeakPolarHBondContact O-CB 3.5Å; L705-Y708 PolarHBondContact O-N 3.26Å; L705-D709 WeakPolarHBondContact O-CB 3.35Å; L705-D709 PolarHBondContact O-N 2.7Å
706	L	90.8	Very high	91.1	Very high	30 Å²	30	47.1 Å²	47.1	16%	0.157	25%	0.249	C	C	.	.	H	α-helix	trans	-57.1	-42.6	-172.4	176.7	64.7	0	0	0	113.6	V32 Y701 Y708 D709 S710	V32-L706 HydrophobicContact CB-CD2 4.15Å; V32-L706 HydrophobicContact CG1-CD2 3.72Å; V32-L706 HydrophobicContact CG2-CD2 3.33Å; Y701-L706 HydrophobicContact CD1-CB 4.17Å; Y701-L706 HydrophobicContact CE1-CB 4.05Å; Y701-L706 HydrophobicContact CE1-CD1 3.98Å; Y701-L706 PolarHBondContact O-N 2.85Å; L706-Y708 VanDerWaalsContact C-N 3.31Å; L706-Y708 PolarHBondContact O-N 2.95Å; L706-D709 PolarHBondContact O-N 3.28Å; L706-S710 WeakPolarHBondContact O-CB 3.24Å; L706-S710 PolarHBondContact O-N 2.82Å; L706-S710 VanDerWaalsContact O-N 3.15Å; L706-S710 PolarHBondContact O-OG 3.42Å
707	S	91.1	Very high	91	Very high	36 Å²	36	50.9 Å²	50.9	25%	0.252	26%	0.262	S	S	.	.	H	α-helix	trans	-70.6	-28.5	178.1	64.3	0	0	0	0	112.7	H634 L705	H634-S707 WeakPolarHBondContact NE2-CA 3.45Å; H634-S707 WeakPolarHBondContact NE2-CB 3.42Å; H634-S707 PolarHBondContact NE2-O 2.67Å; H634-S707 PolarHBondContact NE2-OG 2.8Å; L705-S707 VanDerWaalsContact C-N 3.34Å; L705-S707 PolarHBondContact O-N 2.9Å
708	Y	91.8	Very high	91	Very high	9 Å²	9	58.9 Å²	58.9	4%	0.035	29%	0.292	C	S	.	.	H	α-helix	trans	-77.6	-38.1	176	-179.7	-93.8	0	0	0	111.4	C630 I631 H634 F659 L705 L706 S710 L711 H716 L719	C630-Y708 HydrophobicContact CB-CE2 4Å; I631-Y708 HydrophobicContact CD1-CE1 4.48Å; I631-Y708 HydrophobicContact CG1-CD1 3.87Å; I631-Y708 HydrophobicContact CG1-CD2 4.04Å; I631-Y708 HydrophobicContact CG1-CE1 3.84Å; I631-Y708 HydrophobicContact CG1-CE2 3.99Å; I631-Y708 HydrophobicContact CG1-CG 3.99Å; H634-Y708 HydrophobicContact CB-CD2 3.86Å; H634-Y708 PolarHBondContact NE2-N 3.28Å; F659-Y708 HydrophobicContact CD1-CE1 4.3Å; F659-Y708 AromaticContact CD2-CD1 3.79Å; F659-Y708 HydrophobicContact CD2-CD1 3.79Å; F659-Y708 AromaticContact CD2-CE1 3.92Å; F659-Y708 HydrophobicContact CD2-CE1 3.92Å; F659-Y708 HydrophobicContact CE1-CE1 4.1Å; F659-Y708 AromaticContact CE2-CD1 3.72Å; F659-Y708 HydrophobicContact CE2-CD1 3.72Å; F659-Y708 AromaticContact CE2-CE1 3.7Å; F659-Y708 HydrophobicContact CE2-CE1 3.7Å; F659-Y708 HydrophobicContact CG-CD1 4.41Å; F659-Y708 HydrophobicContact CG-CE1 4.2Å; F659-Y708 HydrophobicContact CZ-CD1 4.28Å; F659-Y708 AromaticContact CZ-CE1 3.79Å; F659-Y708 HydrophobicContact CZ-CE1 3.79Å; L705-Y708 CarbonylContact O-C 3.57Å; L705-Y708 WeakPolarHBondContact O-CA 3.27Å; L705-Y708 WeakPolarHBondContact O-CB 3.5Å; L705-Y708 PolarHBondContact O-N 3.26Å; L706-Y708 VanDerWaalsContact C-N 3.31Å; L706-Y708 PolarHBondContact O-N 2.95Å; Y708-S710 PolarHBondContact O-N 2.9Å; Y708-L711 HydrophobicContact CD2-CD1 3.95Å; Y708-L711 HydrophobicContact CE2-CD1 4.36Å; Y708-L711 HydrophobicContact CG-CD1 4.49Å; Y708-L711 WeakPolarHBondContact O-CB 3.21Å; Y708-L711 WeakPolarHBondContact O-CG 3.12Å; Y708-L711 PolarHBondContact O-N 3.23Å; Y708-H716 AromaticContact CD1-CE1 3.75Å; Y708-H716 AromaticContact CE1-CE1 3.41Å; Y708-H716 VanDerWaalsContact CE1-CE1 3.41Å; Y708-H716 WeakPolarHBondContact CE1-CE1 3.48Å; Y708-H716 AromaticContact CE1-ND1 3.79Å; Y708-H716 AromaticContact CE2-ND1 3.89Å; Y708-H716 AromaticContact CZ-CE1 3.6Å; Y708-H716 AromaticContact CZ-ND1 3.48Å; Y708-H716 PolarHBondContact O-CE1 2.88Å; Y708-H716 PolarHBondContact O-NE2 3.28Å; Y708-L719 HydrophobicContact CD2-CD2 4.35Å; Y708-L719 HydrophobicContact CE2-CD2 3.83Å
709	D	90.8	Very high	91.1	Very high	36 Å²	36	56.7 Å²	56.7	19%	0.193	28%	0.282	C	S	.	.	H	α-helix	trans	-73.1	-14.6	177	-166.5	71.2	0	0	0	113.2	F659 N663 Y701 L705 L706	F659-D709 HydrophobicContact CD2-CB 4.38Å; F659-D709 HydrophobicContact CE2-CB 4.2Å; F659-D709 VanDerWaalsContact CE2-OD1 3.29Å; F659-D709 WeakPolarHBondContact CE2-OD1 3.46Å; N663-D709 PolarHBondContact ND2-OD1 3.25Å; Y701-D709 WeakPolarHBondContact OH-CB 3.19Å; Y701-D709 PolarHBondContact OH-OD2 2.57Å; L705-D709 WeakPolarHBondContact O-CB 3.35Å; L705-D709 PolarHBondContact O-N 2.7Å; L706-D709 PolarHBondContact O-N 3.28Å
710	S	89.5	Confident	91.1	Very high	88 Å²	88	54.1 Å²	54.1	62%	0.615	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-0.3	173.7	-56.6	0	0	0	0	113.8	L706 Y708	L706-S710 WeakPolarHBondContact O-CB 3.24Å; L706-S710 PolarHBondContact O-N 2.82Å; L706-S710 VanDerWaalsContact O-N 3.15Å; L706-S710 PolarHBondContact O-OG 3.42Å; Y708-S710 PolarHBondContact O-N 2.9Å
711	L	90.8	Very high	91.1	Very high	28 Å²	28	59.7 Å²	59.7	15%	0.147	29%	0.293	C	S	.	.	S	Bend	trans	-77.5	151.6	-179.3	-67.5	174.6	0	0	0	112.2	H634 Y708 E715 L719	H634-L711 VanDerWaalsContact CE1-CD2 3.41Å; H634-L711 WeakPolarHBondContact CE1-CD2 3.5Å; Y708-L711 HydrophobicContact CD2-CD1 3.95Å; Y708-L711 HydrophobicContact CE2-CD1 4.36Å; Y708-L711 HydrophobicContact CG-CD1 4.49Å; Y708-L711 WeakPolarHBondContact O-CB 3.21Å; Y708-L711 WeakPolarHBondContact O-CG 3.12Å; Y708-L711 PolarHBondContact O-N 3.23Å; L711-E715 HydrophobicContact CB-CB 4.19Å; L711-E715 HydrophobicContact CD2-CB 4.3Å; L711-L719 HydrophobicContact CD1-CD2 4.37Å
712	S	90.7	Very high	91	Very high	36 Å²	36	62.3 Å²	62.3	25%	0.252	31%	0.306	S	S	.	.			trans	-68.4	155.6	172	112.2	0	0	0	0	112	E714 E715 H716	S712-E714 WeakPolarHBondContact CB-OE2 3.36Å; S712-E714 PolarHBondContact O-N 2.97Å; S712-E714 WeakPolarHBondContact OG-CB 3.45Å; S712-E714 PolarHBondContact OG-N 2.91Å; S712-E714 PolarHBondContact OG-OE2 3.01Å; S712-E715 PolarHBondContact N-OE2 3Å; S712-E715 PolarHBondContact O-N 2.87Å; S712-E715 VanDerWaalsContact O-N 3.08Å; S712-E715 PolarHBondContact OG-N 2.82Å; S712-E715 VanDerWaalsContact OG-N 3.16Å; S712-H716 PolarHBondContact O-CD2 2.94Å; S712-H716 PolarHBondContact O-N 2.98Å
713	P	89.3	Confident	91	Very high	87 Å²	87	60.8 Å²	60.8	57%	0.565	30%	0.295	S	S	*	.	H	α-helix	trans	-57.1	-31.7	171.6	-25.3	35.7	0	0	0	113.6	R717	P713-R717 WeakPolarHBondContact O-CB 3.49Å; P713-R717 WeakPolarHBondContact O-CD 3.34Å; P713-R717 WeakPolarHBondContact O-CG 3.33Å; P713-R717 PolarHBondContact O-N 2.86Å; P713-R717 VanDerWaalsContact O-N 3.11Å
714	E	90.4	Very high	91	Very high	127 Å²	127	61.4 Å²	61.4	59%	0.593	30%	0.3	S	S	*	.	H	α-helix	trans	-69.6	-42	173.7	-59.9	67.1	-145	0	0	111.7	S712 R717 R718	S712-E714 WeakPolarHBondContact CB-OE2 3.36Å; S712-E714 PolarHBondContact O-N 2.97Å; S712-E714 WeakPolarHBondContact OG-CB 3.45Å; S712-E714 PolarHBondContact OG-N 2.91Å; S712-E714 PolarHBondContact OG-OE2 3.01Å; E714-R717 PolarHBondContact O-N 3.42Å; E714-R718 WeakPolarHBondContact O-CB 3.34Å; E714-R718 PolarHBondContact O-N 3.18Å
715	E	90.9	Very high	90.8	Very high	98 Å²	98	65.3 Å²	65.3	46%	0.458	32%	0.321	S	S	.	.	H	α-helix	trans	-66.7	-45.1	177.7	-66.3	-178.7	123.9	0	0	111.6	L711 S712 R717 R718 L719	L711-E715 HydrophobicContact CB-CB 4.19Å; L711-E715 HydrophobicContact CD2-CB 4.3Å; S712-E715 PolarHBondContact N-OE2 3Å; S712-E715 PolarHBondContact O-N 2.87Å; S712-E715 VanDerWaalsContact O-N 3.08Å; S712-E715 PolarHBondContact OG-N 2.82Å; S712-E715 VanDerWaalsContact OG-N 3.16Å; E715-R717 VanDerWaalsContact C-N 3.34Å; E715-R717 PolarHBondContact O-N 3.22Å; E715-R718 WeakPolarHBondContact O-CB 3.44Å; E715-R718 PolarHBondContact O-N 3.36Å; E715-L719 WeakPolarHBondContact O-CB 3.32Å; E715-L719 PolarHBondContact O-N 2.89Å
716	H	89.1	Confident	90.6	Very high	36 Å²	36	68.1 Å²	68.1	17%	0.167	33%	0.334	C	S	.	.	H	α-helix	trans	-54.7	-48.2	170.2	-79.7	-55.8	0	0	0	111.8	F659 Y708 S712 R718 L719 E720	F659-H716 AromaticContact CZ-CE1 3.86Å; F659-H716 AromaticContact CZ-NE2 3.86Å; Y708-H716 AromaticContact CD1-CE1 3.75Å; Y708-H716 AromaticContact CE1-CE1 3.41Å; Y708-H716 VanDerWaalsContact CE1-CE1 3.41Å; Y708-H716 WeakPolarHBondContact CE1-CE1 3.48Å; Y708-H716 AromaticContact CE1-ND1 3.79Å; Y708-H716 AromaticContact CE2-ND1 3.89Å; Y708-H716 AromaticContact CZ-CE1 3.6Å; Y708-H716 AromaticContact CZ-ND1 3.48Å; Y708-H716 PolarHBondContact O-CE1 2.88Å; Y708-H716 PolarHBondContact O-NE2 3.28Å; S712-H716 PolarHBondContact O-CD2 2.94Å; S712-H716 PolarHBondContact O-N 2.98Å; H716-R718 VanDerWaalsContact C-N 3.34Å; H716-R718 PolarHBondContact O-N 2.84Å; H716-L719 PolarHBondContact O-N 2.97Å; H716-E720 WeakPolarHBondContact O-CB 3.25Å; H716-E720 PolarHBondContact O-N 2.93Å
717	R	91.2	Very high	90.3	Very high	152 Å²	152	68.6 Å²	68.6	57%	0.574	34%	0.335	S	S	*	.	H	α-helix	trans	-63.2	-35.9	176.9	-85.5	163.4	41.3	91.4	-7	113.1	P713 E714 E715 K721	P713-R717 WeakPolarHBondContact O-CB 3.49Å; P713-R717 WeakPolarHBondContact O-CD 3.34Å; P713-R717 WeakPolarHBondContact O-CG 3.33Å; P713-R717 PolarHBondContact O-N 2.86Å; P713-R717 VanDerWaalsContact O-N 3.11Å; E714-R717 PolarHBondContact O-N 3.42Å; E715-R717 VanDerWaalsContact C-N 3.34Å; E715-R717 PolarHBondContact O-N 3.22Å; R717-K721 VanDerWaalsContact O-CG 3.32Å; R717-K721 WeakPolarHBondContact O-CG 3.38Å; R717-K721 PolarHBondContact O-N 3.19Å
718	R	92.8	Very high	90	Very high	167 Å²	167	71.5 Å²	71.5	63%	0.63	34%	0.344	S	S	*	.	H	α-helix	trans	-66.1	-51.3	175.4	178.1	-173.7	162.8	-175.1	-7.7	110	E714 E715 H716 E720 K721 E722	E714-R718 WeakPolarHBondContact O-CB 3.34Å; E714-R718 PolarHBondContact O-N 3.18Å; E715-R718 WeakPolarHBondContact O-CB 3.44Å; E715-R718 PolarHBondContact O-N 3.36Å; H716-R718 VanDerWaalsContact C-N 3.34Å; H716-R718 PolarHBondContact O-N 2.84Å; R718-E720 VanDerWaalsContact C-N 3.34Å; R718-E720 PolarHBondContact O-N 3.45Å; R718-K721 WeakPolarHBondContact O-CB 3.48Å; R718-K721 PolarHBondContact O-N 3.12Å; R718-E722 IonicContact CZ-OE1 3.62Å; R718-E722 VanDerWaalsContact CZ-OE1 3.25Å; R718-E722 IonicContact NE-OE1 3.36Å; R718-E722 PolarHBondContact NE-OE1 3.42Å; R718-E722 IonicContact NH2-OE1 3.39Å; R718-E722 PolarHBondContact NH2-OE1 3.45Å; R718-E722 WeakPolarHBondContact O-CG 3.44Å; R718-E722 PolarHBondContact O-N 3.44Å
719	L	92.3	Very high	89.6	Confident	21 Å²	21	75.2 Å²	75.2	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-61.3	-41.1	-178.8	-178.5	60.3	0	0	0	112.2	C630 K633 H634 Y708 L711 E715 H716 E722 V723	C630-L719 HydrophobicContact CB-CD2 4.22Å; C630-L719 HydrophobicContact CB-CG 4.22Å; K633-L719 HydrophobicContact CB-CD1 4.13Å; K633-L719 HydrophobicContact CD-CD1 3.77Å; K633-L719 HydrophobicContact CG-CD1 3.87Å; H634-L719 HydrophobicContact CB-CD2 3.89Å; Y708-L719 HydrophobicContact CD2-CD2 4.35Å; Y708-L719 HydrophobicContact CE2-CD2 3.83Å; L711-L719 HydrophobicContact CD1-CD2 4.37Å; E715-L719 WeakPolarHBondContact O-CB 3.32Å; E715-L719 PolarHBondContact O-N 2.89Å; H716-L719 PolarHBondContact O-N 2.97Å; L719-E722 PolarHBondContact O-N 3.41Å; L719-V723 WeakPolarHBondContact O-CG2 3.04Å; L719-V723 PolarHBondContact O-N 2.93Å
720	E	91.9	Very high	88.9	Confident	62 Å²	62	74.4 Å²	74.4	29%	0.29	36%	0.36	S	S	.	.	H	α-helix	trans	-63.3	-41.2	174.6	-178	164.9	-125.8	0	0	112.2	Q626 H716 R718 V723 L724	Q626-E720 PolarHBondContact NE2-OE1 2.95Å; H716-E720 WeakPolarHBondContact O-CB 3.25Å; H716-E720 PolarHBondContact O-N 2.93Å; R718-E720 VanDerWaalsContact C-N 3.34Å; R718-E720 PolarHBondContact O-N 3.45Å; E720-V723 PolarHBondContact O-N 2.87Å; E720-L724 HydrophobicContact CG-CD1 4.18Å; E720-L724 WeakPolarHBondContact O-CB 3.15Å; E720-L724 VanDerWaalsContact O-CG 3.31Å; E720-L724 WeakPolarHBondContact O-CG 3.38Å; E720-L724 PolarHBondContact O-N 3.12Å
721	K	92.5	Very high	88.3	Confident	121 Å²	121	72.5 Å²	72.5	53%	0.526	34%	0.341	S	S	.	.	H	α-helix	trans	-62.2	-45.8	173	-76.8	175.5	175.5	-171.2	0	112.3	R717 R718 V723 L724 M725	R717-K721 VanDerWaalsContact O-CG 3.32Å; R717-K721 WeakPolarHBondContact O-CG 3.38Å; R717-K721 PolarHBondContact O-N 3.19Å; R718-K721 WeakPolarHBondContact O-CB 3.48Å; R718-K721 PolarHBondContact O-N 3.12Å; K721-V723 VanDerWaalsContact C-N 3.35Å; K721-V723 PolarHBondContact O-N 3.38Å; K721-L724 PolarHBondContact O-N 3.19Å; K721-M725 WeakPolarHBondContact O-CG 3.23Å; K721-M725 PolarHBondContact O-N 2.9Å
722	E	91.8	Very high	87.5	Confident	55 Å²	55	78.5 Å²	78.5	26%	0.257	37%	0.366	S	S	.	.	H	α-helix	trans	-63	-41.6	179.1	-68.2	-179.5	-168.1	0	0	111.5	K633 R718 L719 L724 M725 E726	K633-E722 WeakPolarHBondContact CE-OE2 2.5Å; K633-E722 IonicContact NZ-OE2 2.7Å; K633-E722 PolarHBondContact NZ-OE2 2.98Å; R718-E722 IonicContact CZ-OE1 3.62Å; R718-E722 VanDerWaalsContact CZ-OE1 3.25Å; R718-E722 IonicContact NE-OE1 3.36Å; R718-E722 PolarHBondContact NE-OE1 3.42Å; R718-E722 IonicContact NH2-OE1 3.39Å; R718-E722 PolarHBondContact NH2-OE1 3.45Å; R718-E722 WeakPolarHBondContact O-CG 3.44Å; R718-E722 PolarHBondContact O-N 3.44Å; L719-E722 PolarHBondContact O-N 3.41Å; E722-L724 VanDerWaalsContact C-N 3.34Å; E722-L724 PolarHBondContact O-N 3Å; E722-M725 PolarHBondContact O-N 3.34Å; E722-E726 WeakPolarHBondContact O-CG 3.35Å; E722-E726 PolarHBondContact O-N 2.98Å
723	V	90.1	Very high	86.6	Confident	0 Å²	0	86 Å²	86	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-63.2	-38.5	174.6	165.9	0	0	0	0	111.9	W621 A629 K633 L719 E720 K721 K727 L807	W621-V723 HydrophobicContact CH2-CG1 3.81Å; W621-V723 HydrophobicContact CZ2-CG1 4.16Å; A629-V723 HydrophobicContact CB-CG1 3.81Å; K633-V723 HydrophobicContact CB-CG2 4.38Å; K633-V723 HydrophobicContact CD-CG2 3.97Å; L719-V723 WeakPolarHBondContact O-CG2 3.04Å; L719-V723 PolarHBondContact O-N 2.93Å; E720-V723 PolarHBondContact O-N 2.87Å; K721-V723 VanDerWaalsContact C-N 3.35Å; K721-V723 PolarHBondContact O-N 3.38Å; V723-K727 WeakPolarHBondContact O-CB 3.26Å; V723-K727 PolarHBondContact O-N 3.21Å; V723-L807 HydrophobicContact CG1-CD2 4.39Å
724	L	89.4	Confident	85.4	Confident	67 Å²	67	86.4 Å²	86.4	35%	0.351	38%	0.382	S	S	.	.	H	α-helix	trans	-69.3	-34.3	174.9	-74	170.3	0	0	0	112.7	E720 K721 E722 K727 E728	E720-L724 HydrophobicContact CG-CD1 4.18Å; E720-L724 WeakPolarHBondContact O-CB 3.15Å; E720-L724 VanDerWaalsContact O-CG 3.31Å; E720-L724 WeakPolarHBondContact O-CG 3.38Å; E720-L724 PolarHBondContact O-N 3.12Å; K721-L724 PolarHBondContact O-N 3.19Å; E722-L724 VanDerWaalsContact C-N 3.34Å; E722-L724 PolarHBondContact O-N 3Å; L724-K727 HydrophobicContact CD2-CD 4.17Å; L724-K727 WeakPolarHBondContact O-CB 3.43Å; L724-K727 PolarHBondContact O-N 3.37Å; L724-E728 WeakPolarHBondContact O-CB 3.34Å; L724-E728 PolarHBondContact O-N 2.93Å
725	M	88.1	Confident	84.3	Confident	115 Å²	115	80.9 Å²	80.9	57%	0.567	36%	0.359	S	S	*	.	H	α-helix	trans	-68.9	-44.7	173.3	-71.9	173.1	174.6	0	0	111.7	K721 E722 K727 E728 I729	K721-M725 WeakPolarHBondContact O-CG 3.23Å; K721-M725 PolarHBondContact O-N 2.9Å; E722-M725 PolarHBondContact O-N 3.34Å; M725-K727 VanDerWaalsContact C-N 3.29Å; M725-K727 PolarHBondContact O-N 2.91Å; M725-E728 PolarHBondContact O-N 2.75Å; M725-I729 WeakPolarHBondContact O-CB 3.41Å; M725-I729 WeakPolarHBondContact O-CD1 3.46Å; M725-I729 VanDerWaalsContact O-CG1 3.26Å; M725-I729 WeakPolarHBondContact O-CG1 3.48Å; M725-I729 PolarHBondContact O-N 2.81Å
726	E	87.1	Confident	82.7	Confident	60 Å²	60	77.5 Å²	77.5	28%	0.28	35%	0.345	S	S	.	.	H	α-helix	trans	-57.9	-42.4	172.5	-76.5	172.6	-147.5	0	0	111.5	K633 E722 I729 L730 L807	K633-E726 WeakPolarHBondContact CE-OE1 3.31Å; K633-E726 IonicContact NZ-OE1 2.73Å; K633-E726 PolarHBondContact NZ-OE1 3.44Å; E722-E726 WeakPolarHBondContact O-CG 3.35Å; E722-E726 PolarHBondContact O-N 2.98Å; E726-I729 PolarHBondContact O-N 3.45Å; E726-L730 VanDerWaalsContact O-CB 3.31Å; E726-L730 WeakPolarHBondContact O-CB 3.5Å; E726-L730 PolarHBondContact O-N 3.45Å; E726-L807 HydrophobicContact CB-CD1 3.57Å; E726-L807 HydrophobicContact CB-CG 4.31Å
727	K	84.6	Confident	81.3	Confident	39 Å²	39	76 Å²	76	17%	0.17	34%	0.338	C	S	.	.	H	α-helix	trans	-59.2	-51.4	174.4	176.6	-162.1	-177.1	-79.9	0	111.1	W621 V723 L724 M725 I729 L730 E731 L807	W621-K727 VanDerWaalsContact CD1-CE 3.42Å; W621-K727 HydrophobicContact CD2-CD 3.75Å; W621-K727 HydrophobicContact CD2-CG 4.31Å; W621-K727 HydrophobicContact CE3-CD 4.2Å; W621-K727 HydrophobicContact CE3-CG 4.26Å; W621-K727 HydrophobicContact CG-CD 4.16Å; W621-K727 HydrophobicContact CH2-CB 4.28Å; W621-K727 HydrophobicContact CH2-CD 4.27Å; W621-K727 HydrophobicContact CH2-CG 4.4Å; W621-K727 HydrophobicContact CZ2-CD 3.81Å; W621-K727 HydrophobicContact CZ2-CG 4.44Å; W621-K727 HydrophobicContact CZ3-CB 4.48Å; W621-K727 HydrophobicContact CZ3-CD 4.45Å; W621-K727 HydrophobicContact CZ3-CG 4.32Å; V723-K727 WeakPolarHBondContact O-CB 3.26Å; V723-K727 PolarHBondContact O-N 3.21Å; L724-K727 HydrophobicContact CD2-CD 4.17Å; L724-K727 WeakPolarHBondContact O-CB 3.43Å; L724-K727 PolarHBondContact O-N 3.37Å; M725-K727 VanDerWaalsContact C-N 3.29Å; M725-K727 PolarHBondContact O-N 2.91Å; K727-I729 VanDerWaalsContact C-N 3.33Å; K727-I729 PolarHBondContact O-N 3.03Å; K727-L730 PolarHBondContact O-N 2.89Å; K727-L730 VanDerWaalsContact O-N 3.13Å; K727-E731 WeakPolarHBondContact CE-OE1 3.49Å; K727-E731 HydrophobicContact CG-CG 4.4Å; K727-E731 IonicContact NZ-OE1 3.56Å; K727-E731 PolarHBondContact NZ-OE1 3.21Å; K727-E731 IonicContact NZ-OE2 3.76Å; K727-E731 PolarHBondContact NZ-OE2 3.11Å; K727-E731 WeakPolarHBondContact O-CG 3.38Å; K727-E731 PolarHBondContact O-N 3.46Å; K727-L807 HydrophobicContact CB-CD1 3.97Å; K727-L807 VanDerWaalsContact N-CD1 3.27Å
728	E	84.5	Confident	79.5	Confident	97 Å²	97	73.4 Å²	73.4	45%	0.453	33%	0.333	S	S	.	.	H	α-helix	trans	-62.8	-39.7	-178.2	-165.4	-167.6	143.5	0	0	111.8	L724 M725 L730 K732	L724-E728 WeakPolarHBondContact O-CB 3.34Å; L724-E728 PolarHBondContact O-N 2.93Å; M725-E728 PolarHBondContact O-N 2.75Å; E728-L730 VanDerWaalsContact C-N 3.35Å; E728-K732 HydrophobicContact CG-CD 4.34Å; E728-K732 VanDerWaalsContact O-CB 3.31Å; E728-K732 WeakPolarHBondContact O-CB 3.48Å; E728-K732 WeakPolarHBondContact O-CD 3.49Å; E728-K732 VanDerWaalsContact O-CG 3.23Å; E728-K732 WeakPolarHBondContact O-CG 3.29Å; E728-K732 PolarHBondContact O-N 3.28Å; E728-K732 VanDerWaalsContact OE1-CE 3.31Å; E728-K732 WeakPolarHBondContact OE1-CE 3.47Å; E728-K732 IonicContact OE1-NZ 2.81Å; E728-K732 PolarHBondContact OE1-NZ 3.03Å
729	I	83.6	Confident	77	Confident	88 Å²	88	66.9 Å²	66.9	45%	0.451	32%	0.317	S	S	.	.	H	α-helix	trans	-63.5	-41	173.8	-68.2	163.6	0	0	0	110.8	M725 E726 K727 K732 R733	M725-I729 WeakPolarHBondContact O-CB 3.41Å; M725-I729 WeakPolarHBondContact O-CD1 3.46Å; M725-I729 VanDerWaalsContact O-CG1 3.26Å; M725-I729 WeakPolarHBondContact O-CG1 3.48Å; M725-I729 PolarHBondContact O-N 2.81Å; E726-I729 PolarHBondContact O-N 3.45Å; K727-I729 VanDerWaalsContact C-N 3.33Å; K727-I729 PolarHBondContact O-N 3.03Å; I729-K732 PolarHBondContact O-N 2.97Å; I729-R733 WeakPolarHBondContact O-CG 3.47Å; I729-R733 PolarHBondContact O-N 3.06Å; I729-R733 VanDerWaalsContact O-N 3.15Å
730	L	75.6	Confident	74.4	Confident	19 Å²	19	72.8 Å²	72.8	10%	0.099	34%	0.344	C	S	.	.	H	α-helix	trans	-71.4	-41.8	179.6	-168.5	154.1	0	0	0	111.7	E726 K727 E728 K732 R733 K734 L807 H811	E726-L730 VanDerWaalsContact O-CB 3.31Å; E726-L730 WeakPolarHBondContact O-CB 3.5Å; E726-L730 PolarHBondContact O-N 3.45Å; K727-L730 PolarHBondContact O-N 2.89Å; K727-L730 VanDerWaalsContact O-N 3.13Å; E728-L730 VanDerWaalsContact C-N 3.35Å; L730-K732 VanDerWaalsContact C-N 3.31Å; L730-K732 PolarHBondContact O-N 2.84Å; L730-R733 CarbonylContact O-C 3.6Å; L730-R733 WeakPolarHBondContact O-CA 3.13Å; L730-R733 PolarHBondContact O-N 3.2Å; L730-K734 HydrophobicContact CD2-CB 4.24Å; L730-K734 HydrophobicContact CD2-CD 4.09Å; L730-K734 HydrophobicContact CD2-CG 4.47Å; L730-K734 HydrophobicContact CG-CD 4.29Å; L730-K734 PolarHBondContact O-N 2.99Å; L730-L807 HydrophobicContact CD1-CB 3.97Å; L730-H811 WeakPolarHBondContact CD2-CE1 3.46Å
731	E	76.7	Confident	71.8	Confident	47 Å²	47	73.9 Å²	73.9	22%	0.22	36%	0.355	C	S	.	.	H	α-helix	trans	-66	-32	174.1	-70.1	176.5	143.2	0	0	112.2	K727 R733 G735	K727-E731 WeakPolarHBondContact CE-OE1 3.49Å; K727-E731 HydrophobicContact CG-CG 4.4Å; K727-E731 IonicContact NZ-OE1 3.56Å; K727-E731 PolarHBondContact NZ-OE1 3.21Å; K727-E731 IonicContact NZ-OE2 3.76Å; K727-E731 PolarHBondContact NZ-OE2 3.11Å; K727-E731 WeakPolarHBondContact O-CG 3.38Å; K727-E731 PolarHBondContact O-N 3.46Å; E731-R733 VanDerWaalsContact C-N 3.27Å; E731-R733 PolarHBondContact O-N 3.02Å; E731-G735 WeakPolarHBondContact O-CA 3.4Å; E731-G735 PolarHBondContact O-N 2.9Å
732	K	74.9	Confident	69.1	Low	155 Å²	155	74.8 Å²	74.8	67%	0.674	36%	0.361	S	S	*	.	H	α-helix	trans	-67.3	-24.8	169.4	-78.4	168	170.4	172.5	0	113.3	E728 I729 L730	E728-K732 HydrophobicContact CG-CD 4.34Å; E728-K732 VanDerWaalsContact O-CB 3.31Å; E728-K732 WeakPolarHBondContact O-CB 3.48Å; E728-K732 WeakPolarHBondContact O-CD 3.49Å; E728-K732 VanDerWaalsContact O-CG 3.23Å; E728-K732 WeakPolarHBondContact O-CG 3.29Å; E728-K732 PolarHBondContact O-N 3.28Å; E728-K732 VanDerWaalsContact OE1-CE 3.31Å; E728-K732 WeakPolarHBondContact OE1-CE 3.47Å; E728-K732 IonicContact OE1-NZ 2.81Å; E728-K732 PolarHBondContact OE1-NZ 3.03Å; I729-K732 PolarHBondContact O-N 2.97Å; L730-K732 VanDerWaalsContact C-N 3.31Å; L730-K732 PolarHBondContact O-N 2.84Å
733	R	71.1	Confident	66.2	Low	193 Å²	193	78.8 Å²	78.8	73%	0.728	38%	0.384	S	S	*	.	H	α-helix	trans	-93.9	-32.1	178.2	-72.6	175.2	178.7	-172.1	0.9	114	I729 L730 E731	I729-R733 WeakPolarHBondContact O-CG 3.47Å; I729-R733 PolarHBondContact O-N 3.06Å; I729-R733 VanDerWaalsContact O-N 3.15Å; L730-R733 CarbonylContact O-C 3.6Å; L730-R733 WeakPolarHBondContact O-CA 3.13Å; L730-R733 PolarHBondContact O-N 3.2Å; E731-R733 VanDerWaalsContact C-N 3.27Å; E731-R733 PolarHBondContact O-N 3.02Å
734	K	65.3	Low	63.5	Low	96 Å²	96	83.7 Å²	83.7	42%	0.417	41%	0.411	S	S	.	.	H	α-helix	trans	-132.2	7.1	-168.7	-57.9	-173.9	176.1	-176.2	0	114.4	L730 E738 N808	L730-K734 HydrophobicContact CD2-CB 4.24Å; L730-K734 HydrophobicContact CD2-CD 4.09Å; L730-K734 HydrophobicContact CD2-CG 4.47Å; L730-K734 HydrophobicContact CG-CD 4.29Å; L730-K734 PolarHBondContact O-N 2.99Å; K734-E738 WeakPolarHBondContact O-CB 3.32Å; K734-N808 PolarHBondContact NZ-OD1 2.98Å
735	G	66.2	Low	60.8	Low	11 Å²	11	88.8 Å²	88.8	11%	0.113	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	178.6	-175.2	0	0	0	0	0	114.6	E731 L737	E731-G735 WeakPolarHBondContact O-CA 3.4Å; E731-G735 PolarHBondContact O-N 2.9Å; G735-L737 PolarHBondContact O-N 3.43Å
736	P	58.3	Low	58.2	Low	26 Å²	26	88.9 Å²	88.9	17%	0.169	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-13.4	-168.1	-18.1	34.2	0	0	0	115.7	Q969	P736-Q969 HydrophobicContact CG-CB 4.2Å
737	L	58.8	Low	55.5	Low	5 Å²	5	94 Å²	94	3%	0.026	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-151.1	7.6	-163.9	-70.8	179.4	0	0	0	115.3	R619 R620 G735 G739 L968 M978	R619-L737 HydrophobicContact CB-CD2 3.91Å; R619-L737 HydrophobicContact CG-CD2 4.15Å; R620-L737 HydrophobicContact CB-CD2 4.45Å; R620-L737 HydrophobicContact CG-CD2 4.09Å; G735-L737 PolarHBondContact O-N 3.43Å; L737-G739 PolarHBondContact O-N 3.02Å; L737-L968 HydrophobicContact CD1-CB 3.83Å; L737-L968 HydrophobicContact CD1-CD2 3.75Å; L737-L968 HydrophobicContact CD1-CG 4.22Å; L737-L968 WeakPolarHBondContact CD1-O 3.28Å; L737-M978 HydrophobicContact CB-CE 3.62Å; L737-M978 HydrophobicContact CD1-CE 4.31Å
738	E	53	Low	53	Low	97 Å²	97	100.8 Å²	100.8	45%	0.453	48%	0.482	S	S	.	.			trans	-62.4	129.9	-165.5	-173.7	161.7	-111.4	0	0	113.7	K734	K734-E738 WeakPolarHBondContact O-CB 3.32Å
739	G	41.6	Very low	50.3	Low	30 Å²	30	104 Å²	104	31%	0.309	50%	0.497	S	S	.	.			trans	-102.4	109.9	-178.7	0	0	0	0	0	111.9	L737 T741	L737-G739 PolarHBondContact O-N 3.02Å; G739-T741 PolarHBondContact O-N 3.07Å; G739-T741 VanDerWaalsContact O-N 3.1Å
740	H	36.5	Very low	47.7	Very low	146 Å²	146	105.7 Å²	105.7	68%	0.676	51%	0.514	S	S	*	.			trans	-67.9	103.2	154.6	-116.8	-104.4	0	0	0	108.1	D744	H740-D744 IonicContact CE1-OD1 3.36Å; H740-D744 IonicContact CE1-OD2 3.09Å; H740-D744 PolarHBondContact CE1-OD2 2.95Å; H740-D744 IonicContact ND1-OD1 2.82Å; H740-D744 IonicContact ND1-OD2 2.9Å; H740-D744 PolarHBondContact ND1-OD2 2.89Å
741	T	37.7	Very low	45.4	Very low	85 Å²	85	112.5 Å²	112.5	52%	0.521	55%	0.549	S	S	.	.			trans	-68.1	135.1	160.2	51.9	0	0	0	0	108.6	G739 N743	G739-T741 PolarHBondContact O-N 3.07Å; G739-T741 VanDerWaalsContact O-N 3.1Å; T741-N743 PolarHBondContact O-N 3.41Å
742	E	36	Very low	43.1	Very low	139 Å²	139	115.8 Å²	115.8	65%	0.65	58%	0.575	S	S	*	*	S	Bend	trans	-71.1	70.5	-178.3	-63.1	-171.8	107.8	0	0	112.6	K812	E742-K812 IonicContact OE1-NZ 3Å; E742-K812 PolarHBondContact OE1-NZ 3.41Å; E742-K812 WeakPolarHBondContact OE2-CE 3.46Å; E742-K812 IonicContact OE2-NZ 3.76Å; E742-K812 PolarHBondContact OE2-NZ 3.36Å
743	N	32.1	Very low	41	Very low	139 Å²	139	119.7 Å²	119.7	74%	0.743	59%	0.585	S	S	*	*			trans	-116.6	19.4	172	-140.9	30.1	0	0	0	111.4	T741 H745	T741-N743 PolarHBondContact O-N 3.41Å; N743-H745 PolarHBondContact O-N 2.86Å
744	D	32.5	Very low	38.8	Very low	104 Å²	104	119.7 Å²	119.7	56%	0.556	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	75.5	175.8	-73.5	-67.1	0	0	0	111.5	H740	H740-D744 IonicContact CE1-OD1 3.36Å; H740-D744 IonicContact CE1-OD2 3.09Å; H740-D744 PolarHBondContact CE1-OD2 2.95Å; H740-D744 IonicContact ND1-OD1 2.82Å; H740-D744 IonicContact ND1-OD2 2.9Å; H740-D744 PolarHBondContact ND1-OD2 2.89Å
745	H	33	Very low	37.2	Very low	173 Å²	173	122 Å²	122	80%	0.801	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.7	-10.1	158.3	-87.6	38.2	0	0	0	112.4	N743	N743-H745 PolarHBondContact O-N 2.86Å
746	H	34	Very low	35.5	Very low	118 Å²	118	127.6 Å²	127.6	55%	0.546	64%	0.638	S	S	.	*	S	Bend	trans	-134.2	101.3	-177.4	-58.5	-44.3	0	0	0	111.2	F748	H746-F748 HydrophobicContact CB-CE2 4.42Å
747	K	30.4	Very low	34.1	Very low	168 Å²	168	135.9 Å²	135.9	73%	0.73	67%	0.671	S	S	*	*			trans	-55.2	140.7	172	-70.8	-171.8	174	-167.7	0	110.8
748	F	31.8	Very low	32.8	Very low	181 Å²	181	143.4 Å²	143.4	79%	0.794	71%	0.711	S	S	*	*			trans	-134	134.8	159.4	-81.4	-80.5	0	0	0	110.9	H746	H746-F748 HydrophobicContact CB-CE2 4.42Å
749	H	26.6	Very low	31.6	Very low	164 Å²	164	142.1 Å²	142.1	76%	0.759	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-77.8	146.9	169.3	-66.2	-97.2	0	0	0	109.8	L751	H749-L751 PolarHBondContact O-N 3.06Å
750	P	29.3	Very low	31.1	Very low	123 Å²	123	148.6 Å²	148.6	80%	0.799	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-67.3	130.6	173.4	28.2	-33.8	0	0	0	110.7
751	L	28.5	Very low	30.7	Very low	163 Å²	163	148.3 Å²	148.3	85%	0.853	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-83.2	146.9	168.3	-74.7	172.9	0	0	0	110.3	H749	H749-L751 PolarHBondContact O-N 3.06Å
752	P	28.4	Very low	30.2	Very low	116 Å²	116	152.9 Å²	152.9	75%	0.753	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-68.5	139.9	-172.6	27	-34.9	0	0	0	112.8	F754	P752-F754 PolarHBondContact O-N 3.46Å
753	R	29.6	Very low	29.7	Very low	236 Å²	236	149.5 Å²	149.5	89%	0.891	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-67.3	122.5	175.7	-159.3	-177.9	-156	167.9	6.4	109.6
754	F	26.1	Very low	29.4	Very low	194 Å²	194	149.7 Å²	149.7	85%	0.851	78%	0.776	S	S	*	*			trans	-102.9	115.5	178.6	-148.5	-85.1	0	0	0	109.6	P752	P752-F754 PolarHBondContact O-N 3.46Å
755	E	30.8	Very low	29.2	Very low	145 Å²	145	149.4 Å²	149.4	68%	0.678	79%	0.788	S	S	*	*			trans	-87.8	147.3	178	-68	-172.4	146.4	0	0	111.9	K757	E755-K757 PolarHBondContact O-N 2.94Å
756	P	30.4	Very low	29.7	Very low	128 Å²	128	146.7 Å²	146.7	83%	0.831	79%	0.785	S	S	*	*			trans	-74.3	113.6	-179.6	29.8	-33.8	0	0	0	111.4	N758	P756-N758 PolarHBondContact O-N 2.84Å
757	K	28.6	Very low	29.3	Very low	199 Å²	199	151.7 Å²	151.7	87%	0.865	80%	0.8	S	S	*	*			trans	-84.6	97.9	174.5	-70.4	-172.7	177.2	-176.4	0	112	E755	E755-K757 PolarHBondContact O-N 2.94Å
758	N	31.4	Very low	29.1	Very low	164 Å²	164	150.8 Å²	150.8	88%	0.877	80%	0.802	S	S	*	*			trans	-76	144.7	142.5	-68	-11.8	0	0	0	107.4	P756	P756-N758 PolarHBondContact O-N 2.84Å
759	G	29.1	Very low	28.9	Very low	69 Å²	69	146 Å²	146	71%	0.711	80%	0.804	S	S	*	*			trans	-158.8	176.5	-178.5	0	0	0	0	0	113.6
760	L	30.1	Very low	28.7	Very low	166 Å²	166	146.5 Å²	146.5	87%	0.869	81%	0.805	S	S	*	*			trans	-155.8	123.7	160.1	-134.7	73	0	0	0	112.7
761	I	29	Very low	28.7	Very low	140 Å²	140	150.2 Å²	150.2	72%	0.718	80%	0.803	S	S	*	*			trans	3	150.7	151.3	-30.8	176.5	0	0	0	121.1
762	H	26.8	Very low	28.5	Very low	182 Å²	182	148 Å²	148	84%	0.843	80%	0.801	S	S	*	*			trans	83.8	137.2	165.8	-70.6	-80.3	0	0	0	118.5
763	G	25.4	Very low	28.4	Very low	67 Å²	67	150.6 Å²	150.6	69%	0.691	80%	0.8	S	S	*	*			cis	-178.7	158.6	-7.4	0	0	0	0	0	116.7
764	V	25.3	Very low	28.3	Very low	144 Å²	144	145.2 Å²	145.2	87%	0.873	79%	0.788	S	S	*	*			trans	28	113.1	154.1	-169.3	0	0	0	0	120.8
765	A	29.1	Very low	28.3	Very low	98 Å²	98	145.5 Å²	145.5	81%	0.81	79%	0.79	S	S	*	*			trans	-169	145.7	132.2	0	0	0	0	0	112
766	P	42.5	Very low	28.2	Very low	116 Å²	116	146.4 Å²	146.4	75%	0.753	79%	0.794	S	S	*	*			trans	-123.5	160.3	-179.2	40.9	-30.7	0	0	0	115.7
767	R	26.6	Very low	28.1	Very low	223 Å²	223	147.3 Å²	147.3	84%	0.842	80%	0.797	S	S	*	*				176.2	155.7	129.1	-106.8	-175.4	171.7	-161	-3.9	117
768	N	26.2	Very low	27.9	Very low	148 Å²	148	140.7 Å²	140.7	79%	0.791	79%	0.785	S	S	*	*			trans	67.1	150	151.7	-62.2	-1.2	0	0	0	120.5
769	G	27.6	Very low	27.7	Very low	81 Å²	81	142.1 Å²	142.1	84%	0.835	79%	0.786	S	S	*	*			trans	148.6	53.5	174.6	0	0	0	0	0	116.1
770	F	22.9	Very low	27.5	Very low	175 Å²	175	142.8 Å²	142.8	77%	0.768	79%	0.785	S	S	*	*			trans	-81.3	133	-164.2	-152.7	-126.1	0	0	0	115.1
771	R	28.2	Very low	27.4	Very low	201 Å²	201	143.6 Å²	143.6	76%	0.758	78%	0.784	S	S	*	*			trans	63.8	147.2	152.5	-71.6	-171.6	-169.6	-156.9	4.6	117.9
772	S	25.3	Very low	27.3	Very low	116 Å²	116	144.5 Å²	144.5	81%	0.811	79%	0.79	S	S	*	*			cis	-143.2	163.1	49.5	-166.4	0	0	0	0	117.2
773	K	25.8	Very low	27.4	Very low	171 Å²	171	144.4 Å²	144.4	74%	0.743	79%	0.787	S	S	*	*			trans	-90.2	-173.4	163	-46	-178.4	174.3	-170.9	0	109
774	L	27.1	Very low	27.5	Very low	122 Å²	122	148.3 Å²	148.3	64%	0.639	80%	0.798	S	S	*	*			cis	-163.1	152.6	1.7	-166.4	85.3	0	0	0	107.7
775	K	25.3	Very low	27.5	Very low	201 Å²	201	144.8 Å²	144.8	87%	0.874	79%	0.791	S	S	*	*				-175.7	137	117.8	-104.6	-178.1	177.1	-175.8	0	113.1
776	E	30.5	Very low	27.6	Very low	163 Å²	163	152.4 Å²	152.4	76%	0.762	80%	0.799	S	S	*	*			trans	-97.2	153.4	171.3	-60.4	152.7	88.2	0	0	110.2
777	V	27.3	Very low	27	Very low	148 Å²	148	158.4 Å²	158.4	90%	0.897	81%	0.806	S	S	*	*			trans	-147	132.2	149.7	175.1	0	0	0	0	108.4
778	G	24.6	Very low	27.4	Very low	60 Å²	60	159.1 Å²	159.1	62%	0.619	81%	0.809	S	S	*	*			trans	-105.2	175.5	159.8	0	0	0	0	0	110.3
779	Q	26.3	Very low	27.5	Very low	193 Å²	193	160 Å²	160	90%	0.902	81%	0.813	S	S	*	*			cis	-156.1	-177.7	21.3	-61.9	176.8	-22.6	0	0	111.3
780	A	26	Very low	27.7	Very low	84 Å²	84	165 Å²	165	69%	0.694	81%	0.812	S	S	*	*			trans	74.6	111.2	145.1	0	0	0	0	0	122.5
781	Q	27.4	Very low	28.3	Very low	182 Å²	182	161 Å²	161	85%	0.85	81%	0.811	S	S	*	*			trans	48.8	114	133.5	-58.7	-173.8	-10.2	0	0	121.7
782	L	27.2	Very low	28.3	Very low	160 Å²	160	159.4 Å²	159.4	84%	0.838	81%	0.812	S	S	*	*				-167.8	-167.7	100.5	-104.1	170	0	0	0	112.7
783	K	27.8	Very low	28.6	Very low	179 Å²	179	160.9 Å²	160.9	78%	0.778	81%	0.806	S	S	*	*			trans	-98.9	166.7	-157.7	-63.4	168.6	-177.7	170.2	0	115.4
784	T	27.8	Very low	28.8	Very low	149 Å²	149	161.3 Å²	161.3	91%	0.914	81%	0.808	S	S	*	*			trans	80	144.4	152.3	1.3	0	0	0	0	118.6
785	G	26.3	Very low	28.8	Very low	71 Å²	71	162.5 Å²	162.5	73%	0.732	81%	0.81	S	S	*	*			trans	128.7	54.3	163.2	0	0	0	0	0	118.8	R787	G785-R787 PolarHBondContact O-N 3.27Å
786	R	30.2	Very low	28.9	Very low	257 Å²	257	157.8 Å²	157.8	97%	0.97	80%	0.798	S	S	*	*			trans	-75.5	91.4	174.9	-168.9	-177.8	-172.5	-173.9	3.6	112.2
787	R	31.6	Very low	29	Very low	242 Å²	242	153.4 Å²	153.4	91%	0.913	78%	0.782	S	S	*	*			trans	-109.3	170.3	161.8	-80.4	-167	174.3	-158.5	0.6	111.7	G785	G785-R787 PolarHBondContact O-N 3.27Å
788	R	34.4	Very low	29	Very low	238 Å²	238	153 Å²	153	90%	0.898	77%	0.768	S	S	*	*			trans	-90.6	133	-156.5	-54.1	175.2	-171.6	-179.1	1.8	112.2
789	L	27	Very low	29.1	Very low	168 Å²	168	157.7 Å²	157.7	88%	0.88	77%	0.774	S	S	*	*			trans	-123.4	91.3	158.6	-72.2	176.2	0	0	0	108.5
790	F	32	Very low	29.4	Very low	186 Å²	186	155.9 Å²	155.9	82%	0.816	77%	0.766	S	S	*	*			trans	-144.5	75.4	168.3	-84.6	-69.3	0	0	0	107.1
791	A	36.2	Very low	29.8	Very low	89 Å²	89	157.3 Å²	157.3	74%	0.736	76%	0.758	S	S	*	*			trans	-139.5	0.8	-175.6	0	0	0	0	0	113.9
792	Q	28.5	Very low	30.1	Very low	168 Å²	168	155.9 Å²	155.9	79%	0.785	75%	0.752	S	S	*	*	S	Bend	trans	-121.3	-14.3	-171.3	-146.7	167.7	21.1	0	0	114.5	K794	Q792-K794 PolarHBondContact O-N 2.69Å
793	E	30.9	Very low	30.7	Very low	147 Å²	147	154.5 Å²	154.5	69%	0.687	75%	0.745	S	S	*	*	H	α-helix	trans	-77.1	-4.5	171.4	-65.7	-177.1	123.9	0	0	113.4	V797	E793-V797 WeakPolarHBondContact O-CG2 3.27Å
794	K	30.7	Very low	31.7	Very low	180 Å²	180	151.5 Å²	151.5	78%	0.783	73%	0.732	S	S	*	*	H	α-helix	trans	-93.8	-9.9	-171.5	-144.8	-172.9	179.1	-169.8	0	114.8	Q792	Q792-K794 PolarHBondContact O-N 2.69Å
795	E	27.7	Very low	33.1	Very low	148 Å²	148	145.8 Å²	145.8	69%	0.692	70%	0.703	S	S	*	*	H	α-helix	trans	-97.4	-39.8	177.7	-60.1	-162.6	128.9	0	0	111.9	V797 K798	E795-V797 PolarHBondContact O-N 3.38Å; E795-K798 WeakPolarHBondContact O-CA 3.5Å; E795-K798 WeakPolarHBondContact O-CB 3.15Å; E795-K798 PolarHBondContact O-N 3Å
796	V	27.5	Very low	34.6	Very low	102 Å²	102	143.7 Å²	143.7	62%	0.618	68%	0.676	S	S	*	*	H	α-helix	trans	-58.6	-33.6	175.9	-174	0	0	0	0	112.6	K798	V796-K798 VanDerWaalsContact C-N 3.26Å; V796-K798 PolarHBondContact O-N 3.11Å
797	V	31.5	Very low	36.1	Very low	70 Å²	70	131.7 Å²	131.7	42%	0.424	63%	0.631	S	S	.	*	H	α-helix	trans	-74	-17.1	175.9	178.6	0	0	0	0	112.5	E793 E795	E793-V797 WeakPolarHBondContact O-CG2 3.27Å; E795-V797 PolarHBondContact O-N 3.38Å
798	K	28.2	Very low	37.4	Very low	140 Å²	140	122.5 Å²	122.5	61%	0.609	60%	0.6	S	S	*	*	H	α-helix	trans	-82.6	-37.7	-175.6	-153.5	-174.4	178.7	-157.5	0	111.9	E795 V796 E800 E801	E795-K798 WeakPolarHBondContact O-CA 3.5Å; E795-K798 WeakPolarHBondContact O-CB 3.15Å; E795-K798 PolarHBondContact O-N 3Å; V796-K798 VanDerWaalsContact C-N 3.26Å; V796-K798 PolarHBondContact O-N 3.11Å; K798-E800 VanDerWaalsContact C-N 3.31Å; K798-E800 PolarHBondContact O-N 3.16Å; K798-E801 PolarHBondContact O-N 3.16Å
799	E	26.8	Very low	38.6	Very low	159 Å²	159	116.2 Å²	116.2	74%	0.743	58%	0.584	S	S	*	*	H	α-helix	trans	-66.1	-32.6	176.4	-61.6	-175.4	152.3	0	0	112	E801 E802	E799-E801 VanDerWaalsContact C-N 3.29Å; E799-E801 PolarHBondContact O-N 3.08Å; E799-E802 PolarHBondContact O-N 2.86Å
800	E	30.9	Very low	40.4	Very low	154 Å²	154	108.6 Å²	108.6	72%	0.72	54%	0.544	S	S	*	.	H	α-helix	trans	-70.3	-16.8	174.5	-69.5	-167.2	143.3	0	0	114.3	K798	K798-E800 VanDerWaalsContact C-N 3.31Å; K798-E800 PolarHBondContact O-N 3.16Å
801	E	35.6	Very low	42.2	Very low	114 Å²	114	101.5 Å²	101.5	53%	0.533	51%	0.513	S	S	.	.	H	α-helix	trans	-84	-24.2	175.8	-74	-142.9	95.9	0	0	113.7	K798 E799 K804	K798-E801 PolarHBondContact O-N 3.16Å; E799-E801 VanDerWaalsContact C-N 3.29Å; E799-E801 PolarHBondContact O-N 3.08Å; E801-K804 WeakPolarHBondContact O-CB 3.37Å; E801-K804 WeakPolarHBondContact O-CG 3.42Å; E801-K804 PolarHBondContact O-N 3.38Å; E801-K804 IonicContact OE1-NZ 2.59Å; E801-K804 PolarHBondContact OE1-NZ 3.26Å
802	E	33.2	Very low	44.1	Very low	153 Å²	153	100.3 Å²	100.3	72%	0.715	49%	0.491	S	S	*	.	H	α-helix	trans	-78.6	-28.9	-173.5	-63.4	-166.1	167.9	0	0	113	E799 K804	E799-E802 PolarHBondContact O-N 2.86Å; E802-K804 PolarHBondContact O-N 3Å; E802-K804 VanDerWaalsContact O-N 3.15Å
803	D	39.4	Very low	46.8	Very low	130 Å²	130	92.7 Å²	92.7	70%	0.695	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	30.2	169.9	-164.8	33.2	0	0	0	113.6	G805	D803-G805 PolarHBondContact O-N 3.33Å
804	K	50.1	Low	49.5	Very low	116 Å²	116	87 Å²	87	50%	0.504	43%	0.43	S	S	.	.			trans	-71.8	78.5	162.6	-75.8	177	179.1	179	0	109.7	E801 E802	E801-K804 WeakPolarHBondContact O-CB 3.37Å; E801-K804 WeakPolarHBondContact O-CG 3.42Å; E801-K804 PolarHBondContact O-N 3.38Å; E801-K804 IonicContact OE1-NZ 2.59Å; E801-K804 PolarHBondContact OE1-NZ 3.26Å; E802-K804 PolarHBondContact O-N 3Å; E802-K804 VanDerWaalsContact O-N 3.15Å
805	G	55.6	Low	52.2	Low	30 Å²	30	81 Å²	81	31%	0.309	40%	0.403	S	S	.	.			trans	-53.7	144.7	174.6	0	0	0	0	0	112.6	D803 L807 N808	D803-G805 PolarHBondContact O-N 3.33Å; G805-L807 PolarHBondContact O-N 3.02Å; G805-N808 PolarHBondContact N-ND2 3.1Å; G805-N808 PolarHBondContact O-N 3.21Å; G805-N808 VanDerWaalsContact O-N 3.08Å; G805-N808 PolarHBondContact O-ND2 2.98Å; G805-N808 VanDerWaalsContact O-ND2 3.12Å
806	V	59.7	Low	55.2	Low	26 Å²	26	82 Å²	82	16%	0.158	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-26.6	-167.5	177.3	0	0	0	0	113.3	K632 K636 F810	K632-V806 HydrophobicContact CB-CG1 3.79Å; K636-V806 HydrophobicContact CD-CG2 3.71Å; V806-F810 HydrophobicContact CG1-CE2 4.26Å; V806-F810 VanDerWaalsContact O-CD2 3.29Å; V806-F810 WeakPolarHBondContact O-CD2 3.2Å; V806-F810 VanDerWaalsContact O-CE2 3.3Å; V806-F810 WeakPolarHBondContact O-CE2 3.4Å
807	L	61.1	Low	58.1	Low	5 Å²	5	77.7 Å²	77.7	3%	0.026	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-11.8	-176.9	-57	-169.2	0	0	0	115.3	W621 A629 V723 E726 K727 L730 G805 D809 F810 H811	W621-L807 HydrophobicContact CH2-CD1 4.49Å; W621-L807 HydrophobicContact CH2-CD2 4.21Å; W621-L807 HydrophobicContact CZ3-CD1 4.46Å; W621-L807 HydrophobicContact CZ3-CD2 4.2Å; A629-L807 HydrophobicContact CB-CD2 3.67Å; V723-L807 HydrophobicContact CG1-CD2 4.39Å; E726-L807 HydrophobicContact CB-CD1 3.57Å; E726-L807 HydrophobicContact CB-CG 4.31Å; K727-L807 HydrophobicContact CB-CD1 3.97Å; K727-L807 VanDerWaalsContact N-CD1 3.27Å; L730-L807 HydrophobicContact CD1-CB 3.97Å; G805-L807 PolarHBondContact O-N 3.02Å; L807-D809 PolarHBondContact O-N 3.42Å; L807-F810 HydrophobicContact CD2-CD2 4.43Å; L807-F810 PolarHBondContact O-N 3.15Å; L807-H811 PolarHBondContact O-CE1 3.38Å; L807-H811 VanDerWaalsContact O-CE1 3.25Å; L807-H811 PolarHBondContact O-ND1 3.29Å; L807-H811 VanDerWaalsContact O-ND1 3.14Å
808	N	57.6	Low	60.9	Low	50 Å²	50	81.9 Å²	81.9	27%	0.267	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-58.5	-50	-176.7	-80	-60	0	0	0	112.2	K734 G805 F810 H811	K734-N808 PolarHBondContact NZ-OD1 2.98Å; G805-N808 PolarHBondContact N-ND2 3.1Å; G805-N808 PolarHBondContact O-N 3.21Å; G805-N808 VanDerWaalsContact O-N 3.08Å; G805-N808 PolarHBondContact O-ND2 2.98Å; G805-N808 VanDerWaalsContact O-ND2 3.12Å; N808-F810 PolarHBondContact O-N 3.43Å; N808-F810 VanDerWaalsContact O-N 3.08Å; N808-H811 PolarHBondContact O-N 3.34Å; N808-H811 PolarHBondContact O-ND1 3.35Å
809	D	61.4	Low	64	Low	105 Å²	105	78.2 Å²	78.2	56%	0.561	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-64.5	-15.7	-177	-62	-26.1	0	0	0	114.7	L807 H811 Y815	L807-D809 PolarHBondContact O-N 3.42Å; D809-H811 VanDerWaalsContact C-N 3.3Å; D809-H811 PolarHBondContact O-N 3.11Å; D809-Y815 PolarHBondContact O-OH 3.47Å
810	F	64.9	Low	67.2	Low	9 Å²	9	72 Å²	72	4%	0.039	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-74	-20.7	-174.4	-76.9	-92.8	0	0	0	113.4	K616 V625 L628 A629 K632 V806 L807 N808 K812	K616-F810 WeakPolarHBondContact CE-O 3.19Å; K616-F810 PolarHBondContact NZ-O 3.36Å; V625-F810 HydrophobicContact CG1-CD1 3.74Å; V625-F810 HydrophobicContact CG1-CE1 4.39Å; V625-F810 HydrophobicContact CG1-CG 4.48Å; L628-F810 HydrophobicContact CB-CE1 4.26Å; L628-F810 HydrophobicContact CD2-CE1 4.1Å; L628-F810 HydrophobicContact CG-CE1 4Å; L628-F810 HydrophobicContact CG-CZ 4.25Å; A629-F810 HydrophobicContact CB-CE1 4.26Å; A629-F810 HydrophobicContact CB-CE2 4.25Å; A629-F810 HydrophobicContact CB-CZ 3.92Å; K632-F810 HydrophobicContact CD-CE2 4.12Å; K632-F810 HydrophobicContact CD-CZ 3.97Å; K632-F810 HydrophobicContact CG-CZ 4.3Å; V806-F810 HydrophobicContact CG1-CE2 4.26Å; V806-F810 VanDerWaalsContact O-CD2 3.29Å; V806-F810 WeakPolarHBondContact O-CD2 3.2Å; V806-F810 VanDerWaalsContact O-CE2 3.3Å; V806-F810 WeakPolarHBondContact O-CE2 3.4Å; L807-F810 HydrophobicContact CD2-CD2 4.43Å; L807-F810 PolarHBondContact O-N 3.15Å; N808-F810 PolarHBondContact O-N 3.43Å; N808-F810 VanDerWaalsContact O-N 3.08Å; F810-K812 VanDerWaalsContact C-N 3.32Å; F810-K812 PolarHBondContact O-N 3.16Å
811	H	67.8	Low	70.2	Confident	36 Å²	36	65.5 Å²	65.5	17%	0.167	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-74.6	-22.9	180	-59.7	80.5	0	0	0	113	R620 L730 L807 N808 D809	R620-H811 VanDerWaalsContact CD-O 3.25Å; R620-H811 WeakPolarHBondContact CD-O 3.3Å; R620-H811 PolarHBondContact NE-O 3.49Å; L730-H811 WeakPolarHBondContact CD2-CE1 3.46Å; L807-H811 PolarHBondContact O-CE1 3.38Å; L807-H811 VanDerWaalsContact O-CE1 3.25Å; L807-H811 PolarHBondContact O-ND1 3.29Å; L807-H811 VanDerWaalsContact O-ND1 3.14Å; N808-H811 PolarHBondContact O-N 3.34Å; N808-H811 PolarHBondContact O-ND1 3.35Å; D809-H811 VanDerWaalsContact C-N 3.3Å; D809-H811 PolarHBondContact O-N 3.11Å
812	K	77.5	Confident	72.9	Confident	64 Å²	64	60.4 Å²	60.4	28%	0.278	30%	0.302	S	S	.	.			trans	-74.3	137.5	173.2	-167.1	166.4	-179.4	-178.3	0	110.4	K616 E742 F810 I814 Y815	K616-K812 VanDerWaalsContact CD-O 3.25Å; K616-K812 WeakPolarHBondContact CD-O 3.37Å; K616-K812 PolarHBondContact NZ-O 2.86Å; E742-K812 IonicContact OE1-NZ 3Å; E742-K812 PolarHBondContact OE1-NZ 3.41Å; E742-K812 WeakPolarHBondContact OE2-CE 3.46Å; E742-K812 IonicContact OE2-NZ 3.76Å; E742-K812 PolarHBondContact OE2-NZ 3.36Å; F810-K812 VanDerWaalsContact C-N 3.32Å; F810-K812 PolarHBondContact O-N 3.16Å; K812-I814 WeakPolarHBondContact CE-O 3.03Å; K812-I814 WeakPolarHBondContact CG-O 3.48Å; K812-Y815 HydrophobicContact CB-CE1 3.84Å; K812-Y815 HydrophobicContact CB-CE2 4.47Å; K812-Y815 HydrophobicContact CD-CD1 3.69Å; K812-Y815 HydrophobicContact CD-CE1 3.68Å; K812-Y815 HydrophobicContact CD-CG 4.4Å; K812-Y815 HydrophobicContact CG-CD1 3.97Å; K812-Y815 HydrophobicContact CG-CE1 3.71Å; K812-Y815 HydrophobicContact CG-CE2 4.3Å; K812-Y815 HydrophobicContact CG-CG 4.37Å; K812-Y815 PolarHBondContact O-OH 2.93Å
813	C	84.4	Confident	75.8	Confident	8 Å²	8	56 Å²	56	5%	0.054	29%	0.286	C	S	.	.			trans	-126.6	-15.2	-179.8	60.7	0	0	0	0	113.8	H613 K616 L617	H613-C813 PolarHBondContact N-O 2.86Å; K616-C813 HydrophobicContact CB-CB 3.67Å; K616-C813 HydrophobicContact CD-CB 4.29Å; L617-C813 HydrophobicContact CD2-CB 4.3Å
814	I	87.7	Confident	78.3	Confident	27 Å²	27	52.8 Å²	52.8	14%	0.138	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	128.3	172	-55.8	-177.5	0	0	0	107.9	Q610 I611 Q612 L617 K812 N982	Q610-I814 HydrophobicContact CB-CG2 4.08Å; I611-I814 CarbonylContact O-C 3.56Å; I611-I814 VanDerWaalsContact O-CA 3.23Å; I611-I814 WeakPolarHBondContact O-CA 3.39Å; Q612-I814 HydrophobicContact CG-CD1 4.45Å; Q612-I814 HydrophobicContact CG-CG1 4.22Å; Q612-I814 HydrophobicContact CG-CG2 4.36Å; L617-I814 HydrophobicContact CD2-CG1 4.47Å; K812-I814 WeakPolarHBondContact CE-O 3.03Å; K812-I814 WeakPolarHBondContact CG-O 3.48Å; I814-N982 HydrophobicContact CD1-CB 4.06Å; I814-N982 WeakPolarHBondContact CD1-OD1 3.4Å
815	Y	88.7	Confident	80.4	Confident	56 Å²	56	47.5 Å²	47.5	22%	0.22	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	150.4	-175.7	-59.4	-99.7	0	0	0	110.7	Q610 I611 H613 K616 D809 K812 G817	Q610-Y815 CarbonylContact C-O 3.58Å; Q610-Y815 WeakPolarHBondContact CA-O 3.45Å; I611-Y815 PolarHBondContact N-O 3.23Å; I611-Y815 PolarHBondContact O-N 2.67Å; H613-Y815 AromaticContact CD2-CD2 3.72Å; H613-Y815 AromaticContact CD2-CE2 3.77Å; H613-Y815 AromaticContact CE1-CD2 3.98Å; H613-Y815 AromaticContact CE1-CE2 3.56Å; H613-Y815 AromaticContact CG-CE2 3.92Å; H613-Y815 AromaticContact ND1-CE2 3.79Å; H613-Y815 AromaticContact NE2-CD2 3.47Å; H613-Y815 WeakPolarHBondContact NE2-CD2 3.14Å; H613-Y815 AromaticContact NE2-CE2 3.52Å; K616-Y815 PolarHBondContact NZ-OH 3.48Å; D809-Y815 PolarHBondContact O-OH 3.47Å; K812-Y815 HydrophobicContact CB-CE1 3.84Å; K812-Y815 HydrophobicContact CB-CE2 4.47Å; K812-Y815 HydrophobicContact CD-CD1 3.69Å; K812-Y815 HydrophobicContact CD-CE1 3.68Å; K812-Y815 HydrophobicContact CD-CG 4.4Å; K812-Y815 HydrophobicContact CG-CD1 3.97Å; K812-Y815 HydrophobicContact CG-CE1 3.71Å; K812-Y815 HydrophobicContact CG-CE2 4.3Å; K812-Y815 HydrophobicContact CG-CG 4.37Å; K812-Y815 PolarHBondContact O-OH 2.93Å; Y815-G817 PolarHBondContact O-N 3.49Å
816	K	90.1	Very high	82.2	Confident	167 Å²	167	51.4 Å²	51.4	73%	0.726	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	112	175.1	-173	176.6	-178	177.4	0	109.6	V608	V608-K816 HydrophobicContact CG1-CG 4.11Å
817	G	88.5	Confident	83.6	Confident	12 Å²	12	58.6 Å²	58.6	12%	0.124	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-173.6	179.2	0	0	0	0	0	113.4	V608 T609 Y815	V608-G817 WeakPolarHBondContact CG1-O 3.29Å; T609-G817 VanDerWaalsContact O-CA 3.25Å; T609-G817 WeakPolarHBondContact O-CA 3.39Å; T609-G817 PolarHBondContact O-N 2.83Å; Y815-G817 PolarHBondContact O-N 3.49Å
818	R	90.3	Very high	85	Confident	159 Å²	159	59.5 Å²	59.5	60%	0.6	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	160.8	-178	-63.9	-179.1	-65	-160.8	-1.9	111.9	T609	T609-R818 PolarHBondContact N-O 3.26Å; T609-R818 PolarHBondContact OG1-N 3.26Å; T609-R818 PolarHBondContact OG1-O 3.48Å
819	S	93.4	Very high	86.6	Confident	62 Å²	62	57.1 Å²	57.1	43%	0.434	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	125.5	169	-179.7	0	0	0	0	110.9	F607	F607-S819 VanDerWaalsContact O-CA 3.27Å; F607-S819 WeakPolarHBondContact O-CA 3.33Å
820	V	93.3	Very high	87.9	Confident	30 Å²	30	59.9 Å²	59.9	18%	0.182	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	155.6	-179	-55.6	0	0	0	0	110.1	R606 F607 T609 T824 F825	R606-V820 VanDerWaalsContact CA-O 3.27Å; R606-V820 WeakPolarHBondContact CA-O 3.25Å; F607-V820 HydrophobicContact CE2-CG2 4.35Å; F607-V820 HydrophobicContact CZ-CG2 4.26Å; F607-V820 PolarHBondContact N-O 3.14Å; F607-V820 VanDerWaalsContact N-O 3.07Å; F607-V820 PolarHBondContact O-N 3.05Å; T609-V820 HydrophobicContact CG2-CG2 3.65Å; V820-T824 HydrophobicContact CB-CG2 4.32Å; V820-F825 HydrophobicContact CG2-CB 4Å; V820-F825 HydrophobicContact CG2-CD2 4.32Å
821	S	94.3	Very high	88.9	Confident	17 Å²	17	61 Å²	61	12%	0.119	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	157.4	168.3	67.2	0	0	0	0	111.6	M605 T823 T824 F825	M605-S821 CarbonylContact O-C 3.53Å; M605-S821 VanDerWaalsContact O-CA 3.27Å; M605-S821 WeakPolarHBondContact O-CA 3.26Å; S821-T823 VanDerWaalsContact C-N 3.3Å; S821-T823 PolarHBondContact O-N 2.83Å; S821-T824 WeakPolarHBondContact O-CA 3.43Å; S821-T824 WeakPolarHBondContact O-CB 3.42Å; S821-T824 PolarHBondContact O-N 3.12Å; S821-T824 PolarHBondContact OG-N 3.03Å; S821-T824 PolarHBondContact OG-OG1 2.85Å; S821-F825 PolarHBondContact O-N 2.84Å
822	L	92.9	Very high	89.9	Confident	6 Å²	6	59.5 Å²	59.5	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-53.3	-45.6	176	-168.5	66.6	0	0	0	112.1	L601 D603 M605 F607 T824 F825 Y826 I919 Y1023	L601-L822 HydrophobicContact CB-CD2 4.05Å; L601-L822 HydrophobicContact CD1-CD2 4.29Å; D603-L822 PolarHBondContact O-N 2.97Å; M605-L822 HydrophobicContact CE-CB 4.36Å; M605-L822 HydrophobicContact CE-CD1 3.92Å; M605-L822 HydrophobicContact CE-CD2 4.19Å; M605-L822 HydrophobicContact CE-CG 4.39Å; M605-L822 PolarHBondContact O-N 2.94Å; F607-L822 HydrophobicContact CE1-CB 4.49Å; F607-L822 HydrophobicContact CE1-CD1 4.01Å; L822-T824 VanDerWaalsContact C-N 3.28Å; L822-T824 PolarHBondContact O-N 3.44Å; L822-F825 PolarHBondContact O-N 3.23Å; L822-Y826 WeakPolarHBondContact O-CB 3.28Å; L822-Y826 PolarHBondContact O-N 3.34Å; L822-I919 HydrophobicContact CD1-CD1 4.02Å; L822-I919 HydrophobicContact CD1-CG2 4.09Å; L822-Y1023 HydrophobicContact CD1-CE2 4.48Å; L822-Y1023 WeakPolarHBondContact CD1-OH 3.38Å
823	T	92.3	Very high	90.5	Very high	60 Å²	60	58.4 Å²	58.4	37%	0.368	27%	0.27	S	S	.	.	H	α-helix	trans	-61.2	-33.5	175.1	-39.2	0	0	0	0	113.2	D603 S821 R827	D603-T823 WeakPolarHBondContact CB-OG1 3.31Å; D603-T823 PolarHBondContact O-N 3.2Å; D603-T823 PolarHBondContact O-OG1 3.24Å; D603-T823 VanDerWaalsContact O-OG1 3.12Å; S821-T823 VanDerWaalsContact C-N 3.3Å; S821-T823 PolarHBondContact O-N 2.83Å; T823-R827 WeakPolarHBondContact O-CG 3.36Å; T823-R827 PolarHBondContact O-N 3.25Å
824	T	91.9	Very high	90.5	Very high	64 Å²	64	61.6 Å²	61.6	39%	0.393	29%	0.293	S	S	.	.	H	α-helix	trans	-71.4	-46	176.5	-55.2	0	0	0	0	110.1	V820 S821 L822 Y826 R827 T828	V820-T824 HydrophobicContact CB-CG2 4.32Å; S821-T824 WeakPolarHBondContact O-CA 3.43Å; S821-T824 WeakPolarHBondContact O-CB 3.42Å; S821-T824 PolarHBondContact O-N 3.12Å; S821-T824 PolarHBondContact OG-N 3.03Å; S821-T824 PolarHBondContact OG-OG1 2.85Å; L822-T824 VanDerWaalsContact C-N 3.28Å; L822-T824 PolarHBondContact O-N 3.44Å; T824-Y826 PolarHBondContact O-N 3.03Å; T824-R827 PolarHBondContact O-N 3.14Å; T824-T828 PolarHBondContact O-N 3.27Å; T824-T828 PolarHBondContact O-OG1 3.44Å
825	F	94.2	Very high	90.1	Very high	4 Å²	4	62.3 Å²	62.3	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-58.8	-46.3	176.1	-175.2	-81.6	0	0	0	111.7	F607 T609 V820 S821 L822 R827 T828 A829 H864 I919 G920 M921 Y1023	F607-F825 HydrophobicContact CE1-CB 4.47Å; F607-F825 AromaticContact CE2-CD2 3.8Å; F607-F825 HydrophobicContact CE2-CD2 3.8Å; F607-F825 HydrophobicContact CE2-CE2 4.17Å; F607-F825 HydrophobicContact CE2-CG 4.36Å; F607-F825 HydrophobicContact CZ-CB 3.82Å; F607-F825 HydrophobicContact CZ-CD1 4.46Å; F607-F825 AromaticContact CZ-CD2 3.63Å; F607-F825 HydrophobicContact CZ-CD2 3.63Å; F607-F825 HydrophobicContact CZ-CE2 4.29Å; F607-F825 AromaticContact CZ-CG 3.72Å; F607-F825 HydrophobicContact CZ-CG 3.72Å; T609-F825 HydrophobicContact CG2-CD2 3.92Å; T609-F825 HydrophobicContact CG2-CE2 4.18Å; V820-F825 HydrophobicContact CG2-CB 4Å; V820-F825 HydrophobicContact CG2-CD2 4.32Å; S821-F825 PolarHBondContact O-N 2.84Å; L822-F825 PolarHBondContact O-N 3.23Å; F825-R827 VanDerWaalsContact C-N 3.3Å; F825-R827 PolarHBondContact O-N 3.19Å; F825-T828 PolarHBondContact O-N 3.08Å; F825-T828 VanDerWaalsContact O-N 3.12Å; F825-A829 HydrophobicContact CE1-CB 4.42Å; F825-A829 WeakPolarHBondContact O-CB 3.34Å; F825-A829 PolarHBondContact O-N 3.41Å; F825-H864 HydrophobicContact CD2-CB 4.44Å; F825-H864 HydrophobicContact CE2-CB 3.87Å; F825-H864 WeakPolarHBondContact CE2-O 3.2Å; F825-H864 WeakPolarHBondContact CZ-O 3.44Å; F825-I919 HydrophobicContact CD1-CG2 3.83Å; F825-I919 HydrophobicContact CE1-CG2 3.63Å; F825-I919 HydrophobicContact CG-CG2 4.45Å; F825-I919 HydrophobicContact CZ-CG2 4.06Å; F825-G920 WeakPolarHBondContact CE1-O 3.36Å; F825-M921 HydrophobicContact CD1-CE 4.41Å; F825-M921 HydrophobicContact CD2-CE 4.19Å; F825-M921 HydrophobicContact CE1-CB 4.3Å; F825-M921 HydrophobicContact CE1-CE 3.95Å; F825-M921 HydrophobicContact CE2-CE 3.73Å; F825-M921 HydrophobicContact CZ-CB 4.34Å; F825-M921 HydrophobicContact CZ-CE 3.6Å; F825-Y1023 AromaticContact CD1-CD2 3.96Å; F825-Y1023 HydrophobicContact CD1-CD2 3.96Å; F825-Y1023 AromaticContact CD1-CE2 3.9Å; F825-Y1023 HydrophobicContact CD1-CE2 3.9Å; F825-Y1023 HydrophobicContact CE1-CD2 4Å; F825-Y1023 HydrophobicContact CE1-CE2 4.22Å
826	Y	93.3	Very high	89.9	Confident	112 Å²	112	60.6 Å²	60.6	44%	0.439	29%	0.292	S	S	.	.	H	α-helix	trans	-57.1	-41.3	176.6	178.1	-112.1	0	0	0	112.6	L822 T824 A829 R830 Y1023	L822-Y826 WeakPolarHBondContact O-CB 3.28Å; L822-Y826 PolarHBondContact O-N 3.34Å; T824-Y826 PolarHBondContact O-N 3.03Å; Y826-A829 PolarHBondContact O-N 3.41Å; Y826-R830 WeakPolarHBondContact O-CB 3.31Å; Y826-R830 PolarHBondContact O-N 2.85Å; Y826-Y1023 AromaticContact CD2-CD1 3.56Å; Y826-Y1023 HydrophobicContact CD2-CD1 3.56Å; Y826-Y1023 AromaticContact CD2-CD2 3.86Å; Y826-Y1023 HydrophobicContact CD2-CD2 3.86Å; Y826-Y1023 AromaticContact CD2-CE1 3.84Å; Y826-Y1023 HydrophobicContact CD2-CE1 3.84Å; Y826-Y1023 HydrophobicContact CD2-CE2 4.12Å; Y826-Y1023 AromaticContact CD2-CG 3.54Å; Y826-Y1023 HydrophobicContact CD2-CG 3.54Å; Y826-Y1023 AromaticContact CE2-CD1 3.83Å; Y826-Y1023 HydrophobicContact CE2-CD1 3.83Å; Y826-Y1023 HydrophobicContact CE2-CE1 4.32Å; Y826-Y1023 HydrophobicContact CE2-CG 4.06Å
827	R	89.4	Confident	89.8	Confident	177 Å²	177	54.2 Å²	54.2	67%	0.668	26%	0.264	S	S	*	.	H	α-helix	trans	-65.4	-41.4	175.2	-72.3	174.1	64.6	-173.3	-0.3	112.3	T823 T824 F825 N831	T823-R827 WeakPolarHBondContact O-CG 3.36Å; T823-R827 PolarHBondContact O-N 3.25Å; T824-R827 PolarHBondContact O-N 3.14Å; F825-R827 VanDerWaalsContact C-N 3.3Å; F825-R827 PolarHBondContact O-N 3.19Å; R827-N831 WeakPolarHBondContact O-CB 3.44Å; R827-N831 PolarHBondContact O-N 3.37Å
828	T	90	Very high	89.5	Confident	24 Å²	24	60 Å²	60	15%	0.147	30%	0.303	C	S	.	.	H	α-helix	trans	-65.5	-45.4	175.1	-58.2	0	0	0	0	111.6	T824 F825 R830 N831 I832 M921	T824-T828 PolarHBondContact O-N 3.27Å; T824-T828 PolarHBondContact O-OG1 3.44Å; F825-T828 PolarHBondContact O-N 3.08Å; F825-T828 VanDerWaalsContact O-N 3.12Å; T828-R830 PolarHBondContact O-N 2.93Å; T828-N831 WeakPolarHBondContact O-CB 3.37Å; T828-N831 PolarHBondContact O-N 2.78Å; T828-I832 HydrophobicContact CG2-CD1 3.86Å; T828-I832 PolarHBondContact O-N 3.48Å; T828-M921 HydrophobicContact CG2-CE 4.17Å
829	A	92.8	Very high	89.3	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-56.3	-47.2	175.8	0	0	0	0	0	112	F825 Y826 I832 M833 M921 Y1023	F825-A829 HydrophobicContact CE1-CB 4.42Å; F825-A829 WeakPolarHBondContact O-CB 3.34Å; F825-A829 PolarHBondContact O-N 3.41Å; Y826-A829 PolarHBondContact O-N 3.41Å; A829-I832 PolarHBondContact O-N 2.96Å; A829-M833 WeakPolarHBondContact O-CB 3.49Å; A829-M833 PolarHBondContact O-N 3.48Å; A829-M921 HydrophobicContact CB-CB 3.44Å; A829-M921 VanDerWaalsContact CB-CB 3.44Å; A829-M921 HydrophobicContact CB-CE 4.01Å; A829-Y1023 HydrophobicContact CB-CD2 4.25Å
830	R	89	Confident	88.8	Confident	162 Å²	162	67.2 Å²	67.2	61%	0.611	33%	0.334	S	S	*	.	H	α-helix	trans	-68.6	-35.9	177.8	-172.2	-171.2	141.2	102.3	8.6	112.5	Y826 T828 S834	Y826-R830 WeakPolarHBondContact O-CB 3.31Å; Y826-R830 PolarHBondContact O-N 2.85Å; T828-R830 PolarHBondContact O-N 2.93Å; R830-S834 WeakPolarHBondContact O-CB 3.29Å; R830-S834 PolarHBondContact O-N 3.02Å; R830-S834 VanDerWaalsContact O-N 3.14Å; R830-S834 PolarHBondContact O-OG 3.47Å
831	N	86	Confident	88.7	Confident	33 Å²	33	66.8 Å²	66.8	18%	0.176	33%	0.332	C	S	.	.	H	α-helix	trans	-58.8	-57	171.3	-85.6	-8.6	0	0	0	109.8	G649 P687 T689 R827 T828 M833 S834 M835	G649-N831 PolarHBondContact O-ND2 3.01Å; P687-N831 HydrophobicContact CB-CB 4.49Å; P687-N831 HydrophobicContact CG-CB 4.25Å; T689-N831 PolarHBondContact OG1-OD1 3.44Å; R827-N831 WeakPolarHBondContact O-CB 3.44Å; R827-N831 PolarHBondContact O-N 3.37Å; T828-N831 WeakPolarHBondContact O-CB 3.37Å; T828-N831 PolarHBondContact O-N 2.78Å; N831-M833 VanDerWaalsContact C-N 3.34Å; N831-M833 PolarHBondContact O-N 2.97Å; N831-S834 CarbonylContact O-C 3.55Å; N831-S834 WeakPolarHBondContact O-CA 3.32Å; N831-S834 WeakPolarHBondContact O-CB 3.39Å; N831-S834 PolarHBondContact O-N 3.09Å; N831-M835 WeakPolarHBondContact O-CG 3.49Å; N831-M835 PolarHBondContact O-N 3.1Å
832	I	88.3	Confident	88.7	Confident	5 Å²	5	68.3 Å²	68.3	3%	0.026	35%	0.345	C	S	.	.	H	α-helix	trans	-59.5	-42.3	-177.6	-68.8	167.6	0	0	0	111.5	T828 A829 S834 M835 C836 V863 M921 V922	T828-I832 HydrophobicContact CG2-CD1 3.86Å; T828-I832 PolarHBondContact O-N 3.48Å; A829-I832 PolarHBondContact O-N 2.96Å; I832-S834 PolarHBondContact O-N 3.33Å; I832-M835 HydrophobicContact CB-SD 4.43Å; I832-M835 HydrophobicContact CG1-SD 3.96Å; I832-M835 WeakPolarHBondContact O-CA 3.41Å; I832-M835 VanDerWaalsContact O-CB 3.3Å; I832-M835 WeakPolarHBondContact O-CB 3.19Å; I832-M835 PolarHBondContact O-N 2.93Å; I832-C836 PolarHBondContact O-N 3.15Å; I832-C836 PolarHBondContact O-SG 3.22Å; I832-C836 VanDerWaalsContact O-SG 3.4Å; I832-V863 HydrophobicContact CG2-CG1 4.29Å; I832-M921 HydrophobicContact CD1-SD 3.54Å; I832-M921 VanDerWaalsContact CD1-SD 3.54Å; I832-V922 HydrophobicContact CG2-CG1 3.77Å
833	M	89.1	Confident	88.7	Confident	40 Å²	40	69.8 Å²	69.8	20%	0.197	36%	0.355	C	S	.	.	H	α-helix	trans	-54.8	-40.3	172.2	-168.9	61.7	160.4	0	0	112.5	A829 N831 M835 F837 P841 I846 V922 C1021	A829-M833 WeakPolarHBondContact O-CB 3.49Å; A829-M833 PolarHBondContact O-N 3.48Å; N831-M833 VanDerWaalsContact C-N 3.34Å; N831-M833 PolarHBondContact O-N 2.97Å; M833-M835 VanDerWaalsContact C-N 3.35Å; M833-F837 PolarHBondContact O-N 2.84Å; M833-F837 HydrophobicContact SD-CD2 4Å; M833-P841 VanDerWaalsContact CE-CD 3.48Å; M833-P841 HydrophobicContact CE-CG 3.84Å; M833-I846 HydrophobicContact CE-CD1 4.33Å; M833-V922 HydrophobicContact CB-CG1 4.4Å; M833-V922 HydrophobicContact SD-CB 3.73Å; M833-V922 HydrophobicContact SD-CG1 4.05Å; M833-V922 HydrophobicContact SD-CG2 3.76Å; M833-C1021 WeakPolarHBondContact CE-O 3.24Å
834	S	84.3	Confident	88.7	Confident	76 Å²	76	69.6 Å²	69.6	53%	0.531	36%	0.36	S	S	.	.	H	α-helix	trans	-78.3	-14.5	177.3	-47.5	0	0	0	0	114	R830 N831 I832	R830-S834 WeakPolarHBondContact O-CB 3.29Å; R830-S834 PolarHBondContact O-N 3.02Å; R830-S834 VanDerWaalsContact O-N 3.14Å; R830-S834 PolarHBondContact O-OG 3.47Å; N831-S834 CarbonylContact O-C 3.55Å; N831-S834 WeakPolarHBondContact O-CA 3.32Å; N831-S834 WeakPolarHBondContact O-CB 3.39Å; N831-S834 PolarHBondContact O-N 3.09Å; I832-S834 PolarHBondContact O-N 3.33Å
835	M	80.8	Confident	88.9	Confident	41 Å²	41	71.8 Å²	71.8	20%	0.202	37%	0.366	C	S	.	.	H	α-helix	trans	-79.4	-44.2	171.8	-61.4	174.5	59	0	0	110.6	C651 R685 P687 N831 I832 M833	C651-M835 HydrophobicContact CB-CE 3.98Å; C651-M835 HydrophobicContact CB-SD 3.87Å; C651-M835 PolarHBondContact SG-SD 3.45Å; R685-M835 HydrophobicContact CB-CB 4.06Å; R685-M835 HydrophobicContact CB-CE 4.27Å; R685-M835 VanDerWaalsContact O-CB 3.3Å; R685-M835 WeakPolarHBondContact O-CB 3.1Å; R685-M835 VanDerWaalsContact O-CE 3.3Å; R685-M835 WeakPolarHBondContact O-CE 3.45Å; R685-M835 WeakPolarHBondContact O-CG 3.43Å; P687-M835 HydrophobicContact CG-CG 3.74Å; P687-M835 HydrophobicContact CG-SD 3.6Å; N831-M835 WeakPolarHBondContact O-CG 3.49Å; N831-M835 PolarHBondContact O-N 3.1Å; I832-M835 HydrophobicContact CB-SD 4.43Å; I832-M835 HydrophobicContact CG1-SD 3.96Å; I832-M835 WeakPolarHBondContact O-CA 3.41Å; I832-M835 VanDerWaalsContact O-CB 3.3Å; I832-M835 WeakPolarHBondContact O-CB 3.19Å; I832-M835 PolarHBondContact O-N 2.93Å; M833-M835 VanDerWaalsContact C-N 3.35Å
836	C	83.8	Confident	88.9	Confident	20 Å²	20	71.7 Å²	71.7	14%	0.135	37%	0.365	C	S	.	.	H	α-helix	trans	-79.2	-36.8	-175.6	-60.2	0	0	0	0	112.2	I832 F923	I832-C836 PolarHBondContact O-N 3.15Å; I832-C836 PolarHBondContact O-SG 3.22Å; I832-C836 VanDerWaalsContact O-SG 3.4Å; C836-F923 HydrophobicContact CB-CE2 4.15Å; C836-F923 HydrophobicContact CB-CZ 4.42Å
837	F	88.1	Confident	89	Confident	33 Å²	33	66.5 Å²	66.5	15%	0.145	35%	0.345	C	S	.	.			trans	-133.2	131	-173.3	-53.7	-83	0	0	0	112.1	M833 K839 P841 I846 E849 V922 F923	M833-F837 PolarHBondContact O-N 2.84Å; M833-F837 HydrophobicContact SD-CD2 4Å; F837-K839 VanDerWaalsContact C-N 3.27Å; F837-K839 WeakPolarHBondContact CB-O 3.39Å; F837-K839 PolarHBondContact O-N 3.06Å; F837-P841 HydrophobicContact CB-CB 4.39Å; F837-P841 HydrophobicContact CB-CG 4.05Å; F837-P841 HydrophobicContact CD1-CB 3.74Å; F837-P841 HydrophobicContact CD1-CG 3.83Å; F837-P841 HydrophobicContact CD2-CG 3.84Å; F837-P841 HydrophobicContact CE1-CB 4.17Å; F837-P841 HydrophobicContact CE1-CG 4.24Å; F837-P841 HydrophobicContact CE2-CG 4.26Å; F837-P841 HydrophobicContact CG-CB 4.01Å; F837-P841 HydrophobicContact CG-CG 3.62Å; F837-P841 HydrophobicContact CZ-CG 4.45Å; F837-I846 HydrophobicContact CE2-CG1 4.21Å; F837-I846 HydrophobicContact CZ-CB 4.37Å; F837-I846 HydrophobicContact CZ-CG1 4.03Å; F837-E849 HydrophobicContact CE1-CB 4.28Å; F837-E849 HydrophobicContact CZ-CB 4.11Å; F837-E849 HydrophobicContact CZ-CG 4.19Å; F837-V922 HydrophobicContact CE2-CG2 4.03Å; F837-F923 HydrophobicContact CE2-CE1 4.28Å; F837-F923 AromaticContact CE2-CZ 3.78Å; F837-F923 HydrophobicContact CE2-CZ 3.78Å; F837-F923 HydrophobicContact CZ-CE1 4.15Å; F837-F923 AromaticContact CZ-CZ 3.77Å; F837-F923 HydrophobicContact CZ-CZ 3.77Å
838	S	81.4	Confident	89.3	Confident	133 Å²	133	64.3 Å²	64.3	93%	0.93	34%	0.342	S	S	*	.	S	Bend	trans	-81.7	-3.1	179.3	-47.7	0	0	0	0	114.3
839	K	85.8	Confident	89.4	Confident	183 Å²	183	64.5 Å²	64.5	80%	0.796	34%	0.342	S	S	*	.	S	Bend	trans	-143.6	166.9	176.1	-64.7	178.7	-176.4	171.7	0	107.1	F837 P841	F837-K839 VanDerWaalsContact C-N 3.27Å; F837-K839 WeakPolarHBondContact CB-O 3.39Å; F837-K839 PolarHBondContact O-N 3.06Å; K839-P841 VanDerWaalsContact O-CD 3.23Å; K839-P841 WeakPolarHBondContact O-CD 3.43Å
840	E	84.8	Confident	89.6	Confident	190 Å²	190	64.5 Å²	64.5	89%	0.888	34%	0.341	S	S	*	.			trans	-65.3	115.5	164.6	-70	172.3	169.6	0	0	108.3
841	P	90.9	Very high	89.9	Confident	22 Å²	22	57 Å²	57	14%	0.143	31%	0.313	C	S	.	.			trans	-89	160.6	-176.7	38.5	-35.6	0	0	0	111.1	M833 F837 K839 E845 I846	M833-P841 VanDerWaalsContact CE-CD 3.48Å; M833-P841 HydrophobicContact CE-CG 3.84Å; F837-P841 HydrophobicContact CB-CB 4.39Å; F837-P841 HydrophobicContact CB-CG 4.05Å; F837-P841 HydrophobicContact CD1-CB 3.74Å; F837-P841 HydrophobicContact CD1-CG 3.83Å; F837-P841 HydrophobicContact CD2-CG 3.84Å; F837-P841 HydrophobicContact CE1-CB 4.17Å; F837-P841 HydrophobicContact CE1-CG 4.24Å; F837-P841 HydrophobicContact CE2-CG 4.26Å; F837-P841 HydrophobicContact CG-CB 4.01Å; F837-P841 HydrophobicContact CG-CG 3.62Å; F837-P841 HydrophobicContact CZ-CG 4.45Å; K839-P841 VanDerWaalsContact O-CD 3.23Å; K839-P841 WeakPolarHBondContact O-CD 3.43Å; P841-E845 VanDerWaalsContact CA-OE2 3.23Å; P841-E845 WeakPolarHBondContact CA-OE2 3.29Å; P841-E845 HydrophobicContact CB-CB 4.13Å; P841-E845 WeakPolarHBondContact CB-OE2 3.44Å; P841-I846 HydrophobicContact CB-CG1 4.13Å; P841-I846 HydrophobicContact CG-CD1 3.81Å; P841-I846 HydrophobicContact CG-CG1 3.51Å
842	A	93.2	Very high	90.3	Very high	48 Å²	48	58.3 Å²	58.3	40%	0.397	32%	0.316	S	S	.	.			trans	-74.7	153.7	170.7	0	0	0	0	0	111.3	A844 E845 I846	A842-A844 PolarHBondContact O-N 3.01Å; A842-A844 VanDerWaalsContact O-N 3.12Å; A842-E845 HydrophobicContact CB-CG 4.26Å; A842-E845 PolarHBondContact N-OE2 2.93Å; A842-E845 WeakPolarHBondContact O-CB 3.29Å; A842-E845 PolarHBondContact O-N 3.1Å; A842-I846 PolarHBondContact O-N 2.89Å
843	P	93.6	Very high	90.5	Very high	37 Å²	37	58.1 Å²	58.1	24%	0.24	32%	0.315	C	S	.	.	H	α-helix	trans	-50.5	-38.8	176.1	-30.9	37	0	0	0	114.1	E845 I846 E847 D946 I948 V1001	P843-E845 PolarHBondContact O-N 3.04Å; P843-I846 PolarHBondContact O-N 3.18Å; P843-E847 WeakPolarHBondContact O-CB 3.33Å; P843-E847 PolarHBondContact O-N 3.32Å; P843-D946 HydrophobicContact CG-CB 4.4Å; P843-I948 HydrophobicContact CB-CG1 4.46Å; P843-V1001 HydrophobicContact CB-CG1 4.39Å; P843-V1001 HydrophobicContact CG-CG1 4.35Å
844	A	92.9	Very high	90.7	Very high	57 Å²	57	56.4 Å²	56.4	47%	0.471	31%	0.307	S	S	.	.	H	α-helix	trans	-68.3	-27.9	177.3	0	0	0	0	0	114.2	A842 Q848	A842-A844 PolarHBondContact O-N 3.01Å; A842-A844 VanDerWaalsContact O-N 3.12Å; A844-Q848 WeakPolarHBondContact O-CB 3.42Å; A844-Q848 PolarHBondContact O-N 3.45Å; A844-Q848 VanDerWaalsContact O-N 3.12Å
845	E	94.4	Very high	91	Very high	109 Å²	109	57.5 Å²	57.5	51%	0.509	30%	0.303	S	S	.	.	H	α-helix	trans	-75	-36	175	-63.4	175.5	141.7	0	0	110.7	P841 A842 P843 E849	P841-E845 VanDerWaalsContact CA-OE2 3.23Å; P841-E845 WeakPolarHBondContact CA-OE2 3.29Å; P841-E845 HydrophobicContact CB-CB 4.13Å; P841-E845 WeakPolarHBondContact CB-OE2 3.44Å; A842-E845 HydrophobicContact CB-CG 4.26Å; A842-E845 PolarHBondContact N-OE2 2.93Å; A842-E845 WeakPolarHBondContact O-CB 3.29Å; A842-E845 PolarHBondContact O-N 3.1Å; P843-E845 PolarHBondContact O-N 3.04Å; E845-E849 PolarHBondContact O-N 2.88Å; E845-E849 VanDerWaalsContact O-N 3.14Å
846	I	95.3	Very high	91.4	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-67.7	-45	173.6	-56.9	167	0	0	0	110.3	M833 F837 P841 A842 P843 Q848 E849 Y850 V922 F923 C1021	M833-I846 HydrophobicContact CE-CD1 4.33Å; F837-I846 HydrophobicContact CE2-CG1 4.21Å; F837-I846 HydrophobicContact CZ-CB 4.37Å; F837-I846 HydrophobicContact CZ-CG1 4.03Å; P841-I846 HydrophobicContact CB-CG1 4.13Å; P841-I846 HydrophobicContact CG-CD1 3.81Å; P841-I846 HydrophobicContact CG-CG1 3.51Å; A842-I846 PolarHBondContact O-N 2.89Å; P843-I846 PolarHBondContact O-N 3.18Å; I846-Q848 VanDerWaalsContact C-N 3.31Å; I846-Q848 PolarHBondContact O-N 2.81Å; I846-E849 PolarHBondContact O-N 2.83Å; I846-Y850 WeakPolarHBondContact O-CB 3.35Å; I846-Y850 PolarHBondContact O-N 3.13Å; I846-V922 HydrophobicContact CG2-CG2 3.87Å; I846-F923 HydrophobicContact CG2-CD1 3.88Å; I846-F923 HydrophobicContact CG2-CE1 3.62Å; I846-C1021 HydrophobicContact CD1-CB 3.42Å; I846-C1021 VanDerWaalsContact CD1-CB 3.42Å; I846-C1021 VanDerWaalsContact CD1-O 3.24Å; I846-C1021 WeakPolarHBondContact CD1-O 3.17Å
847	E	95.3	Very high	91.7	Very high	3 Å²	3	61 Å²	61	1%	0.014	32%	0.317	C	S	.	.	H	α-helix	trans	-55.7	-45.2	175.6	-173.7	166.3	-147.4	0	0	111.7	W551 P843 Y850 W851 I948 Y950 R999	W551-E847 HydrophobicContact CH2-CG 4.3Å; W551-E847 HydrophobicContact CZ2-CG 4.38Å; W551-E847 HydrophobicContact CZ3-CG 4.32Å; P843-E847 WeakPolarHBondContact O-CB 3.33Å; P843-E847 PolarHBondContact O-N 3.32Å; E847-Y850 PolarHBondContact O-N 3.44Å; E847-W851 PolarHBondContact O-N 3.32Å; E847-I948 HydrophobicContact CB-CD1 3.82Å; E847-I948 HydrophobicContact CG-CD1 4.34Å; E847-Y950 WeakPolarHBondContact OE1-CE1 3.25Å; E847-Y950 PolarHBondContact OE1-OH 3.41Å; E847-R999 IonicContact OE1-CZ 2.68Å; E847-R999 IonicContact OE1-NE 3.83Å; E847-R999 PolarHBondContact OE1-NE 2.81Å; E847-R999 IonicContact OE1-NH2 2.75Å; E847-R999 IonicContact OE2-CZ 2.86Å; E847-R999 IonicContact OE2-NE 3.53Å; E847-R999 PolarHBondContact OE2-NE 3.11Å; E847-R999 IonicContact OE2-NH2 2.7Å; E847-R999 PolarHBondContact OE2-NH2 3.06Å
848	Q	94.6	Very high	91.6	Very high	131 Å²	131	61.4 Å²	61.4	61%	0.612	32%	0.32	S	S	*	.	H	α-helix	trans	-65.7	-47.5	178.4	-171.7	176.8	-3.6	0	0	112.8	A844 I846 Y850 R852	A844-Q848 WeakPolarHBondContact O-CB 3.42Å; A844-Q848 PolarHBondContact O-N 3.45Å; A844-Q848 VanDerWaalsContact O-N 3.12Å; I846-Q848 VanDerWaalsContact C-N 3.31Å; I846-Q848 PolarHBondContact O-N 2.81Å; Q848-Y850 VanDerWaalsContact C-N 3.32Å; Q848-Y850 PolarHBondContact O-N 3.3Å; Q848-R852 WeakPolarHBondContact O-CB 3.45Å; Q848-R852 PolarHBondContact O-N 3.06Å
849	E	94	Very high	91.9	Very high	29 Å²	29	56 Å²	56	14%	0.136	28%	0.282	C	S	.	.	H	α-helix	trans	-67	-33.6	176.2	175.5	71.4	165	0	0	111.6	R685 F837 E845 I846 R852 L853 F923	R685-E849 IonicContact CZ-OE1 2.76Å; R685-E849 IonicContact NH1-OE1 3.23Å; R685-E849 PolarHBondContact NH1-OE1 3.07Å; R685-E849 IonicContact NH2-OE1 3.84Å; R685-E849 PolarHBondContact NH2-OE1 3.3Å; F837-E849 HydrophobicContact CE1-CB 4.28Å; F837-E849 HydrophobicContact CZ-CB 4.11Å; F837-E849 HydrophobicContact CZ-CG 4.19Å; E845-E849 PolarHBondContact O-N 2.88Å; E845-E849 VanDerWaalsContact O-N 3.14Å; I846-E849 PolarHBondContact O-N 2.83Å; E849-R852 VanDerWaalsContact CD-NH2 3.35Å; E849-R852 IonicContact OE1-NH2 3.03Å; E849-R852 PolarHBondContact OE1-NH2 2.83Å; E849-R852 VanDerWaalsContact OE1-NH2 3.09Å; E849-R852 IonicContact OE2-CZ 3.63Å; E849-R852 IonicContact OE2-NE 3.84Å; E849-R852 PolarHBondContact OE2-NE 3.27Å; E849-R852 IonicContact OE2-NH2 3.62Å; E849-R852 PolarHBondContact OE2-NH2 2.85Å; E849-L853 HydrophobicContact CG-CD1 4.16Å; E849-L853 WeakPolarHBondContact O-CB 3.49Å; E849-L853 VanDerWaalsContact O-CG 3.23Å; E849-L853 WeakPolarHBondContact O-CG 3.47Å; E849-L853 PolarHBondContact O-N 3.03Å; E849-F923 HydrophobicContact CB-CZ 4.28Å; E849-F923 HydrophobicContact CG-CE1 4.38Å; E849-F923 HydrophobicContact CG-CZ 3.7Å
850	Y	95.9	Very high	92.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.9	-55.4	175.3	175.7	-95	0	0	0	111.6	I614 I846 E847 Q848 R852 L853 V854 F923 T925 M984 V1019	I614-Y850 HydrophobicContact CD1-CE2 4.4Å; I614-Y850 HydrophobicContact CG2-CD2 4.01Å; I614-Y850 HydrophobicContact CG2-CE2 3.8Å; I846-Y850 WeakPolarHBondContact O-CB 3.35Å; I846-Y850 PolarHBondContact O-N 3.13Å; E847-Y850 PolarHBondContact O-N 3.44Å; Q848-Y850 VanDerWaalsContact C-N 3.32Å; Q848-Y850 PolarHBondContact O-N 3.3Å; Y850-R852 VanDerWaalsContact C-N 3.32Å; Y850-R852 PolarHBondContact O-N 3.29Å; Y850-L853 WeakPolarHBondContact O-CB 3.44Å; Y850-L853 PolarHBondContact O-N 3.19Å; Y850-V854 HydrophobicContact CD1-CG2 4.42Å; Y850-V854 HydrophobicContact CE1-CG2 3.93Å; Y850-V854 HydrophobicContact CE2-CG2 4.29Å; Y850-V854 WeakPolarHBondContact O-CG2 3.34Å; Y850-V854 PolarHBondContact O-N 3.41Å; Y850-V854 VanDerWaalsContact O-N 3.08Å; Y850-F923 HydrophobicContact CD2-CB 3.91Å; Y850-F923 AromaticContact CD2-CD1 3.78Å; Y850-F923 HydrophobicContact CD2-CD1 3.78Å; Y850-F923 HydrophobicContact CD2-CG 4.15Å; Y850-F923 HydrophobicContact CE2-CB 4.34Å; Y850-F923 HydrophobicContact CG-CD1 4.29Å; Y850-T925 WeakPolarHBondContact CE2-OG1 3.38Å; Y850-T925 VanDerWaalsContact OH-CG2 3.3Å; Y850-T925 WeakPolarHBondContact OH-CG2 3.46Å; Y850-T925 PolarHBondContact OH-OG1 2.88Å; Y850-M984 HydrophobicContact CE1-CE 3.99Å; Y850-M984 VanDerWaalsContact OH-CE 3.25Å; Y850-M984 WeakPolarHBondContact OH-CE 3.3Å; Y850-V1019 HydrophobicContact CD1-CG1 4.39Å; Y850-V1019 HydrophobicContact CD1-CG2 4.35Å; Y850-V1019 HydrophobicContact CD2-CG1 3.86Å; Y850-V1019 HydrophobicContact CE1-CG2 3.9Å; Y850-V1019 HydrophobicContact CE2-CG1 4.02Å; Y850-V1019 HydrophobicContact CE2-CG2 4.29Å; Y850-V1019 HydrophobicContact CG-CG1 4.04Å
851	W	95.4	Very high	92.3	Very high	5 Å²	5	39.5 Å²	39.5	2%	0.019	21%	0.209	C	C	.	.	H	α-helix	trans	-67.1	-35.1	-179.5	-71.6	114	0	0	0	111.7	W551 E847 L853 V854 E855 Y950 M984 I985 S986 P987	W551-W851 HydrophobicContact CH2-CB 4.35Å; W551-W851 AromaticContact CH2-CD1 3.2Å; W551-W851 AromaticContact CH2-CG 3.83Å; W551-W851 HydrophobicContact CH2-CG 3.83Å; W551-W851 AromaticContact CH2-NE1 3.68Å; W551-W851 AromaticContact CZ2-CD1 3.85Å; W551-W851 HydrophobicContact CZ2-CG 4.41Å; W551-W851 AromaticContact CZ3-CD1 3.99Å; E847-W851 PolarHBondContact O-N 3.32Å; W851-L853 PolarHBondContact O-N 2.93Å; W851-V854 HydrophobicContact CE3-CB 4.22Å; W851-V854 HydrophobicContact CE3-CG1 4.17Å; W851-V854 HydrophobicContact CZ3-CG1 4.15Å; W851-V854 PolarHBondContact O-N 3.39Å; W851-E855 VanDerWaalsContact O-CB 3.3Å; W851-E855 WeakPolarHBondContact O-CB 3.25Å; W851-E855 WeakPolarHBondContact O-CG 3.49Å; W851-E855 PolarHBondContact O-N 2.76Å; W851-Y950 HydrophobicContact CZ2-CD2 4.47Å; W851-Y950 AromaticContact CZ2-CE2 3.78Å; W851-Y950 HydrophobicContact CZ2-CE2 3.78Å; W851-Y950 AromaticContact CZ2-CZ 3.91Å; W851-Y950 AromaticContact NE1-CZ 3.64Å; W851-Y950 PolarHBondContact NE1-OH 3.23Å; W851-M984 HydrophobicContact CH2-CB 4.41Å; W851-M984 HydrophobicContact CH2-CE 3.44Å; W851-M984 VanDerWaalsContact CH2-CE 3.44Å; W851-M984 HydrophobicContact CZ2-CE 3.92Å; W851-M984 HydrophobicContact CZ3-CB 4.23Å; W851-M984 HydrophobicContact CZ3-CE 4.26Å; W851-I985 WeakPolarHBondContact CH2-O 3.49Å; W851-S986 VanDerWaalsContact CZ3-CA 3.46Å; W851-P987 HydrophobicContact CZ2-CG 3.97Å
852	R	94.3	Very high	92.4	Very high	61 Å²	61	39.1 Å²	39.1	23%	0.23	21%	0.207	C	C	.	.	H	α-helix	trans	-55.7	-48.1	169.9	-167.5	-163.7	64.4	76.4	2.2	111.9	Q848 E849 Y850 V854 E855 E856 D858	Q848-R852 WeakPolarHBondContact O-CB 3.45Å; Q848-R852 PolarHBondContact O-N 3.06Å; E849-R852 VanDerWaalsContact CD-NH2 3.35Å; E849-R852 IonicContact OE1-NH2 3.03Å; E849-R852 PolarHBondContact OE1-NH2 2.83Å; E849-R852 VanDerWaalsContact OE1-NH2 3.09Å; E849-R852 IonicContact OE2-CZ 3.63Å; E849-R852 IonicContact OE2-NE 3.84Å; E849-R852 PolarHBondContact OE2-NE 3.27Å; E849-R852 IonicContact OE2-NH2 3.62Å; E849-R852 PolarHBondContact OE2-NH2 2.85Å; Y850-R852 VanDerWaalsContact C-N 3.32Å; Y850-R852 PolarHBondContact O-N 3.29Å; R852-V854 VanDerWaalsContact C-N 3.35Å; R852-V854 PolarHBondContact O-N 2.82Å; R852-E855 PolarHBondContact O-N 2.9Å; R852-E856 VanDerWaalsContact CD-OE2 3.31Å; R852-E856 WeakPolarHBondContact CD-OE2 3.37Å; R852-E856 HydrophobicContact CG-CG 3.89Å; R852-E856 WeakPolarHBondContact CG-OE1 3.27Å; R852-E856 WeakPolarHBondContact CG-OE2 3.32Å; R852-E856 IonicContact CZ-OE2 3.72Å; R852-E856 IonicContact NE-OE2 3.03Å; R852-E856 IonicContact NH1-OE2 2.7Å; R852-E856 PolarHBondContact NH1-OE2 2.89Å; R852-E856 WeakPolarHBondContact O-CB 3.5Å; R852-E856 PolarHBondContact O-N 2.73Å; R852-D858 IonicContact NH1-OD1 3.83Å; R852-D858 PolarHBondContact NH1-OD1 2.86Å
853	L	92.9	Very high	92.4	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-40.4	178.3	-73.2	167	0	0	0	112.5	I614 H615 E849 Y850 W851 K857 C859 V861 F923	I614-L853 HydrophobicContact CG2-CB 4.11Å; H615-L853 WeakPolarHBondContact CA-O 3.25Å; E849-L853 HydrophobicContact CG-CD1 4.16Å; E849-L853 WeakPolarHBondContact O-CB 3.49Å; E849-L853 VanDerWaalsContact O-CG 3.23Å; E849-L853 WeakPolarHBondContact O-CG 3.47Å; E849-L853 PolarHBondContact O-N 3.03Å; Y850-L853 WeakPolarHBondContact O-CB 3.44Å; Y850-L853 PolarHBondContact O-N 3.19Å; W851-L853 PolarHBondContact O-N 2.93Å; L853-K857 PolarHBondContact O-N 2.84Å; L853-C859 HydrophobicContact CD2-CB 4.26Å; L853-V861 HydrophobicContact CD1-CB 4.43Å; L853-V861 HydrophobicContact CD1-CG2 3.97Å; L853-V861 HydrophobicContact CD2-CG2 3.75Å; L853-F923 HydrophobicContact CD1-CD2 4.23Å; L853-F923 HydrophobicContact CD1-CE2 3.78Å; L853-F923 HydrophobicContact CD1-CZ 4.05Å
854	V	92.5	Very high	92.5	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.024	18%	0.183	C	C	.	.	H	α-helix	trans	-70.8	-35.4	178.2	173.6	0	0	0	0	112.4	I614 Y850 W851 R852 K857 M984	I614-V854 HydrophobicContact CG2-CG2 3.82Å; Y850-V854 HydrophobicContact CD1-CG2 4.42Å; Y850-V854 HydrophobicContact CE1-CG2 3.93Å; Y850-V854 HydrophobicContact CE2-CG2 4.29Å; Y850-V854 WeakPolarHBondContact O-CG2 3.34Å; Y850-V854 PolarHBondContact O-N 3.41Å; Y850-V854 VanDerWaalsContact O-N 3.08Å; W851-V854 HydrophobicContact CE3-CB 4.22Å; W851-V854 HydrophobicContact CE3-CG1 4.17Å; W851-V854 HydrophobicContact CZ3-CG1 4.15Å; W851-V854 PolarHBondContact O-N 3.39Å; R852-V854 VanDerWaalsContact C-N 3.35Å; R852-V854 PolarHBondContact O-N 2.82Å; V854-K857 WeakPolarHBondContact O-CE 3.47Å; V854-K857 WeakPolarHBondContact O-CG 3.41Å; V854-K857 PolarHBondContact O-NZ 3.27Å; V854-M984 HydrophobicContact CG1-CB 4.31Å
855	E	91.3	Very high	92.6	Very high	99 Å²	99	34.5 Å²	34.5	46%	0.463	17%	0.166	S	C	.	.	H	α-helix	trans	-87.1	-48.6	-175.8	-70	-178.9	-172.2	0	0	112.8	W851 R852 K857 S986	W851-E855 VanDerWaalsContact O-CB 3.3Å; W851-E855 WeakPolarHBondContact O-CB 3.25Å; W851-E855 WeakPolarHBondContact O-CG 3.49Å; W851-E855 PolarHBondContact O-N 2.76Å; R852-E855 PolarHBondContact O-N 2.9Å; E855-K857 PolarHBondContact O-NZ 3.23Å; E855-S986 WeakPolarHBondContact OE1-CB 3.48Å; E855-S986 PolarHBondContact OE1-OG 3.25Å
856	E	89.7	Confident	92.6	Very high	105 Å²	105	29.5 Å²	29.5	49%	0.491	14%	0.144	S	C	.	.	H	α-helix	trans	-78.1	-36.3	-176.4	-64.4	-178.8	173.6	0	0	113.5	R852 D858	R852-E856 VanDerWaalsContact CD-OE2 3.31Å; R852-E856 WeakPolarHBondContact CD-OE2 3.37Å; R852-E856 HydrophobicContact CG-CG 3.89Å; R852-E856 WeakPolarHBondContact CG-OE1 3.27Å; R852-E856 WeakPolarHBondContact CG-OE2 3.32Å; R852-E856 IonicContact CZ-OE2 3.72Å; R852-E856 IonicContact NE-OE2 3.03Å; R852-E856 IonicContact NH1-OE2 2.7Å; R852-E856 PolarHBondContact NH1-OE2 2.89Å; R852-E856 WeakPolarHBondContact O-CB 3.5Å; R852-E856 PolarHBondContact O-N 2.73Å; E856-D858 PolarHBondContact O-N 3.34Å; E856-D858 VanDerWaalsContact O-N 3.15Å
857	K	89.9	Confident	92.4	Very high	30 Å²	30	34.7 Å²	34.7	13%	0.13	17%	0.166	C	C	.	.			trans	56.1	28.6	175.6	-44	177.7	-170.1	67	0	114.4	H615 R619 W621 N624 L853 V854 E855	H615-K857 VanDerWaalsContact O-CG 3.3Å; H615-K857 WeakPolarHBondContact O-CG 3.07Å; R619-K857 WeakPolarHBondContact O-CD 3.34Å; R619-K857 WeakPolarHBondContact O-CE 3.29Å; W621-K857 WeakPolarHBondContact O-CD 3.3Å; N624-K857 WeakPolarHBondContact CB-O 3.38Å; N624-K857 PolarHBondContact N-O 2.99Å; N624-K857 VanDerWaalsContact N-O 3.14Å; L853-K857 PolarHBondContact O-N 2.84Å; V854-K857 WeakPolarHBondContact O-CE 3.47Å; V854-K857 WeakPolarHBondContact O-CG 3.41Å; V854-K857 PolarHBondContact O-NZ 3.27Å; E855-K857 PolarHBondContact O-NZ 3.23Å
858	D	86.6	Confident	92.3	Very high	41 Å²	41	34.9 Å²	34.9	22%	0.219	17%	0.168	C	C	.	.			trans	-85.4	-26.3	-177.6	99.1	-69.3	0	0	0	112.9	N624 R660 R852 E856	N624-D858 WeakPolarHBondContact CB-O 3.49Å; N624-D858 PolarHBondContact ND2-O 3.48Å; R660-D858 IonicContact CZ-OD2 2.83Å; R660-D858 IonicContact NH1-OD2 3.21Å; R660-D858 PolarHBondContact NH1-OD2 3.44Å; R660-D858 IonicContact NH2-OD2 2.78Å; R660-D858 PolarHBondContact NH2-OD2 2.7Å; R852-D858 IonicContact NH1-OD1 3.83Å; R852-D858 PolarHBondContact NH1-OD1 2.86Å; E856-D858 PolarHBondContact O-N 3.34Å; E856-D858 VanDerWaalsContact O-N 3.15Å
859	C	87.1	Confident	92	Very high	20 Å²	20	29.4 Å²	29.4	14%	0.135	14%	0.142	C	C	.	.	S	Bend	trans	-122.8	129.8	-175	-175.8	0	0	0	0	111.1	H615 D654 L853 V861	H615-C859 VanDerWaalsContact CB-O 3.29Å; H615-C859 WeakPolarHBondContact CB-O 3.48Å; D654-C859 WeakPolarHBondContact OD2-CA 3.3Å; D654-C859 PolarHBondContact OD2-SG 3.14Å; D654-C859 VanDerWaalsContact OD2-SG 3.33Å; L853-C859 HydrophobicContact CD2-CB 4.26Å; C859-V861 PolarHBondContact O-N 2.83Å
860	H	89.5	Confident	91.8	Very high	11 Å²	11	28.7 Å²	28.7	5%	0.051	14%	0.14	C	C	.	.			trans	-72.4	120.7	171.8	171.1	102.2	0	0	0	109.7	H613 H615 N624 L645 E652 D654	H613-H860 AromaticContact CE1-CE1 3.86Å; H613-H860 AromaticContact ND1-CE1 3.81Å; H615-H860 AromaticContact CE1-CE1 3.83Å; H615-H860 AromaticContact CE1-CG 3.72Å; H615-H860 AromaticContact CE1-ND1 3.16Å; H615-H860 PolarHBondContact CE1-ND1 3.21Å; H615-H860 AromaticContact NE2-ND1 3.52Å; N624-H860 PolarHBondContact ND2-N 3.5Å; L645-H860 VanDerWaalsContact CD1-CE1 3.45Å; L645-H860 WeakPolarHBondContact CD1-CE1 3.5Å; E652-H860 WeakPolarHBondContact CB-NE2 3.48Å; E652-H860 IonicContact OE2-CE1 2.6Å; E652-H860 IonicContact OE2-NE2 3.23Å; D654-H860 HydrophobicContact CB-CB 3.86Å; D654-H860 PolarHBondContact OD2-N 2.91Å
861	V	89.8	Confident	91.4	Very high	15 Å²	15	34.9 Å²	34.9	9%	0.091	17%	0.173	C	C	.	.			trans	-128.1	120.9	168.8	177.3	0	0	0	0	108.6	H613 I614 H615 L853 C859 V863 F923	H613-V861 CarbonylContact C-O 3.56Å; H613-V861 WeakPolarHBondContact CA-O 3.31Å; I614-V861 HydrophobicContact CB-CB 4.5Å; I614-V861 HydrophobicContact CG1-CG1 4.27Å; I614-V861 PolarHBondContact N-O 2.86Å; H615-V861 PolarHBondContact ND1-N 2.9Å; H615-V861 PolarHBondContact ND1-O 2.9Å; L853-V861 HydrophobicContact CD1-CB 4.43Å; L853-V861 HydrophobicContact CD1-CG2 3.97Å; L853-V861 HydrophobicContact CD2-CG2 3.75Å; C859-V861 PolarHBondContact O-N 2.83Å; V861-V863 HydrophobicContact CG1-CG1 4Å; V861-F923 HydrophobicContact CG1-CD2 4.29Å
862	A	91.9	Very high	90.8	Very high	13 Å²	13	39 Å²	39	11%	0.107	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.8	170.7	0	0	0	0	0	109.6	I611 Q612 E652	I611-A862 HydrophobicContact CG2-CB 4Å; Q612-A862 WeakPolarHBondContact O-CA 3.46Å; E652-A862 HydrophobicContact CB-CB 4.18Å; E652-A862 HydrophobicContact CG-CB 4.25Å
863	V	94	Very high	90.1	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	158	176.7	-55.4	0	0	0	0	110.4	I611 Q612 I614 I832 V861 M921 F923	I611-V863 CarbonylContact C-O 3.1Å; I611-V863 WeakPolarHBondContact CA-O 3.33Å; Q612-V863 HydrophobicContact CB-CG2 4.06Å; Q612-V863 PolarHBondContact N-O 3.38Å; Q612-V863 PolarHBondContact O-N 3.09Å; I614-V863 HydrophobicContact CD1-CG2 3.71Å; I614-V863 HydrophobicContact CG1-CG1 4.35Å; I614-V863 HydrophobicContact CG1-CG2 4.08Å; I832-V863 HydrophobicContact CG2-CG1 4.29Å; V861-V863 HydrophobicContact CG1-CG1 4Å; V863-M921 HydrophobicContact CB-CG 4.09Å; V863-M921 HydrophobicContact CB-SD 4.01Å; V863-F923 HydrophobicContact CG1-CB 4.31Å
864	H	94.3	Very high	89.8	Confident	29 Å²	29	41.7 Å²	41.7	13%	0.134	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	141.8	179.6	-54.1	-83.1	0	0	0	111.9	T609 Q610 F825 M921 S924	T609-H864 HydrophobicContact CG2-CB 4.11Å; Q610-H864 CarbonylContact O-C 3.57Å; Q610-H864 VanDerWaalsContact O-CA 3.28Å; Q610-H864 WeakPolarHBondContact O-CA 3.35Å; F825-H864 HydrophobicContact CD2-CB 4.44Å; F825-H864 HydrophobicContact CE2-CB 3.87Å; F825-H864 WeakPolarHBondContact CE2-O 3.2Å; F825-H864 WeakPolarHBondContact CZ-O 3.44Å; H864-M921 HydrophobicContact CB-CE 3.72Å; H864-M921 HydrophobicContact CB-SD 4.39Å; H864-M921 PolarHBondContact N-SD 2.76Å; H864-M921 VanDerWaalsContact N-SD 3.38Å; H864-M921 WeakPolarHBondContact O-CE 3.48Å; H864-M921 VanDerWaalsContact O-CG 3.31Å; H864-M921 WeakPolarHBondContact O-CG 3.5Å; H864-S924 PolarHBondContact O-OG 2.88Å; H864-S924 VanDerWaalsContact O-OG 3.09Å
865	C	95.8	Very high	89.8	Confident	17 Å²	17	42.1 Å²	42.1	12%	0.115	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	169.9	165.1	59.7	0	0	0	0	110.5	T609 Q610 Q612 I919	T609-C865 CarbonylContact C-O 3.57Å; T609-C865 VanDerWaalsContact CA-O 3.27Å; T609-C865 WeakPolarHBondContact CA-O 3.44Å; Q610-C865 PolarHBondContact N-O 3.12Å; Q610-C865 PolarHBondContact O-N 2.81Å; Q612-C865 VanDerWaalsContact CD-SG 3.57Å; C865-I919 CarbonylContact C-O 3.54Å; C865-I919 WeakPolarHBondContact CA-O 3.41Å
866	G	93.9	Very high	89.9	Confident	3 Å²	3	37.4 Å²	37.4	3%	0.031	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	144	173.7	0	0	0	0	0	111.1	N918 I919	G866-N918 WeakPolarHBondContact O-CA 3.29Å; G866-I919 PolarHBondContact N-O 3.2Å; G866-I919 PolarHBondContact O-N 3.43Å
867	K	92.1	Very high	90.1	Very high	111 Å²	111	32.6 Å²	32.6	48%	0.483	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	122.2	173.8	-175.5	163.7	-176.9	170	0	108.4	W916 L917	K867-W916 HydrophobicContact CD-CD2 4.24Å; K867-W916 HydrophobicContact CD-CE3 4.4Å; K867-W916 HydrophobicContact CD-CG 4.33Å; K867-W916 VanDerWaalsContact CE-CD2 3.44Å; K867-W916 HydrophobicContact CG-CB 4.31Å; K867-W916 HydrophobicContact CG-CD2 3.85Å; K867-W916 HydrophobicContact CG-CE3 3.56Å; K867-W916 HydrophobicContact CG-CG 4.19Å; K867-W916 HydrophobicContact CG-CZ3 4.18Å; K867-L917 WeakPolarHBondContact CA-O 3.5Å
868	V	92.3	Very high	90.2	Very high	7 Å²	7	31.4 Å²	31.4	4%	0.042	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	132.4	-160.1	-171	0	0	0	0	110	F607 H873 L917 I919	F607-V868 HydrophobicContact CB-CG2 3.55Å; F607-V868 HydrophobicContact CD2-CG2 4.34Å; F607-V868 HydrophobicContact CG-CG2 3.94Å; V868-H873 HydrophobicContact CG1-CB 3.92Å; V868-H873 WeakPolarHBondContact CG1-CD2 3.28Å; V868-L917 HydrophobicContact CB-CB 4.3Å; V868-L917 PolarHBondContact N-O 2.9Å; V868-L917 PolarHBondContact O-N 3.05Å; V868-I919 HydrophobicContact CG2-CD1 4.1Å
869	D	89	Confident	90.3	Very high	16 Å²	16	34 Å²	34	9%	0.086	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	124.8	-179.5	-179.3	-65.4	0	0	0	110.1	N871 T872 H873 P910 I914 W916	D869-N871 VanDerWaalsContact C-N 3.25Å; D869-N871 PolarHBondContact O-N 3.21Å; D869-N871 WeakPolarHBondContact OD1-CA 3.49Å; D869-N871 WeakPolarHBondContact OD1-CB 3.11Å; D869-N871 PolarHBondContact OD1-N 2.79Å; D869-T872 HydrophobicContact CB-CG2 4.26Å; D869-T872 PolarHBondContact O-N 3.06Å; D869-T872 PolarHBondContact O-OG1 3.47Å; D869-H873 PolarHBondContact O-N 3.48Å; D869-P910 WeakPolarHBondContact OD2-CB 3.36Å; D869-I914 WeakPolarHBondContact OD1-CG2 3.25Å; D869-W916 HydrophobicContact CB-CE3 4.32Å; D869-W916 HydrophobicContact CB-CH2 4.28Å; D869-W916 HydrophobicContact CB-CZ3 3.85Å
870	T	89.9	Confident	90.2	Very high	14 Å²	14	34.2 Å²	34.2	9%	0.086	20%	0.201	C	C	.	.	H	α-helix	trans	-67.3	-19.3	-174.4	51.4	0	0	0	0	114.6	T872 G874 I914 P915 L917 E1027	T870-T872 VanDerWaalsContact C-N 3.28Å; T870-G874 WeakPolarHBondContact CA-O 3.47Å; T870-G874 CarbonylContact O-C 3.45Å; T870-G874 VanDerWaalsContact O-C 3.26Å; T870-G874 WeakPolarHBondContact O-CA 3.37Å; T870-G874 PolarHBondContact O-N 3.3Å; T870-I914 WeakPolarHBondContact OG1-CG2 3.13Å; T870-P915 WeakPolarHBondContact CB-O 3.37Å; T870-P915 HydrophobicContact CG2-CB 4.09Å; T870-P915 VanDerWaalsContact CG2-O 3.29Å; T870-P915 WeakPolarHBondContact CG2-O 3.2Å; T870-P915 PolarHBondContact N-O 3.46Å; T870-P915 WeakPolarHBondContact OG1-CD 3.49Å; T870-P915 PolarHBondContact OG1-O 2.8Å; T870-L917 HydrophobicContact CG2-CB 4Å; T870-E1027 VanDerWaalsContact CG2-OE1 3.28Å; T870-E1027 WeakPolarHBondContact CG2-OE1 3.26Å
871	N	86.6	Confident	90	Very high	131 Å²	131	42.1 Å²	42.1	70%	0.701	24%	0.235	S	C	*	.	H	α-helix	trans	-74	-20.8	171.1	-178.5	66.5	0	0	0	112	D869 I914	D869-N871 VanDerWaalsContact C-N 3.25Å; D869-N871 PolarHBondContact O-N 3.21Å; D869-N871 WeakPolarHBondContact OD1-CA 3.49Å; D869-N871 WeakPolarHBondContact OD1-CB 3.11Å; D869-N871 PolarHBondContact OD1-N 2.79Å; N871-I914 HydrophobicContact CB-CD1 4.18Å; N871-I914 HydrophobicContact CB-CG2 3.85Å
872	T	82.9	Confident	89.8	Confident	91 Å²	91	47 Å²	47	56%	0.558	27%	0.27	S	S	*	.	H	α-helix	trans	-90.4	-30.2	178.6	63.5	0	0	0	0	114.2	D869 T870	D869-T872 HydrophobicContact CB-CG2 4.26Å; D869-T872 PolarHBondContact O-N 3.06Å; D869-T872 PolarHBondContact O-OG1 3.47Å; T870-T872 VanDerWaalsContact C-N 3.28Å
873	H	80.8	Confident	89.6	Confident	83 Å²	83	48.8 Å²	48.8	38%	0.384	28%	0.276	S	S	.	.	H	α-helix	trans	-129.6	0.2	-173.3	-73.5	-74	0	0	0	115.3	M605 R606 V868 D869	M605-H873 HydrophobicContact CG-CB 4.02Å; M605-H873 HydrophobicContact SD-CB 3.7Å; R606-H873 PolarHBondContact O-CE1 2.9Å; R606-H873 PolarHBondContact O-NE2 2.78Å; V868-H873 HydrophobicContact CG1-CB 3.92Å; V868-H873 WeakPolarHBondContact CG1-CD2 3.28Å; D869-H873 PolarHBondContact O-N 3.48Å
874	G	86.9	Confident	89.3	Confident	35 Å²	35	53.1 Å²	53.1	36%	0.361	30%	0.304	S	S	.	.			trans	90.4	163	-172.2	0	0	0	0	0	112.7	T870	T870-G874 WeakPolarHBondContact CA-O 3.47Å; T870-G874 CarbonylContact O-C 3.45Å; T870-G874 VanDerWaalsContact O-C 3.26Å; T870-G874 WeakPolarHBondContact O-CA 3.37Å; T870-G874 PolarHBondContact O-N 3.3Å
875	S	92.4	Very high	89.2	Confident	13 Å²	13	54.5 Å²	54.5	9%	0.091	31%	0.31	C	S	.	.			trans	-98.1	151.3	172.2	171.7	0	0	0	0	110.6	F877 T893 E1027	S875-F877 PolarHBondContact O-N 3.27Å; S875-F877 PolarHBondContact OG-N 2.9Å; S875-T893 WeakPolarHBondContact OG-CG2 3.14Å; S875-E1027 WeakPolarHBondContact CA-OE1 3.17Å; S875-E1027 WeakPolarHBondContact CB-OE1 3.25Å; S875-E1027 PolarHBondContact OG-OE1 2.78Å; S875-E1027 PolarHBondContact OG-OE2 2.88Å
876	G	92.2	Very high	89	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-72.7	-5.9	165.6	0	0	0	0	0	113.5	C599 H942 E1027	C599-G876 WeakPolarHBondContact CA-O 3.43Å; G876-H942 PolarHBondContact O-CE1 2.76Å; G876-H942 PolarHBondContact O-ND1 2.62Å; G876-H942 VanDerWaalsContact O-ND1 3.07Å; G876-E1027 PolarHBondContact N-OE1 3.05Å
877	F	94.6	Very high	89	Confident	4 Å²	4	63 Å²	63	2%	0.018	34%	0.341	C	S	.	.	S	Bend	trans	-86.2	147.6	164.7	-76.9	-77.3	0	0	0	111.2	W595 P597 S875 V879 N891 L892 Y940 H942 F1007 E1027	W595-F877 HydrophobicContact CH2-CE1 4.48Å; W595-F877 AromaticContact CZ2-CE1 3.82Å; W595-F877 HydrophobicContact CZ2-CE1 3.82Å; P597-F877 HydrophobicContact CB-CD1 4.05Å; P597-F877 HydrophobicContact CB-CE1 4.31Å; P597-F877 HydrophobicContact CG-CD1 4.21Å; P597-F877 HydrophobicContact CG-CE1 3.95Å; S875-F877 PolarHBondContact O-N 3.27Å; S875-F877 PolarHBondContact OG-N 2.9Å; F877-V879 PolarHBondContact O-N 3.47Å; F877-N891 VanDerWaalsContact CB-OD1 3.31Å; F877-N891 WeakPolarHBondContact CB-OD1 3.37Å; F877-N891 HydrophobicContact CD1-CB 4.39Å; F877-N891 WeakPolarHBondContact CG-OD1 3.42Å; F877-L892 HydrophobicContact CD2-CB 4.14Å; F877-L892 HydrophobicContact CD2-CG 4.42Å; F877-L892 HydrophobicContact CE2-CB 3.73Å; F877-L892 HydrophobicContact CE2-CD1 3.97Å; F877-L892 HydrophobicContact CE2-CG 3.53Å; F877-L892 HydrophobicContact CZ-CG 4Å; F877-Y940 AromaticContact CE1-CD1 3.92Å; F877-Y940 HydrophobicContact CE1-CD1 3.92Å; F877-Y940 AromaticContact CE1-CE1 3.94Å; F877-Y940 HydrophobicContact CE1-CE1 3.94Å; F877-Y940 AromaticContact CE2-CD1 3.96Å; F877-Y940 HydrophobicContact CE2-CD1 3.96Å; F877-Y940 HydrophobicContact CE2-CG 4.43Å; F877-Y940 AromaticContact CZ-CD1 3.29Å; F877-Y940 HydrophobicContact CZ-CD1 3.29Å; F877-Y940 AromaticContact CZ-CE1 3.81Å; F877-Y940 HydrophobicContact CZ-CE1 3.81Å; F877-Y940 AromaticContact CZ-CG 3.69Å; F877-Y940 HydrophobicContact CZ-CG 3.69Å; F877-H942 AromaticContact CD2-CE1 3.39Å; F877-H942 WeakPolarHBondContact CD2-CE1 3.48Å; F877-H942 AromaticContact CD2-NE2 3.7Å; F877-H942 AromaticContact CE2-CE1 3.42Å; F877-H942 VanDerWaalsContact CE2-CE1 3.42Å; F877-H942 WeakPolarHBondContact CE2-CE1 3.49Å; F877-H942 AromaticContact CE2-NE2 3.46Å; F877-H942 WeakPolarHBondContact CE2-NE2 3.48Å; F877-H942 AromaticContact CG-CE1 3.7Å; F877-H942 AromaticContact CZ-CE1 3.78Å; F877-H942 PolarHBondContact N-CE1 2.89Å; F877-F1007 HydrophobicContact CZ-CE1 4.49Å; F877-E1027 WeakPolarHBondContact CD2-OE2 3.43Å
878	P	91.6	Very high	89.1	Confident	6 Å²	6	59.9 Å²	59.9	4%	0.039	33%	0.328	C	S	.	.			trans	-60	131.8	167.4	24.7	-32.6	0	0	0	110.4	P597 E883 P884 F885 S886 N891	P597-P878 HydrophobicContact CB-CG 4.3Å; P878-E883 WeakPolarHBondContact CA-OE2 3.3Å; P878-E883 HydrophobicContact CB-CB 3.71Å; P878-E883 HydrophobicContact CB-CG 4.36Å; P878-E883 WeakPolarHBondContact CB-OE2 3.36Å; P878-P884 WeakPolarHBondContact CG-O 3.4Å; P878-F885 HydrophobicContact CG-CB 4.4Å; P878-S886 WeakPolarHBondContact O-CA 3.34Å; P878-N891 PolarHBondContact O-ND2 3.06Å
879	V	88.9	Confident	89.1	Confident	94 Å²	94	60.2 Å²	60.2	57%	0.57	33%	0.332	S	S	*	.			trans	-120.9	-7.7	178	-65.8	0	0	0	0	112.5	F877 K881 E883 T893	F877-V879 PolarHBondContact O-N 3.47Å; V879-K881 PolarHBondContact O-N 2.8Å; V879-E883 PolarHBondContact N-OE2 3.21Å; V879-T893 HydrophobicContact CG1-CG2 4.02Å
880	G	85.8	Confident	89.5	Confident	26 Å²	26	59.5 Å²	59.5	27%	0.268	33%	0.328	S	S	.	.	S	Bend	trans	-65.6	129.5	175.2	0	0	0	0	0	111	S882 E883 S886	G880-S882 PolarHBondContact O-N 2.85Å; G880-E883 PolarHBondContact N-OE2 2.85Å; G880-E883 WeakPolarHBondContact O-CB 3.23Å; G880-E883 PolarHBondContact O-N 3.35Å; G880-S886 WeakPolarHBondContact O-CB 3.39Å; G880-S886 PolarHBondContact O-OG 3.34Å; G880-S886 VanDerWaalsContact O-OG 3.12Å
881	K	83.8	Confident	89.7	Confident	176 Å²	176	58.8 Å²	58.8	77%	0.765	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-14.5	-176.1	-70.8	-178.4	179.5	176.1	0	115.5	V879 R887	V879-K881 PolarHBondContact O-N 2.8Å; K881-R887 PolarHBondContact O-NH2 2.76Å
882	S	85.5	Confident	90.2	Very high	119 Å²	119	52.6 Å²	52.6	83%	0.832	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-4.8	178.9	51.9	0	0	0	0	113.9	G880	G880-S882 PolarHBondContact O-N 2.85Å
883	E	88.4	Confident	90.7	Very high	50 Å²	50	50.1 Å²	50.1	23%	0.234	28%	0.276	C	S	.	.	S	Bend	trans	-80.2	145.8	177.9	-65.6	-171.5	105.1	0	0	111.2	K600 P878 V879 G880 S886	K600-E883 IonicContact NZ-OE1 2.68Å; K600-E883 PolarHBondContact NZ-OE1 3.49Å; P878-E883 WeakPolarHBondContact CA-OE2 3.3Å; P878-E883 HydrophobicContact CB-CB 3.71Å; P878-E883 HydrophobicContact CB-CG 4.36Å; P878-E883 WeakPolarHBondContact CB-OE2 3.36Å; V879-E883 PolarHBondContact N-OE2 3.21Å; G880-E883 PolarHBondContact N-OE2 2.85Å; G880-E883 WeakPolarHBondContact O-CB 3.23Å; G880-E883 PolarHBondContact O-N 3.35Å; E883-S886 VanDerWaalsContact O-CB 3.31Å; E883-S886 WeakPolarHBondContact O-CB 3.48Å; E883-S886 PolarHBondContact O-N 3.26Å; E883-S886 PolarHBondContact O-OG 2.69Å
884	P	88.1	Confident	91.3	Very high	90 Å²	90	48.1 Å²	48.1	58%	0.584	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	147.4	169.7	-25.6	35.3	0	0	0	112.1	P878 S886	P878-P884 WeakPolarHBondContact CG-O 3.4Å; P884-S886 PolarHBondContact O-N 2.73Å
885	F	91.7	Very high	91.7	Very high	58 Å²	58	46.4 Å²	46.4	25%	0.254	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	-3.7	178.2	-42.5	-69.2	0	0	0	116.8	D594 W595 P597 P878 R887 H888 N891	D594-F885 WeakPolarHBondContact O-CZ 3.47Å; W595-F885 HydrophobicContact CE3-CB 4.41Å; W595-F885 AromaticContact CE3-CD1 3.43Å; W595-F885 HydrophobicContact CE3-CD1 3.43Å; W595-F885 VanDerWaalsContact CE3-CD1 3.43Å; W595-F885 AromaticContact CE3-CE1 3.88Å; W595-F885 HydrophobicContact CE3-CE1 3.88Å; W595-F885 HydrophobicContact CE3-CG 4.01Å; W595-F885 HydrophobicContact CH2-CB 4.11Å; W595-F885 HydrophobicContact CZ3-CB 3.7Å; W595-F885 AromaticContact CZ3-CD1 3.46Å; W595-F885 HydrophobicContact CZ3-CD1 3.46Å; W595-F885 VanDerWaalsContact CZ3-CD1 3.46Å; W595-F885 HydrophobicContact CZ3-CE1 4.36Å; W595-F885 AromaticContact CZ3-CG 3.8Å; W595-F885 HydrophobicContact CZ3-CG 3.8Å; P597-F885 HydrophobicContact CB-CB 4.42Å; P597-F885 HydrophobicContact CB-CD2 4.19Å; P878-F885 HydrophobicContact CG-CB 4.4Å; F885-R887 PolarHBondContact O-N 3.1Å; F885-H888 HydrophobicContact CB-CB 4.46Å; F885-H888 WeakPolarHBondContact O-CB 3.45Å; F885-H888 PolarHBondContact O-N 3.48Å; F885-H888 VanDerWaalsContact O-N 3.08Å; F885-N891 PolarHBondContact O-ND2 3Å
886	S	92.4	Very high	91.8	Very high	16 Å²	16	45.8 Å²	45.8	11%	0.112	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-20.8	-179.7	59	0	0	0	0	115.7	P878 G880 E883 P884	P878-S886 WeakPolarHBondContact O-CA 3.34Å; G880-S886 WeakPolarHBondContact O-CB 3.39Å; G880-S886 PolarHBondContact O-OG 3.34Å; G880-S886 VanDerWaalsContact O-OG 3.12Å; E883-S886 VanDerWaalsContact O-CB 3.31Å; E883-S886 WeakPolarHBondContact O-CB 3.48Å; E883-S886 PolarHBondContact O-N 3.26Å; E883-S886 PolarHBondContact O-OG 2.69Å; P884-S886 PolarHBondContact O-N 2.73Å
887	R	92.1	Very high	91.8	Very high	184 Å²	184	50.2 Å²	50.2	69%	0.694	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	11	178	-48.6	-172.4	-159.9	-176.5	8.5	113.5	K881 F885	K881-R887 PolarHBondContact O-NH2 2.76Å; F885-R887 PolarHBondContact O-N 3.1Å
888	H	94.2	Very high	91.7	Very high	45 Å²	45	51.1 Å²	51.1	21%	0.208	28%	0.276	C	S	.	.			trans	-75.5	144.9	-177.9	-160.4	-106.5	0	0	0	110.6	F567 W595 F885 W890 N891	F567-H888 AromaticContact CD1-CE1 3.65Å; F567-H888 AromaticContact CE1-CE1 3.61Å; F567-H888 PolarHBondContact O-CE1 3.47Å; F567-H888 VanDerWaalsContact O-CE1 3.26Å; W595-H888 AromaticContact CE3-ND1 3.88Å; W595-H888 HydrophobicContact CH2-CB 4.08Å; W595-H888 AromaticContact CH2-ND1 3.73Å; W595-H888 HydrophobicContact CZ3-CB 3.7Å; W595-H888 AromaticContact CZ3-CE1 3.96Å; W595-H888 AromaticContact CZ3-CG 3.53Å; W595-H888 AromaticContact CZ3-ND1 3.17Å; W595-H888 WeakPolarHBondContact CZ3-ND1 3.42Å; F885-H888 HydrophobicContact CB-CB 4.46Å; F885-H888 WeakPolarHBondContact O-CB 3.45Å; F885-H888 PolarHBondContact O-N 3.48Å; F885-H888 VanDerWaalsContact O-N 3.08Å; H888-W890 AromaticContact CE1-CD1 3.75Å; H888-W890 AromaticContact ND1-CD1 3.87Å; H888-W890 PolarHBondContact O-N 3.14Å; H888-N891 VanDerWaalsContact O-CB 3.23Å; H888-N891 WeakPolarHBondContact O-CB 3.38Å; H888-N891 PolarHBondContact O-N 3.1Å
889	G	93.9	Very high	91.5	Very high	13 Å²	13	56.3 Å²	56.3	13%	0.134	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-35.4	-177.1	0	0	0	0	0	113.5	P570 N891	P570-G889 WeakPolarHBondContact CG-O 3.4Å; G889-N891 VanDerWaalsContact C-N 3.27Å; G889-N891 PolarHBondContact O-N 2.88Å
890	W	95.8	Very high	91.4	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	0.5	177.3	-68.6	85.1	0	0	0	115.2	F567 P570 Y573 I574 V589 W595 H888 L892 I938 F1007	F567-W890 AromaticContact CD2-CD1 3.82Å; F567-W890 AromaticContact CD2-CD2 3.94Å; F567-W890 HydrophobicContact CD2-CD2 3.94Å; F567-W890 AromaticContact CD2-CE2 3.43Å; F567-W890 VanDerWaalsContact CD2-CE2 3.43Å; F567-W890 HydrophobicContact CD2-CG 4.17Å; F567-W890 AromaticContact CD2-CZ2 3.85Å; F567-W890 HydrophobicContact CD2-CZ2 3.85Å; F567-W890 AromaticContact CD2-NE1 3.35Å; F567-W890 HydrophobicContact CE1-CB 4.41Å; F567-W890 AromaticContact CE1-CD1 3.98Å; F567-W890 HydrophobicContact CE1-CG 4.14Å; F567-W890 HydrophobicContact CE2-CB 4.32Å; F567-W890 AromaticContact CE2-CD1 3.64Å; F567-W890 AromaticContact CE2-CD2 3.31Å; F567-W890 HydrophobicContact CE2-CD2 3.31Å; F567-W890 AromaticContact CE2-CE2 3.32Å; F567-W890 AromaticContact CE2-CE3 3.89Å; F567-W890 HydrophobicContact CE2-CE3 3.89Å; F567-W890 AromaticContact CE2-CG 3.53Å; F567-W890 HydrophobicContact CE2-CG 3.53Å; F567-W890 HydrophobicContact CE2-CH2 4.43Å; F567-W890 AromaticContact CE2-CZ2 3.91Å; F567-W890 HydrophobicContact CE2-CZ2 3.91Å; F567-W890 HydrophobicContact CE2-CZ3 4.42Å; F567-W890 AromaticContact CE2-NE1 3.51Å; F567-W890 AromaticContact CG-NE1 3.8Å; F567-W890 HydrophobicContact CZ-CB 3.84Å; F567-W890 AromaticContact CZ-CD1 3.71Å; F567-W890 AromaticContact CZ-CD2 3.79Å; F567-W890 HydrophobicContact CZ-CD2 3.79Å; F567-W890 HydrophobicContact CZ-CE3 4.44Å; F567-W890 AromaticContact CZ-CG 3.5Å; F567-W890 HydrophobicContact CZ-CG 3.5Å; F567-W890 VanDerWaalsContact CZ-CG 3.5Å; F567-W890 PolarHBondContact O-NE1 3.44Å; P570-W890 HydrophobicContact CB-CD2 3.71Å; P570-W890 VanDerWaalsContact CB-CE2 3.47Å; P570-W890 HydrophobicContact CB-CE3 4.18Å; P570-W890 HydrophobicContact CB-CG 4.1Å; P570-W890 HydrophobicContact CB-CH2 4.23Å; P570-W890 HydrophobicContact CB-CZ2 3.78Å; P570-W890 HydrophobicContact CB-CZ3 4.42Å; P570-W890 HydrophobicContact CG-CD2 4.45Å; P570-W890 HydrophobicContact CG-CG 4.35Å; Y573-W890 HydrophobicContact CD1-CH2 4.27Å; Y573-W890 AromaticContact CD1-CZ2 3.96Å; Y573-W890 HydrophobicContact CD1-CZ2 3.96Å; I574-W890 HydrophobicContact CD1-CH2 4.35Å; I574-W890 HydrophobicContact CG1-CH2 4.46Å; V589-W890 HydrophobicContact CB-CH2 4.34Å; V589-W890 HydrophobicContact CB-CZ3 4.44Å; V589-W890 HydrophobicContact CG1-CH2 3.96Å; V589-W890 HydrophobicContact CG1-CZ3 4.39Å; V589-W890 HydrophobicContact CG2-CH2 4.19Å; V589-W890 HydrophobicContact CG2-CZ3 4.47Å; W595-W890 HydrophobicContact CH2-CB 3.88Å; W595-W890 HydrophobicContact CZ2-CB 3.97Å; W595-W890 HydrophobicContact CZ3-CB 4.5Å; H888-W890 AromaticContact CE1-CD1 3.75Å; H888-W890 AromaticContact ND1-CD1 3.87Å; H888-W890 PolarHBondContact O-N 3.14Å; W890-L892 PolarHBondContact O-N 3.08Å; W890-I938 HydrophobicContact CZ3-CD1 4.4Å; W890-F1007 HydrophobicContact CB-CE1 4.38Å; W890-F1007 HydrophobicContact CB-CZ 3.88Å; W890-F1007 HydrophobicContact CD2-CE2 4.47Å; W890-F1007 HydrophobicContact CD2-CZ 4.39Å; W890-F1007 AromaticContact CE3-CD1 3.91Å; W890-F1007 HydrophobicContact CE3-CD1 3.91Å; W890-F1007 AromaticContact CE3-CD2 3.92Å; W890-F1007 HydrophobicContact CE3-CD2 3.92Å; W890-F1007 AromaticContact CE3-CE1 3.83Å; W890-F1007 HydrophobicContact CE3-CE1 3.83Å; W890-F1007 AromaticContact CE3-CE2 3.86Å; W890-F1007 HydrophobicContact CE3-CE2 3.86Å; W890-F1007 AromaticContact CE3-CG 3.94Å; W890-F1007 HydrophobicContact CE3-CG 3.94Å; W890-F1007 AromaticContact CE3-CZ 3.81Å; W890-F1007 HydrophobicContact CE3-CZ 3.81Å; W890-F1007 HydrophobicContact CG-CZ 4.48Å; W890-F1007 HydrophobicContact CZ3-CB 4.34Å; W890-F1007 HydrophobicContact CZ3-CD1 4.27Å; W890-F1007 HydrophobicContact CZ3-CD2 4.13Å; W890-F1007 HydrophobicContact CZ3-CG 4.01Å
891	N	95.8	Very high	91.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.282	C	S	.	.	S	Bend	trans	-75.1	119.5	167.9	-176.8	-34	0	0	0	108.1	F877 P878 F885 H888 G889 T893 V894 L895	F877-N891 VanDerWaalsContact CB-OD1 3.31Å; F877-N891 WeakPolarHBondContact CB-OD1 3.37Å; F877-N891 HydrophobicContact CD1-CB 4.39Å; F877-N891 WeakPolarHBondContact CG-OD1 3.42Å; P878-N891 PolarHBondContact O-ND2 3.06Å; F885-N891 PolarHBondContact O-ND2 3Å; H888-N891 VanDerWaalsContact O-CB 3.23Å; H888-N891 WeakPolarHBondContact O-CB 3.38Å; H888-N891 PolarHBondContact O-N 3.1Å; G889-N891 VanDerWaalsContact C-N 3.27Å; G889-N891 PolarHBondContact O-N 2.88Å; N891-T893 PolarHBondContact O-N 3.37Å; N891-T893 VanDerWaalsContact O-N 3.14Å; N891-T893 PolarHBondContact OD1-N 3.41Å; N891-T893 VanDerWaalsContact OD1-N 3.12Å; N891-T893 PolarHBondContact OD1-OG1 2.87Å; N891-V894 HydrophobicContact CB-CB 4.3Å; N891-V894 HydrophobicContact CB-CG2 4Å; N891-V894 WeakPolarHBondContact O-CA 3.27Å; N891-V894 WeakPolarHBondContact O-CB 3.44Å; N891-V894 PolarHBondContact O-N 3.25Å; N891-L895 PolarHBondContact O-N 2.89Å
892	L	95.6	Very high	92.1	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18	-171.6	-60.2	-171.5	0	0	0	113.4	F877 W890 V894 L895 P896 P915 I938 F1007 E1027 V1029	F877-L892 HydrophobicContact CD2-CB 4.14Å; F877-L892 HydrophobicContact CD2-CG 4.42Å; F877-L892 HydrophobicContact CE2-CB 3.73Å; F877-L892 HydrophobicContact CE2-CD1 3.97Å; F877-L892 HydrophobicContact CE2-CG 3.53Å; F877-L892 HydrophobicContact CZ-CG 4Å; W890-L892 PolarHBondContact O-N 3.08Å; L892-V894 VanDerWaalsContact C-N 3.29Å; L892-L895 HydrophobicContact CD2-CD2 3.8Å; L892-P896 VanDerWaalsContact O-CD 3.29Å; L892-P896 WeakPolarHBondContact O-CD 3.34Å; L892-P915 HydrophobicContact CB-CG 4.19Å; L892-P915 WeakPolarHBondContact O-CG 3.22Å; L892-I938 HydrophobicContact CD2-CB 4.1Å; L892-I938 HydrophobicContact CD2-CG2 4.21Å; L892-F1007 HydrophobicContact CD2-CE1 4.44Å; L892-E1027 HydrophobicContact CD1-CB 4.06Å; L892-E1027 VanDerWaalsContact CD1-O 3.32Å; L892-E1027 WeakPolarHBondContact CD1-O 3.2Å; L892-V1029 HydrophobicContact CB-CB 4.37Å; L892-V1029 HydrophobicContact CB-CG1 3.81Å; L892-V1029 HydrophobicContact CD2-CG1 4.04Å; L892-V1029 HydrophobicContact CG-CG1 4.31Å
893	T	93.8	Very high	92.5	Very high	38 Å²	38	38.1 Å²	38.1	23%	0.233	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-21.5	170	68	0	0	0	0	113.3	S875 V879 N891 P915	S875-T893 WeakPolarHBondContact OG-CG2 3.14Å; V879-T893 HydrophobicContact CG1-CG2 4.02Å; N891-T893 PolarHBondContact O-N 3.37Å; N891-T893 VanDerWaalsContact O-N 3.14Å; N891-T893 PolarHBondContact OD1-N 3.41Å; N891-T893 VanDerWaalsContact OD1-N 3.12Å; N891-T893 PolarHBondContact OD1-OG1 2.87Å; T893-P915 HydrophobicContact CG2-CG 4.31Å
894	V	94.3	Very high	92.7	Very high	41 Å²	41	38.7 Å²	38.7	25%	0.248	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-36.7	-178.9	-177	0	0	0	0	111.3	N891 L892 N897 N898	N891-V894 HydrophobicContact CB-CB 4.3Å; N891-V894 HydrophobicContact CB-CG2 4Å; N891-V894 WeakPolarHBondContact O-CA 3.27Å; N891-V894 WeakPolarHBondContact O-CB 3.44Å; N891-V894 PolarHBondContact O-N 3.25Å; L892-V894 VanDerWaalsContact C-N 3.29Å; V894-N897 WeakPolarHBondContact O-CA 3.41Å; V894-N897 WeakPolarHBondContact O-CB 3.31Å; V894-N897 PolarHBondContact O-N 2.86Å; V894-N898 PolarHBondContact O-N 3.43Å
895	L	95	Very high	92.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-46.9	-47.5	-173.5	178	70.4	0	0	0	114.9	P570 L571 N891 L892 N897 N898 I938 V1029 F1031	P570-L895 HydrophobicContact CB-CD1 3.99Å; P570-L895 HydrophobicContact CG-CD1 3.44Å; P570-L895 VanDerWaalsContact CG-CD1 3.44Å; L571-L895 HydrophobicContact CD2-CD1 3.87Å; L571-L895 HydrophobicContact CG-CD1 4.17Å; N891-L895 PolarHBondContact O-N 2.89Å; L892-L895 HydrophobicContact CD2-CD2 3.8Å; L895-N897 PolarHBondContact O-N 2.8Å; L895-N898 VanDerWaalsContact O-CB 3.25Å; L895-N898 WeakPolarHBondContact O-CB 3.39Å; L895-N898 PolarHBondContact O-N 2.83Å; L895-N898 VanDerWaalsContact O-N 3.17Å; L895-I938 HydrophobicContact CD2-CB 4.31Å; L895-I938 HydrophobicContact CD2-CD1 3.59Å; L895-I938 HydrophobicContact CD2-CG1 3.91Å; L895-V1029 HydrophobicContact CB-CG1 4.48Å; L895-V1029 HydrophobicContact CD2-CG1 3.9Å; L895-F1031 HydrophobicContact CD2-CB 4.33Å; L895-F1031 HydrophobicContact CD2-CD1 4.38Å; L895-F1031 HydrophobicContact CG-CB 4.29Å
896	P	94.4	Very high	92.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-65	-23.6	-179.1	-22.2	35.2	0	0	0	113.4	L892 S901 L903 R904 T913 V1029	L892-P896 VanDerWaalsContact O-CD 3.29Å; L892-P896 WeakPolarHBondContact O-CD 3.34Å; P896-S901 VanDerWaalsContact O-CB 3.27Å; P896-S901 WeakPolarHBondContact O-CB 3.4Å; P896-S901 PolarHBondContact O-OG 3.03Å; P896-L903 HydrophobicContact CB-CB 4.45Å; P896-R904 PolarHBondContact O-N 3.12Å; P896-R904 VanDerWaalsContact O-N 3.08Å; P896-T913 HydrophobicContact CB-CG2 4.46Å; P896-V1029 HydrophobicContact CG-CG1 4.15Å; P896-V1029 HydrophobicContact CG-CG2 3.57Å
897	N	92.4	Very high	92.3	Very high	93 Å²	93	34.1 Å²	34.1	50%	0.497	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-94.4	-3.4	-179.3	-64.4	-62.1	0	0	0	113.6	V894 L895	V894-N897 WeakPolarHBondContact O-CA 3.41Å; V894-N897 WeakPolarHBondContact O-CB 3.31Å; V894-N897 PolarHBondContact O-N 2.86Å; L895-N897 PolarHBondContact O-N 2.8Å
898	N	91.5	Very high	92.1	Very high	22 Å²	22	29.5 Å²	29.5	12%	0.118	19%	0.189	C	C	.	.	S	Bend	trans	-59	151.1	179.8	-173.8	8.2	0	0	0	111.9	D569 L571 V894 L895 G900 S901 R904	D569-N898 PolarHBondContact OD1-ND2 3.14Å; L571-N898 HydrophobicContact CD1-CB 3.9Å; L571-N898 WeakPolarHBondContact CD1-ND2 3.28Å; V894-N898 PolarHBondContact O-N 3.43Å; L895-N898 VanDerWaalsContact O-CB 3.25Å; L895-N898 WeakPolarHBondContact O-CB 3.39Å; L895-N898 PolarHBondContact O-N 2.83Å; L895-N898 VanDerWaalsContact O-N 3.17Å; N898-G900 PolarHBondContact O-N 2.96Å; N898-G900 VanDerWaalsContact O-N 3.12Å; N898-S901 PolarHBondContact O-N 3.28Å; N898-R904 PolarHBondContact O-NE 2.86Å; N898-R904 PolarHBondContact O-NH2 2.87Å
899	T	87.8	Confident	91.8	Very high	115 Å²	115	28.3 Å²	28.3	71%	0.706	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.9	-178.7	30	0	0	0	0	115.2	R904	T899-R904 VanDerWaalsContact O-CZ 3.28Å; T899-R904 PolarHBondContact O-NH1 3.15Å; T899-R904 PolarHBondContact O-NH2 2.72Å
900	G	87.2	Confident	91.4	Very high	28 Å²	28	31.4 Å²	31.4	29%	0.289	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-18.4	167	0	0	0	0	0	115.4	L571 N898	L571-G900 VanDerWaalsContact CD1-C 3.42Å; N898-G900 PolarHBondContact O-N 2.96Å; N898-G900 VanDerWaalsContact O-N 3.12Å
901	S	92.9	Very high	90.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	21%	0.205	C	C	.	.			trans	-91	121.7	-173	169.9	0	0	0	0	111.8	L571 P896 N898 L903 R904 A1032	L571-S901 VanDerWaalsContact CD1-N 3.26Å; P896-S901 VanDerWaalsContact O-CB 3.27Å; P896-S901 WeakPolarHBondContact O-CB 3.4Å; P896-S901 PolarHBondContact O-OG 3.03Å; N898-S901 PolarHBondContact O-N 3.28Å; S901-L903 PolarHBondContact O-N 3.22Å; S901-L903 PolarHBondContact OG-N 3.29Å; S901-R904 VanDerWaalsContact C-NH2 3.34Å; S901-R904 PolarHBondContact O-NE 3.45Å; S901-R904 PolarHBondContact O-NH2 3.05Å; S901-A1032 CarbonylContact C-O 3.46Å; S901-A1032 VanDerWaalsContact CA-O 3.28Å; S901-A1032 WeakPolarHBondContact CA-O 3.41Å
902	I	92.4	Very high	90.5	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.021	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-72.2	-14.2	174.8	68.9	172.9	0	0	0	112.7	R904 H905 A1032 T1034 W1036 T1037 L1061 I1065	I902-R904 PolarHBondContact O-N 3.04Å; I902-R904 VanDerWaalsContact O-N 3.16Å; I902-H905 PolarHBondContact O-CD2 3.4Å; I902-H905 VanDerWaalsContact O-CD2 3.27Å; I902-H905 PolarHBondContact O-N 3.27Å; I902-A1032 HydrophobicContact CD1-CB 4.1Å; I902-A1032 HydrophobicContact CG1-CB 3.69Å; I902-A1032 PolarHBondContact N-O 2.68Å; I902-T1034 HydrophobicContact CG2-CG2 3.97Å; I902-W1036 HydrophobicContact CD1-CE3 3.78Å; I902-W1036 HydrophobicContact CD1-CZ3 4.07Å; I902-T1037 HydrophobicContact CD1-CG2 3.41Å; I902-T1037 VanDerWaalsContact CD1-CG2 3.41Å; I902-L1061 HydrophobicContact CD1-CD2 4.22Å; I902-L1061 WeakPolarHBondContact O-CD1 3.23Å; I902-I1065 HydrophobicContact CB-CD1 4.01Å; I902-I1065 HydrophobicContact CB-CG1 4.49Å; I902-I1065 HydrophobicContact CD1-CD1 4.15Å; I902-I1065 HydrophobicContact CG2-CD1 4.4Å
903	L	93.4	Very high	90.4	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-66.8	-17.4	-178.4	-55.1	-172.5	0	0	0	113	P896 S901 H905 L906 V912 T913 L935 H1030 A1032	P896-L903 HydrophobicContact CB-CB 4.45Å; S901-L903 PolarHBondContact O-N 3.22Å; S901-L903 PolarHBondContact OG-N 3.29Å; L903-H905 PolarHBondContact O-N 2.93Å; L903-L906 HydrophobicContact CD2-CD1 3.93Å; L903-L906 WeakPolarHBondContact O-CB 2.98Å; L903-L906 PolarHBondContact O-N 2.79Å; L903-V912 HydrophobicContact CD1-CG1 4.09Å; L903-T913 HydrophobicContact CB-CG2 4.16Å; L903-L935 HydrophobicContact CD1-CD2 4.44Å; L903-L935 HydrophobicContact CD2-CD2 4.01Å; L903-H1030 HydrophobicContact CD1-CB 4.07Å; L903-A1032 HydrophobicContact CD2-CB 3.83Å; L903-A1032 HydrophobicContact CG-CB 3.99Å
904	R	91.9	Very high	90.4	Very high	63 Å²	63	31.4 Å²	31.4	24%	0.238	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-53.9	-24.6	172.7	89.9	-169.7	81.8	141.6	14.4	113.3	P896 N898 T899 S901 I902	P896-R904 PolarHBondContact O-N 3.12Å; P896-R904 VanDerWaalsContact O-N 3.08Å; N898-R904 PolarHBondContact O-NE 2.86Å; N898-R904 PolarHBondContact O-NH2 2.87Å; T899-R904 VanDerWaalsContact O-CZ 3.28Å; T899-R904 PolarHBondContact O-NH1 3.15Å; T899-R904 PolarHBondContact O-NH2 2.72Å; S901-R904 VanDerWaalsContact C-NH2 3.34Å; S901-R904 PolarHBondContact O-NE 3.45Å; S901-R904 PolarHBondContact O-NH2 3.05Å; I902-R904 PolarHBondContact O-N 3.04Å; I902-R904 VanDerWaalsContact O-N 3.16Å
905	H	90.5	Very high	90.4	Very high	24 Å²	24	29.6 Å²	29.6	11%	0.111	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-84.1	-6.8	-179.2	-60.6	-87.3	0	0	0	113.7	I902 L903 L1061 Q1064 I1065 A1068 E1069	I902-H905 PolarHBondContact O-CD2 3.4Å; I902-H905 VanDerWaalsContact O-CD2 3.27Å; I902-H905 PolarHBondContact O-N 3.27Å; L903-H905 PolarHBondContact O-N 2.93Å; H905-L1061 HydrophobicContact CB-CD1 4.04Å; H905-Q1064 HydrophobicContact CB-CB 3.93Å; H905-Q1064 PolarHBondContact ND1-O 2.83Å; H905-Q1064 WeakPolarHBondContact O-CB 3.32Å; H905-I1065 HydrophobicContact CB-CG1 4.11Å; H905-A1068 VanDerWaalsContact CE1-CB 3.45Å; H905-A1068 WeakPolarHBondContact CE1-CB 3.47Å; H905-E1069 IonicContact CE1-OE1 2.86Å; H905-E1069 PolarHBondContact CE1-OE1 3.44Å; H905-E1069 IonicContact NE2-OE1 3.17Å
906	L	87.4	Confident	90.4	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.016	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-29.5	177.6	-84.8	160.6	0	0	0	113.9	L903 V909 V912 T913 F1056 K1060 L1061	L903-L906 HydrophobicContact CD2-CD1 3.93Å; L903-L906 WeakPolarHBondContact O-CB 2.98Å; L903-L906 PolarHBondContact O-N 2.79Å; L906-V909 HydrophobicContact CB-CG2 4.25Å; L906-V912 HydrophobicContact CD1-CG1 4.24Å; L906-T913 HydrophobicContact CB-CG2 4.27Å; L906-F1056 HydrophobicContact CD1-CD1 4.16Å; L906-F1056 HydrophobicContact CD1-CD2 3.95Å; L906-F1056 HydrophobicContact CD1-CE1 4.28Å; L906-F1056 HydrophobicContact CD1-CE2 4.05Å; L906-F1056 HydrophobicContact CD1-CG 4.01Å; L906-F1056 HydrophobicContact CD1-CZ 4.22Å; L906-F1056 HydrophobicContact CD2-CB 3.62Å; L906-F1056 HydrophobicContact CD2-CD2 3.57Å; L906-F1056 HydrophobicContact CD2-CE2 4.38Å; L906-F1056 HydrophobicContact CD2-CG 3.67Å; L906-F1056 HydrophobicContact CG-CD2 4.38Å; L906-K1060 PolarHBondContact O-NZ 3.26Å; L906-L1061 HydrophobicContact CD1-CD2 4.42Å; L906-L1061 HydrophobicContact CD2-CB 4.34Å; L906-L1061 HydrophobicContact CG-CB 4.5Å; L906-L1061 HydrophobicContact CG-CD1 4.19Å
907	G	86.9	Confident	90.4	Very high	41 Å²	41	33.1 Å²	33.1	42%	0.423	21%	0.206	S	C	.	.			trans	74.6	-172.1	-161	0	0	0	0	0	111.9	V909 T913	G907-V909 PolarHBondContact O-N 3.29Å; G907-T913 WeakPolarHBondContact O-CG2 3.32Å; G907-T913 PolarHBondContact O-OG1 3.19Å; G907-T913 VanDerWaalsContact O-OG1 3.1Å
908	A	87.1	Confident	90.6	Very high	87 Å²	87	30 Å²	30	72%	0.719	19%	0.189	S	C	*	.			trans	-67.7	111.4	-175.2	0	0	0	0	0	112.3	T913 I914	A908-T913 WeakPolarHBondContact CA-OG1 3.18Å; A908-I914 HydrophobicContact CB-CD1 4.13Å; A908-I914 HydrophobicContact CB-CG1 4.41Å
909	V	88.1	Confident	90.8	Very high	19 Å²	19	29.1 Å²	29.1	12%	0.115	18%	0.184	C	C	.	.			trans	-125.6	113.9	175.8	179.5	0	0	0	0	109.2	L906 G907 G911 V912 T913 I914 P1055	L906-V909 HydrophobicContact CB-CG2 4.25Å; G907-V909 PolarHBondContact O-N 3.29Å; V909-G911 PolarHBondContact O-N 3.27Å; V909-V912 HydrophobicContact CB-CB 4.08Å; V909-V912 HydrophobicContact CG1-CB 3.82Å; V909-V912 HydrophobicContact CG1-CG2 3.91Å; V909-V912 PolarHBondContact O-N 3.46Å; V909-V912 VanDerWaalsContact O-N 3.08Å; V909-T913 HydrophobicContact CB-CG2 4.48Å; V909-T913 PolarHBondContact N-OG1 3.29Å; V909-T913 PolarHBondContact O-N 3.42Å; V909-I914 PolarHBondContact O-N 2.94Å; V909-P1055 HydrophobicContact CG1-CB 4.45Å
910	P	86.1	Confident	91.3	Very high	78 Å²	78	23.8 Å²	23.8	51%	0.506	15%	0.152	S	C	.	.	B	Isolated β-bridge	trans	-45.1	125.6	175.2	-34	38.5	0	0	0	113.2	D869 V912 I914	D869-P910 WeakPolarHBondContact OD2-CB 3.36Å; P910-V912 PolarHBondContact O-N 3.04Å; P910-V912 VanDerWaalsContact O-N 3.11Å; P910-I914 HydrophobicContact CG-CD1 4.13Å
911	G	81.4	Confident	91.7	Very high	5 Å²	5	22.5 Å²	22.5	5%	0.052	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	-14.8	179.2	0	0	0	0	0	117.4	V909 I914 H1030	V909-G911 PolarHBondContact O-N 3.27Å; G911-I914 WeakPolarHBondContact CA-O 3.39Å; G911-I914 PolarHBondContact N-O 3.26Å; G911-H1030 PolarHBondContact O-CE1 3.12Å; G911-H1030 PolarHBondContact O-ND1 3.11Å
912	V	91.2	Very high	91.8	Very high	6 Å²	6	22.5 Å²	22.5	4%	0.036	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-56.4	176.8	176.6	0	0	0	0	109.8	L903 L906 V909 P910 L935 P1055 F1056	L903-V912 HydrophobicContact CD1-CG1 4.09Å; L906-V912 HydrophobicContact CD1-CG1 4.24Å; V909-V912 HydrophobicContact CB-CB 4.08Å; V909-V912 HydrophobicContact CG1-CB 3.82Å; V909-V912 HydrophobicContact CG1-CG2 3.91Å; V909-V912 PolarHBondContact O-N 3.46Å; V909-V912 VanDerWaalsContact O-N 3.08Å; P910-V912 PolarHBondContact O-N 3.04Å; P910-V912 VanDerWaalsContact O-N 3.11Å; V912-L935 HydrophobicContact CG1-CD1 4.11Å; V912-P1055 HydrophobicContact CG2-CB 4.06Å; V912-P1055 HydrophobicContact CG2-CG 4.09Å; V912-F1056 HydrophobicContact CG1-CD1 4.18Å; V912-F1056 HydrophobicContact CG1-CE1 3.91Å; V912-F1056 HydrophobicContact CG2-CD1 4.12Å; V912-F1056 HydrophobicContact CG2-CE1 4.14Å
913	T	93.1	Very high	92	Very high	12 Å²	12	22.3 Å²	22.3	7%	0.074	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-11	177.1	76.2	0	0	0	0	113.1	P896 L903 L906 G907 A908 V909	P896-T913 HydrophobicContact CB-CG2 4.46Å; L903-T913 HydrophobicContact CB-CG2 4.16Å; L906-T913 HydrophobicContact CB-CG2 4.27Å; G907-T913 WeakPolarHBondContact O-CG2 3.32Å; G907-T913 PolarHBondContact O-OG1 3.19Å; G907-T913 VanDerWaalsContact O-OG1 3.1Å; A908-T913 WeakPolarHBondContact CA-OG1 3.18Å; V909-T913 HydrophobicContact CB-CG2 4.48Å; V909-T913 PolarHBondContact N-OG1 3.29Å; V909-T913 PolarHBondContact O-N 3.42Å
914	I	93.1	Very high	92.2	Very high	17 Å²	17	22.4 Å²	22.4	9%	0.087	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-106.1	121.9	173.3	-50.7	177.6	0	0	0	106.6	D869 T870 N871 A908 V909 P910 G911	D869-I914 WeakPolarHBondContact OD1-CG2 3.25Å; T870-I914 WeakPolarHBondContact OG1-CG2 3.13Å; N871-I914 HydrophobicContact CB-CD1 4.18Å; N871-I914 HydrophobicContact CB-CG2 3.85Å; A908-I914 HydrophobicContact CB-CD1 4.13Å; A908-I914 HydrophobicContact CB-CG1 4.41Å; V909-I914 PolarHBondContact O-N 2.94Å; P910-I914 HydrophobicContact CG-CD1 4.13Å; G911-I914 WeakPolarHBondContact CA-O 3.39Å; G911-I914 PolarHBondContact N-O 3.26Å
915	P	95.3	Very high	92.4	Very high	4 Å²	4	19.7 Å²	19.7	3%	0.026	13%	0.129	C	C	.	.	P	Polyproline II helix	trans	-59.9	144	178.5	-24	31.9	0	0	0	113.3	T870 L892 T893 T1028 V1029	T870-P915 WeakPolarHBondContact CB-O 3.37Å; T870-P915 HydrophobicContact CG2-CB 4.09Å; T870-P915 VanDerWaalsContact CG2-O 3.29Å; T870-P915 WeakPolarHBondContact CG2-O 3.2Å; T870-P915 PolarHBondContact N-O 3.46Å; T870-P915 WeakPolarHBondContact OG1-CD 3.49Å; T870-P915 PolarHBondContact OG1-O 2.8Å; L892-P915 HydrophobicContact CB-CG 4.19Å; L892-P915 WeakPolarHBondContact O-CG 3.22Å; T893-P915 HydrophobicContact CG2-CG 4.31Å; P915-T1028 WeakPolarHBondContact CA-O 3.31Å; P915-V1029 HydrophobicContact CB-CB 4.12Å; P915-V1029 HydrophobicContact CB-CG2 4.3Å; P915-V1029 HydrophobicContact CG-CB 4Å; P915-V1029 HydrophobicContact CG-CG2 3.91Å
916	W	94.2	Very high	92.6	Very high	74 Å²	74	21.5 Å²	21.5	28%	0.28	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	126.3	163.7	-79.2	115.1	0	0	0	109.6	K867 D869 N918 E1027 T1028	K867-W916 HydrophobicContact CD-CD2 4.24Å; K867-W916 HydrophobicContact CD-CE3 4.4Å; K867-W916 HydrophobicContact CD-CG 4.33Å; K867-W916 VanDerWaalsContact CE-CD2 3.44Å; K867-W916 HydrophobicContact CG-CB 4.31Å; K867-W916 HydrophobicContact CG-CD2 3.85Å; K867-W916 HydrophobicContact CG-CE3 3.56Å; K867-W916 HydrophobicContact CG-CG 4.19Å; K867-W916 HydrophobicContact CG-CZ3 4.18Å; D869-W916 HydrophobicContact CB-CE3 4.32Å; D869-W916 HydrophobicContact CB-CH2 4.28Å; D869-W916 HydrophobicContact CB-CZ3 3.85Å; W916-N918 PolarHBondContact O-ND2 3.45Å; W916-E1027 CarbonylContact O-C 3.52Å; W916-E1027 VanDerWaalsContact O-CA 3.28Å; W916-E1027 WeakPolarHBondContact O-CA 3.41Å; W916-T1028 PolarHBondContact N-O 3.37Å; W916-T1028 PolarHBondContact O-N 3.46Å
917	L	95.4	Very high	92.9	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	117.3	166.2	-179.2	70.4	0	0	0	109.4	L601 M605 K867 V868 T870 I919 V1025 E1027	L601-L917 HydrophobicContact CD1-CD1 4.2Å; L601-L917 HydrophobicContact CD1-CD2 3.84Å; L601-L917 HydrophobicContact CD2-CD1 4.49Å; L601-L917 HydrophobicContact CD2-CD2 3.71Å; L601-L917 HydrophobicContact CG-CD2 4.46Å; M605-L917 HydrophobicContact CE-CD2 4.02Å; M605-L917 HydrophobicContact SD-CD2 4.17Å; K867-L917 WeakPolarHBondContact CA-O 3.5Å; V868-L917 HydrophobicContact CB-CB 4.3Å; V868-L917 PolarHBondContact N-O 2.9Å; V868-L917 PolarHBondContact O-N 3.05Å; T870-L917 HydrophobicContact CG2-CB 4Å; L917-I919 HydrophobicContact CD2-CD1 4.28Å; L917-I919 HydrophobicContact CD2-CG1 4.5Å; L917-I919 HydrophobicContact CG-CG1 4.25Å; L917-V1025 HydrophobicContact CD1-CG1 3.77Å; L917-E1027 HydrophobicContact CB-CG 4.31Å; L917-E1027 HydrophobicContact CD1-CG 3.62Å
918	N	95.9	Very high	93.3	Very high	27 Å²	27	19.8 Å²	19.8	14%	0.144	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.6	178.8	-42.2	-87.9	0	0	0	109.6	G866 W916 S1026 T1028	G866-N918 WeakPolarHBondContact O-CA 3.29Å; W916-N918 PolarHBondContact O-ND2 3.45Å; N918-S1026 WeakPolarHBondContact CA-O 3.46Å; N918-S1026 PolarHBondContact N-O 2.6Å; N918-S1026 PolarHBondContact ND2-O 3.46Å; N918-S1026 VanDerWaalsContact ND2-O 3.15Å; N918-S1026 PolarHBondContact O-N 3.08Å; N918-T1028 PolarHBondContact ND2-OG1 3.21Å
919	I	96.8	Very high	93.5	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.015	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	112.1	-174	-52.4	168.1	0	0	0	107.5	M605 F607 L822 F825 C865 G866 V868 L917 Y1023 S1024	M605-I919 HydrophobicContact CE-CD1 3.66Å; F607-I919 HydrophobicContact CD1-CD1 3.85Å; F607-I919 HydrophobicContact CD2-CD1 4.43Å; F607-I919 HydrophobicContact CE1-CD1 3.54Å; F607-I919 HydrophobicContact CE2-CD1 4.15Å; F607-I919 HydrophobicContact CG-CD1 4.29Å; F607-I919 HydrophobicContact CZ-CB 4.3Å; F607-I919 HydrophobicContact CZ-CD1 3.7Å; F607-I919 HydrophobicContact CZ-CG2 4.01Å; L822-I919 HydrophobicContact CD1-CD1 4.02Å; L822-I919 HydrophobicContact CD1-CG2 4.09Å; F825-I919 HydrophobicContact CD1-CG2 3.83Å; F825-I919 HydrophobicContact CE1-CG2 3.63Å; F825-I919 HydrophobicContact CG-CG2 4.45Å; F825-I919 HydrophobicContact CZ-CG2 4.06Å; C865-I919 CarbonylContact C-O 3.54Å; C865-I919 WeakPolarHBondContact CA-O 3.41Å; G866-I919 PolarHBondContact N-O 3.2Å; G866-I919 PolarHBondContact O-N 3.43Å; V868-I919 HydrophobicContact CG2-CD1 4.1Å; L917-I919 HydrophobicContact CD2-CD1 4.28Å; L917-I919 HydrophobicContact CD2-CG1 4.5Å; L917-I919 HydrophobicContact CG-CG1 4.25Å; I919-Y1023 HydrophobicContact CG2-CE2 4.18Å; I919-S1024 WeakPolarHBondContact CA-O 3.38Å
920	G	96.8	Very high	93.6	Very high	4 Å²	4	19.1 Å²	19.1	4%	0.041	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	162	-175.3	0	0	0	0	0	113.3	F825 Y1023 S1024	F825-G920 WeakPolarHBondContact CE1-O 3.36Å; G920-Y1023 VanDerWaalsContact O-CA 3.3Å; G920-Y1023 WeakPolarHBondContact O-CA 3.4Å; G920-S1024 PolarHBondContact N-O 3.14Å; G920-S1024 PolarHBondContact O-N 3.24Å
921	M	96.1	Very high	93.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.094	C	C	.	.			trans	-125.6	-176.5	162.9	68.4	-178.7	56.2	0	0	110.1	F825 T828 A829 I832 V863 H864 F923 S924 C1020 G1022	F825-M921 HydrophobicContact CD1-CE 4.41Å; F825-M921 HydrophobicContact CD2-CE 4.19Å; F825-M921 HydrophobicContact CE1-CB 4.3Å; F825-M921 HydrophobicContact CE1-CE 3.95Å; F825-M921 HydrophobicContact CE2-CE 3.73Å; F825-M921 HydrophobicContact CZ-CB 4.34Å; F825-M921 HydrophobicContact CZ-CE 3.6Å; T828-M921 HydrophobicContact CG2-CE 4.17Å; A829-M921 HydrophobicContact CB-CB 3.44Å; A829-M921 VanDerWaalsContact CB-CB 3.44Å; A829-M921 HydrophobicContact CB-CE 4.01Å; I832-M921 HydrophobicContact CD1-SD 3.54Å; I832-M921 VanDerWaalsContact CD1-SD 3.54Å; V863-M921 HydrophobicContact CB-CG 4.09Å; V863-M921 HydrophobicContact CB-SD 4.01Å; H864-M921 HydrophobicContact CB-CE 3.72Å; H864-M921 HydrophobicContact CB-SD 4.39Å; H864-M921 PolarHBondContact N-SD 2.76Å; H864-M921 VanDerWaalsContact N-SD 3.38Å; H864-M921 WeakPolarHBondContact O-CE 3.48Å; H864-M921 VanDerWaalsContact O-CG 3.31Å; H864-M921 WeakPolarHBondContact O-CG 3.5Å; M921-F923 PolarHBondContact O-N 2.95Å; M921-S924 WeakPolarHBondContact CG-OG 3.17Å; M921-S924 PolarHBondContact N-OG 2.94Å; M921-S924 VanDerWaalsContact O-CB 3.25Å; M921-S924 WeakPolarHBondContact O-CB 3.34Å; M921-S924 PolarHBondContact O-N 3.07Å; M921-S924 PolarHBondContact O-OG 3.02Å; M921-C1020 WeakPolarHBondContact O-CB 3.41Å; M921-G1022 CarbonylContact C-O 3.46Å; M921-G1022 WeakPolarHBondContact CA-O 3.47Å
922	V	96	Very high	94	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	136.6	177.2	68	0	0	0	0	110.9	I832 M833 F837 I846 S924 C1020	I832-V922 HydrophobicContact CG2-CG1 3.77Å; M833-V922 HydrophobicContact CB-CG1 4.4Å; M833-V922 HydrophobicContact SD-CB 3.73Å; M833-V922 HydrophobicContact SD-CG1 4.05Å; M833-V922 HydrophobicContact SD-CG2 3.76Å; F837-V922 HydrophobicContact CE2-CG2 4.03Å; I846-V922 HydrophobicContact CG2-CG2 3.87Å; V922-S924 PolarHBondContact O-N 3.04Å; V922-S924 VanDerWaalsContact O-N 3.12Å; V922-C1020 WeakPolarHBondContact CA-O 3.44Å
923	F	96.6	Very high	93.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	-2.1	-173.6	-46.5	-45.4	0	0	0	116.5	I614 C836 F837 I846 E849 Y850 L853 V861 V863 M921 T925 C1020	I614-F923 HydrophobicContact CD1-CB 4.16Å; I614-F923 VanDerWaalsContact CD1-O 3.31Å; I614-F923 WeakPolarHBondContact CD1-O 3.5Å; I614-F923 HydrophobicContact CG1-CB 4.01Å; C836-F923 HydrophobicContact CB-CE2 4.15Å; C836-F923 HydrophobicContact CB-CZ 4.42Å; F837-F923 HydrophobicContact CE2-CE1 4.28Å; F837-F923 AromaticContact CE2-CZ 3.78Å; F837-F923 HydrophobicContact CE2-CZ 3.78Å; F837-F923 HydrophobicContact CZ-CE1 4.15Å; F837-F923 AromaticContact CZ-CZ 3.77Å; F837-F923 HydrophobicContact CZ-CZ 3.77Å; I846-F923 HydrophobicContact CG2-CD1 3.88Å; I846-F923 HydrophobicContact CG2-CE1 3.62Å; E849-F923 HydrophobicContact CB-CZ 4.28Å; E849-F923 HydrophobicContact CG-CE1 4.38Å; E849-F923 HydrophobicContact CG-CZ 3.7Å; Y850-F923 HydrophobicContact CD2-CB 3.91Å; Y850-F923 AromaticContact CD2-CD1 3.78Å; Y850-F923 HydrophobicContact CD2-CD1 3.78Å; Y850-F923 HydrophobicContact CD2-CG 4.15Å; Y850-F923 HydrophobicContact CE2-CB 4.34Å; Y850-F923 HydrophobicContact CG-CD1 4.29Å; L853-F923 HydrophobicContact CD1-CD2 4.23Å; L853-F923 HydrophobicContact CD1-CE2 3.78Å; L853-F923 HydrophobicContact CD1-CZ 4.05Å; V861-F923 HydrophobicContact CG1-CD2 4.29Å; V863-F923 HydrophobicContact CG1-CB 4.31Å; M921-F923 PolarHBondContact O-N 2.95Å; F923-T925 PolarHBondContact O-N 3.15Å; F923-T925 PolarHBondContact O-OG1 2.87Å; F923-C1020 PolarHBondContact N-O 2.85Å
924	S	96.8	Very high	93.8	Very high	4 Å²	4	22.3 Å²	22.3	3%	0.028	12%	0.117	C	C	.	.			trans	-56.7	127	171	-66.7	0	0	0	0	109.9	H864 M921 V922 C1020	H864-S924 PolarHBondContact O-OG 2.88Å; H864-S924 VanDerWaalsContact O-OG 3.09Å; M921-S924 WeakPolarHBondContact CG-OG 3.17Å; M921-S924 PolarHBondContact N-OG 2.94Å; M921-S924 VanDerWaalsContact O-CB 3.25Å; M921-S924 WeakPolarHBondContact O-CB 3.34Å; M921-S924 PolarHBondContact O-N 3.07Å; M921-S924 PolarHBondContact O-OG 3.02Å; V922-S924 PolarHBondContact O-N 3.04Å; V922-S924 VanDerWaalsContact O-N 3.12Å; S924-C1020 PolarHBondContact O-N 3.36Å
925	T	95.9	Very high	93.8	Very high	6 Å²	6	21.6 Å²	21.6	4%	0.037	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.6	-166	-61.8	0	0	0	0	111	Q612 L617 Y850 F923 M984 K1018 V1019	Q612-T925 PolarHBondContact NE2-O 2.79Å; Q612-T925 PolarHBondContact OE1-O 2.97Å; L617-T925 HydrophobicContact CD1-CG2 4.13Å; Y850-T925 WeakPolarHBondContact CE2-OG1 3.38Å; Y850-T925 VanDerWaalsContact OH-CG2 3.3Å; Y850-T925 WeakPolarHBondContact OH-CG2 3.46Å; Y850-T925 PolarHBondContact OH-OG1 2.88Å; F923-T925 PolarHBondContact O-N 3.15Å; F923-T925 PolarHBondContact O-OG1 2.87Å; T925-M984 HydrophobicContact CG2-CE 3.79Å; T925-M984 HydrophobicContact CG2-CG 3.98Å; T925-M984 HydrophobicContact CG2-SD 3.79Å; T925-K1018 CarbonylContact C-O 3.57Å; T925-K1018 WeakPolarHBondContact CA-O 3.05Å; T925-V1019 HydrophobicContact CG2-CG2 4.44Å
926	S	94.7	Very high	93.8	Very high	62 Å²	62	21.6 Å²	21.6	43%	0.434	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	113.8	152.9	-54.3	0	0	0	0	107.3	S1017 K1018	S926-S1017 WeakPolarHBondContact O-CA 3.46Å; S926-S1017 WeakPolarHBondContact O-CB 3.47Å; S926-S1017 PolarHBondContact O-OG 2.88Å; S926-K1018 PolarHBondContact N-O 2.84Å; S926-K1018 PolarHBondContact O-N 3.28Å; S926-K1018 VanDerWaalsContact O-N 3.11Å
927	C	94.1	Very high	93.9	Very high	8 Å²	8	19.7 Å²	19.7	5%	0.054	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	165.4	-178.3	-61.9	0	0	0	0	111.5	S929 N982 M984	C927-S929 PolarHBondContact O-N 3.31Å; C927-S929 VanDerWaalsContact O-N 3.07Å; C927-S929 PolarHBondContact O-OG 3.48Å; C927-N982 HydrophobicContact CB-CB 4.4Å; C927-M984 HydrophobicContact CB-CG 4.45Å; C927-M984 HydrophobicContact CB-SD 4.17Å
928	W	94.1	Very high	94	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.7	117.1	173.6	-73.4	115.6	0	0	0	111	Y950 I952 L979 I985 P987 L990 V997 F1015 V1016	W928-Y950 HydrophobicContact CH2-CG 4.46Å; W928-I952 HydrophobicContact CD2-CD1 4.32Å; W928-I952 HydrophobicContact CE3-CD1 3.89Å; W928-I952 HydrophobicContact CH2-CD1 3.74Å; W928-I952 HydrophobicContact CH2-CG1 3.78Å; W928-I952 HydrophobicContact CZ2-CD1 4.2Å; W928-I952 HydrophobicContact CZ3-CD1 3.59Å; W928-I952 HydrophobicContact CZ3-CG1 3.75Å; W928-L979 HydrophobicContact CB-CD1 3.61Å; W928-L979 HydrophobicContact CB-CD2 3.9Å; W928-L979 HydrophobicContact CB-CG 3.52Å; W928-L979 HydrophobicContact CG-CD1 3.94Å; W928-L979 HydrophobicContact CG-CD2 4.44Å; W928-L979 HydrophobicContact CG-CG 4.28Å; W928-I985 PolarHBondContact NE1-O 3.19Å; W928-P987 HydrophobicContact CZ2-CB 4.41Å; W928-L990 HydrophobicContact CZ2-CD1 4.02Å; W928-V997 HydrophobicContact CH2-CG1 3.86Å; W928-V997 HydrophobicContact CZ2-CG1 4.39Å; W928-F1015 HydrophobicContact CE3-CB 4.32Å; W928-V1016 WeakPolarHBondContact CA-O 3.31Å
929	S	91.8	Very high	94.1	Very high	47 Å²	47	18.5 Å²	18.5	33%	0.329	10%	0.1	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	161	-173.5	48.2	0	0	0	0	110.7	C927 F1015 V1016	C927-S929 PolarHBondContact O-N 3.31Å; C927-S929 VanDerWaalsContact O-N 3.07Å; C927-S929 PolarHBondContact O-OG 3.48Å; S929-F1015 WeakPolarHBondContact O-CA 3.44Å; S929-V1016 PolarHBondContact N-O 3.28Å; S929-V1016 WeakPolarHBondContact O-CG2 3.3Å; S929-V1016 PolarHBondContact O-N 2.85Å
930	R	90.8	Very high	94.2	Very high	45 Å²	45	18.7 Å²	18.7	17%	0.17	10%	0.101	C	C	.	.			trans	-134.3	150.5	179.4	-171.1	166.8	64.9	76	-48.2	108.1	Q932 H934 E957 G1013 F1015	R930-Q932 PolarHBondContact O-N 3.35Å; R930-H934 VanDerWaalsContact CZ-NE2 3.25Å; R930-H934 PolarHBondContact NH1-CD2 2.81Å; R930-H934 VanDerWaalsContact NH1-CD2 3.27Å; R930-H934 PolarHBondContact NH1-NE2 3.31Å; R930-H934 PolarHBondContact NH2-NE2 2.85Å; R930-E957 IonicContact CZ-OE1 3.88Å; R930-E957 IonicContact NE-OE1 2.66Å; R930-E957 PolarHBondContact NE-OE1 2.94Å; R930-E957 IonicContact NH2-OE1 2.89Å; R930-E957 PolarHBondContact NH2-OE1 2.74Å; R930-E957 IonicContact NH2-OE2 3.52Å; R930-G1013 VanDerWaalsContact CD-C 3.5Å; R930-G1013 WeakPolarHBondContact CD-O 3.27Å; R930-F1015 HydrophobicContact CB-CD1 3.92Å; R930-F1015 HydrophobicContact CB-CE1 3.83Å; R930-F1015 HydrophobicContact CB-CE2 4.45Å; R930-F1015 HydrophobicContact CB-CG 4.26Å; R930-F1015 HydrophobicContact CB-CZ 4.11Å
931	D	90.3	Very high	94.2	Very high	32 Å²	32	18.5 Å²	18.5	17%	0.171	10%	0.099	C	C	.	.			trans	-70.4	133.2	171.7	176.7	54.5	0	0	0	110.6	N933 H934 L935 H1030	D931-N933 PolarHBondContact O-N 3.23Å; D931-N933 PolarHBondContact OD1-ND2 3.33Å; D931-N933 VanDerWaalsContact OD1-ND2 3.1Å; D931-N933 VanDerWaalsContact OD2-C 3.22Å; D931-N933 WeakPolarHBondContact OD2-CA 3.33Å; D931-N933 WeakPolarHBondContact OD2-CB 3.46Å; D931-N933 PolarHBondContact OD2-N 3.38Å; D931-N933 PolarHBondContact OD2-ND2 3.23Å; D931-H934 PolarHBondContact O-N 3.01Å; D931-H934 VanDerWaalsContact O-N 3.14Å; D931-H934 PolarHBondContact OD2-N 3.22Å; D931-L935 WeakPolarHBondContact OD2-CB 3.27Å; D931-L935 PolarHBondContact OD2-N 2.84Å; D931-H1030 IonicContact OD1-NE2 3.33Å
932	Q	85.9	Confident	94.2	Very high	94 Å²	94	19.2 Å²	19.2	44%	0.439	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-17.6	-177	-65	-178.4	-14.7	0	0	113	R930 T1043 M1047	R930-Q932 PolarHBondContact O-N 3.35Å; Q932-T1043 WeakPolarHBondContact O-CG2 3.36Å; Q932-M1047 HydrophobicContact CB-SD 4.21Å; Q932-M1047 VanDerWaalsContact O-SD 3.33Å
933	N	87.6	Confident	94.2	Very high	9 Å²	9	22.1 Å²	22.1	5%	0.048	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	2.5	176.6	-40.8	-97.6	0	0	0	111.4	D931 L935 W1036 M1047 P1055	D931-N933 PolarHBondContact O-N 3.23Å; D931-N933 PolarHBondContact OD1-ND2 3.33Å; D931-N933 VanDerWaalsContact OD1-ND2 3.1Å; D931-N933 VanDerWaalsContact OD2-C 3.22Å; D931-N933 WeakPolarHBondContact OD2-CA 3.33Å; D931-N933 WeakPolarHBondContact OD2-CB 3.46Å; D931-N933 PolarHBondContact OD2-N 3.38Å; D931-N933 PolarHBondContact OD2-ND2 3.23Å; N933-L935 HydrophobicContact CB-CD1 3.94Å; N933-L935 HydrophobicContact CB-CG 3.94Å; N933-L935 PolarHBondContact O-N 3.45Å; N933-W1036 HydrophobicContact CB-CZ2 4.32Å; N933-W1036 WeakPolarHBondContact O-CZ2 3.46Å; N933-W1036 PolarHBondContact O-NE1 3.3Å; N933-W1036 VanDerWaalsContact O-NE1 3.1Å; N933-M1047 HydrophobicContact CB-CE 4.4Å; N933-M1047 WeakPolarHBondContact OD1-CE 3.17Å; N933-P1055 WeakPolarHBondContact OD1-CD 3.37Å
934	H	91	Very high	94	Very high	32 Å²	32	23.7 Å²	23.7	15%	0.148	14%	0.136	C	C	.	.			trans	50	29.7	-167.3	-55.6	97.1	0	0	0	113.6	R930 D931 P1012 W1036 M1039 T1043	R930-H934 VanDerWaalsContact CZ-NE2 3.25Å; R930-H934 PolarHBondContact NH1-CD2 2.81Å; R930-H934 VanDerWaalsContact NH1-CD2 3.27Å; R930-H934 PolarHBondContact NH1-NE2 3.31Å; R930-H934 PolarHBondContact NH2-NE2 2.85Å; D931-H934 PolarHBondContact O-N 3.01Å; D931-H934 VanDerWaalsContact O-N 3.14Å; D931-H934 PolarHBondContact OD2-N 3.22Å; H934-P1012 HydrophobicContact CB-CB 4.28Å; H934-P1012 VanDerWaalsContact O-CB 3.31Å; H934-P1012 WeakPolarHBondContact O-CB 3.28Å; H934-W1036 PolarHBondContact O-NE1 3.17Å; H934-M1039 HydrophobicContact CB-CG 4.04Å; H934-M1039 HydrophobicContact CB-SD 3.99Å; H934-T1043 WeakPolarHBondContact ND1-CG2 3.42Å; H934-T1043 PolarHBondContact ND1-OG1 2.9Å
935	L	93.6	Very high	94	Very high	3 Å²	3	25 Å²	25	2%	0.016	15%	0.147	C	C	.	.			trans	-72.8	133.9	175.3	-76.9	166	0	0	0	110.3	L903 V912 D931 N933 H1030 A1032 W1036 F1056	L903-L935 HydrophobicContact CD1-CD2 4.44Å; L903-L935 HydrophobicContact CD2-CD2 4.01Å; V912-L935 HydrophobicContact CG1-CD1 4.11Å; D931-L935 WeakPolarHBondContact OD2-CB 3.27Å; D931-L935 PolarHBondContact OD2-N 2.84Å; N933-L935 HydrophobicContact CB-CD1 3.94Å; N933-L935 HydrophobicContact CB-CG 3.94Å; N933-L935 PolarHBondContact O-N 3.45Å; L935-H1030 HydrophobicContact CB-CB 4.21Å; L935-H1030 VanDerWaalsContact CB-CD2 3.47Å; L935-H1030 WeakPolarHBondContact CB-CD2 3.32Å; L935-H1030 HydrophobicContact CD1-CB 4.18Å; L935-A1032 HydrophobicContact CD2-CB 3.78Å; L935-W1036 HydrophobicContact CD2-CD2 3.85Å; L935-W1036 VanDerWaalsContact CD2-CE2 3.4Å; L935-W1036 HydrophobicContact CD2-CE3 4.31Å; L935-W1036 HydrophobicContact CD2-CG 4.43Å; L935-W1036 HydrophobicContact CD2-CH2 3.93Å; L935-W1036 HydrophobicContact CD2-CZ2 3.46Å; L935-W1036 VanDerWaalsContact CD2-CZ2 3.46Å; L935-W1036 HydrophobicContact CD2-CZ3 4.34Å; L935-W1036 HydrophobicContact CG-CH2 4.45Å; L935-W1036 HydrophobicContact CG-CZ2 3.69Å; L935-F1056 HydrophobicContact CD1-CE1 3.98Å; L935-F1056 HydrophobicContact CD1-CZ 4.16Å
936	P	95.3	Very high	94.1	Very high	4 Å²	4	26.4 Å²	26.4	3%	0.026	15%	0.154	C	C	.	.			trans	-70	151.7	166.4	31.8	-33.2	0	0	0	110.3	C1010 P1012 H1030 F1031	P936-C1010 VanDerWaalsContact CA-O 3.27Å; P936-C1010 WeakPolarHBondContact CA-O 3.35Å; P936-C1010 WeakPolarHBondContact CB-O 3.38Å; P936-P1012 HydrophobicContact CB-CG 4.37Å; P936-H1030 WeakPolarHBondContact O-CA 3.39Å; P936-F1031 HydrophobicContact CB-CD1 4.42Å; P936-F1031 HydrophobicContact CB-CE1 3.79Å; P936-F1031 HydrophobicContact CB-CE2 4.13Å; P936-F1031 HydrophobicContact CB-CZ 3.64Å; P936-F1031 VanDerWaalsContact CD-O 3.28Å; P936-F1031 WeakPolarHBondContact CD-O 3.49Å; P936-F1031 HydrophobicContact CG-CD1 4.41Å; P936-F1031 HydrophobicContact CG-CD2 4.07Å; P936-F1031 HydrophobicContact CG-CE1 4.15Å; P936-F1031 HydrophobicContact CG-CE2 3.81Å; P936-F1031 HydrophobicContact CG-CG 4.38Å; P936-F1031 HydrophobicContact CG-CZ 3.85Å; P936-F1031 WeakPolarHBondContact CG-O 3.36Å; P936-F1031 PolarHBondContact O-N 3.1Å
937	Y	96.6	Very high	94.2	Very high	34 Å²	34	23.4 Å²	23.4	13%	0.133	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	161.5	-179.5	73.1	-105.7	0	0	0	112.5	W949 V1009 C1010 V1016 T1028 V1029	Y937-W949 HydrophobicContact CE2-CH2 4.36Å; Y937-V1009 WeakPolarHBondContact O-CA 3.28Å; Y937-C1010 HydrophobicContact CD1-CB 3.89Å; Y937-C1010 HydrophobicContact CD2-CB 4.15Å; Y937-C1010 HydrophobicContact CE1-CB 3.63Å; Y937-C1010 HydrophobicContact CE2-CB 3.91Å; Y937-C1010 WeakPolarHBondContact CE2-SG 3.35Å; Y937-C1010 HydrophobicContact CG-CB 4.15Å; Y937-C1010 PolarHBondContact N-O 3.21Å; Y937-C1010 VanDerWaalsContact N-O 3.14Å; Y937-C1010 PolarHBondContact O-N 3.05Å; Y937-C1010 PolarHBondContact OH-SG 3.3Å; Y937-V1016 HydrophobicContact CE1-CG2 4.5Å; Y937-V1016 WeakPolarHBondContact OH-CG2 3.5Å; Y937-T1028 HydrophobicContact CD2-CG2 3.27Å; Y937-T1028 HydrophobicContact CE2-CG2 3.58Å; Y937-T1028 HydrophobicContact CG-CG2 4.07Å; Y937-V1029 WeakPolarHBondContact CA-O 3.12Å; Y937-V1029 WeakPolarHBondContact CB-O 3.48Å
938	I	97.2	Very high	94.4	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.3	174	-47.8	-168.5	0	0	0	109.2	I574 W890 L892 L895 F1007 V1008 V1009 T1028 V1029 F1031	I574-I938 HydrophobicContact CD1-CD1 3.56Å; W890-I938 HydrophobicContact CZ3-CD1 4.4Å; L892-I938 HydrophobicContact CD2-CB 4.1Å; L892-I938 HydrophobicContact CD2-CG2 4.21Å; L895-I938 HydrophobicContact CD2-CB 4.31Å; L895-I938 HydrophobicContact CD2-CD1 3.59Å; L895-I938 HydrophobicContact CD2-CG1 3.91Å; I938-F1007 HydrophobicContact CG2-CB 4.02Å; I938-F1007 HydrophobicContact CG2-CD1 3.65Å; I938-F1007 HydrophobicContact CG2-CG 4.29Å; I938-V1008 CarbonylContact C-O 3.46Å; I938-V1008 WeakPolarHBondContact CA-O 3.29Å; I938-V1009 HydrophobicContact CD1-CG2 4.11Å; I938-V1009 HydrophobicContact CG1-CG1 4.38Å; I938-V1009 HydrophobicContact CG1-CG2 4.08Å; I938-V1009 HydrophobicContact CG2-CG2 4.18Å; I938-T1028 VanDerWaalsContact O-CA 3.31Å; I938-T1028 WeakPolarHBondContact O-CA 3.49Å; I938-V1029 PolarHBondContact N-O 3.06Å; I938-V1029 PolarHBondContact O-N 2.81Å; I938-F1031 HydrophobicContact CD1-CD1 4.25Å; I938-F1031 HydrophobicContact CD1-CE1 4.05Å; I938-F1031 HydrophobicContact CG1-CD1 3.76Å; I938-F1031 HydrophobicContact CG1-CE1 3.52Å
939	D	98.1	Very high	94.6	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.011	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	133.7	167.8	-174.4	-84.9	0	0	0	110.3	W949 Q1002 F1007 V1008 K1018 E1027 T1028	D939-W949 HydrophobicContact CB-CH2 3.95Å; D939-W949 HydrophobicContact CB-CZ2 3.76Å; D939-Q1002 PolarHBondContact O-NE2 2.69Å; D939-Q1002 PolarHBondContact OD1-NE2 2.93Å; D939-Q1002 PolarHBondContact OD1-OE1 3.01Å; D939-F1007 CarbonylContact O-C 3.58Å; D939-F1007 VanDerWaalsContact O-CA 3.25Å; D939-F1007 WeakPolarHBondContact O-CA 3.27Å; D939-V1008 PolarHBondContact N-O 3Å; D939-V1008 PolarHBondContact O-N 3.09Å; D939-K1018 IonicContact OD1-NZ 2.72Å; D939-K1018 PolarHBondContact OD1-NZ 3.19Å; D939-K1018 IonicContact OD2-NZ 2.69Å; D939-K1018 PolarHBondContact OD2-NZ 3.03Å; D939-E1027 CarbonylContact C-O 3.59Å; D939-E1027 VanDerWaalsContact CA-O 3.23Å; D939-E1027 WeakPolarHBondContact CA-O 3.46Å; D939-T1028 HydrophobicContact CB-CG2 4.21Å; D939-T1028 PolarHBondContact OD2-OG1 2.85Å
940	Y	98.3	Very high	94.9	Very high	7 Å²	7	21.1 Å²	21.1	3%	0.027	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.1	174.5	179.7	-105.1	0	0	0	110.8	W595 P597 F877 H942 G1005 F1007 S1026 E1027	W595-Y940 AromaticContact NE1-CE2 3.57Å; W595-Y940 AromaticContact NE1-CZ 3.69Å; W595-Y940 PolarHBondContact NE1-OH 2.84Å; P597-Y940 HydrophobicContact CG-CE1 4.16Å; P597-Y940 WeakPolarHBondContact CG-OH 3.48Å; F877-Y940 AromaticContact CE1-CD1 3.92Å; F877-Y940 HydrophobicContact CE1-CD1 3.92Å; F877-Y940 AromaticContact CE1-CE1 3.94Å; F877-Y940 HydrophobicContact CE1-CE1 3.94Å; F877-Y940 AromaticContact CE2-CD1 3.96Å; F877-Y940 HydrophobicContact CE2-CD1 3.96Å; F877-Y940 HydrophobicContact CE2-CG 4.43Å; F877-Y940 AromaticContact CZ-CD1 3.29Å; F877-Y940 HydrophobicContact CZ-CD1 3.29Å; F877-Y940 AromaticContact CZ-CE1 3.81Å; F877-Y940 HydrophobicContact CZ-CE1 3.81Å; F877-Y940 AromaticContact CZ-CG 3.69Å; F877-Y940 HydrophobicContact CZ-CG 3.69Å; Y940-H942 AromaticContact CD1-CD2 3.7Å; Y940-H942 AromaticContact CD1-CE1 3.71Å; Y940-H942 AromaticContact CD1-CG 3.79Å; Y940-H942 AromaticContact CD1-ND1 3.81Å; Y940-H942 AromaticContact CD1-NE2 3.66Å; Y940-H942 HydrophobicContact CE1-CB 4.37Å; Y940-H942 AromaticContact CE1-CE1 3.95Å; Y940-H942 AromaticContact CE1-CG 3.86Å; Y940-H942 AromaticContact CE1-ND1 3.68Å; Y940-H942 PolarHBondContact O-N 2.8Å; Y940-G1005 WeakPolarHBondContact CE2-O 2.97Å; Y940-F1007 AromaticContact CD2-CD1 3.51Å; Y940-F1007 HydrophobicContact CD2-CD1 3.51Å; Y940-F1007 AromaticContact CD2-CD2 3.83Å; Y940-F1007 HydrophobicContact CD2-CD2 3.83Å; Y940-F1007 AromaticContact CD2-CE1 3.36Å; Y940-F1007 HydrophobicContact CD2-CE1 3.36Å; Y940-F1007 AromaticContact CD2-CE2 3.67Å; Y940-F1007 HydrophobicContact CD2-CE2 3.67Å; Y940-F1007 AromaticContact CD2-CG 3.75Å; Y940-F1007 HydrophobicContact CD2-CG 3.75Å; Y940-F1007 AromaticContact CD2-CZ 3.45Å; Y940-F1007 HydrophobicContact CD2-CZ 3.45Å; Y940-F1007 VanDerWaalsContact CD2-CZ 3.45Å; Y940-F1007 HydrophobicContact CE2-CD2 4.17Å; Y940-F1007 HydrophobicContact CE2-CE1 4.13Å; Y940-F1007 AromaticContact CE2-CE2 3.74Å; Y940-F1007 HydrophobicContact CE2-CE2 3.74Å; Y940-F1007 AromaticContact CE2-CZ 3.72Å; Y940-F1007 HydrophobicContact CE2-CZ 3.72Å; Y940-F1007 HydrophobicContact CG-CD1 4Å; Y940-F1007 AromaticContact CG-CE1 3.78Å; Y940-F1007 HydrophobicContact CG-CE1 3.78Å; Y940-F1007 HydrophobicContact CG-CZ 4.2Å; Y940-S1026 CarbonylContact O-C 3.59Å; Y940-S1026 WeakPolarHBondContact O-CA 3.42Å; Y940-S1026 WeakPolarHBondContact O-CB 3.47Å; Y940-E1027 PolarHBondContact N-O 3.37Å; Y940-E1027 PolarHBondContact O-N 3.47Å
941	L	98.1	Very high	95.1	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	99.1	177.1	179.7	57.3	0	0	0	109.5	C947 Q1002 S1004 G1005 Q1006	L941-C947 HydrophobicContact CD2-CB 4.5Å; L941-Q1002 HydrophobicContact CB-CG 3.89Å; L941-Q1002 HydrophobicContact CD2-CG 4.1Å; L941-Q1002 WeakPolarHBondContact CD2-O 3.39Å; L941-S1004 WeakPolarHBondContact O-CA 3.46Å; L941-G1005 PolarHBondContact O-N 3.25Å; L941-Q1006 PolarHBondContact N-O 3.38Å
942	H	96.2	Very high	95.4	Very high	14 Å²	14	17.5 Å²	17.5	7%	0.065	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	-51.3	-177.7	-71	-98.5	0	0	0	112.1	C599 G876 F877 Y940 S1004 V1025 E1027	C599-H942 HydrophobicContact CB-CB 4.02Å; G876-H942 PolarHBondContact O-CE1 2.76Å; G876-H942 PolarHBondContact O-ND1 2.62Å; G876-H942 VanDerWaalsContact O-ND1 3.07Å; F877-H942 AromaticContact CD2-CE1 3.39Å; F877-H942 WeakPolarHBondContact CD2-CE1 3.48Å; F877-H942 AromaticContact CD2-NE2 3.7Å; F877-H942 AromaticContact CE2-CE1 3.42Å; F877-H942 VanDerWaalsContact CE2-CE1 3.42Å; F877-H942 WeakPolarHBondContact CE2-CE1 3.49Å; F877-H942 AromaticContact CE2-NE2 3.46Å; F877-H942 WeakPolarHBondContact CE2-NE2 3.48Å; F877-H942 AromaticContact CG-CE1 3.7Å; F877-H942 AromaticContact CZ-CE1 3.78Å; F877-H942 PolarHBondContact N-CE1 2.89Å; Y940-H942 AromaticContact CD1-CD2 3.7Å; Y940-H942 AromaticContact CD1-CE1 3.71Å; Y940-H942 AromaticContact CD1-CG 3.79Å; Y940-H942 AromaticContact CD1-ND1 3.81Å; Y940-H942 AromaticContact CD1-NE2 3.66Å; Y940-H942 HydrophobicContact CE1-CB 4.37Å; Y940-H942 AromaticContact CE1-CE1 3.95Å; Y940-H942 AromaticContact CE1-CG 3.86Å; Y940-H942 AromaticContact CE1-ND1 3.68Å; Y940-H942 PolarHBondContact O-N 2.8Å; H942-S1004 PolarHBondContact O-OG 2.69Å; H942-S1004 VanDerWaalsContact O-OG 3.06Å; H942-V1025 WeakPolarHBondContact CB-O 3.47Å; H942-V1025 PolarHBondContact N-O 3.26Å; H942-E1027 WeakPolarHBondContact NE2-CG 3.31Å
943	T	95.2	Very high	95.8	Very high	61 Å²	61	13.1 Å²	13.1	37%	0.374	8%	0.08	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	161.7	-171.1	-172.1	0	0	0	0	111.9	C599 S1004 V1025	C599-T943 HydrophobicContact CB-CG2 4.48Å; T943-S1004 WeakPolarHBondContact CA-OG 3.11Å; T943-V1025 HydrophobicContact CG2-CB 3.92Å; T943-V1025 HydrophobicContact CG2-CG2 4.2Å; T943-V1025 PolarHBondContact N-O 3.36Å; T943-V1025 PolarHBondContact O-N 3.44Å
944	G	93.8	Very high	96.1	Very high	34 Å²	34	14.3 Å²	14.3	35%	0.351	9%	0.091	S	C	.	.	E	Extended strand (participates in β ladder)	trans	104.6	-158.8	180	0	0	0	0	0	113.5	Y1023	G944-Y1023 CarbonylContact C-O 3.6Å; G944-Y1023 WeakPolarHBondContact CA-O 3.32Å
945	A	95.9	Very high	96.2	Very high	31 Å²	31	18.4 Å²	18.4	26%	0.256	11%	0.11	S	C	.	.	S	Bend	trans	-77.5	158.9	176.9	0	0	0	0	0	112	C1021 Y1023	A945-C1021 HydrophobicContact CB-CB 4.23Å; A945-Y1023 PolarHBondContact N-O 3.14Å
946	D	97.4	Very high	96.2	Very high	35 Å²	35	18.4 Å²	18.4	19%	0.187	11%	0.111	C	C	.	.			trans	-56.8	157.8	178.7	-69.5	0.6	0	0	0	113.1	P843 V1001 Q1002 Q1003 C1021	P843-D946 HydrophobicContact CG-CB 4.4Å; D946-V1001 HydrophobicContact CB-CG1 3.64Å; D946-Q1002 CarbonylContact C-O 3.57Å; D946-Q1002 VanDerWaalsContact CA-O 3.27Å; D946-Q1002 WeakPolarHBondContact CA-O 3.47Å; D946-Q1002 WeakPolarHBondContact CB-O 3.12Å; D946-Q1003 WeakPolarHBondContact OD1-CA 3.28Å; D946-Q1003 WeakPolarHBondContact OD1-CB 3.5Å; D946-Q1003 PolarHBondContact OD2-NE2 3.04Å; D946-C1021 HydrophobicContact CB-CB 4.49Å; D946-C1021 WeakPolarHBondContact O-CB 3.43Å; D946-C1021 PolarHBondContact O-N 3.3Å; D946-C1021 PolarHBondContact O-SG 3.07Å
947	C	97.9	Very high	96	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.3	171	-64.7	0	0	0	0	110.1	L941 V1001 Q1002 K1018 V1019	L941-C947 HydrophobicContact CD2-CB 4.5Å; C947-V1001 CarbonylContact O-C 3.54Å; C947-V1001 WeakPolarHBondContact O-CA 3.48Å; C947-Q1002 HydrophobicContact CB-CB 4.39Å; C947-Q1002 PolarHBondContact N-O 2.76Å; C947-Q1002 PolarHBondContact O-N 2.98Å; C947-K1018 HydrophobicContact CB-CG 4.11Å; C947-V1019 WeakPolarHBondContact CA-O 3.4Å
948	I	97.8	Very high	95.8	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	138.3	169.1	-57.8	149.1	0	0	0	107.5	P843 E847 Y950 V1001 K1018 V1019	P843-I948 HydrophobicContact CB-CG1 4.46Å; E847-I948 HydrophobicContact CB-CD1 3.82Å; E847-I948 HydrophobicContact CG-CD1 4.34Å; I948-Y950 HydrophobicContact CG2-CE1 3.8Å; I948-Y950 HydrophobicContact CG2-CE2 4.12Å; I948-V1001 HydrophobicContact CG1-CG2 4.41Å; I948-K1018 CarbonylContact O-C 3.57Å; I948-K1018 WeakPolarHBondContact O-CA 3.42Å; I948-V1019 PolarHBondContact N-O 3.32Å; I948-V1019 PolarHBondContact O-N 3.1Å
949	W	97.9	Very high	95.5	Very high	7 Å²	7	29.7 Å²	29.7	3%	0.027	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	143.7	176.1	-72.9	84.9	0	0	0	110.9	M586 Y937 D939 R999 T1000 V1008 S1017 K1018	M586-W949 HydrophobicContact CE-CB 3.63Å; M586-W949 HydrophobicContact CE-CD2 4.45Å; M586-W949 HydrophobicContact CE-CE3 4.17Å; M586-W949 HydrophobicContact CE-CG 4.33Å; M586-W949 HydrophobicContact SD-CE3 4Å; M586-W949 HydrophobicContact SD-CZ3 4.47Å; Y937-W949 HydrophobicContact CE2-CH2 4.36Å; D939-W949 HydrophobicContact CB-CH2 3.95Å; D939-W949 HydrophobicContact CB-CZ2 3.76Å; W949-R999 WeakPolarHBondContact O-CA 3.46Å; W949-T1000 HydrophobicContact CB-CG2 4.1Å; W949-T1000 PolarHBondContact N-O 2.97Å; W949-T1000 PolarHBondContact O-N 3.2Å; W949-V1008 HydrophobicContact CD2-CG1 4.26Å; W949-V1008 HydrophobicContact CE3-CG1 4.48Å; W949-V1008 HydrophobicContact CZ2-CB 4.28Å; W949-V1008 HydrophobicContact CZ2-CG1 4.29Å; W949-S1017 WeakPolarHBondContact CA-O 3.44Å; W949-K1018 HydrophobicContact CD2-CB 4.04Å; W949-K1018 HydrophobicContact CD2-CD 4.37Å; W949-K1018 HydrophobicContact CD2-CG 3.92Å; W949-K1018 HydrophobicContact CE3-CB 3.97Å; W949-K1018 HydrophobicContact CE3-CG 4.32Å; W949-K1018 HydrophobicContact CG-CG 4.43Å; W949-K1018 HydrophobicContact CH2-CB 4.38Å; W949-K1018 HydrophobicContact CH2-CD 3.85Å; W949-K1018 HydrophobicContact CH2-CG 4.35Å; W949-K1018 HydrophobicContact CZ2-CB 4.43Å; W949-K1018 HydrophobicContact CZ2-CD 3.43Å; W949-K1018 VanDerWaalsContact CZ2-CD 3.43Å; W949-K1018 HydrophobicContact CZ2-CG 3.93Å; W949-K1018 HydrophobicContact CZ3-CB 4.14Å; W949-K1018 HydrophobicContact CZ3-CD 4.45Å
950	Y	97.3	Very high	95.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	145.4	171.5	-42	-81	0	0	0	109.3	E847 W851 W928 I948 P987 H998 R999 V1016 S1017 V1019	E847-Y950 WeakPolarHBondContact OE1-CE1 3.25Å; E847-Y950 PolarHBondContact OE1-OH 3.41Å; W851-Y950 HydrophobicContact CZ2-CD2 4.47Å; W851-Y950 AromaticContact CZ2-CE2 3.78Å; W851-Y950 HydrophobicContact CZ2-CE2 3.78Å; W851-Y950 AromaticContact CZ2-CZ 3.91Å; W851-Y950 AromaticContact NE1-CZ 3.64Å; W851-Y950 PolarHBondContact NE1-OH 3.23Å; W928-Y950 HydrophobicContact CH2-CG 4.46Å; I948-Y950 HydrophobicContact CG2-CE1 3.8Å; I948-Y950 HydrophobicContact CG2-CE2 4.12Å; Y950-P987 HydrophobicContact CD1-CB 4.3Å; Y950-P987 HydrophobicContact CD1-CG 3.79Å; Y950-P987 HydrophobicContact CE1-CG 3.81Å; Y950-P987 HydrophobicContact CG-CG 4.33Å; Y950-H998 CarbonylContact C-O 3.57Å; Y950-H998 WeakPolarHBondContact CA-O 3.45Å; Y950-R999 HydrophobicContact CD1-CG 4.1Å; Y950-R999 HydrophobicContact CE1-CG 4.19Å; Y950-V1016 WeakPolarHBondContact O-CA 3.28Å; Y950-S1017 PolarHBondContact N-O 3.26Å; Y950-S1017 PolarHBondContact O-N 2.77Å; Y950-V1019 HydrophobicContact CE2-CG2 4.06Å
951	C	96.8	Very high	94.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	143.2	174.8	-179.1	0	0	0	0	111.8	I557 M586 V997 H998 F1015 V1016	I557-C951 HydrophobicContact CD1-CB 4.45Å; M586-C951 HydrophobicContact CB-CB 3.9Å; M586-C951 HydrophobicContact CE-CB 3.56Å; M586-C951 HydrophobicContact SD-CB 4.32Å; C951-V997 WeakPolarHBondContact O-CA 3.47Å; C951-H998 PolarHBondContact N-O 3.12Å; C951-H998 PolarHBondContact O-N 3.01Å; C951-F1015 CarbonylContact C-O 3.5Å; C951-F1015 VanDerWaalsContact CA-O 3.28Å; C951-F1015 WeakPolarHBondContact CA-O 3.34Å; C951-F1015 PolarHBondContact SG-O 3.5Å; C951-V1016 HydrophobicContact CB-CG1 4.02Å
952	I	96.3	Very high	94.3	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	121.2	170.6	-57.4	156.2	0	0	0	106.1	W928 E956 L960 L990 I995 V997 S1014 F1015	W928-I952 HydrophobicContact CD2-CD1 4.32Å; W928-I952 HydrophobicContact CE3-CD1 3.89Å; W928-I952 HydrophobicContact CH2-CD1 3.74Å; W928-I952 HydrophobicContact CH2-CG1 3.78Å; W928-I952 HydrophobicContact CZ2-CD1 4.2Å; W928-I952 HydrophobicContact CZ3-CD1 3.59Å; W928-I952 HydrophobicContact CZ3-CG1 3.75Å; I952-E956 HydrophobicContact CG2-CB 3.83Å; I952-L960 HydrophobicContact CD1-CD1 3.92Å; I952-L960 HydrophobicContact CD1-CD2 3.88Å; I952-L960 HydrophobicContact CG2-CD2 4.27Å; I952-L990 HydrophobicContact CD1-CD1 3.83Å; I952-I995 HydrophobicContact CG1-CG2 4.37Å; I952-I995 HydrophobicContact CG2-CG2 3.7Å; I952-V997 HydrophobicContact CG1-CG1 4.28Å; I952-V997 HydrophobicContact CG1-CG2 4.17Å; I952-S1014 WeakPolarHBondContact O-CA 3.34Å; I952-F1015 HydrophobicContact CB-CB 4.24Å; I952-F1015 HydrophobicContact CD1-CB 4.27Å; I952-F1015 PolarHBondContact N-O 3.49Å; I952-F1015 PolarHBondContact O-N 2.81Å
953	P	94.8	Very high	94.1	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.019	21%	0.213	C	C	.	.			trans	-61.3	154.5	178.8	-22	33.1	0	0	0	112.8	K583 E955 E956 H998	K583-P953 WeakPolarHBondContact O-CG 3.2Å; P953-E955 WeakPolarHBondContact CB-OE2 3.34Å; P953-E955 PolarHBondContact O-N 2.67Å; P953-E956 PolarHBondContact O-N 3.23Å; P953-E956 VanDerWaalsContact O-N 3.14Å; P953-H998 WeakPolarHBondContact CG-NE2 3.47Å
954	A	92.8	Very high	93.7	Very high	34 Å²	34	35.5 Å²	35.5	28%	0.281	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-58.5	-31.4	-179.6	0	0	0	0	0	113.1	E956 E957	A954-E956 PolarHBondContact O-N 2.72Å; A954-E956 VanDerWaalsContact O-N 3.15Å; A954-E957 VanDerWaalsContact O-CB 3.29Å; A954-E957 WeakPolarHBondContact O-CB 3.46Å; A954-E957 PolarHBondContact O-N 2.7Å; A954-E957 VanDerWaalsContact O-N 3.1Å
955	E	93.6	Very high	93.3	Very high	117 Å²	117	37.9 Å²	37.9	55%	0.547	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-65.9	-14.1	-179.5	-56.4	93	146.5	0	0	113.7	P953	P953-E955 WeakPolarHBondContact CB-OE2 3.34Å; P953-E955 PolarHBondContact O-N 2.67Å
956	E	93.8	Very high	92.8	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.019	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-96.5	-3	176.6	-61	-64.8	150.8	0	0	113	I952 P953 A954 N958 K959 L960 I995 K996	I952-E956 HydrophobicContact CG2-CB 3.83Å; P953-E956 PolarHBondContact O-N 3.23Å; P953-E956 VanDerWaalsContact O-N 3.14Å; A954-E956 PolarHBondContact O-N 2.72Å; A954-E956 VanDerWaalsContact O-N 3.15Å; E956-N958 PolarHBondContact O-N 3.36Å; E956-K959 VanDerWaalsContact CD-NZ 3.31Å; E956-K959 PolarHBondContact O-N 3.14Å; E956-K959 VanDerWaalsContact O-N 3.09Å; E956-K959 IonicContact OE1-NZ 2.68Å; E956-K959 PolarHBondContact OE1-NZ 3.43Å; E956-K959 VanDerWaalsContact OE1-NZ 3.15Å; E956-K959 WeakPolarHBondContact OE2-CD 3.35Å; E956-K959 WeakPolarHBondContact OE2-CE 3.45Å; E956-K959 IonicContact OE2-NZ 3.41Å; E956-K959 PolarHBondContact OE2-NZ 2.98Å; E956-L960 WeakPolarHBondContact O-CB 3.38Å; E956-L960 PolarHBondContact O-N 2.82Å; E956-I995 HydrophobicContact CB-CG2 4.37Å; E956-K996 HydrophobicContact CG-CB 4.2Å; E956-K996 HydrophobicContact CG-CG 4.38Å; E956-K996 IonicContact OE1-NZ 3.45Å; E956-K996 PolarHBondContact OE1-NZ 2.81Å
957	E	91	Very high	92.1	Very high	44 Å²	44	41.3 Å²	41.3	21%	0.206	22%	0.215	C	C	.	.	H	α-helix	trans	-53.2	-45.7	-172.9	-179.4	162	-132	0	0	113.4	R930 A954 K959 L960 E961 L976 F1015	R930-E957 IonicContact CZ-OE1 3.88Å; R930-E957 IonicContact NE-OE1 2.66Å; R930-E957 PolarHBondContact NE-OE1 2.94Å; R930-E957 IonicContact NH2-OE1 2.89Å; R930-E957 PolarHBondContact NH2-OE1 2.74Å; R930-E957 IonicContact NH2-OE2 3.52Å; A954-E957 VanDerWaalsContact O-CB 3.29Å; A954-E957 WeakPolarHBondContact O-CB 3.46Å; A954-E957 PolarHBondContact O-N 2.7Å; A954-E957 VanDerWaalsContact O-N 3.1Å; E957-K959 PolarHBondContact O-N 3.08Å; E957-L960 WeakPolarHBondContact O-CB 3.42Å; E957-L960 PolarHBondContact O-N 3.05Å; E957-E961 PolarHBondContact O-N 3.15Å; E957-L976 HydrophobicContact CG-CD1 3.58Å; E957-F1015 HydrophobicContact CG-CE2 4.1Å; E957-F1015 WeakPolarHBondContact OE1-CE2 3.27Å
958	N	90.9	Very high	91.2	Very high	132 Å²	132	41.8 Å²	41.8	71%	0.706	22%	0.217	S	C	*	.	H	α-helix	trans	-61.6	-43.9	178.9	-63.7	-35.7	0	0	0	112.5	E956 L960 E961 D962	E956-N958 PolarHBondContact O-N 3.36Å; N958-L960 VanDerWaalsContact C-N 3.35Å; N958-E961 PolarHBondContact O-N 2.97Å; N958-D962 PolarHBondContact O-N 3.1Å
959	K	92.6	Very high	90	Very high	99 Å²	99	47.2 Å²	47.2	43%	0.43	24%	0.243	S	C	.	.	H	α-helix	trans	-71	-35.6	178.3	-56.2	-174	-148.8	148.9	0	111.1	E956 E957 E961 D962 V963 I995	E956-K959 VanDerWaalsContact CD-NZ 3.31Å; E956-K959 PolarHBondContact O-N 3.14Å; E956-K959 VanDerWaalsContact O-N 3.09Å; E956-K959 IonicContact OE1-NZ 2.68Å; E956-K959 PolarHBondContact OE1-NZ 3.43Å; E956-K959 VanDerWaalsContact OE1-NZ 3.15Å; E956-K959 WeakPolarHBondContact OE2-CD 3.35Å; E956-K959 WeakPolarHBondContact OE2-CE 3.45Å; E956-K959 IonicContact OE2-NZ 3.41Å; E956-K959 PolarHBondContact OE2-NZ 2.98Å; E957-K959 PolarHBondContact O-N 3.08Å; K959-E961 VanDerWaalsContact C-N 3.26Å; K959-E961 PolarHBondContact O-N 3.4Å; K959-D962 PolarHBondContact O-N 3.39Å; K959-V963 WeakPolarHBondContact O-CB 3.42Å; K959-V963 WeakPolarHBondContact O-CG2 3.1Å; K959-V963 PolarHBondContact O-N 2.89Å; K959-I995 HydrophobicContact CB-CD1 3.53Å
960	L	91.9	Very high	88.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.3	-37.2	176.4	-175.6	66	0	0	0	110.3	I952 E956 E957 N958 V964 L976 L979 L990 I995 F1015	I952-L960 HydrophobicContact CD1-CD1 3.92Å; I952-L960 HydrophobicContact CD1-CD2 3.88Å; I952-L960 HydrophobicContact CG2-CD2 4.27Å; E956-L960 WeakPolarHBondContact O-CB 3.38Å; E956-L960 PolarHBondContact O-N 2.82Å; E957-L960 WeakPolarHBondContact O-CB 3.42Å; E957-L960 PolarHBondContact O-N 3.05Å; N958-L960 VanDerWaalsContact C-N 3.35Å; L960-V964 HydrophobicContact CD1-CG2 3.65Å; L960-V964 HydrophobicContact CG-CG2 3.97Å; L960-V964 WeakPolarHBondContact O-CB 3.47Å; L960-V964 WeakPolarHBondContact O-CG2 3.36Å; L960-V964 PolarHBondContact O-N 3.43Å; L960-L976 HydrophobicContact CB-CD2 4.06Å; L960-L976 HydrophobicContact CD2-CD2 3.82Å; L960-L976 HydrophobicContact CG-CD2 3.73Å; L960-L979 HydrophobicContact CD1-CD2 4.44Å; L960-L979 HydrophobicContact CD2-CD2 3.91Å; L960-L979 HydrophobicContact CG-CD2 4.31Å; L960-L990 HydrophobicContact CD1-CD2 4.03Å; L960-I995 HydrophobicContact CB-CD1 4.44Å; L960-I995 HydrophobicContact CD1-CG1 4.48Å; L960-I995 HydrophobicContact CD1-CG2 4.36Å; L960-F1015 HydrophobicContact CD2-CB 4.33Å; L960-F1015 HydrophobicContact CD2-CD1 4.46Å; L960-F1015 HydrophobicContact CD2-CD2 3.65Å; L960-F1015 HydrophobicContact CD2-CE2 4.02Å; L960-F1015 HydrophobicContact CD2-CG 3.9Å
961	E	89.7	Confident	86.6	Confident	68 Å²	68	52.9 Å²	52.9	32%	0.318	27%	0.274	S	S	.	.	H	α-helix	trans	-59.8	-53.5	173.1	-175.3	142.5	-131.1	0	0	112.1	E957 N958 K959 V963 V964 H965 P974 G975 L976	E957-E961 PolarHBondContact O-N 3.15Å; N958-E961 PolarHBondContact O-N 2.97Å; K959-E961 VanDerWaalsContact C-N 3.26Å; K959-E961 PolarHBondContact O-N 3.4Å; E961-V963 PolarHBondContact O-N 3.43Å; E961-V964 PolarHBondContact O-N 3.37Å; E961-H965 WeakPolarHBondContact O-CB 3.2Å; E961-H965 PolarHBondContact O-N 3.31Å; E961-P974 VanDerWaalsContact OE1-CB 3.3Å; E961-P974 WeakPolarHBondContact OE1-CB 3.19Å; E961-G975 PolarHBondContact OE1-N 3.11Å; E961-L976 HydrophobicContact CB-CD1 4.05Å; E961-L976 HydrophobicContact CB-CD2 4.23Å; E961-L976 HydrophobicContact CB-CG 3.8Å; E961-L976 HydrophobicContact CG-CG 4.22Å
962	D	87.9	Confident	84.9	Confident	114 Å²	114	56.4 Å²	56.4	61%	0.61	31%	0.31	S	S	*	.	H	α-helix	trans	-59.9	-46.7	179.4	-72.1	-33.2	0	0	0	112.6	N958 K959 T966	N958-D962 PolarHBondContact O-N 3.1Å; K959-D962 PolarHBondContact O-N 3.39Å; D962-T966 WeakPolarHBondContact O-CB 3.25Å; D962-T966 PolarHBondContact O-N 3.22Å; D962-T966 PolarHBondContact O-OG1 2.83Å
963	V	90.6	Very high	83.5	Confident	23 Å²	23	58 Å²	58	14%	0.139	32%	0.32	C	S	.	.	H	α-helix	trans	-65.7	-44	179.8	166.6	0	0	0	0	110.5	K959 E961 T966 L967 L990 E993 I995	K959-V963 WeakPolarHBondContact O-CB 3.42Å; K959-V963 WeakPolarHBondContact O-CG2 3.1Å; K959-V963 PolarHBondContact O-N 2.89Å; E961-V963 PolarHBondContact O-N 3.43Å; V963-T966 PolarHBondContact O-N 3.37Å; V963-L967 HydrophobicContact CG1-CD1 3.66Å; V963-L967 HydrophobicContact CG1-CG 4.19Å; V963-L967 WeakPolarHBondContact O-CB 3.27Å; V963-L967 VanDerWaalsContact O-CG 3.26Å; V963-L967 WeakPolarHBondContact O-CG 3.11Å; V963-L967 PolarHBondContact O-N 3.14Å; V963-L990 HydrophobicContact CG1-CD2 4.28Å; V963-E993 HydrophobicContact CG1-CB 3.63Å; V963-E993 HydrophobicContact CG1-CG 3.96Å; V963-E993 HydrophobicContact CG2-CB 4.04Å; V963-I995 HydrophobicContact CB-CD1 4.3Å; V963-I995 HydrophobicContact CB-CG1 4.32Å; V963-I995 HydrophobicContact CG1-CG1 4.22Å; V963-I995 HydrophobicContact CG2-CD1 3.99Å; V963-I995 HydrophobicContact CG2-CG1 4.22Å
964	V	87.7	Confident	82.4	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-70.1	-42.1	179.6	174.9	0	0	0	0	111.2	L960 E961 T966 L967 L968 G975 L979 I985	L960-V964 HydrophobicContact CD1-CG2 3.65Å; L960-V964 HydrophobicContact CG-CG2 3.97Å; L960-V964 WeakPolarHBondContact O-CB 3.47Å; L960-V964 WeakPolarHBondContact O-CG2 3.36Å; L960-V964 PolarHBondContact O-N 3.43Å; E961-V964 PolarHBondContact O-N 3.37Å; V964-T966 VanDerWaalsContact C-N 3.26Å; V964-T966 PolarHBondContact O-N 3.39Å; V964-L967 PolarHBondContact O-N 3.18Å; V964-L968 HydrophobicContact CG1-CD1 3.49Å; V964-L968 VanDerWaalsContact CG1-CD1 3.49Å; V964-L968 HydrophobicContact CG1-CG 3.8Å; V964-L968 VanDerWaalsContact O-CB 3.24Å; V964-L968 WeakPolarHBondContact O-CB 3.33Å; V964-L968 WeakPolarHBondContact O-CG 3.37Å; V964-L968 PolarHBondContact O-N 3.05Å; V964-G975 WeakPolarHBondContact CG1-O 3.34Å; V964-L979 HydrophobicContact CG1-CB 4.23Å; V964-L979 HydrophobicContact CG2-CD2 4.31Å; V964-I985 HydrophobicContact CB-CD1 4.47Å; V964-I985 HydrophobicContact CG1-CD1 4.16Å; V964-I985 HydrophobicContact CG2-CD1 3.85Å
965	H	84.9	Confident	81.4	Confident	84 Å²	84	59 Å²	59	39%	0.389	32%	0.323	S	S	.	.	H	α-helix	trans	-56.4	-43.7	174.6	-178.2	-80.4	0	0	0	111.1	E961 Q969 A970	E961-H965 WeakPolarHBondContact O-CB 3.2Å; E961-H965 PolarHBondContact O-N 3.31Å; H965-Q969 PolarHBondContact O-N 2.87Å; H965-A970 HydrophobicContact CB-CB 4.45Å; H965-A970 PolarHBondContact NE2-O 2.71Å; H965-A970 PolarHBondContact O-N 2.9Å; H965-A970 VanDerWaalsContact O-N 3.11Å
966	T	85.1	Confident	80.8	Confident	103 Å²	103	54.2 Å²	54.2	63%	0.632	30%	0.302	S	S	*	.	H	α-helix	trans	-66.6	-54	175.9	-58.1	0	0	0	0	112.5	D962 V963 V964 L968 Q969	D962-T966 WeakPolarHBondContact O-CB 3.25Å; D962-T966 PolarHBondContact O-N 3.22Å; D962-T966 PolarHBondContact O-OG1 2.83Å; V963-T966 PolarHBondContact O-N 3.37Å; V964-T966 VanDerWaalsContact C-N 3.26Å; V964-T966 PolarHBondContact O-N 3.39Å; T966-L968 PolarHBondContact O-N 3.2Å; T966-Q969 PolarHBondContact O-N 2.72Å
967	L	83.8	Confident	80	Confident	36 Å²	36	58 Å²	58	19%	0.188	32%	0.319	C	S	.	.	H	α-helix	trans	-62.7	-42.9	-177.7	-73.7	175.3	0	0	0	112.3	R619 V963 V964 Q969 I985 V989 L990 E993	R619-L967 PolarHBondContact NH1-O 2.97Å; R619-L967 PolarHBondContact NH2-O 3.08Å; V963-L967 HydrophobicContact CG1-CD1 3.66Å; V963-L967 HydrophobicContact CG1-CG 4.19Å; V963-L967 WeakPolarHBondContact O-CB 3.27Å; V963-L967 VanDerWaalsContact O-CG 3.26Å; V963-L967 WeakPolarHBondContact O-CG 3.11Å; V963-L967 PolarHBondContact O-N 3.14Å; V964-L967 PolarHBondContact O-N 3.18Å; L967-Q969 VanDerWaalsContact C-N 3.32Å; L967-I985 HydrophobicContact CD1-CD1 4.43Å; L967-I985 HydrophobicContact CD1-CG2 4.1Å; L967-V989 HydrophobicContact CD1-CG1 3.91Å; L967-V989 HydrophobicContact CD2-CG1 4.08Å; L967-L990 HydrophobicContact CD1-CD2 4.37Å; L967-E993 HydrophobicContact CD1-CG 4.26Å; L967-E993 HydrophobicContact CD2-CG 4.32Å
968	L	77.6	Confident	79.2	Confident	9 Å²	9	56.6 Å²	56.6	5%	0.047	31%	0.313	C	S	.	.	H	α-helix	trans	-82.2	-10.7	-176.9	-60.3	-167.1	0	0	0	113.2	L737 V964 T966 M978 V983 I985	L737-L968 HydrophobicContact CD1-CB 3.83Å; L737-L968 HydrophobicContact CD1-CD2 3.75Å; L737-L968 HydrophobicContact CD1-CG 4.22Å; L737-L968 WeakPolarHBondContact CD1-O 3.28Å; V964-L968 HydrophobicContact CG1-CD1 3.49Å; V964-L968 VanDerWaalsContact CG1-CD1 3.49Å; V964-L968 HydrophobicContact CG1-CG 3.8Å; V964-L968 VanDerWaalsContact O-CB 3.24Å; V964-L968 WeakPolarHBondContact O-CB 3.33Å; V964-L968 WeakPolarHBondContact O-CG 3.37Å; V964-L968 PolarHBondContact O-N 3.05Å; T966-L968 PolarHBondContact O-N 3.2Å; L968-M978 HydrophobicContact CB-CE 4.07Å; L968-M978 HydrophobicContact CD1-CB 3.74Å; L968-M978 HydrophobicContact CD1-CE 4.38Å; L968-V983 HydrophobicContact CD1-CG1 4.08Å; L968-V983 HydrophobicContact CD1-CG2 4.48Å; L968-V983 HydrophobicContact CD2-CG1 4Å; L968-I985 HydrophobicContact CD1-CD1 4.45Å; L968-I985 HydrophobicContact CD2-CD1 3.92Å; L968-I985 HydrophobicContact CD2-CG1 4.16Å; L968-I985 HydrophobicContact CG-CD1 4.19Å
969	Q	73.1	Confident	78.8	Confident	115 Å²	115	50.3 Å²	50.3	54%	0.537	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	58.4	-173.1	-63.8	174.9	-40.5	0	0	110.5	P736 H965 T966 L967 N971	P736-Q969 HydrophobicContact CG-CB 4.2Å; H965-Q969 PolarHBondContact O-N 2.87Å; T966-Q969 PolarHBondContact O-N 2.72Å; L967-Q969 VanDerWaalsContact C-N 3.32Å; Q969-N971 PolarHBondContact O-N 2.99Å; Q969-N971 VanDerWaalsContact O-N 3.11Å; Q969-N971 PolarHBondContact O-OD1 3.35Å
970	A	61.4	Low	78.2	Confident	6 Å²	6	48.2 Å²	48.2	5%	0.05	27%	0.271	C	S	.	.			trans	-72.9	102.1	-174.8	0	0	0	0	0	110.6	H965 G972 T973 M978	H965-A970 HydrophobicContact CB-CB 4.45Å; H965-A970 PolarHBondContact NE2-O 2.71Å; H965-A970 PolarHBondContact O-N 2.9Å; H965-A970 VanDerWaalsContact O-N 3.11Å; A970-G972 PolarHBondContact O-N 3.12Å; A970-T973 VanDerWaalsContact CB-O 3.25Å; A970-T973 WeakPolarHBondContact CB-O 3.02Å; A970-M978 HydrophobicContact CB-SD 3.32Å; A970-M978 WeakPolarHBondContact CB-SD 3.27Å
971	N	61.6	Low	77.3	Confident	120 Å²	120	49.5 Å²	49.5	64%	0.642	28%	0.28	S	S	*	.	S	Bend	trans	-75.8	59.8	-175.1	-75	-10.3	0	0	0	112.9	Q969	Q969-N971 PolarHBondContact O-N 2.99Å; Q969-N971 VanDerWaalsContact O-N 3.11Å; Q969-N971 PolarHBondContact O-OD1 3.35Å
972	G	61	Low	77	Confident	73 Å²	73	49.3 Å²	49.3	75%	0.753	28%	0.281	S	S	*	.	S	Bend	trans	97.8	3	-179.9	0	0	0	0	0	115.4	A970	A970-G972 PolarHBondContact O-N 3.12Å
973	T	67.3	Low	77	Confident	34 Å²	34	44 Å²	44	21%	0.209	25%	0.253	C	S	.	.	S	Bend	trans	-96.5	137.4	174.4	-56.8	0	0	0	0	109.8	A970 G975 M978	A970-T973 VanDerWaalsContact CB-O 3.25Å; A970-T973 WeakPolarHBondContact CB-O 3.02Å; T973-G975 PolarHBondContact O-N 3.37Å; T973-M978 HydrophobicContact CG2-CG 3.64Å; T973-M978 HydrophobicContact CG2-SD 4.27Å
974	P	71.4	Confident	77.1	Confident	57 Å²	57	43.1 Å²	43.1	37%	0.37	25%	0.247	S	C	.	.			trans	-57.4	137.1	175.4	-25.6	35.4	0	0	0	112.2	E961 L976 Q977 M978	E961-P974 VanDerWaalsContact OE1-CB 3.3Å; E961-P974 WeakPolarHBondContact OE1-CB 3.19Å; P974-L976 PolarHBondContact O-N 2.86Å; P974-Q977 HydrophobicContact CB-CB 4.27Å; P974-Q977 PolarHBondContact O-N 2.95Å; P974-Q977 VanDerWaalsContact O-N 3.16Å; P974-M978 PolarHBondContact O-N 2.81Å
975	G	72.8	Confident	77.3	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-46	-172	0	0	0	0	0	112.3	E961 V964 T973 Q977 M978 L979	E961-G975 PolarHBondContact OE1-N 3.11Å; V964-G975 WeakPolarHBondContact CG1-O 3.34Å; T973-G975 PolarHBondContact O-N 3.37Å; G975-Q977 VanDerWaalsContact C-N 3.31Å; G975-Q977 PolarHBondContact O-N 3.47Å; G975-M978 WeakPolarHBondContact O-CB 3.43Å; G975-M978 PolarHBondContact O-N 2.96Å; G975-M978 VanDerWaalsContact O-N 3.11Å; G975-L979 PolarHBondContact O-N 2.71Å; G975-L979 VanDerWaalsContact O-N 3.08Å
976	L	81.3	Confident	77.7	Confident	18 Å²	18	40.1 Å²	40.1	9%	0.094	23%	0.234	C	C	.	.	H	α-helix	trans	-62.9	-36.6	-179.8	-58.2	177.7	0	0	0	112.4	E957 L960 E961 P974 M978 L979 E980 F1015	E957-L976 HydrophobicContact CG-CD1 3.58Å; L960-L976 HydrophobicContact CB-CD2 4.06Å; L960-L976 HydrophobicContact CD2-CD2 3.82Å; L960-L976 HydrophobicContact CG-CD2 3.73Å; E961-L976 HydrophobicContact CB-CD1 4.05Å; E961-L976 HydrophobicContact CB-CD2 4.23Å; E961-L976 HydrophobicContact CB-CG 3.8Å; E961-L976 HydrophobicContact CG-CG 4.22Å; P974-L976 PolarHBondContact O-N 2.86Å; L976-M978 VanDerWaalsContact C-N 3.29Å; L976-M978 PolarHBondContact O-N 3.14Å; L976-L979 WeakPolarHBondContact O-CB 3.48Å; L976-L979 PolarHBondContact O-N 3.12Å; L976-L979 VanDerWaalsContact O-N 3.11Å; L976-E980 WeakPolarHBondContact O-CG 3.47Å; L976-E980 PolarHBondContact O-N 2.71Å; L976-F1015 HydrophobicContact CB-CZ 4.2Å; L976-F1015 HydrophobicContact CD1-CE2 4.45Å; L976-F1015 HydrophobicContact CD1-CZ 4.22Å; L976-F1015 HydrophobicContact CD2-CE2 4.11Å; L976-F1015 HydrophobicContact CD2-CZ 3.86Å; L976-F1015 HydrophobicContact CG-CZ 4.31Å
977	Q	76.2	Confident	78	Confident	82 Å²	82	35.2 Å²	35.2	38%	0.383	20%	0.204	S	C	.	.	H	α-helix	trans	-66.3	-31.3	177	-176.8	170.6	-37.1	0	0	112	P974 G975 S981	P974-Q977 HydrophobicContact CB-CB 4.27Å; P974-Q977 PolarHBondContact O-N 2.95Å; P974-Q977 VanDerWaalsContact O-N 3.16Å; G975-Q977 VanDerWaalsContact C-N 3.31Å; G975-Q977 PolarHBondContact O-N 3.47Å; Q977-S981 PolarHBondContact O-N 3.26Å; Q977-S981 PolarHBondContact O-OG 2.92Å
978	M	75.1	Confident	78.4	Confident	15 Å²	15	35.3 Å²	35.3	7%	0.074	20%	0.204	C	C	.	.	H	α-helix	trans	-73.6	-33.7	171.1	-68.9	-173.1	64.6	0	0	112.6	L737 L968 A970 T973 P974 G975 L976 S981 V983	L737-M978 HydrophobicContact CB-CE 3.62Å; L737-M978 HydrophobicContact CD1-CE 4.31Å; L968-M978 HydrophobicContact CB-CE 4.07Å; L968-M978 HydrophobicContact CD1-CB 3.74Å; L968-M978 HydrophobicContact CD1-CE 4.38Å; A970-M978 HydrophobicContact CB-SD 3.32Å; A970-M978 WeakPolarHBondContact CB-SD 3.27Å; T973-M978 HydrophobicContact CG2-CG 3.64Å; T973-M978 HydrophobicContact CG2-SD 4.27Å; P974-M978 PolarHBondContact O-N 2.81Å; G975-M978 WeakPolarHBondContact O-CB 3.43Å; G975-M978 PolarHBondContact O-N 2.96Å; G975-M978 VanDerWaalsContact O-N 3.11Å; L976-M978 VanDerWaalsContact C-N 3.29Å; L976-M978 PolarHBondContact O-N 3.14Å; M978-S981 WeakPolarHBondContact O-CB 3.4Å; M978-S981 PolarHBondContact O-N 3.12Å; M978-V983 WeakPolarHBondContact O-CG2 3.32Å
979	L	82	Confident	79.1	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-50.4	174.6	-168.1	62.7	0	0	0	111	W928 L960 V964 G975 L976 S981 V983 I985 F1015	W928-L979 HydrophobicContact CB-CD1 3.61Å; W928-L979 HydrophobicContact CB-CD2 3.9Å; W928-L979 HydrophobicContact CB-CG 3.52Å; W928-L979 HydrophobicContact CG-CD1 3.94Å; W928-L979 HydrophobicContact CG-CD2 4.44Å; W928-L979 HydrophobicContact CG-CG 4.28Å; L960-L979 HydrophobicContact CD1-CD2 4.44Å; L960-L979 HydrophobicContact CD2-CD2 3.91Å; L960-L979 HydrophobicContact CG-CD2 4.31Å; V964-L979 HydrophobicContact CG1-CB 4.23Å; V964-L979 HydrophobicContact CG2-CD2 4.31Å; G975-L979 PolarHBondContact O-N 2.71Å; G975-L979 VanDerWaalsContact O-N 3.08Å; L976-L979 WeakPolarHBondContact O-CB 3.48Å; L976-L979 PolarHBondContact O-N 3.12Å; L976-L979 VanDerWaalsContact O-N 3.11Å; L979-S981 PolarHBondContact O-N 2.85Å; L979-S981 VanDerWaalsContact O-N 3.16Å; L979-V983 PolarHBondContact O-N 2.76Å; L979-V983 VanDerWaalsContact O-N 3.16Å; L979-I985 HydrophobicContact CD1-CD1 3.93Å; L979-I985 HydrophobicContact CD1-CG1 4.09Å; L979-F1015 HydrophobicContact CD2-CD1 4.01Å; L979-F1015 HydrophobicContact CD2-CE1 4.27Å
980	E	80.3	Confident	80	Confident	56 Å²	56	31.5 Å²	31.5	26%	0.262	19%	0.189	S	C	.	.	H	α-helix	trans	-61	-20.7	175.1	-67.1	-178.6	137.2	0	0	113.2	L976 N982 F1015	L976-E980 WeakPolarHBondContact O-CG 3.47Å; L976-E980 PolarHBondContact O-N 2.71Å; E980-N982 PolarHBondContact O-N 2.96Å; E980-F1015 HydrophobicContact CG-CE1 4.18Å
981	S	73.6	Confident	81.5	Confident	27 Å²	27	32.9 Å²	32.9	19%	0.189	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	40.1	176.3	-62.3	0	0	0	0	113.2	R620 Q977 M978 L979	R620-S981 PolarHBondContact NH2-O 2.62Å; Q977-S981 PolarHBondContact O-N 3.26Å; Q977-S981 PolarHBondContact O-OG 2.92Å; M978-S981 WeakPolarHBondContact O-CB 3.4Å; M978-S981 PolarHBondContact O-N 3.12Å; L979-S981 PolarHBondContact O-N 2.85Å; L979-S981 VanDerWaalsContact O-N 3.16Å
982	N	83.1	Confident	83	Confident	63 Å²	63	33.9 Å²	33.9	34%	0.337	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	45.2	-179.2	-57.6	-83.6	0	0	0	113.6	R620 I814 C927 E980	R620-N982 PolarHBondContact NH1-O 2.86Å; R620-N982 PolarHBondContact NH2-O 2.72Å; I814-N982 HydrophobicContact CD1-CB 4.06Å; I814-N982 WeakPolarHBondContact CD1-OD1 3.4Å; C927-N982 HydrophobicContact CB-CB 4.4Å; E980-N982 PolarHBondContact O-N 2.96Å
983	V	87.3	Confident	84.5	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.012	18%	0.184	C	C	.	.			trans	-101	135.7	176	179.2	0	0	0	0	110.9	L617 L968 M978 L979 I985	L617-V983 CarbonylContact O-C 3.54Å; L617-V983 WeakPolarHBondContact O-CA 3.48Å; L968-V983 HydrophobicContact CD1-CG1 4.08Å; L968-V983 HydrophobicContact CD1-CG2 4.48Å; L968-V983 HydrophobicContact CD2-CG1 4Å; M978-V983 WeakPolarHBondContact O-CG2 3.32Å; L979-V983 PolarHBondContact O-N 2.76Å; L979-V983 VanDerWaalsContact O-N 3.16Å; V983-I985 HydrophobicContact CG1-CG1 4.12Å
984	M	92.3	Very high	85.6	Confident	5 Å²	5	36.2 Å²	36.2	3%	0.025	20%	0.199	C	C	.	.			trans	-107.5	102.6	172.8	-73.6	-62.4	-80.8	0	0	110.2	L617 G618 Y850 W851 V854 T925 C927 S1017 V1019	L617-M984 HydrophobicContact CB-CB 3.99Å; L617-M984 HydrophobicContact CB-CG 3.93Å; L617-M984 HydrophobicContact CD1-CG 4.3Å; L617-M984 PolarHBondContact O-N 3.22Å; G618-M984 WeakPolarHBondContact CA-O 3.46Å; Y850-M984 HydrophobicContact CE1-CE 3.99Å; Y850-M984 VanDerWaalsContact OH-CE 3.25Å; Y850-M984 WeakPolarHBondContact OH-CE 3.3Å; W851-M984 HydrophobicContact CH2-CB 4.41Å; W851-M984 HydrophobicContact CH2-CE 3.44Å; W851-M984 VanDerWaalsContact CH2-CE 3.44Å; W851-M984 HydrophobicContact CZ2-CE 3.92Å; W851-M984 HydrophobicContact CZ3-CB 4.23Å; W851-M984 HydrophobicContact CZ3-CE 4.26Å; V854-M984 HydrophobicContact CG1-CB 4.31Å; T925-M984 HydrophobicContact CG2-CE 3.79Å; T925-M984 HydrophobicContact CG2-CG 3.98Å; T925-M984 HydrophobicContact CG2-SD 3.79Å; C927-M984 HydrophobicContact CB-CG 4.45Å; C927-M984 HydrophobicContact CB-SD 4.17Å; M984-S1017 VanDerWaalsContact CE-OG 3.28Å; M984-S1017 WeakPolarHBondContact CE-OG 3.41Å; M984-V1019 HydrophobicContact CE-CG2 4.24Å
985	I	92.1	Very high	86.7	Confident	14 Å²	14	33.7 Å²	33.7	7%	0.072	18%	0.182	C	C	.	.			trans	-90.5	134.2	165.7	-52.3	-179.9	0	0	0	107.7	W851 W928 V964 L967 L968 L979 V983 V989 L990	W851-I985 WeakPolarHBondContact CH2-O 3.49Å; W928-I985 PolarHBondContact NE1-O 3.19Å; V964-I985 HydrophobicContact CB-CD1 4.47Å; V964-I985 HydrophobicContact CG1-CD1 4.16Å; V964-I985 HydrophobicContact CG2-CD1 3.85Å; L967-I985 HydrophobicContact CD1-CD1 4.43Å; L967-I985 HydrophobicContact CD1-CG2 4.1Å; L968-I985 HydrophobicContact CD1-CD1 4.45Å; L968-I985 HydrophobicContact CD2-CD1 3.92Å; L968-I985 HydrophobicContact CD2-CG1 4.16Å; L968-I985 HydrophobicContact CG-CD1 4.19Å; L979-I985 HydrophobicContact CD1-CD1 3.93Å; L979-I985 HydrophobicContact CD1-CG1 4.09Å; V983-I985 HydrophobicContact CG1-CG1 4.12Å; I985-V989 HydrophobicContact CG2-CB 4.41Å; I985-V989 HydrophobicContact CG2-CG1 4.4Å; I985-L990 HydrophobicContact CB-CD1 4.47Å; I985-L990 HydrophobicContact CB-CD2 4.38Å; I985-L990 HydrophobicContact CB-CG 4.37Å; I985-L990 HydrophobicContact CD1-CD2 4.48Å; I985-L990 HydrophobicContact CG2-CD1 4.46Å; I985-L990 HydrophobicContact CG2-CD2 3.83Å; I985-L990 HydrophobicContact CG2-CG 3.85Å
986	S	92.7	Very high	87.7	Confident	7 Å²	7	38.7 Å²	38.7	5%	0.049	20%	0.204	C	C	.	.			trans	-61.5	126.6	177.3	-176.3	0	0	0	0	110.5	W851 E855 E988 V989 L990	W851-S986 VanDerWaalsContact CZ3-CA 3.46Å; E855-S986 WeakPolarHBondContact OE1-CB 3.48Å; E855-S986 PolarHBondContact OE1-OG 3.25Å; S986-E988 PolarHBondContact O-N 2.96Å; S986-V989 WeakPolarHBondContact O-CA 3.39Å; S986-V989 WeakPolarHBondContact O-CB 3.23Å; S986-V989 PolarHBondContact O-N 2.81Å; S986-L990 PolarHBondContact O-N 3.47Å; S986-L990 VanDerWaalsContact O-N 3.12Å
987	P	93.3	Very high	88.4	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.8	-25.7	-179.9	25	-32.9	0	0	0	111.7	W551 M554 W851 W928 Y950 V989 L990 C991 V997	W551-P987 HydrophobicContact CZ3-CG 4.25Å; M554-P987 HydrophobicContact CE-CB 3.78Å; M554-P987 HydrophobicContact CE-CG 3.86Å; M554-P987 HydrophobicContact SD-CB 4.11Å; M554-P987 HydrophobicContact SD-CG 4.24Å; W851-P987 HydrophobicContact CZ2-CG 3.97Å; W928-P987 HydrophobicContact CZ2-CB 4.41Å; Y950-P987 HydrophobicContact CD1-CB 4.3Å; Y950-P987 HydrophobicContact CD1-CG 3.79Å; Y950-P987 HydrophobicContact CE1-CG 3.81Å; Y950-P987 HydrophobicContact CG-CG 4.33Å; P987-V989 VanDerWaalsContact C-N 3.3Å; P987-V989 PolarHBondContact O-N 2.91Å; P987-L990 PolarHBondContact O-N 3.11Å; P987-C991 PolarHBondContact O-N 3.43Å; P987-C991 PolarHBondContact O-SG 3.02Å; P987-V997 HydrophobicContact CB-CB 4.32Å; P987-V997 HydrophobicContact CB-CG1 3.81Å; P987-V997 HydrophobicContact CB-CG2 4.41Å
988	E	91.1	Very high	89.3	Confident	38 Å²	38	34.4 Å²	34.4	18%	0.178	18%	0.184	C	C	.	.	H	α-helix	trans	-61.5	-36.5	169.1	-90.4	-155	-153.7	0	0	112.6	G550 W551 M554 S986 K992	G550-E988 WeakPolarHBondContact CA-OE1 3.46Å; W551-E988 HydrophobicContact CE3-CG 4.39Å; W551-E988 HydrophobicContact CH2-CG 4.32Å; W551-E988 HydrophobicContact CZ3-CG 4.19Å; W551-E988 PolarHBondContact N-OE1 3.09Å; M554-E988 HydrophobicContact CE-CB 4.19Å; M554-E988 HydrophobicContact CE-CG 3.66Å; M554-E988 VanDerWaalsContact CE-N 3.31Å; S986-E988 PolarHBondContact O-N 2.96Å; E988-K992 WeakPolarHBondContact O-CD 3.13Å; E988-K992 VanDerWaalsContact O-CE 3.24Å; E988-K992 WeakPolarHBondContact O-CE 2.92Å; E988-K992 WeakPolarHBondContact O-CG 3.5Å; E988-K992 PolarHBondContact O-N 3.11Å; E988-K992 IonicContact OE2-NZ 2.76Å; E988-K992 PolarHBondContact OE2-NZ 3.45Å
989	V	91.9	Very high	90.3	Very high	45 Å²	45	35.6 Å²	35.6	27%	0.273	19%	0.187	S	C	.	.	H	α-helix	trans	-71.6	-45.2	176.5	174.3	0	0	0	0	110	L967 I985 S986 P987 C991 K992 E993	L967-V989 HydrophobicContact CD1-CG1 3.91Å; L967-V989 HydrophobicContact CD2-CG1 4.08Å; I985-V989 HydrophobicContact CG2-CB 4.41Å; I985-V989 HydrophobicContact CG2-CG1 4.4Å; S986-V989 WeakPolarHBondContact O-CA 3.39Å; S986-V989 WeakPolarHBondContact O-CB 3.23Å; S986-V989 PolarHBondContact O-N 2.81Å; P987-V989 VanDerWaalsContact C-N 3.3Å; P987-V989 PolarHBondContact O-N 2.91Å; V989-C991 VanDerWaalsContact C-N 3.31Å; V989-C991 PolarHBondContact O-N 3.19Å; V989-K992 WeakPolarHBondContact O-CB 3.37Å; V989-K992 PolarHBondContact O-N 3.15Å; V989-E993 PolarHBondContact O-N 2.89Å
990	L	92.9	Very high	91	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.1	-42	176.6	-65.8	176	0	0	0	112.2	W928 I952 L960 V963 L967 I985 S986 P987 K992 E993 G994 I995 V997	W928-L990 HydrophobicContact CZ2-CD1 4.02Å; I952-L990 HydrophobicContact CD1-CD1 3.83Å; L960-L990 HydrophobicContact CD1-CD2 4.03Å; V963-L990 HydrophobicContact CG1-CD2 4.28Å; L967-L990 HydrophobicContact CD1-CD2 4.37Å; I985-L990 HydrophobicContact CB-CD1 4.47Å; I985-L990 HydrophobicContact CB-CD2 4.38Å; I985-L990 HydrophobicContact CB-CG 4.37Å; I985-L990 HydrophobicContact CD1-CD2 4.48Å; I985-L990 HydrophobicContact CG2-CD1 4.46Å; I985-L990 HydrophobicContact CG2-CD2 3.83Å; I985-L990 HydrophobicContact CG2-CG 3.85Å; S986-L990 PolarHBondContact O-N 3.47Å; S986-L990 VanDerWaalsContact O-N 3.12Å; P987-L990 PolarHBondContact O-N 3.11Å; L990-K992 VanDerWaalsContact C-N 3.34Å; L990-K992 PolarHBondContact O-N 2.83Å; L990-E993 CarbonylContact O-C 3.46Å; L990-E993 PolarHBondContact O-N 3.04Å; L990-G994 PolarHBondContact O-N 3.38Å; L990-I995 HydrophobicContact CB-CB 4.18Å; L990-I995 WeakPolarHBondContact O-CB 3.23Å; L990-I995 PolarHBondContact O-N 3.03Å; L990-V997 HydrophobicContact CB-CG2 3.77Å; L990-V997 HydrophobicContact CD1-CG2 4.36Å
991	C	93.1	Very high	91.8	Very high	35 Å²	35	34.2 Å²	34.2	24%	0.236	18%	0.183	C	C	.	.	H	α-helix	trans	-65.1	-33.5	173.8	-67	0	0	0	0	113.5	P987 V989 G994 I995	P987-C991 PolarHBondContact O-N 3.43Å; P987-C991 PolarHBondContact O-SG 3.02Å; V989-C991 VanDerWaalsContact C-N 3.31Å; V989-C991 PolarHBondContact O-N 3.19Å; C991-G994 PolarHBondContact O-N 3Å; C991-I995 WeakPolarHBondContact CA-O 3.47Å
992	K	92.3	Very high	93	Very high	140 Å²	140	32.9 Å²	32.9	61%	0.609	17%	0.174	S	C	*	.	H	α-helix	trans	-70	-33.2	176.4	-70.9	158.1	-161.1	166.3	0	111.9	E988 V989 L990 G994	E988-K992 WeakPolarHBondContact O-CD 3.13Å; E988-K992 VanDerWaalsContact O-CE 3.24Å; E988-K992 WeakPolarHBondContact O-CE 2.92Å; E988-K992 WeakPolarHBondContact O-CG 3.5Å; E988-K992 PolarHBondContact O-N 3.11Å; E988-K992 IonicContact OE2-NZ 2.76Å; E988-K992 PolarHBondContact OE2-NZ 3.45Å; V989-K992 WeakPolarHBondContact O-CB 3.37Å; V989-K992 PolarHBondContact O-N 3.15Å; L990-K992 VanDerWaalsContact C-N 3.34Å; L990-K992 PolarHBondContact O-N 2.83Å; K992-G994 PolarHBondContact O-N 3.21Å
993	E	91.8	Very high	93.6	Very high	106 Å²	106	34 Å²	34	50%	0.495	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	7.6	171.2	-55.3	-54.7	143.7	0	0	113.4	V963 L967 V989 L990	V963-E993 HydrophobicContact CG1-CB 3.63Å; V963-E993 HydrophobicContact CG1-CG 3.96Å; V963-E993 HydrophobicContact CG2-CB 4.04Å; L967-E993 HydrophobicContact CD1-CG 4.26Å; L967-E993 HydrophobicContact CD2-CG 4.32Å; V989-E993 PolarHBondContact O-N 2.89Å; L990-E993 CarbonylContact O-C 3.46Å; L990-E993 PolarHBondContact O-N 3.04Å
994	G	91.5	Very high	94.1	Very high	50 Å²	50	36.9 Å²	36.9	52%	0.515	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.7	8.8	172.7	0	0	0	0	0	116.5	L990 C991 K992	L990-G994 PolarHBondContact O-N 3.38Å; C991-G994 PolarHBondContact O-N 3Å; K992-G994 PolarHBondContact O-N 3.21Å
995	I	94.2	Very high	94.3	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	20%	0.204	C	C	.	.			trans	-78.3	132.5	171.7	-54.1	-59.6	0	0	0	109.5	I952 E956 K959 L960 V963 L990 C991 V997	I952-I995 HydrophobicContact CG1-CG2 4.37Å; I952-I995 HydrophobicContact CG2-CG2 3.7Å; E956-I995 HydrophobicContact CB-CG2 4.37Å; K959-I995 HydrophobicContact CB-CD1 3.53Å; L960-I995 HydrophobicContact CB-CD1 4.44Å; L960-I995 HydrophobicContact CD1-CG1 4.48Å; L960-I995 HydrophobicContact CD1-CG2 4.36Å; V963-I995 HydrophobicContact CB-CD1 4.3Å; V963-I995 HydrophobicContact CB-CG1 4.32Å; V963-I995 HydrophobicContact CG1-CG1 4.22Å; V963-I995 HydrophobicContact CG2-CD1 3.99Å; V963-I995 HydrophobicContact CG2-CG1 4.22Å; L990-I995 HydrophobicContact CB-CB 4.18Å; L990-I995 WeakPolarHBondContact O-CB 3.23Å; L990-I995 PolarHBondContact O-N 3.03Å; C991-I995 WeakPolarHBondContact CA-O 3.47Å; I995-V997 HydrophobicContact CG2-CG2 4.4Å; I995-V997 PolarHBondContact O-N 3.07Å
996	K	94.1	Very high	94.6	Very high	106 Å²	106	37.5 Å²	37.5	46%	0.461	20%	0.204	S	C	.	.			trans	-72	126.2	171.2	-56.2	-161.3	-154.5	80.1	0	110	E956	E956-K996 HydrophobicContact CG-CB 4.2Å; E956-K996 HydrophobicContact CG-CG 4.38Å; E956-K996 IonicContact OE1-NZ 3.45Å; E956-K996 PolarHBondContact OE1-NZ 2.81Å
997	V	95.7	Very high	94.8	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.024	20%	0.202	C	C	.	.			trans	-127.6	128.4	172.6	-163.7	0	0	0	0	109.6	W928 C951 I952 P987 L990 I995	W928-V997 HydrophobicContact CH2-CG1 3.86Å; W928-V997 HydrophobicContact CZ2-CG1 4.39Å; C951-V997 WeakPolarHBondContact O-CA 3.47Å; I952-V997 HydrophobicContact CG1-CG1 4.28Å; I952-V997 HydrophobicContact CG1-CG2 4.17Å; P987-V997 HydrophobicContact CB-CB 4.32Å; P987-V997 HydrophobicContact CB-CG1 3.81Å; P987-V997 HydrophobicContact CB-CG2 4.41Å; L990-V997 HydrophobicContact CB-CG2 3.77Å; L990-V997 HydrophobicContact CD1-CG2 4.36Å; I995-V997 HydrophobicContact CG2-CG2 4.4Å; I995-V997 PolarHBondContact O-N 3.07Å
998	H	95.6	Very high	95.1	Very high	6 Å²	6	37.1 Å²	37.1	3%	0.028	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	145.9	178	-55.8	-62.1	0	0	0	110.8	D555 I557 F584 Y950 C951 P953	D555-H998 VanDerWaalsContact CB-ND1 3.32Å; D555-H998 WeakPolarHBondContact CB-ND1 3.25Å; D555-H998 VanDerWaalsContact O-CA 3.32Å; D555-H998 WeakPolarHBondContact O-CA 3.4Å; D555-H998 IonicContact OD2-CE1 3.27Å; I557-H998 HydrophobicContact CD1-CB 4.22Å; I557-H998 HydrophobicContact CG1-CB 3.5Å; F584-H998 AromaticContact CD1-CE1 3.64Å; F584-H998 AromaticContact CD1-CG 4Å; F584-H998 AromaticContact CD1-ND1 3.72Å; F584-H998 AromaticContact CD1-NE2 3.85Å; F584-H998 PolarHBondContact O-CD2 3.17Å; Y950-H998 CarbonylContact C-O 3.57Å; Y950-H998 WeakPolarHBondContact CA-O 3.45Å; C951-H998 PolarHBondContact N-O 3.12Å; C951-H998 PolarHBondContact O-N 3.01Å; P953-H998 WeakPolarHBondContact CG-NE2 3.47Å
999	R	95.4	Very high	95.4	Very high	39 Å²	39	35.3 Å²	35.3	15%	0.147	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	147.1	-173.6	-172.9	-174.3	164.8	-73.7	-2.3	112.7	M554 D555 I557 E847 W949 Y950	M554-R999 HydrophobicContact CB-CB 4.39Å; D555-R999 PolarHBondContact O-N 3.2Å; I557-R999 PolarHBondContact N-O 2.83Å; E847-R999 IonicContact OE1-CZ 2.68Å; E847-R999 IonicContact OE1-NE 3.83Å; E847-R999 PolarHBondContact OE1-NE 2.81Å; E847-R999 IonicContact OE1-NH2 2.75Å; E847-R999 IonicContact OE2-CZ 2.86Å; E847-R999 IonicContact OE2-NE 3.53Å; E847-R999 PolarHBondContact OE2-NE 3.11Å; E847-R999 IonicContact OE2-NH2 2.7Å; E847-R999 PolarHBondContact OE2-NH2 3.06Å; W949-R999 WeakPolarHBondContact O-CA 3.46Å; Y950-R999 HydrophobicContact CD1-CG 4.1Å; Y950-R999 HydrophobicContact CE1-CG 4.19Å
1000	T	96.4	Very high	95.6	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.018	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	172	164.6	-150	0	0	0	0	113.8	I557 R588 W949	I557-T1000 HydrophobicContact CB-CG2 4.48Å; I557-T1000 HydrophobicContact CD1-CG2 4Å; R588-T1000 HydrophobicContact CB-CG2 4.43Å; R588-T1000 PolarHBondContact NE-OG1 3.25Å; W949-T1000 HydrophobicContact CB-CG2 4.1Å; W949-T1000 PolarHBondContact N-O 2.97Å; W949-T1000 PolarHBondContact O-N 3.2Å
1001	V	97.2	Very high	95.8	Very high	24 Å²	24	33.7 Å²	33.7	15%	0.145	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	110.9	171.5	-177.1	0	0	0	0	108.4	R588 P843 D946 C947 I948	R588-V1001 WeakPolarHBondContact CD-O 3.31Å; R588-V1001 PolarHBondContact NH1-O 3.1Å; P843-V1001 HydrophobicContact CB-CG1 4.39Å; P843-V1001 HydrophobicContact CG-CG1 4.35Å; D946-V1001 HydrophobicContact CB-CG1 3.64Å; C947-V1001 CarbonylContact O-C 3.54Å; C947-V1001 WeakPolarHBondContact O-CA 3.48Å; I948-V1001 HydrophobicContact CG1-CG2 4.41Å
1002	Q	98.1	Very high	95.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	128	172.6	-178.6	-170.2	29.9	0	0	108.8	D939 L941 D946 C947 Q1006 V1008	D939-Q1002 PolarHBondContact O-NE2 2.69Å; D939-Q1002 PolarHBondContact OD1-NE2 2.93Å; D939-Q1002 PolarHBondContact OD1-OE1 3.01Å; L941-Q1002 HydrophobicContact CB-CG 3.89Å; L941-Q1002 HydrophobicContact CD2-CG 4.1Å; L941-Q1002 WeakPolarHBondContact CD2-O 3.39Å; D946-Q1002 CarbonylContact C-O 3.57Å; D946-Q1002 VanDerWaalsContact CA-O 3.27Å; D946-Q1002 WeakPolarHBondContact CA-O 3.47Å; D946-Q1002 WeakPolarHBondContact CB-O 3.12Å; C947-Q1002 HydrophobicContact CB-CB 4.39Å; C947-Q1002 PolarHBondContact N-O 2.76Å; C947-Q1002 PolarHBondContact O-N 2.98Å; Q1002-Q1006 HydrophobicContact CG-CB 4.37Å; Q1002-Q1006 PolarHBondContact NE2-O 2.83Å; Q1002-V1008 HydrophobicContact CB-CG2 3.85Å; Q1002-V1008 HydrophobicContact CG-CG2 3.81Å
1003	Q	97.3	Very high	95.7	Very high	87 Å²	87	26.4 Å²	26.4	41%	0.407	15%	0.151	S	C	.	.			trans	-107.3	162.6	177	-42.9	-171.9	-75.2	0	0	110.7	D946 G1005 Q1006	D946-Q1003 WeakPolarHBondContact OD1-CA 3.28Å; D946-Q1003 WeakPolarHBondContact OD1-CB 3.5Å; D946-Q1003 PolarHBondContact OD2-NE2 3.04Å; Q1003-G1005 PolarHBondContact O-N 3.25Å; Q1003-Q1006 HydrophobicContact CB-CG 4.37Å; Q1003-Q1006 VanDerWaalsContact O-CB 3.29Å; Q1003-Q1006 WeakPolarHBondContact O-CB 3.48Å; Q1003-Q1006 PolarHBondContact O-N 3.1Å; Q1003-Q1006 VanDerWaalsContact OE1-NE2 3.12Å
1004	S	96.6	Very high	95.8	Very high	61 Å²	61	21.7 Å²	21.7	43%	0.427	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	129.9	174.6	-174.1	0	0	0	0	111.2	L941 H942 T943	L941-S1004 WeakPolarHBondContact O-CA 3.46Å; H942-S1004 PolarHBondContact O-OG 2.69Å; H942-S1004 VanDerWaalsContact O-OG 3.06Å; T943-S1004 WeakPolarHBondContact CA-OG 3.11Å
1005	G	96.6	Very high	96	Very high	18 Å²	18	19.4 Å²	19.4	19%	0.186	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	5.6	-175.4	0	0	0	0	0	115.4	P591 Y940 L941 Q1003	P591-G1005 WeakPolarHBondContact CD-O 3.18Å; P591-G1005 WeakPolarHBondContact CG-O 3.3Å; Y940-G1005 WeakPolarHBondContact CE2-O 2.97Å; L941-G1005 PolarHBondContact O-N 3.25Å; Q1003-G1005 PolarHBondContact O-N 3.25Å
1006	Q	97.9	Very high	96.1	Very high	14 Å²	14	19.4 Å²	19.4	7%	0.065	11%	0.106	C	C	.	.			trans	-110	145.3	-179.3	-59.4	174.8	-1.3	0	0	112.6	I590 L941 Q1002 Q1003	I590-Q1006 HydrophobicContact CG1-CG 4.19Å; L941-Q1006 PolarHBondContact N-O 3.38Å; Q1002-Q1006 HydrophobicContact CG-CB 4.37Å; Q1002-Q1006 PolarHBondContact NE2-O 2.83Å; Q1003-Q1006 HydrophobicContact CB-CG 4.37Å; Q1003-Q1006 VanDerWaalsContact O-CB 3.29Å; Q1003-Q1006 WeakPolarHBondContact O-CB 3.48Å; Q1003-Q1006 PolarHBondContact O-N 3.1Å; Q1003-Q1006 VanDerWaalsContact OE1-NE2 3.12Å
1007	F	98.4	Very high	96.2	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	150.1	172.9	-58.3	-94.8	0	0	0	111.2	F567 R588 V589 P591 W595 F877 W890 L892 I938 D939 Y940	F567-F1007 HydrophobicContact CE2-CE2 4.1Å; F567-F1007 AromaticContact CZ-CE2 3.91Å; F567-F1007 HydrophobicContact CZ-CE2 3.91Å; F567-F1007 HydrophobicContact CZ-CZ 4.41Å; R588-F1007 CarbonylContact C-O 3.56Å; R588-F1007 WeakPolarHBondContact CA-O 3.28Å; V589-F1007 HydrophobicContact CB-CB 4.2Å; V589-F1007 PolarHBondContact N-O 2.9Å; V589-F1007 PolarHBondContact O-N 3.18Å; P591-F1007 HydrophobicContact CB-CD2 4.48Å; P591-F1007 HydrophobicContact CB-CE2 4.09Å; P591-F1007 HydrophobicContact CG-CD2 4.34Å; P591-F1007 HydrophobicContact CG-CE2 4.09Å; W595-F1007 AromaticContact CE2-CZ 3.81Å; W595-F1007 HydrophobicContact CZ2-CE2 4.5Å; W595-F1007 AromaticContact CZ2-CZ 3.75Å; W595-F1007 HydrophobicContact CZ2-CZ 3.75Å; W595-F1007 AromaticContact NE1-CE2 3.59Å; W595-F1007 AromaticContact NE1-CZ 3.58Å; F877-F1007 HydrophobicContact CZ-CE1 4.49Å; W890-F1007 HydrophobicContact CB-CE1 4.38Å; W890-F1007 HydrophobicContact CB-CZ 3.88Å; W890-F1007 HydrophobicContact CD2-CE2 4.47Å; W890-F1007 HydrophobicContact CD2-CZ 4.39Å; W890-F1007 AromaticContact CE3-CD1 3.91Å; W890-F1007 HydrophobicContact CE3-CD1 3.91Å; W890-F1007 AromaticContact CE3-CD2 3.92Å; W890-F1007 HydrophobicContact CE3-CD2 3.92Å; W890-F1007 AromaticContact CE3-CE1 3.83Å; W890-F1007 HydrophobicContact CE3-CE1 3.83Å; W890-F1007 AromaticContact CE3-CE2 3.86Å; W890-F1007 HydrophobicContact CE3-CE2 3.86Å; W890-F1007 AromaticContact CE3-CG 3.94Å; W890-F1007 HydrophobicContact CE3-CG 3.94Å; W890-F1007 AromaticContact CE3-CZ 3.81Å; W890-F1007 HydrophobicContact CE3-CZ 3.81Å; W890-F1007 HydrophobicContact CG-CZ 4.48Å; W890-F1007 HydrophobicContact CZ3-CB 4.34Å; W890-F1007 HydrophobicContact CZ3-CD1 4.27Å; W890-F1007 HydrophobicContact CZ3-CD2 4.13Å; W890-F1007 HydrophobicContact CZ3-CG 4.01Å; L892-F1007 HydrophobicContact CD2-CE1 4.44Å; I938-F1007 HydrophobicContact CG2-CB 4.02Å; I938-F1007 HydrophobicContact CG2-CD1 3.65Å; I938-F1007 HydrophobicContact CG2-CG 4.29Å; D939-F1007 CarbonylContact O-C 3.58Å; D939-F1007 VanDerWaalsContact O-CA 3.25Å; D939-F1007 WeakPolarHBondContact O-CA 3.27Å; Y940-F1007 AromaticContact CD2-CD1 3.51Å; Y940-F1007 HydrophobicContact CD2-CD1 3.51Å; Y940-F1007 AromaticContact CD2-CD2 3.83Å; Y940-F1007 HydrophobicContact CD2-CD2 3.83Å; Y940-F1007 AromaticContact CD2-CE1 3.36Å; Y940-F1007 HydrophobicContact CD2-CE1 3.36Å; Y940-F1007 AromaticContact CD2-CE2 3.67Å; Y940-F1007 HydrophobicContact CD2-CE2 3.67Å; Y940-F1007 AromaticContact CD2-CG 3.75Å; Y940-F1007 HydrophobicContact CD2-CG 3.75Å; Y940-F1007 AromaticContact CD2-CZ 3.45Å; Y940-F1007 HydrophobicContact CD2-CZ 3.45Å; Y940-F1007 VanDerWaalsContact CD2-CZ 3.45Å; Y940-F1007 HydrophobicContact CE2-CD2 4.17Å; Y940-F1007 HydrophobicContact CE2-CE1 4.13Å; Y940-F1007 AromaticContact CE2-CE2 3.74Å; Y940-F1007 HydrophobicContact CE2-CE2 3.74Å; Y940-F1007 AromaticContact CE2-CZ 3.72Å; Y940-F1007 HydrophobicContact CE2-CZ 3.72Å; Y940-F1007 HydrophobicContact CG-CD1 4Å; Y940-F1007 AromaticContact CG-CE1 3.78Å; Y940-F1007 HydrophobicContact CG-CE1 3.78Å; Y940-F1007 HydrophobicContact CG-CZ 4.2Å
1008	V	98.2	Very high	96.3	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.9	165.5	173.5	0	0	0	0	107.4	M586 C587 I938 D939 W949 Q1002	M586-V1008 HydrophobicContact CE-CG1 4.42Å; M586-V1008 HydrophobicContact CG-CG1 3.58Å; M586-V1008 HydrophobicContact SD-CG1 3.32Å; M586-V1008 WeakPolarHBondContact SD-CG1 3.39Å; C587-V1008 WeakPolarHBondContact O-CA 3.39Å; I938-V1008 CarbonylContact C-O 3.46Å; I938-V1008 WeakPolarHBondContact CA-O 3.29Å; D939-V1008 PolarHBondContact N-O 3Å; D939-V1008 PolarHBondContact O-N 3.09Å; W949-V1008 HydrophobicContact CD2-CG1 4.26Å; W949-V1008 HydrophobicContact CE3-CG1 4.48Å; W949-V1008 HydrophobicContact CZ2-CB 4.28Å; W949-V1008 HydrophobicContact CZ2-CG1 4.29Å; Q1002-V1008 HydrophobicContact CB-CG2 3.85Å; Q1002-V1008 HydrophobicContact CG-CG2 3.81Å
1009	V	97.8	Very high	96.4	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120	179.1	-177.3	0	0	0	0	108.3	I574 M586 C587 V589 Y937 I938 F1011 F1031	I574-V1009 HydrophobicContact CD1-CG1 4.13Å; I574-V1009 HydrophobicContact CD1-CG2 4.03Å; I574-V1009 HydrophobicContact CG1-CG2 4.47Å; I574-V1009 HydrophobicContact CG2-CG1 4.33Å; M586-V1009 CarbonylContact C-O 3.55Å; M586-V1009 VanDerWaalsContact CA-O 3.3Å; M586-V1009 WeakPolarHBondContact CA-O 3.29Å; M586-V1009 WeakPolarHBondContact CG-O 3.27Å; C587-V1009 PolarHBondContact N-O 3.31Å; C587-V1009 PolarHBondContact O-N 3.32Å; V589-V1009 HydrophobicContact CG2-CG2 4.01Å; Y937-V1009 WeakPolarHBondContact O-CA 3.28Å; I938-V1009 HydrophobicContact CD1-CG2 4.11Å; I938-V1009 HydrophobicContact CG1-CG1 4.38Å; I938-V1009 HydrophobicContact CG1-CG2 4.08Å; I938-V1009 HydrophobicContact CG2-CG2 4.18Å; V1009-F1011 HydrophobicContact CG1-CE2 4.24Å; V1009-F1011 HydrophobicContact CG1-CZ 4.28Å; V1009-F1031 HydrophobicContact CG1-CE1 4.16Å; V1009-F1031 HydrophobicContact CG1-CZ 4.08Å
1010	C	97	Very high	96.5	Very high	3 Å²	3	13 Å²	13	2%	0.02	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.7	179.5	-59	0	0	0	0	109.7	M586 P936 Y937	M586-C1010 PolarHBondContact SD-SG 2.89Å; P936-C1010 VanDerWaalsContact CA-O 3.27Å; P936-C1010 WeakPolarHBondContact CA-O 3.35Å; P936-C1010 WeakPolarHBondContact CB-O 3.38Å; Y937-C1010 HydrophobicContact CD1-CB 3.89Å; Y937-C1010 HydrophobicContact CD2-CB 4.15Å; Y937-C1010 HydrophobicContact CE1-CB 3.63Å; Y937-C1010 HydrophobicContact CE2-CB 3.91Å; Y937-C1010 WeakPolarHBondContact CE2-SG 3.35Å; Y937-C1010 HydrophobicContact CG-CB 4.15Å; Y937-C1010 PolarHBondContact N-O 3.21Å; Y937-C1010 VanDerWaalsContact N-O 3.14Å; Y937-C1010 PolarHBondContact O-N 3.05Å; Y937-C1010 PolarHBondContact OH-SG 3.3Å
1011	F	95.8	Very high	96.5	Very high	8 Å²	8	13.1 Å²	13.1	4%	0.035	8%	0.081	C	C	.	.	P	Polyproline II helix	trans	-91	162.3	-178.6	-71.2	-89.1	0	0	0	111.8	I574 R578 V581 E582 G585 C587 V1009	I574-F1011 HydrophobicContact CG2-CE1 4.18Å; I574-F1011 HydrophobicContact CG2-CZ 4.19Å; R578-F1011 HydrophobicContact CG-CE1 4.12Å; V581-F1011 HydrophobicContact CG2-CE1 4.47Å; V581-F1011 HydrophobicContact CG2-CE2 3.67Å; V581-F1011 HydrophobicContact CG2-CZ 3.51Å; E582-F1011 HydrophobicContact CB-CD1 4.08Å; E582-F1011 HydrophobicContact CB-CE1 4.4Å; E582-F1011 HydrophobicContact CB-CG 4.3Å; E582-F1011 HydrophobicContact CG-CB 4.12Å; E582-F1011 HydrophobicContact CG-CD1 3.84Å; E582-F1011 HydrophobicContact CG-CG 4.05Å; E582-F1011 WeakPolarHBondContact OE1-CD1 3.22Å; G585-F1011 WeakPolarHBondContact O-CB 3.33Å; G585-F1011 PolarHBondContact O-N 2.92Å; C587-F1011 HydrophobicContact CB-CE2 4.47Å; V1009-F1011 HydrophobicContact CG1-CE2 4.24Å; V1009-F1011 HydrophobicContact CG1-CZ 4.28Å
1012	P	93.6	Very high	96.5	Very high	15 Å²	15	12.1 Å²	12.1	10%	0.097	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	154.9	177.7	-27.4	39.5	0	0	0	112.8	H934 P936 S1014 M1039	H934-P1012 HydrophobicContact CB-CB 4.28Å; H934-P1012 VanDerWaalsContact O-CB 3.31Å; H934-P1012 WeakPolarHBondContact O-CB 3.28Å; P936-P1012 HydrophobicContact CB-CG 4.37Å; P1012-S1014 PolarHBondContact O-N 3.03Å; P1012-S1014 PolarHBondContact O-OG 3.41Å; P1012-M1039 HydrophobicContact CB-CE 3.37Å; P1012-M1039 HydrophobicContact CB-SD 3.84Å; P1012-M1039 HydrophobicContact CG-CE 3.59Å
1013	G	90.3	Very high	96.4	Very high	7 Å²	7	14.3 Å²	14.3	7%	0.072	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	-12.2	175.4	0	0	0	0	0	116.1	R930	R930-G1013 VanDerWaalsContact CD-C 3.5Å; R930-G1013 WeakPolarHBondContact CD-O 3.27Å
1014	S	94.6	Very high	96.3	Very high	7 Å²	7	10.2 Å²	10.2	5%	0.049	7%	0.065	C	C	.	.			trans	-86.3	131	-170.2	-56.4	0	0	0	0	111.6	G585 I952 P1012	G585-S1014 WeakPolarHBondContact CA-OG 3.38Å; G585-S1014 PolarHBondContact O-OG 2.84Å; I952-S1014 WeakPolarHBondContact O-CA 3.34Å; P1012-S1014 PolarHBondContact O-N 3.03Å; P1012-S1014 PolarHBondContact O-OG 3.41Å
1015	F	95.5	Very high	96.4	Very high	1 Å²	1	7.3 Å²	7.3	0%	0.004	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	138.5	172	-76.5	-95	0	0	0	109.7	W928 S929 R930 C951 I952 E957 L960 L976 L979 E980	W928-F1015 HydrophobicContact CE3-CB 4.32Å; S929-F1015 WeakPolarHBondContact O-CA 3.44Å; R930-F1015 HydrophobicContact CB-CD1 3.92Å; R930-F1015 HydrophobicContact CB-CE1 3.83Å; R930-F1015 HydrophobicContact CB-CE2 4.45Å; R930-F1015 HydrophobicContact CB-CG 4.26Å; R930-F1015 HydrophobicContact CB-CZ 4.11Å; C951-F1015 CarbonylContact C-O 3.5Å; C951-F1015 VanDerWaalsContact CA-O 3.28Å; C951-F1015 WeakPolarHBondContact CA-O 3.34Å; C951-F1015 PolarHBondContact SG-O 3.5Å; I952-F1015 HydrophobicContact CB-CB 4.24Å; I952-F1015 HydrophobicContact CD1-CB 4.27Å; I952-F1015 PolarHBondContact N-O 3.49Å; I952-F1015 PolarHBondContact O-N 2.81Å; E957-F1015 HydrophobicContact CG-CE2 4.1Å; E957-F1015 WeakPolarHBondContact OE1-CE2 3.27Å; L960-F1015 HydrophobicContact CD2-CB 4.33Å; L960-F1015 HydrophobicContact CD2-CD1 4.46Å; L960-F1015 HydrophobicContact CD2-CD2 3.65Å; L960-F1015 HydrophobicContact CD2-CE2 4.02Å; L960-F1015 HydrophobicContact CD2-CG 3.9Å; L976-F1015 HydrophobicContact CB-CZ 4.2Å; L976-F1015 HydrophobicContact CD1-CE2 4.45Å; L976-F1015 HydrophobicContact CD1-CZ 4.22Å; L976-F1015 HydrophobicContact CD2-CE2 4.11Å; L976-F1015 HydrophobicContact CD2-CZ 3.86Å; L976-F1015 HydrophobicContact CG-CZ 4.31Å; L979-F1015 HydrophobicContact CD2-CD1 4.01Å; L979-F1015 HydrophobicContact CD2-CE1 4.27Å; E980-F1015 HydrophobicContact CG-CE1 4.18Å
1016	V	96.1	Very high	96.4	Very high	5 Å²	5	6.6 Å²	6.6	3%	0.03	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	150.2	-171.8	-71.9	0	0	0	0	112	M586 W928 S929 Y937 Y950 C951	M586-V1016 HydrophobicContact SD-CG1 4.07Å; W928-V1016 WeakPolarHBondContact CA-O 3.31Å; S929-V1016 PolarHBondContact N-O 3.28Å; S929-V1016 WeakPolarHBondContact O-CG2 3.3Å; S929-V1016 PolarHBondContact O-N 2.85Å; Y937-V1016 HydrophobicContact CE1-CG2 4.5Å; Y937-V1016 WeakPolarHBondContact OH-CG2 3.5Å; Y950-V1016 WeakPolarHBondContact O-CA 3.28Å; C951-V1016 HydrophobicContact CB-CG1 4.02Å
1017	S	97	Very high	96.3	Very high	1 Å²	1	6 Å²	6	1%	0.007	3%	0.034	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	147.3	172.3	176.2	0	0	0	0	110.8	S926 W949 Y950 M984	S926-S1017 WeakPolarHBondContact O-CA 3.46Å; S926-S1017 WeakPolarHBondContact O-CB 3.47Å; S926-S1017 PolarHBondContact O-OG 2.88Å; W949-S1017 WeakPolarHBondContact CA-O 3.44Å; Y950-S1017 PolarHBondContact N-O 3.26Å; Y950-S1017 PolarHBondContact O-N 2.77Å; M984-S1017 VanDerWaalsContact CE-OG 3.28Å; M984-S1017 WeakPolarHBondContact CE-OG 3.41Å
1018	K	96.8	Very high	96.2	Very high	9 Å²	9	7 Å²	7	4%	0.039	4%	0.04	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	131.2	-177.5	-170.5	-178.1	-161.9	171.2	0	109.5	T925 S926 D939 C947 I948 W949 S1026	T925-K1018 CarbonylContact C-O 3.57Å; T925-K1018 WeakPolarHBondContact CA-O 3.05Å; S926-K1018 PolarHBondContact N-O 2.84Å; S926-K1018 PolarHBondContact O-N 3.28Å; S926-K1018 VanDerWaalsContact O-N 3.11Å; D939-K1018 IonicContact OD1-NZ 2.72Å; D939-K1018 PolarHBondContact OD1-NZ 3.19Å; D939-K1018 IonicContact OD2-NZ 2.69Å; D939-K1018 PolarHBondContact OD2-NZ 3.03Å; C947-K1018 HydrophobicContact CB-CG 4.11Å; I948-K1018 CarbonylContact O-C 3.57Å; I948-K1018 WeakPolarHBondContact O-CA 3.42Å; W949-K1018 HydrophobicContact CD2-CB 4.04Å; W949-K1018 HydrophobicContact CD2-CD 4.37Å; W949-K1018 HydrophobicContact CD2-CG 3.92Å; W949-K1018 HydrophobicContact CE3-CB 3.97Å; W949-K1018 HydrophobicContact CE3-CG 4.32Å; W949-K1018 HydrophobicContact CG-CG 4.43Å; W949-K1018 HydrophobicContact CH2-CB 4.38Å; W949-K1018 HydrophobicContact CH2-CD 3.85Å; W949-K1018 HydrophobicContact CH2-CG 4.35Å; W949-K1018 HydrophobicContact CZ2-CB 4.43Å; W949-K1018 HydrophobicContact CZ2-CD 3.43Å; W949-K1018 VanDerWaalsContact CZ2-CD 3.43Å; W949-K1018 HydrophobicContact CZ2-CG 3.93Å; W949-K1018 HydrophobicContact CZ3-CB 4.14Å; W949-K1018 HydrophobicContact CZ3-CD 4.45Å; K1018-S1026 PolarHBondContact NZ-OG 3.46Å
1019	V	97.8	Very high	96.1	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.04	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.2	173.6	-179.5	0	0	0	0	109.6	Y850 T925 C947 I948 Y950 M984	Y850-V1019 HydrophobicContact CD1-CG1 4.39Å; Y850-V1019 HydrophobicContact CD1-CG2 4.35Å; Y850-V1019 HydrophobicContact CD2-CG1 3.86Å; Y850-V1019 HydrophobicContact CE1-CG2 3.9Å; Y850-V1019 HydrophobicContact CE2-CG1 4.02Å; Y850-V1019 HydrophobicContact CE2-CG2 4.29Å; Y850-V1019 HydrophobicContact CG-CG1 4.04Å; T925-V1019 HydrophobicContact CG2-CG2 4.44Å; C947-V1019 WeakPolarHBondContact CA-O 3.4Å; I948-V1019 PolarHBondContact N-O 3.32Å; I948-V1019 PolarHBondContact O-N 3.1Å; Y950-V1019 HydrophobicContact CE2-CG2 4.06Å; M984-V1019 HydrophobicContact CE-CG2 4.24Å
1020	C	97.8	Very high	96.1	Very high	11 Å²	11	8.3 Å²	8.3	7%	0.074	5%	0.046	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	133.7	-176.6	-65	0	0	0	0	112.1	M921 V922 F923 S924 G1022 S1024	M921-C1020 WeakPolarHBondContact O-CB 3.41Å; V922-C1020 WeakPolarHBondContact CA-O 3.44Å; F923-C1020 PolarHBondContact N-O 2.85Å; S924-C1020 PolarHBondContact O-N 3.36Å; C1020-G1022 VanDerWaalsContact C-N 3.28Å; C1020-G1022 PolarHBondContact O-N 3.02Å; C1020-S1024 PolarHBondContact SG-OG 3.42Å
1021	C	96.9	Very high	96	Very high	5 Å²	5	8.3 Å²	8.3	3%	0.034	5%	0.046	C	C	.	.	S	Bend	trans	-83	1.3	179.4	-62	0	0	0	0	114	M833 I846 A945 D946	M833-C1021 WeakPolarHBondContact CE-O 3.24Å; I846-C1021 HydrophobicContact CD1-CB 3.42Å; I846-C1021 VanDerWaalsContact CD1-CB 3.42Å; I846-C1021 VanDerWaalsContact CD1-O 3.24Å; I846-C1021 WeakPolarHBondContact CD1-O 3.17Å; A945-C1021 HydrophobicContact CB-CB 4.23Å; D946-C1021 HydrophobicContact CB-CB 4.49Å; D946-C1021 WeakPolarHBondContact O-CB 3.43Å; D946-C1021 PolarHBondContact O-N 3.3Å; D946-C1021 PolarHBondContact O-SG 3.07Å
1022	G	95.7	Very high	95.9	Very high	3 Å²	3	7.9 Å²	7.9	3%	0.031	4%	0.044	C	C	.	.	S	Bend	trans	164.6	-165.4	-172	0	0	0	0	0	110.4	M921 C1020 S1024	M921-G1022 CarbonylContact C-O 3.46Å; M921-G1022 WeakPolarHBondContact CA-O 3.47Å; C1020-G1022 VanDerWaalsContact C-N 3.28Å; C1020-G1022 PolarHBondContact O-N 3.02Å; G1022-S1024 PolarHBondContact O-N 3.31Å; G1022-S1024 PolarHBondContact O-OG 2.98Å
1023	Y	96.4	Very high	95.8	Very high	45 Å²	45	7.9 Å²	7.9	18%	0.176	4%	0.043	C	C	.	.	S	Bend	trans	-58.2	123.1	169.9	175.3	-102.7	0	0	0	109.9	L822 F825 Y826 A829 I919 G920 G944 A945 V1025	L822-Y1023 HydrophobicContact CD1-CE2 4.48Å; L822-Y1023 WeakPolarHBondContact CD1-OH 3.38Å; F825-Y1023 AromaticContact CD1-CD2 3.96Å; F825-Y1023 HydrophobicContact CD1-CD2 3.96Å; F825-Y1023 AromaticContact CD1-CE2 3.9Å; F825-Y1023 HydrophobicContact CD1-CE2 3.9Å; F825-Y1023 HydrophobicContact CE1-CD2 4Å; F825-Y1023 HydrophobicContact CE1-CE2 4.22Å; Y826-Y1023 AromaticContact CD2-CD1 3.56Å; Y826-Y1023 HydrophobicContact CD2-CD1 3.56Å; Y826-Y1023 AromaticContact CD2-CD2 3.86Å; Y826-Y1023 HydrophobicContact CD2-CD2 3.86Å; Y826-Y1023 AromaticContact CD2-CE1 3.84Å; Y826-Y1023 HydrophobicContact CD2-CE1 3.84Å; Y826-Y1023 HydrophobicContact CD2-CE2 4.12Å; Y826-Y1023 AromaticContact CD2-CG 3.54Å; Y826-Y1023 HydrophobicContact CD2-CG 3.54Å; Y826-Y1023 AromaticContact CE2-CD1 3.83Å; Y826-Y1023 HydrophobicContact CE2-CD1 3.83Å; Y826-Y1023 HydrophobicContact CE2-CE1 4.32Å; Y826-Y1023 HydrophobicContact CE2-CG 4.06Å; A829-Y1023 HydrophobicContact CB-CD2 4.25Å; I919-Y1023 HydrophobicContact CG2-CE2 4.18Å; G920-Y1023 VanDerWaalsContact O-CA 3.3Å; G920-Y1023 WeakPolarHBondContact O-CA 3.4Å; G944-Y1023 CarbonylContact C-O 3.6Å; G944-Y1023 WeakPolarHBondContact CA-O 3.32Å; A945-Y1023 PolarHBondContact N-O 3.14Å; Y1023-V1025 HydrophobicContact CE1-CG2 3.89Å; Y1023-V1025 HydrophobicContact CE2-CG2 4.29Å; Y1023-V1025 WeakPolarHBondContact OH-CG2 3.48Å
1024	S	96.5	Very high	95.6	Very high	1 Å²	1	9.1 Å²	9.1	1%	0.007	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	144	-174.2	51.5	0	0	0	0	110.7	I919 G920 C1020 G1022	I919-S1024 WeakPolarHBondContact CA-O 3.38Å; G920-S1024 PolarHBondContact N-O 3.14Å; G920-S1024 PolarHBondContact O-N 3.24Å; C1020-S1024 PolarHBondContact SG-OG 3.42Å; G1022-S1024 PolarHBondContact O-N 3.31Å; G1022-S1024 PolarHBondContact O-OG 2.98Å
1025	V	96.9	Very high	95.3	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.006	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	112.7	-179.6	178.7	0	0	0	0	109	L601 L917 H942 T943 Y1023	L601-V1025 HydrophobicContact CD1-CG1 3.61Å; L917-V1025 HydrophobicContact CD1-CG1 3.77Å; H942-V1025 WeakPolarHBondContact CB-O 3.47Å; H942-V1025 PolarHBondContact N-O 3.26Å; T943-V1025 HydrophobicContact CG2-CB 3.92Å; T943-V1025 HydrophobicContact CG2-CG2 4.2Å; T943-V1025 PolarHBondContact N-O 3.36Å; T943-V1025 PolarHBondContact O-N 3.44Å; Y1023-V1025 HydrophobicContact CE1-CG2 3.89Å; Y1023-V1025 HydrophobicContact CE2-CG2 4.29Å; Y1023-V1025 WeakPolarHBondContact OH-CG2 3.48Å
1026	S	97.1	Very high	95.1	Very high	3 Å²	3	14.9 Å²	14.9	2%	0.021	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	140.4	-175.7	53.7	0	0	0	0	112.2	N918 Y940 K1018	N918-S1026 WeakPolarHBondContact CA-O 3.46Å; N918-S1026 PolarHBondContact N-O 2.6Å; N918-S1026 PolarHBondContact ND2-O 3.46Å; N918-S1026 VanDerWaalsContact ND2-O 3.15Å; N918-S1026 PolarHBondContact O-N 3.08Å; Y940-S1026 CarbonylContact O-C 3.59Å; Y940-S1026 WeakPolarHBondContact O-CA 3.42Å; Y940-S1026 WeakPolarHBondContact O-CB 3.47Å; K1018-S1026 PolarHBondContact NZ-OG 3.46Å
1027	E	96.5	Very high	94.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	143.6	172.5	-75	-167.5	179.7	0	0	112.2	T870 S875 G876 F877 L892 W916 L917 D939 Y940 H942	T870-E1027 VanDerWaalsContact CG2-OE1 3.28Å; T870-E1027 WeakPolarHBondContact CG2-OE1 3.26Å; S875-E1027 WeakPolarHBondContact CA-OE1 3.17Å; S875-E1027 WeakPolarHBondContact CB-OE1 3.25Å; S875-E1027 PolarHBondContact OG-OE1 2.78Å; S875-E1027 PolarHBondContact OG-OE2 2.88Å; G876-E1027 PolarHBondContact N-OE1 3.05Å; F877-E1027 WeakPolarHBondContact CD2-OE2 3.43Å; L892-E1027 HydrophobicContact CD1-CB 4.06Å; L892-E1027 VanDerWaalsContact CD1-O 3.32Å; L892-E1027 WeakPolarHBondContact CD1-O 3.2Å; W916-E1027 CarbonylContact O-C 3.52Å; W916-E1027 VanDerWaalsContact O-CA 3.28Å; W916-E1027 WeakPolarHBondContact O-CA 3.41Å; L917-E1027 HydrophobicContact CB-CG 4.31Å; L917-E1027 HydrophobicContact CD1-CG 3.62Å; D939-E1027 CarbonylContact C-O 3.59Å; D939-E1027 VanDerWaalsContact CA-O 3.23Å; D939-E1027 WeakPolarHBondContact CA-O 3.46Å; Y940-E1027 PolarHBondContact N-O 3.37Å; Y940-E1027 PolarHBondContact O-N 3.47Å; H942-E1027 WeakPolarHBondContact NE2-CG 3.31Å
1028	T	96.8	Very high	94.6	Very high	21 Å²	21	17.2 Å²	17.2	13%	0.129	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	134.7	175.9	-34.8	0	0	0	0	110.7	P915 W916 N918 Y937 I938 D939	P915-T1028 WeakPolarHBondContact CA-O 3.31Å; W916-T1028 PolarHBondContact N-O 3.37Å; W916-T1028 PolarHBondContact O-N 3.46Å; N918-T1028 PolarHBondContact ND2-OG1 3.21Å; Y937-T1028 HydrophobicContact CD2-CG2 3.27Å; Y937-T1028 HydrophobicContact CE2-CG2 3.58Å; Y937-T1028 HydrophobicContact CG-CG2 4.07Å; I938-T1028 VanDerWaalsContact O-CA 3.31Å; I938-T1028 WeakPolarHBondContact O-CA 3.49Å; D939-T1028 HydrophobicContact CB-CG2 4.21Å; D939-T1028 PolarHBondContact OD2-OG1 2.85Å
1029	V	96.4	Very high	94.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	150.9	171.5	83.2	0	0	0	0	111.7	L892 L895 P896 P915 Y937 I938	L892-V1029 HydrophobicContact CB-CB 4.37Å; L892-V1029 HydrophobicContact CB-CG1 3.81Å; L892-V1029 HydrophobicContact CD2-CG1 4.04Å; L892-V1029 HydrophobicContact CG-CG1 4.31Å; L895-V1029 HydrophobicContact CB-CG1 4.48Å; L895-V1029 HydrophobicContact CD2-CG1 3.9Å; P896-V1029 HydrophobicContact CG-CG1 4.15Å; P896-V1029 HydrophobicContact CG-CG2 3.57Å; P915-V1029 HydrophobicContact CB-CB 4.12Å; P915-V1029 HydrophobicContact CB-CG2 4.3Å; P915-V1029 HydrophobicContact CG-CB 4Å; P915-V1029 HydrophobicContact CG-CG2 3.91Å; Y937-V1029 WeakPolarHBondContact CA-O 3.12Å; Y937-V1029 WeakPolarHBondContact CB-O 3.48Å; I938-V1029 PolarHBondContact N-O 3.06Å; I938-V1029 PolarHBondContact O-N 2.81Å
1030	H	96.2	Very high	94.1	Very high	28 Å²	28	20.4 Å²	20.4	13%	0.13	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	155.6	175.7	-63.7	88.6	0	0	0	111.8	L903 G911 D931 L935 P936	L903-H1030 HydrophobicContact CD1-CB 4.07Å; G911-H1030 PolarHBondContact O-CE1 3.12Å; G911-H1030 PolarHBondContact O-ND1 3.11Å; D931-H1030 IonicContact OD1-NE2 3.33Å; L935-H1030 HydrophobicContact CB-CB 4.21Å; L935-H1030 VanDerWaalsContact CB-CD2 3.47Å; L935-H1030 WeakPolarHBondContact CB-CD2 3.32Å; L935-H1030 HydrophobicContact CD1-CB 4.18Å; P936-H1030 WeakPolarHBondContact O-CA 3.39Å
1031	F	94.9	Very high	93.8	Very high	3 Å²	3	20.6 Å²	20.6	1%	0.013	11%	0.108	C	C	.	.			trans	-137.3	169.4	167	67.4	-81.1	0	0	0	109.1	L571 I574 L895 P936 I938 V1009	L571-F1031 HydrophobicContact CD2-CB 4.15Å; L571-F1031 HydrophobicContact CD2-CD2 3.36Å; L571-F1031 HydrophobicContact CD2-CE2 3.91Å; L571-F1031 HydrophobicContact CD2-CG 3.91Å; I574-F1031 HydrophobicContact CD1-CZ 4.14Å; I574-F1031 HydrophobicContact CG2-CE2 4.33Å; I574-F1031 HydrophobicContact CG2-CZ 4.11Å; L895-F1031 HydrophobicContact CD2-CB 4.33Å; L895-F1031 HydrophobicContact CD2-CD1 4.38Å; L895-F1031 HydrophobicContact CG-CB 4.29Å; P936-F1031 HydrophobicContact CB-CD1 4.42Å; P936-F1031 HydrophobicContact CB-CE1 3.79Å; P936-F1031 HydrophobicContact CB-CE2 4.13Å; P936-F1031 HydrophobicContact CB-CZ 3.64Å; P936-F1031 VanDerWaalsContact CD-O 3.28Å; P936-F1031 WeakPolarHBondContact CD-O 3.49Å; P936-F1031 HydrophobicContact CG-CD1 4.41Å; P936-F1031 HydrophobicContact CG-CD2 4.07Å; P936-F1031 HydrophobicContact CG-CE1 4.15Å; P936-F1031 HydrophobicContact CG-CE2 3.81Å; P936-F1031 HydrophobicContact CG-CG 4.38Å; P936-F1031 HydrophobicContact CG-CZ 3.85Å; P936-F1031 WeakPolarHBondContact CG-O 3.36Å; P936-F1031 PolarHBondContact O-N 3.1Å; I938-F1031 HydrophobicContact CD1-CD1 4.25Å; I938-F1031 HydrophobicContact CD1-CE1 4.05Å; I938-F1031 HydrophobicContact CG1-CD1 3.76Å; I938-F1031 HydrophobicContact CG1-CE1 3.52Å; V1009-F1031 HydrophobicContact CG1-CE1 4.16Å; V1009-F1031 HydrophobicContact CG1-CZ 4.08Å
1032	A	93.7	Very high	93.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.			trans	-154.7	127.1	170.4	0	0	0	0	0	110.3	S901 I902 L903 L935 W1036	S901-A1032 CarbonylContact C-O 3.46Å; S901-A1032 VanDerWaalsContact CA-O 3.28Å; S901-A1032 WeakPolarHBondContact CA-O 3.41Å; I902-A1032 HydrophobicContact CD1-CB 4.1Å; I902-A1032 HydrophobicContact CG1-CB 3.69Å; I902-A1032 PolarHBondContact N-O 2.68Å; L903-A1032 HydrophobicContact CD2-CB 3.83Å; L903-A1032 HydrophobicContact CG-CB 3.99Å; L935-A1032 HydrophobicContact CD2-CB 3.78Å; A1032-W1036 HydrophobicContact CB-CB 4.21Å; A1032-W1036 HydrophobicContact CB-CD2 4.1Å; A1032-W1036 HydrophobicContact CB-CE3 4Å; A1032-W1036 HydrophobicContact CB-CG 4.21Å
1033	T	91.2	Very high	93.3	Very high	14 Å²	14	25.2 Å²	25.2	9%	0.086	13%	0.129	C	C	.	.			trans	-83.1	171.4	164.4	58.1	0	0	0	0	110.1	E575 R578 Q1035 W1036	E575-T1033 WeakPolarHBondContact OE2-CG2 3.37Å; E575-T1033 PolarHBondContact OE2-OG1 3.23Å; R578-T1033 PolarHBondContact NH2-OG1 3.43Å; T1033-Q1035 PolarHBondContact O-N 3.36Å; T1033-W1036 PolarHBondContact O-N 3.12Å; T1033-W1036 VanDerWaalsContact O-N 3.15Å
1034	T	87.9	Confident	93.1	Very high	33 Å²	33	23.5 Å²	23.5	20%	0.202	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-32.2	-179.3	50	0	0	0	0	113	I902 W1036 T1037 T1077	I902-T1034 HydrophobicContact CG2-CG2 3.97Å; T1034-W1036 PolarHBondContact O-N 2.87Å; T1034-W1036 VanDerWaalsContact O-N 3.11Å; T1034-T1037 PolarHBondContact O-N 2.89Å; T1034-T1037 PolarHBondContact O-OG1 2.99Å; T1034-T1077 HydrophobicContact CG2-CG2 3.77Å
1035	Q	86.5	Confident	92.8	Very high	122 Å²	122	27 Å²	27	57%	0.57	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.5	178.6	-55.3	-61.6	3.8	0	0	113.5	T1033 T1037	T1033-Q1035 PolarHBondContact O-N 3.36Å; Q1035-T1037 VanDerWaalsContact C-N 3.32Å; Q1035-T1037 PolarHBondContact O-N 3.38Å
1036	W	92.6	Very high	92.3	Very high	7 Å²	7	30.2 Å²	30.2	3%	0.027	15%	0.154	C	C	.	.	H	α-helix	trans	-72	-20.8	177.8	173.1	91.1	0	0	0	113.2	I902 N933 H934 L935 A1032 T1033 T1034 S1038 M1039 G1040 F1056 M1058 L1061	I902-W1036 HydrophobicContact CD1-CE3 3.78Å; I902-W1036 HydrophobicContact CD1-CZ3 4.07Å; N933-W1036 HydrophobicContact CB-CZ2 4.32Å; N933-W1036 WeakPolarHBondContact O-CZ2 3.46Å; N933-W1036 PolarHBondContact O-NE1 3.3Å; N933-W1036 VanDerWaalsContact O-NE1 3.1Å; H934-W1036 PolarHBondContact O-NE1 3.17Å; L935-W1036 HydrophobicContact CD2-CD2 3.85Å; L935-W1036 VanDerWaalsContact CD2-CE2 3.4Å; L935-W1036 HydrophobicContact CD2-CE3 4.31Å; L935-W1036 HydrophobicContact CD2-CG 4.43Å; L935-W1036 HydrophobicContact CD2-CH2 3.93Å; L935-W1036 HydrophobicContact CD2-CZ2 3.46Å; L935-W1036 VanDerWaalsContact CD2-CZ2 3.46Å; L935-W1036 HydrophobicContact CD2-CZ3 4.34Å; L935-W1036 HydrophobicContact CG-CH2 4.45Å; L935-W1036 HydrophobicContact CG-CZ2 3.69Å; A1032-W1036 HydrophobicContact CB-CB 4.21Å; A1032-W1036 HydrophobicContact CB-CD2 4.1Å; A1032-W1036 HydrophobicContact CB-CE3 4Å; A1032-W1036 HydrophobicContact CB-CG 4.21Å; T1033-W1036 PolarHBondContact O-N 3.12Å; T1033-W1036 VanDerWaalsContact O-N 3.15Å; T1034-W1036 PolarHBondContact O-N 2.87Å; T1034-W1036 VanDerWaalsContact O-N 3.11Å; W1036-S1038 VanDerWaalsContact C-N 3.3Å; W1036-S1038 PolarHBondContact O-N 2.92Å; W1036-S1038 VanDerWaalsContact O-N 3.17Å; W1036-M1039 PolarHBondContact O-N 2.73Å; W1036-G1040 PolarHBondContact O-N 3.2Å; W1036-F1056 HydrophobicContact CH2-CE2 4.26Å; W1036-F1056 AromaticContact CH2-CZ 3.96Å; W1036-F1056 HydrophobicContact CH2-CZ 3.96Å; W1036-M1058 HydrophobicContact CH2-CE 4Å; W1036-M1058 HydrophobicContact CH2-SD 3.44Å; W1036-M1058 WeakPolarHBondContact CH2-SD 3.48Å; W1036-M1058 HydrophobicContact CZ2-SD 4.49Å; W1036-M1058 HydrophobicContact CZ3-CE 3.82Å; W1036-M1058 HydrophobicContact CZ3-SD 3.79Å; W1036-L1061 HydrophobicContact CH2-CD2 4.31Å; W1036-L1061 HydrophobicContact CZ3-CD2 3.77Å
1037	T	91.4	Very high	91.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.3	-39	-169.1	54.3	0	0	0	0	113.8	I902 T1034 Q1035 F1041 I1081	I902-T1037 HydrophobicContact CD1-CG2 3.41Å; I902-T1037 VanDerWaalsContact CD1-CG2 3.41Å; T1034-T1037 PolarHBondContact O-N 2.89Å; T1034-T1037 PolarHBondContact O-OG1 2.99Å; Q1035-T1037 VanDerWaalsContact C-N 3.32Å; Q1035-T1037 PolarHBondContact O-N 3.38Å; T1037-F1041 VanDerWaalsContact O-CB 3.31Å; T1037-F1041 WeakPolarHBondContact O-CB 3.45Å; T1037-F1041 PolarHBondContact O-N 2.82Å; T1037-I1081 HydrophobicContact CG2-CG2 4.05Å
1038	S	91.6	Very high	91.4	Very high	55 Å²	55	32.2 Å²	32.2	39%	0.385	16%	0.163	S	C	.	.	H	α-helix	trans	-68.5	-47.8	-179.4	-48.5	0	0	0	0	111.3	W1036 F1041 E1042	W1036-S1038 VanDerWaalsContact C-N 3.3Å; W1036-S1038 PolarHBondContact O-N 2.92Å; W1036-S1038 VanDerWaalsContact O-N 3.17Å; S1038-F1041 PolarHBondContact O-N 3.4Å; S1038-E1042 PolarHBondContact O-N 2.77Å; S1038-E1042 VanDerWaalsContact O-N 3.1Å
1039	M	91.3	Very high	90.9	Very high	74 Å²	74	39.2 Å²	39.2	37%	0.365	19%	0.187	S	C	.	.	H	α-helix	trans	-62.4	-43.7	175.4	174.1	163.8	46.8	0	0	111.7	H934 P1012 W1036 F1041 E1042 T1043	H934-M1039 HydrophobicContact CB-CG 4.04Å; H934-M1039 HydrophobicContact CB-SD 3.99Å; P1012-M1039 HydrophobicContact CB-CE 3.37Å; P1012-M1039 HydrophobicContact CB-SD 3.84Å; P1012-M1039 HydrophobicContact CG-CE 3.59Å; W1036-M1039 PolarHBondContact O-N 2.73Å; M1039-F1041 VanDerWaalsContact C-N 3.27Å; M1039-F1041 PolarHBondContact O-N 3.12Å; M1039-E1042 PolarHBondContact O-N 3.45Å; M1039-T1043 WeakPolarHBondContact O-CB 3.44Å; M1039-T1043 PolarHBondContact O-N 2.75Å; M1039-T1043 PolarHBondContact O-OG1 3.36Å
1040	G	91.9	Very high	90.3	Very high	2 Å²	2	44.2 Å²	44.2	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-62.7	-31.2	175.4	0	0	0	0	0	113.5	W1036 A1044	W1036-G1040 PolarHBondContact O-N 3.2Å; G1040-A1044 VanDerWaalsContact O-CB 3.3Å; G1040-A1044 WeakPolarHBondContact O-CB 3.35Å; G1040-A1044 PolarHBondContact O-N 3.09Å
1041	F	92.2	Very high	89.8	Confident	16 Å²	16	47.3 Å²	47.3	7%	0.07	22%	0.22	C	C	.	.	H	α-helix	trans	-72.4	-47.5	177	-168.7	-113.1	0	0	0	111.7	T1037 S1038 M1039 T1043 A1044 K1045 M1058 L1062 L1084 L1088	T1037-F1041 VanDerWaalsContact O-CB 3.31Å; T1037-F1041 WeakPolarHBondContact O-CB 3.45Å; T1037-F1041 PolarHBondContact O-N 2.82Å; S1038-F1041 PolarHBondContact O-N 3.4Å; M1039-F1041 VanDerWaalsContact C-N 3.27Å; M1039-F1041 PolarHBondContact O-N 3.12Å; F1041-T1043 PolarHBondContact O-N 2.76Å; F1041-A1044 WeakPolarHBondContact O-CB 3.4Å; F1041-A1044 PolarHBondContact O-N 2.75Å; F1041-A1044 VanDerWaalsContact O-N 3.1Å; F1041-K1045 PolarHBondContact O-N 3.28Å; F1041-M1058 HydrophobicContact CB-CE 4.42Å; F1041-L1062 HydrophobicContact CD2-CD1 3.66Å; F1041-L1062 HydrophobicContact CE2-CD1 3.84Å; F1041-L1084 HydrophobicContact CB-CD1 4.45Å; F1041-L1084 HydrophobicContact CB-CD2 4.29Å; F1041-L1084 HydrophobicContact CD1-CD2 3.83Å; F1041-L1084 HydrophobicContact CE1-CD2 4.43Å; F1041-L1084 HydrophobicContact CG-CD2 4.23Å; F1041-L1088 HydrophobicContact CE2-CB 4.42Å; F1041-L1088 HydrophobicContact CZ-CB 4.24Å
1042	E	91.6	Very high	89.2	Confident	94 Å²	94	49.2 Å²	49.2	44%	0.439	23%	0.23	S	C	.	.	H	α-helix	trans	-63.3	-41.8	173.6	-62.7	-43.8	109.9	0	0	111.8	S1038 M1039 A1044 K1045 E1046	S1038-E1042 PolarHBondContact O-N 2.77Å; S1038-E1042 VanDerWaalsContact O-N 3.1Å; M1039-E1042 PolarHBondContact O-N 3.45Å; E1042-A1044 PolarHBondContact O-N 3.13Å; E1042-K1045 WeakPolarHBondContact O-CB 3.44Å; E1042-K1045 PolarHBondContact O-N 3.02Å; E1042-K1045 WeakPolarHBondContact OE1-CE 3.47Å; E1042-K1045 IonicContact OE1-NZ 3.15Å; E1042-K1045 PolarHBondContact OE1-NZ 2.93Å; E1042-K1045 WeakPolarHBondContact OE2-CD 3.48Å; E1042-K1045 IonicContact OE2-NZ 3.91Å; E1042-K1045 PolarHBondContact OE2-NZ 3.08Å; E1042-E1046 PolarHBondContact O-N 3.35Å
1043	T	90.4	Very high	88.7	Confident	11 Å²	11	51.5 Å²	51.5	7%	0.067	25%	0.249	C	C	.	.	H	α-helix	trans	-58.5	-36.5	173.3	-49.8	0	0	0	0	111.6	Q932 H934 M1039 F1041 E1046 M1047	Q932-T1043 WeakPolarHBondContact O-CG2 3.36Å; H934-T1043 WeakPolarHBondContact ND1-CG2 3.42Å; H934-T1043 PolarHBondContact ND1-OG1 2.9Å; M1039-T1043 WeakPolarHBondContact O-CB 3.44Å; M1039-T1043 PolarHBondContact O-N 2.75Å; M1039-T1043 PolarHBondContact O-OG1 3.36Å; F1041-T1043 PolarHBondContact O-N 2.76Å; T1043-E1046 PolarHBondContact O-N 2.82Å; T1043-M1047 HydrophobicContact CG2-CE 4.05Å; T1043-M1047 HydrophobicContact CG2-CG 4.48Å; T1043-M1047 WeakPolarHBondContact O-CB 3.14Å; T1043-M1047 WeakPolarHBondContact O-CG 3.46Å; T1043-M1047 PolarHBondContact O-N 3.25Å
1044	A	90.5	Very high	87.9	Confident	8 Å²	8	51.1 Å²	51.1	7%	0.066	25%	0.246	C	C	.	.	H	α-helix	trans	-71.8	-32.3	175.8	0	0	0	0	0	113.1	G1040 F1041 E1042 K1048 K1054 M1058	G1040-A1044 VanDerWaalsContact O-CB 3.3Å; G1040-A1044 WeakPolarHBondContact O-CB 3.35Å; G1040-A1044 PolarHBondContact O-N 3.09Å; F1041-A1044 WeakPolarHBondContact O-CB 3.4Å; F1041-A1044 PolarHBondContact O-N 2.75Å; F1041-A1044 VanDerWaalsContact O-N 3.1Å; E1042-A1044 PolarHBondContact O-N 3.13Å; A1044-K1048 WeakPolarHBondContact O-CB 3.49Å; A1044-K1048 PolarHBondContact O-N 3.4Å; A1044-K1054 VanDerWaalsContact O-CE 3.24Å; A1044-K1054 WeakPolarHBondContact O-CE 3.29Å; A1044-K1054 PolarHBondContact O-NZ 3.17Å; A1044-M1058 HydrophobicContact CB-CB 4.03Å; A1044-M1058 HydrophobicContact CB-CG 3.46Å; A1044-M1058 VanDerWaalsContact CB-CG 3.46Å
1045	K	90.3	Very high	87.4	Confident	74 Å²	74	51.9 Å²	51.9	32%	0.322	25%	0.252	S	S	.	.	H	α-helix	trans	-63.7	-46.7	168.5	-66.3	169.1	-178.8	167.7	0	110.1	F1041 E1042 K1048 R1049 E1087	F1041-K1045 PolarHBondContact O-N 3.28Å; E1042-K1045 WeakPolarHBondContact O-CB 3.44Å; E1042-K1045 PolarHBondContact O-N 3.02Å; E1042-K1045 WeakPolarHBondContact OE1-CE 3.47Å; E1042-K1045 IonicContact OE1-NZ 3.15Å; E1042-K1045 PolarHBondContact OE1-NZ 2.93Å; E1042-K1045 WeakPolarHBondContact OE2-CD 3.48Å; E1042-K1045 IonicContact OE2-NZ 3.91Å; E1042-K1045 PolarHBondContact OE2-NZ 3.08Å; K1045-K1048 WeakPolarHBondContact O-CB 3.44Å; K1045-K1048 PolarHBondContact O-N 3.3Å; K1045-R1049 PolarHBondContact O-N 3.16Å; K1045-E1087 WeakPolarHBondContact CE-OE1 3.48Å; K1045-E1087 IonicContact NZ-OE1 2.62Å; K1045-E1087 PolarHBondContact NZ-OE1 2.84Å; K1045-E1087 IonicContact NZ-OE2 2.66Å; K1045-E1087 PolarHBondContact NZ-OE2 2.86Å
1046	E	88	Confident	87.5	Confident	70 Å²	70	46.6 Å²	46.6	33%	0.327	23%	0.227	S	C	.	.	H	α-helix	trans	-66.2	-46	-178.2	176.9	53.2	-161.4	0	0	113.2	E1042 T1043 K1048 R1049 R1050	E1042-E1046 PolarHBondContact O-N 3.35Å; T1043-E1046 PolarHBondContact O-N 2.82Å; E1046-K1048 PolarHBondContact O-N 3.27Å; E1046-R1049 CarbonylContact O-C 3.5Å; E1046-R1049 WeakPolarHBondContact O-CA 3.47Å; E1046-R1049 WeakPolarHBondContact O-CB 3.48Å; E1046-R1049 PolarHBondContact O-N 2.98Å; E1046-R1049 IonicContact OE1-CZ 2.68Å; E1046-R1049 IonicContact OE1-NE 2.77Å; E1046-R1049 IonicContact OE1-NH2 3.12Å; E1046-R1049 PolarHBondContact OE1-NH2 3.48Å; E1046-R1049 IonicContact OE2-CZ 2.68Å; E1046-R1049 IonicContact OE2-NE 3.7Å; E1046-R1049 PolarHBondContact OE2-NE 3.01Å; E1046-R1049 IonicContact OE2-NH2 3.33Å; E1046-R1049 PolarHBondContact OE2-NH2 3.24Å; E1046-R1050 PolarHBondContact O-N 3.02Å; E1046-R1050 WeakPolarHBondContact OE1-CD 3.21Å; E1046-R1050 VanDerWaalsContact OE1-CG 3.27Å; E1046-R1050 WeakPolarHBondContact OE1-CG 3.42Å
1047	M	86.3	Confident	87.3	Confident	9 Å²	9	46.3 Å²	46.3	4%	0.044	23%	0.226	C	C	.	.	H	α-helix	trans	-58.6	-35.8	172.9	-80.4	-166.6	-77.2	0	0	112.3	Q932 N933 T1043 R1050 H1051 I1052 K1054	Q932-M1047 HydrophobicContact CB-SD 4.21Å; Q932-M1047 VanDerWaalsContact O-SD 3.33Å; N933-M1047 HydrophobicContact CB-CE 4.4Å; N933-M1047 WeakPolarHBondContact OD1-CE 3.17Å; T1043-M1047 HydrophobicContact CG2-CE 4.05Å; T1043-M1047 HydrophobicContact CG2-CG 4.48Å; T1043-M1047 WeakPolarHBondContact O-CB 3.14Å; T1043-M1047 WeakPolarHBondContact O-CG 3.46Å; T1043-M1047 PolarHBondContact O-N 3.25Å; M1047-R1050 CarbonylContact O-C 3.54Å; M1047-R1050 PolarHBondContact O-N 3.22Å; M1047-H1051 PolarHBondContact O-N 2.93Å; M1047-I1052 HydrophobicContact CB-CB 4.18Å; M1047-I1052 HydrophobicContact CG-CB 4.17Å; M1047-I1052 HydrophobicContact CG-CD1 4.49Å; M1047-I1052 HydrophobicContact CG-CG2 4.27Å; M1047-I1052 PolarHBondContact O-N 3.3Å; M1047-I1052 HydrophobicContact SD-CG2 4.17Å; M1047-K1054 HydrophobicContact CB-CG 4.26Å; M1047-K1054 HydrophobicContact CE-CD 4.18Å; M1047-K1054 HydrophobicContact CE-CG 3.86Å; M1047-K1054 HydrophobicContact SD-CG 3.9Å
1048	K	88	Confident	87.3	Confident	35 Å²	35	46.8 Å²	46.8	15%	0.152	23%	0.228	C	C	.	.	H	α-helix	trans	-66.1	-41.4	174.5	-176.8	-172.2	-175.1	-164.3	0	110.8	A1044 K1045 E1046 H1051 C1142 H1144 C1161 E1163	A1044-K1048 WeakPolarHBondContact O-CB 3.49Å; A1044-K1048 PolarHBondContact O-N 3.4Å; K1045-K1048 WeakPolarHBondContact O-CB 3.44Å; K1045-K1048 PolarHBondContact O-N 3.3Å; E1046-K1048 PolarHBondContact O-N 3.27Å; K1048-H1051 PolarHBondContact O-N 3.1Å; K1048-C1142 HydrophobicContact CG-CB 4.17Å; K1048-H1144 HydrophobicContact CG-CB 4.09Å; K1048-C1161 WeakPolarHBondContact CE-SG 3.34Å; K1048-E1163 WeakPolarHBondContact CE-OE2 3.42Å; K1048-E1163 IonicContact NZ-OE2 2.7Å; K1048-E1163 PolarHBondContact NZ-OE2 3.22Å
1049	R	87	Confident	87.3	Confident	168 Å²	168	45.3 Å²	45.3	63%	0.634	22%	0.215	S	C	*	.	H	α-helix	trans	-64	-42.6	175.3	-167.5	-170.3	69.2	91.4	1.5	112.1	K1045 E1046 H1051	K1045-R1049 PolarHBondContact O-N 3.16Å; E1046-R1049 CarbonylContact O-C 3.5Å; E1046-R1049 WeakPolarHBondContact O-CA 3.47Å; E1046-R1049 WeakPolarHBondContact O-CB 3.48Å; E1046-R1049 PolarHBondContact O-N 2.98Å; E1046-R1049 IonicContact OE1-CZ 2.68Å; E1046-R1049 IonicContact OE1-NE 2.77Å; E1046-R1049 IonicContact OE1-NH2 3.12Å; E1046-R1049 PolarHBondContact OE1-NH2 3.48Å; E1046-R1049 IonicContact OE2-CZ 2.68Å; E1046-R1049 IonicContact OE2-NE 3.7Å; E1046-R1049 PolarHBondContact OE2-NE 3.01Å; E1046-R1049 IonicContact OE2-NH2 3.33Å; E1046-R1049 PolarHBondContact OE2-NH2 3.24Å; R1049-H1051 VanDerWaalsContact C-N 3.27Å; R1049-H1051 PolarHBondContact O-CE1 2.96Å; R1049-H1051 PolarHBondContact O-N 2.95Å; R1049-H1051 PolarHBondContact O-ND1 3.31Å
1050	R	83.8	Confident	87.2	Confident	105 Å²	105	44.6 Å²	44.6	40%	0.396	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	3.5	175.8	-72.1	-177.2	70.7	-176.2	2.9	114.7	E1046 M1047 I1052	E1046-R1050 PolarHBondContact O-N 3.02Å; E1046-R1050 WeakPolarHBondContact OE1-CD 3.21Å; E1046-R1050 VanDerWaalsContact OE1-CG 3.27Å; E1046-R1050 WeakPolarHBondContact OE1-CG 3.42Å; M1047-R1050 CarbonylContact O-C 3.54Å; M1047-R1050 PolarHBondContact O-N 3.22Å; R1050-I1052 HydrophobicContact CB-CD1 3.78Å; R1050-I1052 HydrophobicContact CB-CG1 3.87Å; R1050-I1052 PolarHBondContact O-N 2.67Å
1051	H	85.2	Confident	87.2	Confident	94 Å²	94	44.5 Å²	44.5	44%	0.435	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	26.8	178.5	-56.8	53	0	0	0	113.9	M1047 K1048 R1049 I1141	M1047-H1051 PolarHBondContact O-N 2.93Å; K1048-H1051 PolarHBondContact O-N 3.1Å; R1049-H1051 VanDerWaalsContact C-N 3.27Å; R1049-H1051 PolarHBondContact O-CE1 2.96Å; R1049-H1051 PolarHBondContact O-N 2.95Å; R1049-H1051 PolarHBondContact O-ND1 3.31Å; H1051-I1141 PolarHBondContact CD2-O 3.08Å; H1051-I1141 VanDerWaalsContact CD2-O 3.3Å
1052	I	82.8	Confident	87.2	Confident	42 Å²	42	43.7 Å²	43.7	22%	0.215	21%	0.206	C	C	.	.			trans	-81.8	128.6	-176.8	-61.7	173.5	0	0	0	110.4	M1047 R1050 K1054	M1047-I1052 HydrophobicContact CB-CB 4.18Å; M1047-I1052 HydrophobicContact CG-CB 4.17Å; M1047-I1052 HydrophobicContact CG-CD1 4.49Å; M1047-I1052 HydrophobicContact CG-CG2 4.27Å; M1047-I1052 PolarHBondContact O-N 3.3Å; M1047-I1052 HydrophobicContact SD-CG2 4.17Å; R1050-I1052 HydrophobicContact CB-CD1 3.78Å; R1050-I1052 HydrophobicContact CB-CG1 3.87Å; R1050-I1052 PolarHBondContact O-N 2.67Å; I1052-K1054 PolarHBondContact O-N 3.44Å; I1052-K1054 VanDerWaalsContact O-N 3.09Å
1053	A	81.4	Confident	87.2	Confident	49 Å²	49	39.3 Å²	39.3	41%	0.405	19%	0.185	S	C	.	.			trans	-75.5	96.4	-176.2	0	0	0	0	0	112.5	Q1143	A1053-Q1143 HydrophobicContact CB-CB 4.01Å
1054	K	75.7	Confident	87.2	Confident	6 Å²	6	41.6 Å²	41.6	3%	0.026	20%	0.195	C	C	.	.			trans	-62	146.8	-177.5	-55.8	175.3	-174.9	163.6	0	113.5	A1044 M1047 I1052 F1056 R1138 H1144	A1044-K1054 VanDerWaalsContact O-CE 3.24Å; A1044-K1054 WeakPolarHBondContact O-CE 3.29Å; A1044-K1054 PolarHBondContact O-NZ 3.17Å; M1047-K1054 HydrophobicContact CB-CG 4.26Å; M1047-K1054 HydrophobicContact CE-CD 4.18Å; M1047-K1054 HydrophobicContact CE-CG 3.86Å; M1047-K1054 HydrophobicContact SD-CG 3.9Å; I1052-K1054 PolarHBondContact O-N 3.44Å; I1052-K1054 VanDerWaalsContact O-N 3.09Å; K1054-F1056 VanDerWaalsContact C-N 3.34Å; K1054-F1056 VanDerWaalsContact CB-O 3.29Å; K1054-F1056 WeakPolarHBondContact CB-O 3.13Å; K1054-R1138 PolarHBondContact O-NH1 2.87Å; K1054-R1138 PolarHBondContact O-NH2 3.32Å; K1054-H1144 PolarHBondContact NZ-ND1 3Å
1055	P	77.6	Confident	87.2	Confident	49 Å²	49	41.3 Å²	41.3	32%	0.318	19%	0.192	S	C	.	.	S	Bend	trans	-70.4	-26.4	170.5	27	-32.4	0	0	0	113.3	V909 V912 N933	V909-P1055 HydrophobicContact CG1-CB 4.45Å; V912-P1055 HydrophobicContact CG2-CB 4.06Å; V912-P1055 HydrophobicContact CG2-CG 4.09Å; N933-P1055 WeakPolarHBondContact OD1-CD 3.37Å
1056	F	88	Confident	87.2	Confident	10 Å²	10	37.8 Å²	37.8	4%	0.044	18%	0.177	C	C	.	.	S	Bend	trans	-147.9	175.8	177.3	61.4	-89.6	0	0	0	112.8	L906 V912 L935 W1036 K1054 M1058 L1061	L906-F1056 HydrophobicContact CD1-CD1 4.16Å; L906-F1056 HydrophobicContact CD1-CD2 3.95Å; L906-F1056 HydrophobicContact CD1-CE1 4.28Å; L906-F1056 HydrophobicContact CD1-CE2 4.05Å; L906-F1056 HydrophobicContact CD1-CG 4.01Å; L906-F1056 HydrophobicContact CD1-CZ 4.22Å; L906-F1056 HydrophobicContact CD2-CB 3.62Å; L906-F1056 HydrophobicContact CD2-CD2 3.57Å; L906-F1056 HydrophobicContact CD2-CE2 4.38Å; L906-F1056 HydrophobicContact CD2-CG 3.67Å; L906-F1056 HydrophobicContact CG-CD2 4.38Å; V912-F1056 HydrophobicContact CG1-CD1 4.18Å; V912-F1056 HydrophobicContact CG1-CE1 3.91Å; V912-F1056 HydrophobicContact CG2-CD1 4.12Å; V912-F1056 HydrophobicContact CG2-CE1 4.14Å; L935-F1056 HydrophobicContact CD1-CE1 3.98Å; L935-F1056 HydrophobicContact CD1-CZ 4.16Å; W1036-F1056 HydrophobicContact CH2-CE2 4.26Å; W1036-F1056 AromaticContact CH2-CZ 3.96Å; W1036-F1056 HydrophobicContact CH2-CZ 3.96Å; K1054-F1056 VanDerWaalsContact C-N 3.34Å; K1054-F1056 VanDerWaalsContact CB-O 3.29Å; K1054-F1056 WeakPolarHBondContact CB-O 3.13Å; F1056-M1058 HydrophobicContact CE2-SD 3.78Å; F1056-L1061 HydrophobicContact CE2-CD2 4.08Å
1057	S	89.3	Confident	87.2	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.007	17%	0.172	C	C	.	.			trans	-101.8	125.3	174.4	-176.6	0	0	0	0	111.3	E1059 K1060 L1061 L1145	S1057-E1059 VanDerWaalsContact C-N 3.26Å; S1057-E1059 PolarHBondContact O-N 2.9Å; S1057-E1059 WeakPolarHBondContact OG-CB 3.29Å; S1057-E1059 PolarHBondContact OG-N 3.16Å; S1057-K1060 WeakPolarHBondContact O-CB 3.46Å; S1057-K1060 PolarHBondContact O-N 3.02Å; S1057-L1061 PolarHBondContact O-N 3.03Å; S1057-L1145 VanDerWaalsContact CB-O 3.23Å; S1057-L1145 WeakPolarHBondContact CB-O 3.43Å; S1057-L1145 PolarHBondContact OG-O 3.19Å
1058	M	91.1	Very high	87.2	Confident	10 Å²	10	37.6 Å²	37.6	5%	0.049	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-33	171.6	-79.2	-58.3	-69.1	0	0	112.4	W1036 F1041 A1044 F1056 K1060 L1061 L1062	W1036-M1058 HydrophobicContact CH2-CE 4Å; W1036-M1058 HydrophobicContact CH2-SD 3.44Å; W1036-M1058 WeakPolarHBondContact CH2-SD 3.48Å; W1036-M1058 HydrophobicContact CZ2-SD 4.49Å; W1036-M1058 HydrophobicContact CZ3-CE 3.82Å; W1036-M1058 HydrophobicContact CZ3-SD 3.79Å; F1041-M1058 HydrophobicContact CB-CE 4.42Å; A1044-M1058 HydrophobicContact CB-CB 4.03Å; A1044-M1058 HydrophobicContact CB-CG 3.46Å; A1044-M1058 VanDerWaalsContact CB-CG 3.46Å; F1056-M1058 HydrophobicContact CE2-SD 3.78Å; M1058-K1060 VanDerWaalsContact C-N 3.31Å; M1058-K1060 PolarHBondContact O-N 2.69Å; M1058-L1061 HydrophobicContact CE-CD2 4.42Å; M1058-L1061 PolarHBondContact O-N 3.01Å; M1058-L1061 HydrophobicContact SD-CD2 4.01Å; M1058-L1062 HydrophobicContact CE-CG 4.47Å; M1058-L1062 WeakPolarHBondContact O-CG 3.24Å; M1058-L1062 PolarHBondContact O-N 3.43Å
1059	E	90.3	Very high	87	Confident	25 Å²	25	36.1 Å²	36.1	12%	0.117	17%	0.174	C	C	.	.	H	α-helix	trans	-57.4	-47.1	175.5	-51.8	167.2	-169.3	0	0	110.4	S1057 Y1063 L1088 H1144 Y1147 L1148	S1057-E1059 VanDerWaalsContact C-N 3.26Å; S1057-E1059 PolarHBondContact O-N 2.9Å; S1057-E1059 WeakPolarHBondContact OG-CB 3.29Å; S1057-E1059 PolarHBondContact OG-N 3.16Å; E1059-Y1063 WeakPolarHBondContact O-CB 3.43Å; E1059-Y1063 WeakPolarHBondContact O-CD2 3.49Å; E1059-Y1063 PolarHBondContact O-N 3.38Å; E1059-L1088 HydrophobicContact CB-CD2 4.4Å; E1059-L1088 HydrophobicContact CG-CD1 4.12Å; E1059-H1144 IonicContact OE1-CD2 3.35Å; E1059-H1144 IonicContact OE1-CE1 2.75Å; E1059-H1144 PolarHBondContact OE1-CE1 2.86Å; E1059-H1144 IonicContact OE1-NE2 2.66Å; E1059-H1144 PolarHBondContact OE1-NE2 3.47Å; E1059-Y1147 HydrophobicContact CB-CD1 4.18Å; E1059-Y1147 WeakPolarHBondContact OE2-CA 3.26Å; E1059-Y1147 PolarHBondContact OE2-N 3.47Å; E1059-L1148 HydrophobicContact CB-CD1 4.44Å; E1059-L1148 HydrophobicContact CB-CG 4.11Å; E1059-L1148 PolarHBondContact OE2-N 2.84Å
1060	K	90.6	Very high	86.6	Confident	58 Å²	58	28.4 Å²	28.4	25%	0.252	15%	0.146	S	C	.	.	H	α-helix	trans	-59.8	-49.9	175.7	-179.3	-175	168.8	-166.2	0	110.7	L906 S1057 M1058 Y1063 Q1064 Y1147	L906-K1060 PolarHBondContact O-NZ 3.26Å; S1057-K1060 WeakPolarHBondContact O-CB 3.46Å; S1057-K1060 PolarHBondContact O-N 3.02Å; M1058-K1060 VanDerWaalsContact C-N 3.31Å; M1058-K1060 PolarHBondContact O-N 2.69Å; K1060-Y1063 PolarHBondContact O-N 3.48Å; K1060-Q1064 HydrophobicContact CG-CG 4.19Å; K1060-Q1064 WeakPolarHBondContact O-CB 3.34Å; K1060-Q1064 VanDerWaalsContact O-CG 3.23Å; K1060-Q1064 WeakPolarHBondContact O-CG 3.35Å; K1060-Q1064 PolarHBondContact O-N 2.8Å; K1060-Y1147 VanDerWaalsContact CA-CD1 3.47Å; K1060-Y1147 HydrophobicContact CB-CD1 3.91Å; K1060-Y1147 HydrophobicContact CB-CD2 3.66Å; K1060-Y1147 HydrophobicContact CB-CE1 4.21Å; K1060-Y1147 HydrophobicContact CB-CE2 3.98Å; K1060-Y1147 HydrophobicContact CB-CG 3.62Å; K1060-Y1147 HydrophobicContact CD-CD2 4.28Å; K1060-Y1147 HydrophobicContact CD-CE2 4.29Å; K1060-Y1147 HydrophobicContact CG-CD2 3.86Å; K1060-Y1147 HydrophobicContact CG-CE2 3.72Å; K1060-Y1147 HydrophobicContact CG-CG 4.3Å
1061	L	91.9	Very high	86.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.3	-52	-177.9	175	55.2	0	0	0	111.2	I902 H905 L906 W1036 F1056 S1057 M1058 Y1063 Q1064 I1065	I902-L1061 HydrophobicContact CD1-CD2 4.22Å; I902-L1061 WeakPolarHBondContact O-CD1 3.23Å; H905-L1061 HydrophobicContact CB-CD1 4.04Å; L906-L1061 HydrophobicContact CD1-CD2 4.42Å; L906-L1061 HydrophobicContact CD2-CB 4.34Å; L906-L1061 HydrophobicContact CG-CB 4.5Å; L906-L1061 HydrophobicContact CG-CD1 4.19Å; W1036-L1061 HydrophobicContact CH2-CD2 4.31Å; W1036-L1061 HydrophobicContact CZ3-CD2 3.77Å; F1056-L1061 HydrophobicContact CE2-CD2 4.08Å; S1057-L1061 PolarHBondContact O-N 3.03Å; M1058-L1061 HydrophobicContact CE-CD2 4.42Å; M1058-L1061 PolarHBondContact O-N 3.01Å; M1058-L1061 HydrophobicContact SD-CD2 4.01Å; L1061-Y1063 PolarHBondContact O-N 2.93Å; L1061-Q1064 PolarHBondContact O-N 3.42Å; L1061-I1065 HydrophobicContact CD1-CD1 3.67Å; L1061-I1065 HydrophobicContact CD1-CG1 3.95Å; L1061-I1065 HydrophobicContact CG-CD1 3.86Å; L1061-I1065 VanDerWaalsContact O-CG1 3.29Å; L1061-I1065 WeakPolarHBondContact O-CG1 3.45Å; L1061-I1065 PolarHBondContact O-N 3.23Å
1062	L	92.3	Very high	85.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60	-43.8	179.5	-68.5	174.4	0	0	0	112	F1041 M1058 Q1064 I1065 A1066 I1081 L1084 L1085 L1088	F1041-L1062 HydrophobicContact CD2-CD1 3.66Å; F1041-L1062 HydrophobicContact CE2-CD1 3.84Å; M1058-L1062 HydrophobicContact CE-CG 4.47Å; M1058-L1062 WeakPolarHBondContact O-CG 3.24Å; M1058-L1062 PolarHBondContact O-N 3.43Å; L1062-Q1064 PolarHBondContact O-N 2.94Å; L1062-I1065 PolarHBondContact O-N 2.89Å; L1062-A1066 WeakPolarHBondContact O-CB 3.45Å; L1062-A1066 PolarHBondContact O-N 3.38Å; L1062-I1081 HydrophobicContact CD2-CB 4.3Å; L1062-I1081 HydrophobicContact CD2-CG2 4.11Å; L1062-L1084 HydrophobicContact CD1-CB 4.17Å; L1062-L1084 HydrophobicContact CD2-CD1 4.33Å; L1062-L1085 HydrophobicContact CB-CD2 3.98Å; L1062-L1088 HydrophobicContact CD1-CD2 4.22Å
1063	Y	90.8	Very high	85.1	Confident	1 Å²	1	37 Å²	37	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-67	-34	177.1	-90.2	-117.4	0	0	0	113.5	E1059 K1060 L1061 A1066 Q1067 L1085 L1088 Y1147 L1148 Y1184 I1189 L1192	E1059-Y1063 WeakPolarHBondContact O-CB 3.43Å; E1059-Y1063 WeakPolarHBondContact O-CD2 3.49Å; E1059-Y1063 PolarHBondContact O-N 3.38Å; K1060-Y1063 PolarHBondContact O-N 3.48Å; L1061-Y1063 PolarHBondContact O-N 2.93Å; Y1063-A1066 WeakPolarHBondContact O-CB 3.42Å; Y1063-Q1067 WeakPolarHBondContact O-CB 3.44Å; Y1063-Q1067 VanDerWaalsContact O-CG 3.24Å; Y1063-Q1067 WeakPolarHBondContact O-CG 3.5Å; Y1063-Q1067 PolarHBondContact O-N 3.41Å; Y1063-L1085 HydrophobicContact CD2-CD2 4.25Å; Y1063-L1085 HydrophobicContact CE2-CD2 4.32Å; Y1063-L1088 HydrophobicContact CD2-CD2 4.04Å; Y1063-L1088 HydrophobicContact CE2-CD2 3.71Å; Y1063-L1088 HydrophobicContact CE2-CG 4.28Å; Y1063-Y1147 HydrophobicContact CG-CE1 4.42Å; Y1063-L1148 HydrophobicContact CD1-CD2 3.85Å; Y1063-L1148 HydrophobicContact CD2-CD2 3.89Å; Y1063-L1148 HydrophobicContact CE1-CD2 3.58Å; Y1063-L1148 HydrophobicContact CE2-CD1 3.74Å; Y1063-L1148 HydrophobicContact CE2-CD2 3.64Å; Y1063-L1148 HydrophobicContact CE2-CG 4.3Å; Y1063-L1148 HydrophobicContact CG-CD2 3.99Å; Y1063-L1148 VanDerWaalsContact CZ-CD2 3.46Å; Y1063-Y1184 AromaticContact CD1-CD2 3.9Å; Y1063-Y1184 HydrophobicContact CD1-CD2 3.9Å; Y1063-Y1184 AromaticContact CD1-CE2 3.63Å; Y1063-Y1184 HydrophobicContact CD1-CE2 3.63Å; Y1063-Y1184 AromaticContact CE1-CD2 3.78Å; Y1063-Y1184 HydrophobicContact CE1-CD2 3.78Å; Y1063-Y1184 HydrophobicContact CE1-CE2 4.02Å; Y1063-I1189 HydrophobicContact CE1-CG1 4.39Å; Y1063-I1189 WeakPolarHBondContact OH-CG1 3.22Å; Y1063-I1189 VanDerWaalsContact OH-CG2 3.3Å; Y1063-I1189 WeakPolarHBondContact OH-CG2 3.47Å; Y1063-L1192 HydrophobicContact CD1-CD2 3.95Å; Y1063-L1192 HydrophobicContact CE1-CD2 4.07Å
1064	Q	90.4	Very high	84.7	Confident	60 Å²	60	38 Å²	38	28%	0.28	19%	0.185	S	C	.	.	H	α-helix	trans	-78	-30.2	178	-68.5	-61.5	-65	0	0	112.8	H905 K1060 L1061 L1062 A1068 Y1147	H905-Q1064 HydrophobicContact CB-CB 3.93Å; H905-Q1064 PolarHBondContact ND1-O 2.83Å; H905-Q1064 WeakPolarHBondContact O-CB 3.32Å; K1060-Q1064 HydrophobicContact CG-CG 4.19Å; K1060-Q1064 WeakPolarHBondContact O-CB 3.34Å; K1060-Q1064 VanDerWaalsContact O-CG 3.23Å; K1060-Q1064 WeakPolarHBondContact O-CG 3.35Å; K1060-Q1064 PolarHBondContact O-N 2.8Å; L1061-Q1064 PolarHBondContact O-N 3.42Å; L1062-Q1064 PolarHBondContact O-N 2.94Å; Q1064-A1068 WeakPolarHBondContact O-CB 3.41Å; Q1064-A1068 PolarHBondContact O-N 2.88Å; Q1064-Y1147 PolarHBondContact NE2-OH 3.43Å
1065	I	90.9	Very high	84.8	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-51.7	166.6	-60.4	160	0	0	0	109	I902 H905 L1061 L1062 Q1067 A1068 E1069 T1077 I1081	I902-I1065 HydrophobicContact CB-CD1 4.01Å; I902-I1065 HydrophobicContact CB-CG1 4.49Å; I902-I1065 HydrophobicContact CD1-CD1 4.15Å; I902-I1065 HydrophobicContact CG2-CD1 4.4Å; H905-I1065 HydrophobicContact CB-CG1 4.11Å; L1061-I1065 HydrophobicContact CD1-CD1 3.67Å; L1061-I1065 HydrophobicContact CD1-CG1 3.95Å; L1061-I1065 HydrophobicContact CG-CD1 3.86Å; L1061-I1065 VanDerWaalsContact O-CG1 3.29Å; L1061-I1065 WeakPolarHBondContact O-CG1 3.45Å; L1061-I1065 PolarHBondContact O-N 3.23Å; L1062-I1065 PolarHBondContact O-N 2.89Å; I1065-Q1067 PolarHBondContact O-N 2.64Å; I1065-A1068 PolarHBondContact O-N 2.85Å; I1065-A1068 VanDerWaalsContact O-N 3.16Å; I1065-E1069 HydrophobicContact CG2-CB 4.48Å; I1065-E1069 HydrophobicContact CG2-CG 3.88Å; I1065-E1069 WeakPolarHBondContact O-CB 3.18Å; I1065-E1069 WeakPolarHBondContact O-CG 3.45Å; I1065-E1069 PolarHBondContact O-N 3.5Å; I1065-T1077 HydrophobicContact CG2-CG2 3.82Å; I1065-I1081 HydrophobicContact CB-CD1 4.21Å; I1065-I1081 HydrophobicContact CG2-CD1 3.68Å
1066	A	90.1	Very high	85	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-48.9	-55.1	178.4	0	0	0	0	0	112.7	L1062 Y1063 A1068 A1070 L1085 L1192 I1196	L1062-A1066 WeakPolarHBondContact O-CB 3.45Å; L1062-A1066 PolarHBondContact O-N 3.38Å; Y1063-A1066 WeakPolarHBondContact O-CB 3.42Å; A1066-A1068 VanDerWaalsContact C-N 3.33Å; A1066-A1068 PolarHBondContact O-N 2.83Å; A1066-A1070 WeakPolarHBondContact O-CB 3.5Å; A1066-A1070 PolarHBondContact O-N 3.31Å; A1066-A1070 VanDerWaalsContact O-N 3.13Å; A1066-L1085 HydrophobicContact CB-CD1 3.93Å; A1066-L1085 HydrophobicContact CB-CD2 4.36Å; A1066-L1192 HydrophobicContact CB-CD1 4.49Å; A1066-L1192 HydrophobicContact CB-CD2 4.33Å; A1066-I1196 HydrophobicContact CB-CD1 3.4Å; A1066-I1196 VanDerWaalsContact CB-CD1 3.4Å
1067	Q	87.7	Confident	84.7	Confident	48 Å²	48	42.6 Å²	42.6	22%	0.224	22%	0.221	C	C	.	.	H	α-helix	trans	-69.5	-25.5	-177.5	-69.5	168	28.9	0	0	114.3	Y1063 I1065 K1071 Y1184 L1192	Y1063-Q1067 WeakPolarHBondContact O-CB 3.44Å; Y1063-Q1067 VanDerWaalsContact O-CG 3.24Å; Y1063-Q1067 WeakPolarHBondContact O-CG 3.5Å; Y1063-Q1067 PolarHBondContact O-N 3.41Å; I1065-Q1067 PolarHBondContact O-N 2.64Å; Q1067-K1071 WeakPolarHBondContact O-CD 3.3Å; Q1067-K1071 VanDerWaalsContact O-CE 3.22Å; Q1067-K1071 WeakPolarHBondContact O-CE 3.49Å; Q1067-Y1184 PolarHBondContact NE2-OH 2.65Å; Q1067-L1192 HydrophobicContact CG-CD1 4.3Å; Q1067-L1192 HydrophobicContact CG-CD2 4.02Å
1068	A	86.5	Confident	84.4	Confident	28 Å²	28	42.7 Å²	42.7	23%	0.231	22%	0.221	C	C	.	.	H	α-helix	trans	-89.6	-40.7	-178.6	0	0	0	0	0	112.6	H905 Q1064 I1065 A1066	H905-A1068 VanDerWaalsContact CE1-CB 3.45Å; H905-A1068 WeakPolarHBondContact CE1-CB 3.47Å; Q1064-A1068 WeakPolarHBondContact O-CB 3.41Å; Q1064-A1068 PolarHBondContact O-N 2.88Å; I1065-A1068 PolarHBondContact O-N 2.85Å; I1065-A1068 VanDerWaalsContact O-N 3.16Å; A1066-A1068 VanDerWaalsContact C-N 3.33Å; A1066-A1068 PolarHBondContact O-N 2.83Å
1069	E	83.1	Confident	84.2	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.019	24%	0.24	C	C	.	.	H	α-helix	trans	-89.1	-25.1	-173.6	-57	-51.4	115.6	0	0	112.5	H905 I1065 K1071 K1072 E1073 N1074 T1077 L1078	H905-E1069 IonicContact CE1-OE1 2.86Å; H905-E1069 PolarHBondContact CE1-OE1 3.44Å; H905-E1069 IonicContact NE2-OE1 3.17Å; I1065-E1069 HydrophobicContact CG2-CB 4.48Å; I1065-E1069 HydrophobicContact CG2-CG 3.88Å; I1065-E1069 WeakPolarHBondContact O-CB 3.18Å; I1065-E1069 WeakPolarHBondContact O-CG 3.45Å; I1065-E1069 PolarHBondContact O-N 3.5Å; E1069-K1071 PolarHBondContact O-N 3.18Å; E1069-K1071 VanDerWaalsContact O-N 3.13Å; E1069-K1072 PolarHBondContact O-N 3.01Å; E1069-K1072 WeakPolarHBondContact OE1-CE 3.4Å; E1069-K1072 IonicContact OE1-NZ 3.75Å; E1069-K1072 PolarHBondContact OE1-NZ 2.95Å; E1069-K1072 IonicContact OE2-NZ 3.59Å; E1069-E1073 PolarHBondContact O-N 3.48Å; E1069-N1074 PolarHBondContact OE2-ND2 2.86Å; E1069-T1077 HydrophobicContact CG-CG2 4.34Å; E1069-L1078 HydrophobicContact CB-CD2 4.07Å
1070	A	79.4	Confident	84	Confident	5 Å²	5	45.8 Å²	45.8	4%	0.041	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-20.4	169.1	0	0	0	0	0	113.4	A1066 I1196 K1199	A1066-A1070 WeakPolarHBondContact O-CB 3.5Å; A1066-A1070 PolarHBondContact O-N 3.31Å; A1066-A1070 VanDerWaalsContact O-N 3.13Å; A1070-I1196 HydrophobicContact CB-CG1 4.15Å; A1070-K1199 PolarHBondContact O-NZ 3.09Å
1071	K	77.3	Confident	83.9	Confident	175 Å²	175	43 Å²	43	76%	0.761	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-13.2	173.9	-61.5	175.1	-177.1	172	0	114	Q1067 E1069	Q1067-K1071 WeakPolarHBondContact O-CD 3.3Å; Q1067-K1071 VanDerWaalsContact O-CE 3.22Å; Q1067-K1071 WeakPolarHBondContact O-CE 3.49Å; E1069-K1071 PolarHBondContact O-N 3.18Å; E1069-K1071 VanDerWaalsContact O-N 3.13Å
1072	K	75	Confident	83.9	Confident	113 Å²	113	43.9 Å²	43.9	49%	0.491	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-9.6	-177.7	-60.4	178.6	-162.8	160	0	113.8	E1069 N1074	E1069-K1072 PolarHBondContact O-N 3.01Å; E1069-K1072 WeakPolarHBondContact OE1-CE 3.4Å; E1069-K1072 IonicContact OE1-NZ 3.75Å; E1069-K1072 PolarHBondContact OE1-NZ 2.95Å; E1069-K1072 IonicContact OE2-NZ 3.59Å; K1072-N1074 VanDerWaalsContact C-N 3.28Å; K1072-N1074 PolarHBondContact O-N 3.08Å
1073	E	67.7	Low	83.8	Confident	135 Å²	135	47 Å²	47	63%	0.631	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	30.9	176.5	-41.9	-151.9	123.8	0	0	113.8	E1069 G1075 K1199	E1069-E1073 PolarHBondContact O-N 3.48Å; E1073-G1075 PolarHBondContact O-N 3.43Å; E1073-K1199 IonicContact OE1-NZ 2.67Å; E1073-K1199 PolarHBondContact OE1-NZ 3.11Å
1074	N	73.8	Confident	83.9	Confident	70 Å²	70	47.7 Å²	47.7	37%	0.374	27%	0.269	S	S	.	.			trans	-70.7	71.5	172.4	-81	-33.7	0	0	0	111.2	E1069 K1072 T1077 L1078	E1069-N1074 PolarHBondContact OE2-ND2 2.86Å; K1072-N1074 VanDerWaalsContact C-N 3.28Å; K1072-N1074 PolarHBondContact O-N 3.08Å; N1074-T1077 WeakPolarHBondContact O-CB 3.5Å; N1074-T1077 PolarHBondContact O-N 2.72Å; N1074-T1077 VanDerWaalsContact O-N 3.12Å; N1074-L1078 PolarHBondContact O-N 3.21Å; N1074-L1078 VanDerWaalsContact O-N 3.09Å
1075	G	77.1	Confident	84	Confident	32 Å²	32	44.9 Å²	44.9	33%	0.33	26%	0.256	S	S	.	.	H	α-helix	trans	-46.2	-47.5	-175.9	0	0	0	0	0	115.1	E1073 T1077 L1078 S1079	E1073-G1075 PolarHBondContact O-N 3.43Å; G1075-T1077 PolarHBondContact O-N 2.87Å; G1075-L1078 PolarHBondContact O-N 3.4Å; G1075-S1079 WeakPolarHBondContact O-CB 3.23Å; G1075-S1079 PolarHBondContact O-N 2.88Å
1076	P	81.3	Confident	84	Confident	103 Å²	103	47 Å²	47	67%	0.669	27%	0.267	S	S	*	.	H	α-helix	trans	-58.6	-47.8	178.2	-26.6	35.8	0	0	0	113	L1078 S1079 T1080	P1076-L1078 VanDerWaalsContact C-N 3.34Å; P1076-L1078 PolarHBondContact O-N 2.69Å; P1076-S1079 PolarHBondContact O-N 2.88Å; P1076-T1080 PolarHBondContact O-N 3.13Å; P1076-T1080 PolarHBondContact O-OG1 3.33Å; P1076-T1080 VanDerWaalsContact O-OG1 3.11Å
1077	T	81.9	Confident	84.2	Confident	26 Å²	26	50.4 Å²	50.4	16%	0.16	28%	0.283	C	S	.	.	H	α-helix	trans	-59.4	-44.6	176.2	-57.2	0	0	0	0	111.8	T1034 I1065 E1069 N1074 G1075 S1079 T1080 I1081	T1034-T1077 HydrophobicContact CG2-CG2 3.77Å; I1065-T1077 HydrophobicContact CG2-CG2 3.82Å; E1069-T1077 HydrophobicContact CG-CG2 4.34Å; N1074-T1077 WeakPolarHBondContact O-CB 3.5Å; N1074-T1077 PolarHBondContact O-N 2.72Å; N1074-T1077 VanDerWaalsContact O-N 3.12Å; G1075-T1077 PolarHBondContact O-N 2.87Å; T1077-S1079 VanDerWaalsContact C-N 3.31Å; T1077-S1079 PolarHBondContact O-N 2.99Å; T1077-T1080 PolarHBondContact O-N 2.68Å; T1077-I1081 WeakPolarHBondContact O-CG1 3.2Å; T1077-I1081 PolarHBondContact O-N 3.43Å
1078	L	83.7	Confident	84.5	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-65.7	-34.7	178.5	-66.3	176.3	0	0	0	111.8	E1069 N1074 G1075 P1076 I1081 S1082 I1196 V1200	E1069-L1078 HydrophobicContact CB-CD2 4.07Å; N1074-L1078 PolarHBondContact O-N 3.21Å; N1074-L1078 VanDerWaalsContact O-N 3.09Å; G1075-L1078 PolarHBondContact O-N 3.4Å; P1076-L1078 VanDerWaalsContact C-N 3.34Å; P1076-L1078 PolarHBondContact O-N 2.69Å; L1078-I1081 HydrophobicContact CD2-CD1 4.24Å; L1078-S1082 WeakPolarHBondContact O-CB 3.36Å; L1078-S1082 PolarHBondContact O-N 3.34Å; L1078-I1196 HydrophobicContact CB-CG2 4.25Å; L1078-I1196 HydrophobicContact CD2-CD1 4.42Å; L1078-I1196 HydrophobicContact CD2-CG1 4.29Å; L1078-I1196 HydrophobicContact CD2-CG2 4.2Å; L1078-V1200 HydrophobicContact CB-CG2 3.79Å
1079	S	86.3	Confident	84.8	Confident	64 Å²	64	48.9 Å²	48.9	45%	0.448	27%	0.27	S	S	.	.	H	α-helix	trans	-72.7	-30	177.2	-168.7	0	0	0	0	113.5	G1075 P1076 T1077 S1082	G1075-S1079 WeakPolarHBondContact O-CB 3.23Å; G1075-S1079 PolarHBondContact O-N 2.88Å; P1076-S1079 PolarHBondContact O-N 2.88Å; T1077-S1079 VanDerWaalsContact C-N 3.31Å; T1077-S1079 PolarHBondContact O-N 2.99Å; S1079-S1082 PolarHBondContact O-OG 2.95Å; S1079-S1082 VanDerWaalsContact O-OG 3.12Å
1080	T	85.4	Confident	85.4	Confident	37 Å²	37	51.4 Å²	51.4	23%	0.227	28%	0.284	C	S	.	.	H	α-helix	trans	-72.3	-36.5	174.1	-46.4	0	0	0	0	111.6	P1076 T1077	P1076-T1080 PolarHBondContact O-N 3.13Å; P1076-T1080 PolarHBondContact O-OG1 3.33Å; P1076-T1080 VanDerWaalsContact O-OG1 3.11Å; T1077-T1080 PolarHBondContact O-N 2.68Å
1081	I	90.1	Very high	86.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-91.4	-14.4	-176	70.9	-179	0	0	0	114.3	T1037 L1062 I1065 T1077 L1078 A1083 L1084 L1085	T1037-I1081 HydrophobicContact CG2-CG2 4.05Å; L1062-I1081 HydrophobicContact CD2-CB 4.3Å; L1062-I1081 HydrophobicContact CD2-CG2 4.11Å; I1065-I1081 HydrophobicContact CB-CD1 4.21Å; I1065-I1081 HydrophobicContact CG2-CD1 3.68Å; T1077-I1081 WeakPolarHBondContact O-CG1 3.2Å; T1077-I1081 PolarHBondContact O-N 3.43Å; L1078-I1081 HydrophobicContact CD2-CD1 4.24Å; I1081-A1083 PolarHBondContact O-N 2.85Å; I1081-L1084 PolarHBondContact O-N 3.49Å; I1081-L1084 VanDerWaalsContact O-N 3.16Å; I1081-L1085 HydrophobicContact CB-CD1 4.42Å; I1081-L1085 HydrophobicContact CD1-CD1 3.94Å; I1081-L1085 HydrophobicContact CG1-CD1 3.82Å; I1081-L1085 HydrophobicContact CG1-CG 4.5Å; I1081-L1085 WeakPolarHBondContact O-CG 3.46Å; I1081-L1085 PolarHBondContact O-N 2.89Å
1082	S	90.4	Very high	86.9	Confident	17 Å²	17	45.2 Å²	45.2	12%	0.119	26%	0.259	C	S	.	.	H	α-helix	trans	-55.4	-54.5	-175.1	51.9	0	0	0	0	112.3	L1078 S1079 L1084 L1085 D1086	L1078-S1082 WeakPolarHBondContact O-CB 3.36Å; L1078-S1082 PolarHBondContact O-N 3.34Å; S1079-S1082 PolarHBondContact O-OG 2.95Å; S1079-S1082 VanDerWaalsContact O-OG 3.12Å; S1082-L1084 VanDerWaalsContact C-N 3.27Å; S1082-L1084 PolarHBondContact O-N 3.11Å; S1082-L1085 CarbonylContact O-C 3.59Å; S1082-L1085 WeakPolarHBondContact O-CA 3.42Å; S1082-L1085 WeakPolarHBondContact O-CB 3.33Å; S1082-L1085 PolarHBondContact O-N 3.16Å; S1082-D1086 PolarHBondContact O-N 3.35Å
1083	A	91.1	Very high	87.8	Confident	66 Å²	66	40.2 Å²	40.2	55%	0.545	24%	0.238	S	C	.	.	H	α-helix	trans	-59.5	-35	178.1	0	0	0	0	0	113.2	I1081 E1087	I1081-A1083 PolarHBondContact O-N 2.85Å; A1083-E1087 PolarHBondContact O-N 3.13Å
1084	L	92.7	Very high	89.1	Confident	16 Å²	16	39.4 Å²	39.4	8%	0.084	23%	0.229	C	C	.	.	H	α-helix	trans	-71.1	-33.8	176.5	-52.5	177.7	0	0	0	111.6	F1041 L1062 I1081 S1082 L1088	F1041-L1084 HydrophobicContact CB-CD1 4.45Å; F1041-L1084 HydrophobicContact CB-CD2 4.29Å; F1041-L1084 HydrophobicContact CD1-CD2 3.83Å; F1041-L1084 HydrophobicContact CE1-CD2 4.43Å; F1041-L1084 HydrophobicContact CG-CD2 4.23Å; L1062-L1084 HydrophobicContact CD1-CB 4.17Å; L1062-L1084 HydrophobicContact CD2-CD1 4.33Å; I1081-L1084 PolarHBondContact O-N 3.49Å; I1081-L1084 VanDerWaalsContact O-N 3.16Å; S1082-L1084 VanDerWaalsContact C-N 3.27Å; S1082-L1084 PolarHBondContact O-N 3.11Å; L1084-L1088 WeakPolarHBondContact O-CB 3.39Å; L1084-L1088 PolarHBondContact O-N 2.9Å
1085	L	92.1	Very high	90.1	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-74.3	-37.3	174.6	-71.2	170.3	0	0	0	112.1	L1062 Y1063 A1066 I1081 S1082 R1089 V1193 I1196	L1062-L1085 HydrophobicContact CB-CD2 3.98Å; Y1063-L1085 HydrophobicContact CD2-CD2 4.25Å; Y1063-L1085 HydrophobicContact CE2-CD2 4.32Å; A1066-L1085 HydrophobicContact CB-CD1 3.93Å; A1066-L1085 HydrophobicContact CB-CD2 4.36Å; I1081-L1085 HydrophobicContact CB-CD1 4.42Å; I1081-L1085 HydrophobicContact CD1-CD1 3.94Å; I1081-L1085 HydrophobicContact CG1-CD1 3.82Å; I1081-L1085 HydrophobicContact CG1-CG 4.5Å; I1081-L1085 WeakPolarHBondContact O-CG 3.46Å; I1081-L1085 PolarHBondContact O-N 2.89Å; S1082-L1085 CarbonylContact O-C 3.59Å; S1082-L1085 WeakPolarHBondContact O-CA 3.42Å; S1082-L1085 WeakPolarHBondContact O-CB 3.33Å; S1082-L1085 PolarHBondContact O-N 3.16Å; L1085-R1089 WeakPolarHBondContact O-CB 3.47Å; L1085-R1089 PolarHBondContact O-N 3.16Å; L1085-V1193 HydrophobicContact CB-CG1 4.17Å; L1085-V1193 HydrophobicContact CB-CG2 4.04Å; L1085-I1196 HydrophobicContact CD1-CD1 3.81Å; L1085-I1196 HydrophobicContact CD1-CG2 4.27Å
1086	D	92.3	Very high	91	Very high	45 Å²	45	36.6 Å²	36.6	24%	0.241	21%	0.205	C	C	.	.	H	α-helix	trans	-59.7	-52.4	170.6	-79.3	-60	0	0	0	110.6	S1082 L1088 R1089 D1090 V1193 C1197	S1082-D1086 PolarHBondContact O-N 3.35Å; D1086-L1088 VanDerWaalsContact C-N 3.33Å; D1086-L1088 PolarHBondContact O-N 3.38Å; D1086-R1089 PolarHBondContact O-N 3.36Å; D1086-R1089 IonicContact OD1-CZ 2.7Å; D1086-R1089 IonicContact OD1-NH1 3.19Å; D1086-R1089 PolarHBondContact OD1-NH1 3.47Å; D1086-R1089 IonicContact OD1-NH2 2.78Å; D1086-R1089 PolarHBondContact OD1-NH2 2.92Å; D1086-D1090 WeakPolarHBondContact O-CB 3.43Å; D1086-D1090 VanDerWaalsContact O-CG 3.28Å; D1086-D1090 PolarHBondContact O-N 3.45Å; D1086-V1193 WeakPolarHBondContact OD1-CG1 3.4Å; D1086-C1197 PolarHBondContact OD2-SG 2.78Å
1087	E	93.8	Very high	91.6	Very high	71 Å²	71	37.1 Å²	37.1	33%	0.332	19%	0.193	S	C	.	.	H	α-helix	trans	-63.4	-37.9	178.9	-158.8	-149.5	122.3	0	0	112.4	K1045 A1083 D1090 T1091	K1045-E1087 WeakPolarHBondContact CE-OE1 3.48Å; K1045-E1087 IonicContact NZ-OE1 2.62Å; K1045-E1087 PolarHBondContact NZ-OE1 2.84Å; K1045-E1087 IonicContact NZ-OE2 2.66Å; K1045-E1087 PolarHBondContact NZ-OE2 2.86Å; A1083-E1087 PolarHBondContact O-N 3.13Å; E1087-D1090 PolarHBondContact O-N 3.31Å; E1087-T1091 VanDerWaalsContact O-CB 3.26Å; E1087-T1091 WeakPolarHBondContact O-CB 3.49Å; E1087-T1091 PolarHBondContact O-N 3.21Å; E1087-T1091 PolarHBondContact O-OG1 3.18Å
1088	L	93	Very high	92.2	Very high	16 Å²	16	40 Å²	40	8%	0.084	21%	0.205	C	C	.	.	H	α-helix	trans	-67.4	-43.4	176.8	178.5	56.8	0	0	0	112	F1041 E1059 L1062 Y1063 L1084 D1086 E1092 L1148	F1041-L1088 HydrophobicContact CE2-CB 4.42Å; F1041-L1088 HydrophobicContact CZ-CB 4.24Å; E1059-L1088 HydrophobicContact CB-CD2 4.4Å; E1059-L1088 HydrophobicContact CG-CD1 4.12Å; L1062-L1088 HydrophobicContact CD1-CD2 4.22Å; Y1063-L1088 HydrophobicContact CD2-CD2 4.04Å; Y1063-L1088 HydrophobicContact CE2-CD2 3.71Å; Y1063-L1088 HydrophobicContact CE2-CG 4.28Å; L1084-L1088 WeakPolarHBondContact O-CB 3.39Å; L1084-L1088 PolarHBondContact O-N 2.9Å; D1086-L1088 VanDerWaalsContact C-N 3.33Å; D1086-L1088 PolarHBondContact O-N 3.38Å; L1088-E1092 VanDerWaalsContact O-CB 3.26Å; L1088-E1092 WeakPolarHBondContact O-CB 3.23Å; L1088-E1092 PolarHBondContact O-N 3.19Å; L1088-L1148 HydrophobicContact CD1-CD1 3.88Å; L1088-L1148 HydrophobicContact CD2-CD1 4.2Å; L1088-L1148 HydrophobicContact CG-CD1 3.94Å
1089	R	94.3	Very high	92.7	Very high	29 Å²	29	39.9 Å²	39.9	11%	0.109	21%	0.205	C	C	.	.	H	α-helix	trans	-55.5	-56	170.5	167.6	-170.4	77.7	-128.1	-22.6	109.6	L1085 D1086 T1091 E1092 L1093 I1189 V1193	L1085-R1089 WeakPolarHBondContact O-CB 3.47Å; L1085-R1089 PolarHBondContact O-N 3.16Å; D1086-R1089 PolarHBondContact O-N 3.36Å; D1086-R1089 IonicContact OD1-CZ 2.7Å; D1086-R1089 IonicContact OD1-NH1 3.19Å; D1086-R1089 PolarHBondContact OD1-NH1 3.47Å; D1086-R1089 IonicContact OD1-NH2 2.78Å; D1086-R1089 PolarHBondContact OD1-NH2 2.92Å; R1089-T1091 VanDerWaalsContact C-N 3.26Å; R1089-T1091 PolarHBondContact O-N 2.85Å; R1089-E1092 PolarHBondContact O-N 3.05Å; R1089-L1093 HydrophobicContact CG-CD1 3.58Å; R1089-L1093 HydrophobicContact CG-CG 4.14Å; R1089-L1093 WeakPolarHBondContact O-CB 3.49Å; R1089-L1093 VanDerWaalsContact O-CG 3.29Å; R1089-L1093 WeakPolarHBondContact O-CG 3.29Å; R1089-L1093 PolarHBondContact O-N 3.21Å; R1089-I1189 HydrophobicContact CB-CG2 3.94Å; R1089-I1189 HydrophobicContact CG-CG2 3.8Å; R1089-V1193 HydrophobicContact CB-CG2 4.23Å; R1089-V1193 VanDerWaalsContact NH1-CG1 3.32Å
1090	D	94.6	Very high	93	Very high	56 Å²	56	42.6 Å²	42.6	30%	0.299	21%	0.209	S	C	.	.	H	α-helix	trans	-69.1	-30.4	-169.1	-64.6	-26.1	0	0	0	111.4	D1086 E1087 R1094	D1086-D1090 WeakPolarHBondContact O-CB 3.43Å; D1086-D1090 VanDerWaalsContact O-CG 3.28Å; D1086-D1090 PolarHBondContact O-N 3.45Å; E1087-D1090 PolarHBondContact O-N 3.31Å; D1090-R1094 VanDerWaalsContact O-CB 3.24Å; D1090-R1094 WeakPolarHBondContact O-CB 3.26Å; D1090-R1094 WeakPolarHBondContact O-CG 3.46Å; D1090-R1094 PolarHBondContact O-N 2.9Å; D1090-R1094 PolarHBondContact O-NE 2.69Å
1091	T	93.5	Very high	93.3	Very high	37 Å²	37	47.7 Å²	47.7	23%	0.227	23%	0.23	C	C	.	.	H	α-helix	trans	-70.1	-47.4	172.1	-59.1	0	0	0	0	112.4	E1087 R1089 R1094 Q1095	E1087-T1091 VanDerWaalsContact O-CB 3.26Å; E1087-T1091 WeakPolarHBondContact O-CB 3.49Å; E1087-T1091 PolarHBondContact O-N 3.21Å; E1087-T1091 PolarHBondContact O-OG1 3.18Å; R1089-T1091 VanDerWaalsContact C-N 3.26Å; R1089-T1091 PolarHBondContact O-N 2.85Å; T1091-R1094 PolarHBondContact O-N 3.19Å; T1091-R1094 PolarHBondContact OG1-NH2 2.68Å; T1091-Q1095 WeakPolarHBondContact O-CB 3.35Å; T1091-Q1095 WeakPolarHBondContact O-CG 3.45Å; T1091-Q1095 PolarHBondContact O-N 3.36Å
1092	E	94.2	Very high	93.3	Very high	13 Å²	13	49.6 Å²	49.6	6%	0.061	25%	0.246	C	C	.	.	H	α-helix	trans	-58.4	-49.5	176.1	171.8	72.9	177	0	0	110.9	L1088 R1089 Q1095 R1096 L1148 S1149 I1189	L1088-E1092 VanDerWaalsContact O-CB 3.26Å; L1088-E1092 WeakPolarHBondContact O-CB 3.23Å; L1088-E1092 PolarHBondContact O-N 3.19Å; R1089-E1092 PolarHBondContact O-N 3.05Å; E1092-Q1095 PolarHBondContact O-N 3.48Å; E1092-R1096 WeakPolarHBondContact O-CG 3.24Å; E1092-R1096 PolarHBondContact O-N 3.21Å; E1092-R1096 IonicContact OE1-CZ 3.46Å; E1092-R1096 IonicContact OE1-NE 2.7Å; E1092-R1096 PolarHBondContact OE1-NE 2.92Å; E1092-R1096 IonicContact OE1-NH2 2.86Å; E1092-R1096 PolarHBondContact OE1-NH2 3.04Å; E1092-L1148 HydrophobicContact CB-CD1 4.41Å; E1092-L1148 HydrophobicContact CG-CB 4.47Å; E1092-L1148 HydrophobicContact CG-CD1 4.27Å; E1092-S1149 VanDerWaalsContact OE1-CB 3.25Å; E1092-S1149 WeakPolarHBondContact OE1-CB 3.14Å; E1092-S1149 PolarHBondContact OE1-OG 3.41Å; E1092-I1189 HydrophobicContact CG-CD1 4.02Å
1093	L	94.4	Very high	93.2	Very high	9 Å²	9	50.2 Å²	50.2	5%	0.047	26%	0.255	C	S	.	.	H	α-helix	trans	-67.5	-38.8	-179.2	-64.1	-178.2	0	0	0	112.8	R1089 R1097 E1186 I1190	R1089-L1093 HydrophobicContact CG-CD1 3.58Å; R1089-L1093 HydrophobicContact CG-CG 4.14Å; R1089-L1093 WeakPolarHBondContact O-CB 3.49Å; R1089-L1093 VanDerWaalsContact O-CG 3.29Å; R1089-L1093 WeakPolarHBondContact O-CG 3.29Å; R1089-L1093 PolarHBondContact O-N 3.21Å; L1093-R1097 WeakPolarHBondContact O-CG 3.42Å; L1093-R1097 PolarHBondContact O-N 3.42Å; L1093-R1097 VanDerWaalsContact O-N 3.13Å; L1093-E1186 HydrophobicContact CD2-CB 3.62Å; L1093-E1186 HydrophobicContact CD2-CG 3.51Å; L1093-I1190 HydrophobicContact CD1-CD1 4.05Å; L1093-I1190 HydrophobicContact CD1-CG1 3.88Å
1094	R	96.3	Very high	93.2	Very high	117 Å²	117	47.3 Å²	47.3	44%	0.442	23%	0.23	S	C	.	.	H	α-helix	trans	-59.8	-49	171.8	-79.3	-179.2	-58.9	-112.8	3.2	111.1	D1090 T1091 R1096 R1097 Q1098	D1090-R1094 VanDerWaalsContact O-CB 3.24Å; D1090-R1094 WeakPolarHBondContact O-CB 3.26Å; D1090-R1094 WeakPolarHBondContact O-CG 3.46Å; D1090-R1094 PolarHBondContact O-N 2.9Å; D1090-R1094 PolarHBondContact O-NE 2.69Å; T1091-R1094 PolarHBondContact O-N 3.19Å; T1091-R1094 PolarHBondContact OG1-NH2 2.68Å; R1094-R1096 PolarHBondContact O-N 3.22Å; R1094-R1097 PolarHBondContact O-N 3.45Å; R1094-Q1098 WeakPolarHBondContact O-CG 3.34Å; R1094-Q1098 PolarHBondContact O-N 2.87Å
1095	Q	94.8	Very high	93	Very high	34 Å²	34	52.1 Å²	52.1	16%	0.159	25%	0.252	C	S	.	.	H	α-helix	trans	-70.1	-31.5	-176.1	-68.9	-177	5.7	0	0	112.8	T1091 E1092 L1099 L1162	T1091-Q1095 WeakPolarHBondContact O-CB 3.35Å; T1091-Q1095 WeakPolarHBondContact O-CG 3.45Å; T1091-Q1095 PolarHBondContact O-N 3.36Å; E1092-Q1095 PolarHBondContact O-N 3.48Å; Q1095-L1099 WeakPolarHBondContact O-CG 3.44Å; Q1095-L1099 PolarHBondContact O-N 2.77Å; Q1095-L1162 HydrophobicContact CB-CB 3.71Å; Q1095-L1162 HydrophobicContact CB-CD1 3.85Å; Q1095-L1162 HydrophobicContact CB-CG 4.44Å
1096	R	94.8	Very high	92.9	Very high	10 Å²	10	55 Å²	55	4%	0.038	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-49.1	168.7	-73.7	-178.5	-171.9	-160.3	6.4	112	E1092 R1094 L1099 F1100 S1149 L1162 L1180 Y1184 E1186	E1092-R1096 WeakPolarHBondContact O-CG 3.24Å; E1092-R1096 PolarHBondContact O-N 3.21Å; E1092-R1096 IonicContact OE1-CZ 3.46Å; E1092-R1096 IonicContact OE1-NE 2.7Å; E1092-R1096 PolarHBondContact OE1-NE 2.92Å; E1092-R1096 IonicContact OE1-NH2 2.86Å; E1092-R1096 PolarHBondContact OE1-NH2 3.04Å; R1094-R1096 PolarHBondContact O-N 3.22Å; R1096-L1099 PolarHBondContact O-N 2.85Å; R1096-F1100 PolarHBondContact O-N 3.3Å; R1096-S1149 PolarHBondContact NE-OG 3.31Å; R1096-S1149 PolarHBondContact NH2-OG 3.4Å; R1096-S1149 VanDerWaalsContact NH2-OG 3.12Å; R1096-L1162 HydrophobicContact CG-CD1 3.96Å; R1096-L1180 HydrophobicContact CG-CD2 4.33Å; R1096-Y1184 PolarHBondContact NH1-O 3.08Å; R1096-Y1184 PolarHBondContact NH2-O 2.78Å; R1096-E1186 WeakPolarHBondContact CD-OE1 3.48Å
1097	R	94.8	Very high	92.8	Very high	113 Å²	113	55.7 Å²	55.7	43%	0.426	28%	0.28	S	S	.	.	H	α-helix	trans	-62.1	-47.3	179.4	-73.8	-168.9	-64.5	-92.2	4.6	112.4	L1093 R1094 L1099 F1100 E1101	L1093-R1097 WeakPolarHBondContact O-CG 3.42Å; L1093-R1097 PolarHBondContact O-N 3.42Å; L1093-R1097 VanDerWaalsContact O-N 3.13Å; R1094-R1097 PolarHBondContact O-N 3.45Å; R1097-L1099 VanDerWaalsContact C-N 3.27Å; R1097-L1099 PolarHBondContact O-N 3.01Å; R1097-F1100 WeakPolarHBondContact O-CB 3.49Å; R1097-F1100 PolarHBondContact O-N 2.92Å; R1097-E1101 WeakPolarHBondContact O-CB 3.45Å; R1097-E1101 WeakPolarHBondContact O-CG 3.25Å; R1097-E1101 PolarHBondContact O-N 3.31Å
1098	Q	94.8	Very high	92.6	Very high	86 Å²	86	53.6 Å²	53.6	40%	0.402	28%	0.275	S	S	.	.	H	α-helix	trans	-57.9	-37.9	177.1	-71.1	175.2	-55.4	0	0	112.7	R1094 A1102 L1166	R1094-Q1098 WeakPolarHBondContact O-CG 3.34Å; R1094-Q1098 PolarHBondContact O-N 2.87Å; Q1098-A1102 VanDerWaalsContact O-CB 3.31Å; Q1098-A1102 WeakPolarHBondContact O-CB 3.5Å; Q1098-A1102 PolarHBondContact O-N 3Å; Q1098-L1166 HydrophobicContact CB-CD1 4.13Å; Q1098-L1166 HydrophobicContact CB-CD2 3.87Å
1099	L	93.3	Very high	92.4	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-68.9	-39	174.4	-78.6	169.5	0	0	0	112.8	Q1095 R1096 R1097 A1102 G1103 L1104 V1151 L1162 A1165 L1166	Q1095-L1099 WeakPolarHBondContact O-CG 3.44Å; Q1095-L1099 PolarHBondContact O-N 2.77Å; R1096-L1099 PolarHBondContact O-N 2.85Å; R1097-L1099 VanDerWaalsContact C-N 3.27Å; R1097-L1099 PolarHBondContact O-N 3.01Å; L1099-A1102 CarbonylContact O-C 3.5Å; L1099-A1102 PolarHBondContact O-N 2.74Å; L1099-G1103 PolarHBondContact O-N 2.88Å; L1099-L1104 HydrophobicContact CB-CB 4.27Å; L1099-L1104 HydrophobicContact CB-CD2 4.19Å; L1099-L1104 HydrophobicContact CD1-CD2 4.32Å; L1099-L1104 HydrophobicContact CD2-CD2 4.15Å; L1099-L1104 HydrophobicContact CG-CD2 4.48Å; L1099-L1104 WeakPolarHBondContact O-CB 3.33Å; L1099-L1104 PolarHBondContact O-N 3.35Å; L1099-V1151 HydrophobicContact CD1-CG2 3.79Å; L1099-L1162 HydrophobicContact CD1-CB 3.78Å; L1099-L1162 HydrophobicContact CD1-CD2 3.77Å; L1099-L1162 HydrophobicContact CD1-CG 4.26Å; L1099-A1165 HydrophobicContact CD1-CB 4.45Å; L1099-A1165 HydrophobicContact CD2-CB 4.06Å; L1099-L1166 HydrophobicContact CD2-CB 4.02Å; L1099-L1166 HydrophobicContact CD2-CD1 4.17Å; L1099-L1166 HydrophobicContact CG-CB 4.48Å; L1099-L1166 HydrophobicContact CG-CD1 4.49Å
1100	F	92.4	Very high	91.8	Very high	121 Å²	121	56.4 Å²	56.4	53%	0.531	29%	0.285	S	S	.	.	H	α-helix	trans	-65.9	-42.9	175.7	-176.3	-87.7	0	0	0	111.8	R1096 R1097 A1102 G1103 H1105	R1096-F1100 PolarHBondContact O-N 3.3Å; R1097-F1100 WeakPolarHBondContact O-CB 3.49Å; R1097-F1100 PolarHBondContact O-N 2.92Å; F1100-A1102 VanDerWaalsContact C-N 3.29Å; F1100-A1102 PolarHBondContact O-N 2.99Å; F1100-G1103 WeakPolarHBondContact O-CA 3.38Å; F1100-G1103 PolarHBondContact O-N 3.23Å; F1100-H1105 AromaticContact CD2-ND1 3.46Å; F1100-H1105 WeakPolarHBondContact CD2-ND1 3.49Å; F1100-H1105 AromaticContact CE1-ND1 3.88Å; F1100-H1105 HydrophobicContact CE2-CB 4.34Å; F1100-H1105 AromaticContact CE2-ND1 3.19Å; F1100-H1105 WeakPolarHBondContact CE2-ND1 3.28Å; F1100-H1105 AromaticContact CG-ND1 3.93Å; F1100-H1105 AromaticContact CZ-CE1 3.96Å; F1100-H1105 AromaticContact CZ-ND1 3.42Å; F1100-H1105 WeakPolarHBondContact CZ-ND1 3.35Å; F1100-H1105 PolarHBondContact O-CE1 3.31Å; F1100-H1105 VanDerWaalsContact O-CE1 3.25Å
1101	E	92.1	Very high	90.4	Very high	143 Å²	143	54.9 Å²	54.9	67%	0.668	28%	0.282	S	S	*	.	H	α-helix	trans	-61.1	-36.1	173.3	-70.8	158.4	-162.8	0	0	111.6	R1097 G1103	R1097-E1101 WeakPolarHBondContact O-CB 3.45Å; R1097-E1101 WeakPolarHBondContact O-CG 3.25Å; R1097-E1101 PolarHBondContact O-N 3.31Å; E1101-G1103 PolarHBondContact O-N 2.94Å
1102	A	89.4	Confident	88	Confident	41 Å²	41	57.6 Å²	57.6	34%	0.339	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	7.2	171.5	0	0	0	0	0	114.5	Q1098 L1099 F1100 L1166 V1169 C1175	Q1098-A1102 VanDerWaalsContact O-CB 3.31Å; Q1098-A1102 WeakPolarHBondContact O-CB 3.5Å; Q1098-A1102 PolarHBondContact O-N 3Å; L1099-A1102 CarbonylContact O-C 3.5Å; L1099-A1102 PolarHBondContact O-N 2.74Å; F1100-A1102 VanDerWaalsContact C-N 3.29Å; F1100-A1102 PolarHBondContact O-N 2.99Å; A1102-L1166 HydrophobicContact CB-CD1 4.17Å; A1102-V1169 HydrophobicContact CB-CG1 3.8Å; A1102-C1175 PolarHBondContact O-SG 3.24Å
1103	G	89.5	Confident	85.5	Confident	30 Å²	30	65.4 Å²	65.4	31%	0.309	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.7	10	173	0	0	0	0	0	116.1	L1099 F1100 E1101 H1105	L1099-G1103 PolarHBondContact O-N 2.88Å; F1100-G1103 WeakPolarHBondContact O-CA 3.38Å; F1100-G1103 PolarHBondContact O-N 3.23Å; E1101-G1103 PolarHBondContact O-N 2.94Å; G1103-H1105 VanDerWaalsContact C-N 3.27Å; G1103-H1105 PolarHBondContact O-CD2 3.46Å; G1103-H1105 PolarHBondContact O-N 3.5Å
1104	L	90.1	Very high	82.7	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.026	37%	0.37	C	S	.	.			trans	-82.4	67.5	178	-169	62.3	0	0	0	111.8	L1099 S1106 V1151 C1175 L1178 L1180	L1099-L1104 HydrophobicContact CB-CB 4.27Å; L1099-L1104 HydrophobicContact CB-CD2 4.19Å; L1099-L1104 HydrophobicContact CD1-CD2 4.32Å; L1099-L1104 HydrophobicContact CD2-CD2 4.15Å; L1099-L1104 HydrophobicContact CG-CD2 4.48Å; L1099-L1104 WeakPolarHBondContact O-CB 3.33Å; L1099-L1104 PolarHBondContact O-N 3.35Å; L1104-S1106 VanDerWaalsContact C-N 3.34Å; L1104-V1151 HydrophobicContact CD2-CB 4.43Å; L1104-V1151 HydrophobicContact CD2-CG1 3.88Å; L1104-V1151 HydrophobicContact CD2-CG2 3.61Å; L1104-C1175 HydrophobicContact CD1-CB 4.23Å; L1104-L1178 HydrophobicContact CD1-CB 3.66Å; L1104-L1180 HydrophobicContact CD2-CB 4.05Å; L1104-L1180 HydrophobicContact CG-CB 4.43Å
1105	H	88.5	Confident	80.1	Confident	117 Å²	117	69.9 Å²	69.9	54%	0.542	39%	0.392	S	S	.	.			trans	-78.5	-17.7	178.4	-47.5	-54.6	0	0	0	113.4	F1100 G1103 S1107	F1100-H1105 AromaticContact CD2-ND1 3.46Å; F1100-H1105 WeakPolarHBondContact CD2-ND1 3.49Å; F1100-H1105 AromaticContact CE1-ND1 3.88Å; F1100-H1105 HydrophobicContact CE2-CB 4.34Å; F1100-H1105 AromaticContact CE2-ND1 3.19Å; F1100-H1105 WeakPolarHBondContact CE2-ND1 3.28Å; F1100-H1105 AromaticContact CG-ND1 3.93Å; F1100-H1105 AromaticContact CZ-CE1 3.96Å; F1100-H1105 AromaticContact CZ-ND1 3.42Å; F1100-H1105 WeakPolarHBondContact CZ-ND1 3.35Å; F1100-H1105 PolarHBondContact O-CE1 3.31Å; F1100-H1105 VanDerWaalsContact O-CE1 3.25Å; G1103-H1105 VanDerWaalsContact C-N 3.27Å; G1103-H1105 PolarHBondContact O-CD2 3.46Å; G1103-H1105 PolarHBondContact O-N 3.5Å; H1105-S1107 PolarHBondContact O-N 3.19Å
1106	S	89.4	Confident	77.4	Confident	62 Å²	62	73.6 Å²	73.6	43%	0.434	42%	0.422	S	S	.	.			trans	-73.6	113.7	177.1	-175.1	0	0	0	0	110.4	L1104 K1179 L1180	L1104-S1106 VanDerWaalsContact C-N 3.34Å; S1106-K1179 CarbonylContact O-C 3.54Å; S1106-K1179 WeakPolarHBondContact O-CA 3.38Å; S1106-L1180 PolarHBondContact O-N 3.5Å
1107	S	90.9	Very high	74.4	Confident	58 Å²	58	78.2 Å²	78.2	41%	0.406	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	161.7	178.6	71.9	0	0	0	0	113.5	H1105 L1180	H1105-S1107 PolarHBondContact O-N 3.19Å; S1107-L1180 CarbonylContact C-O 3.54Å; S1107-L1180 WeakPolarHBondContact CA-O 3.48Å; S1107-L1180 WeakPolarHBondContact CB-O 3.22Å
1108	A	90.1	Very high	71.3	Confident	27 Å²	27	79.5 Å²	79.5	22%	0.223	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	155.8	168.6	0	0	0	0	0	112.4	L1180 M1181 Y1182	A1108-L1180 PolarHBondContact N-O 3.03Å; A1108-M1181 HydrophobicContact CB-CE 4.05Å; A1108-M1181 HydrophobicContact CB-SD 3.92Å; A1108-M1181 VanDerWaalsContact O-CA 3.32Å; A1108-M1181 WeakPolarHBondContact O-CA 3.11Å; A1108-Y1182 PolarHBondContact O-N 3.37Å; A1108-Y1182 VanDerWaalsContact O-N 3.08Å
1109	R	87.6	Confident	68.7	Low	97 Å²	97	82.6 Å²	82.6	37%	0.366	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	143.6	173.2	-155.2	-171.3	-149.8	111.5	1	112	Y1182 R1183 D1185 Q1188	R1109-Y1182 CarbonylContact C-O 3.54Å; R1109-Y1182 WeakPolarHBondContact CA-O 3.49Å; R1109-Y1182 HydrophobicContact CB-CD2 4.38Å; R1109-Y1182 HydrophobicContact CB-CE2 3.9Å; R1109-Y1182 HydrophobicContact CG-CD2 4.11Å; R1109-Y1182 HydrophobicContact CG-CE2 3.91Å; R1109-Y1182 WeakPolarHBondContact CG-O 3.42Å; R1109-R1183 PolarHBondContact NE-O 3.03Å; R1109-D1185 IonicContact CZ-OD1 2.7Å; R1109-D1185 IonicContact CZ-OD2 3.74Å; R1109-D1185 IonicContact NH1-OD1 2.85Å; R1109-D1185 PolarHBondContact NH1-OD1 3Å; R1109-D1185 IonicContact NH1-OD2 3.02Å; R1109-D1185 PolarHBondContact NH1-OD2 3.31Å; R1109-D1185 VanDerWaalsContact NH2-CG 3.31Å; R1109-D1185 IonicContact NH2-OD1 3.25Å; R1109-D1185 PolarHBondContact NH2-OD1 2.99Å; R1109-D1185 IonicContact NH2-OD2 2.79Å; R1109-D1185 PolarHBondContact NH2-OD2 2.9Å; R1109-Q1188 VanDerWaalsContact NH2-NE2 3.13Å
1110	Y	83.2	Confident	66	Low	8 Å²	8	87.1 Å²	87.1	3%	0.031	54%	0.538	C	S	.	.			trans	-124.9	144.5	167.2	71.6	-80.7	0	0	0	112.4	Y1147 L1148 M1150 M1181 Y1182 R1183	Y1110-Y1147 VanDerWaalsContact OH-C 3.23Å; Y1110-Y1147 PolarHBondContact OH-O 3.41Å; Y1110-L1148 PolarHBondContact OH-O 3Å; Y1110-M1150 HydrophobicContact CE1-CE 4.08Å; Y1110-M1150 HydrophobicContact CE2-CE 3.87Å; Y1110-M1150 VanDerWaalsContact CZ-CE 3.5Å; Y1110-M1150 VanDerWaalsContact OH-CE 3.28Å; Y1110-M1150 WeakPolarHBondContact OH-CE 3.43Å; Y1110-M1181 HydrophobicContact CD1-CB 3.79Å; Y1110-M1181 HydrophobicContact CE1-CB 4.24Å; Y1110-M1181 WeakPolarHBondContact CE1-O 3.11Å; Y1110-Y1182 WeakPolarHBondContact CD1-O 3.31Å; Y1110-Y1182 PolarHBondContact N-O 2.87Å; Y1110-R1183 HydrophobicContact CE1-CB 4.32Å
1111	G	64.9	Low	63.2	Low	23 Å²	23	89.3 Å²	89.3	24%	0.237	56%	0.556	C	S	.	*			trans	69.9	48.8	169.1	0	0	0	0	0	115.6	H1113 R1183	G1111-H1113 PolarHBondContact O-N 3.41Å; G1111-R1183 PolarHBondContact O-NH1 2.85Å; G1111-R1183 VanDerWaalsContact O-NH1 3.14Å
1112	S	42	Very low	60.4	Low	94 Å²	94	85.5 Å²	85.5	66%	0.657	56%	0.555	S	S	*	*			trans	-69.7	121.9	156.4	-176.4	0	0	0	0	109
1113	H	42.8	Very low	58.2	Low	178 Å²	178	93.7 Å²	93.7	82%	0.824	58%	0.583	S	S	*	*			trans	-149.1	36.5	168.3	-156.6	-65	0	0	0	111.1	G1111	G1111-H1113 PolarHBondContact O-N 3.41Å
1114	D	36.1	Very low	55.8	Low	131 Å²	131	101.5 Å²	101.5	70%	0.701	61%	0.608	S	S	*	*			trans	-83	114.3	166.2	-75.8	-57.4	0	0	0	108.8	S1116	D1114-S1116 PolarHBondContact O-N 2.89Å
1115	G	40.7	Very low	53.1	Low	88 Å²	88	110.8 Å²	110.8	91%	0.907	65%	0.648	S	S	*	*	S	Bend	trans	-76.8	52.4	-173.3	0	0	0	0	0	114.7
1116	S	38.1	Very low	50.7	Low	113 Å²	113	110.5 Å²	110.5	79%	0.79	66%	0.657	S	S	*	*			trans	-166.2	84.9	170	-163.8	0	0	0	0	115.2	D1114	D1114-S1116 PolarHBondContact O-N 2.89Å
1117	S	31.4	Very low	48.6	Very low	107 Å²	107	115.1 Å²	115.1	75%	0.748	67%	0.665	S	S	*	*			trans	-169.7	119.4	146.6	48.5	0	0	0	0	114.4
1118	T	30.9	Very low	46.2	Very low	139 Å²	139	122.1 Å²	122.1	85%	0.853	69%	0.688	S	S	*	*			trans	32.3	129.7	144.3	53	0	0	0	0	122.2
1119	V	39.3	Very low	44.1	Very low	151 Å²	151	124.4 Å²	124.4	92%	0.915	69%	0.691	S	S	*	*			trans	-70.9	132.9	167.6	178.5	0	0	0	0	112.2
1120	A	36.2	Very low	42.1	Very low	96 Å²	96	123.8 Å²	123.8	79%	0.793	69%	0.694	S	S	*	*			trans	-151.9	159.4	153.8	0	0	0	0	0	109.6
1121	D	33.6	Very low	40	Very low	168 Å²	168	132.1 Å²	132.1	90%	0.898	73%	0.733	S	S	*	*			trans	-68.2	162.1	-158.5	-131.7	-53.3	0	0	0	117.4
1122	G	33.2	Very low	38.9	Very low	63 Å²	63	134.4 Å²	134.4	65%	0.649	74%	0.74	S	S	*	*			trans	142.5	89	169.7	0	0	0	0	0	116.2	K1124	G1122-K1124 PolarHBondContact O-N 3.05Å
1123	K	44.7	Very low	39.1	Very low	213 Å²	213	137.3 Å²	137.3	93%	0.926	74%	0.743	S	S	*	*			trans	-64	89	178.5	-68.1	177.6	-178.2	172	0	113.9
1124	K	38.5	Very low	39.5	Very low	193 Å²	193	134.5 Å²	134.5	84%	0.839	74%	0.738	S	S	*	*			trans	-134.8	114	159.7	-70.1	-178.6	-178.8	169.9	0	110	G1122	G1122-K1124 PolarHBondContact O-N 3.05Å
1125	K	33.8	Very low	40	Very low	200 Å²	200	131.3 Å²	131.3	87%	0.87	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-56.7	129.4	171.4	-68.6	-177.2	178.8	-179.7	0	108.3	R1127	K1125-R1127 PolarHBondContact O-N 3.33Å
1126	P	37.3	Very low	40.8	Very low	111 Å²	111	132.4 Å²	132.4	72%	0.721	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-59.7	132.9	175.2	24.1	-32.4	0	0	0	109.5	K1128	P1126-K1128 PolarHBondContact O-N 3.33Å
1127	R	44.3	Very low	42.7	Very low	159 Å²	159	128.8 Å²	128.8	60%	0.6	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-60.4	137.9	-179.3	-65.7	-178.4	177.9	-173.4	-2.6	109.3	K1125 W1129 L1130 E1154	K1125-R1127 PolarHBondContact O-N 3.33Å; R1127-W1129 PolarHBondContact O-N 2.94Å; R1127-L1130 PolarHBondContact O-N 2.86Å; R1127-L1130 VanDerWaalsContact O-N 3.09Å; R1127-E1154 IonicContact CZ-OE2 3.57Å; R1127-E1154 IonicContact NH1-OE1 2.69Å; R1127-E1154 PolarHBondContact NH1-OE1 3.14Å; R1127-E1154 IonicContact NH1-OE2 3.52Å; R1127-E1154 PolarHBondContact NH1-OE2 2.88Å; R1127-E1154 IonicContact NH2-OE2 3.76Å
1128	K	40.9	Very low	45.4	Very low	205 Å²	205	126.8 Å²	126.8	89%	0.891	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-47.4	-29.8	-179.1	-75.2	-173.2	173.4	-176.8	0	113.9	P1126 L1130 Q1131	P1126-K1128 PolarHBondContact O-N 3.33Å; K1128-L1130 PolarHBondContact O-N 3.31Å; K1128-L1130 VanDerWaalsContact O-N 3.11Å; K1128-Q1131 PolarHBondContact O-N 3.36Å
1129	W	45.6	Very low	48.2	Very low	76 Å²	76	120.2 Å²	120.2	29%	0.288	61%	0.612	S	S	.	*	G	3₁₀ helix	trans	-56.1	-19	178.1	-135	88.2	0	0	0	116	R1127 V1152 N1157 V1159	R1127-W1129 PolarHBondContact O-N 2.94Å; W1129-V1152 HydrophobicContact CH2-CB 4.46Å; W1129-V1152 HydrophobicContact CH2-CG1 3.79Å; W1129-V1152 HydrophobicContact CH2-CG2 3.76Å; W1129-V1152 HydrophobicContact CZ2-CG1 3.81Å; W1129-V1152 HydrophobicContact CZ3-CG2 4.11Å; W1129-N1157 PolarHBondContact NE1-OD1 3.27Å; W1129-V1159 HydrophobicContact CH2-CG2 3.87Å; W1129-V1159 HydrophobicContact CZ2-CG2 4.32Å
1130	L	46.7	Very low	50.6	Low	83 Å²	83	117.7 Å²	117.7	44%	0.435	59%	0.591	S	S	.	*	G	3₁₀ helix	trans	-73.9	-26.3	178.2	-97.9	76.5	0	0	0	113.8	R1127 K1128 R1137	R1127-L1130 PolarHBondContact O-N 2.86Å; R1127-L1130 VanDerWaalsContact O-N 3.09Å; K1128-L1130 PolarHBondContact O-N 3.31Å; K1128-L1130 VanDerWaalsContact O-N 3.11Å; L1130-R1137 PolarHBondContact O-NH2 2.87Å
1131	Q	39.2	Very low	53.1	Low	184 Å²	184	116.6 Å²	116.6	86%	0.86	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-101.1	23.3	-169.5	-157.7	176	-4	0	0	113.3	K1128	K1128-Q1131 PolarHBondContact O-N 3.36Å
1132	L	40.9	Very low	55.8	Low	70 Å²	70	108.7 Å²	108.7	37%	0.366	53%	0.529	S	S	.	.			trans	-86.9	141.2	178.4	-150.4	55.3	0	0	0	110.5	E1136	L1132-E1136 WeakPolarHBondContact CD1-OE1 3.36Å; L1132-E1136 HydrophobicContact CD2-CB 4.11Å; L1132-E1136 HydrophobicContact CD2-CG 4.43Å; L1132-E1136 WeakPolarHBondContact CD2-OE2 3.24Å; L1132-E1136 HydrophobicContact CG-CB 4.32Å; L1132-E1136 HydrophobicContact CG-CG 4.44Å; L1132-E1136 WeakPolarHBondContact CG-OE1 3.26Å
1133	E	46.6	Very low	58.4	Low	155 Å²	155	107.8 Å²	107.8	72%	0.724	51%	0.507	S	S	*	.			trans	-69.6	169.8	-169.7	-63.5	-169.4	134	0	0	113.2	S1135 E1136	E1133-S1135 PolarHBondContact O-N 3.15Å; E1133-E1136 PolarHBondContact O-N 3.1Å
1134	T	51.9	Low	60.5	Low	119 Å²	119	98.2 Å²	98.2	73%	0.73	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-5.3	-170.9	39.5	0	0	0	0	115.7
1135	S	46	Very low	63	Low	64 Å²	64	90.2 Å²	90.2	45%	0.448	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-37.6	178.6	34.4	0	0	0	0	114.2	E1133 R1137	E1133-S1135 PolarHBondContact O-N 3.15Å; S1135-R1137 PolarHBondContact O-N 3.06Å
1136	E	57.8	Low	65.6	Low	111 Å²	111	80.8 Å²	80.8	52%	0.519	39%	0.392	S	S	.	.	S	Bend	trans	-95.9	9.1	-158.8	-66.7	-173.5	-121.6	0	0	115.7	L1132 E1133	L1132-E1136 WeakPolarHBondContact CD1-OE1 3.36Å; L1132-E1136 HydrophobicContact CD2-CB 4.11Å; L1132-E1136 HydrophobicContact CD2-CG 4.43Å; L1132-E1136 WeakPolarHBondContact CD2-OE2 3.24Å; L1132-E1136 HydrophobicContact CG-CB 4.32Å; L1132-E1136 HydrophobicContact CG-CG 4.44Å; L1132-E1136 WeakPolarHBondContact CG-OE1 3.26Å; E1133-E1136 PolarHBondContact O-N 3.1Å
1137	R	77.5	Confident	68.1	Low	37 Å²	37	76.5 Å²	76.5	14%	0.14	36%	0.361	C	S	.	.			trans	-103.3	42.2	179.4	-69.5	178.4	-175.7	148.3	9.1	113.1	L1130 S1135 C1146 M1150	L1130-R1137 PolarHBondContact O-NH2 2.87Å; S1135-R1137 PolarHBondContact O-N 3.06Å; R1137-C1146 PolarHBondContact O-N 3.42Å; R1137-M1150 HydrophobicContact CB-CE 4.02Å; R1137-M1150 HydrophobicContact CB-SD 4.31Å; R1137-M1150 HydrophobicContact CG-CE 4.03Å; R1137-M1150 HydrophobicContact CG-SD 4.06Å
1138	R	88.4	Confident	70.4	Confident	66 Å²	66	69 Å²	69	25%	0.249	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-91.8	140.8	175	-65.5	-175.5	-178.8	-80.3	-1.4	110.7	K1054 Q1140 Q1143 H1144 V1159	K1054-R1138 PolarHBondContact O-NH1 2.87Å; K1054-R1138 PolarHBondContact O-NH2 3.32Å; R1138-Q1140 PolarHBondContact O-N 3.45Å; R1138-Q1143 PolarHBondContact NH1-O 3.11Å; R1138-H1144 CarbonylContact C-O 3.48Å; R1138-H1144 WeakPolarHBondContact CA-O 3.49Å; R1138-V1159 WeakPolarHBondContact O-CB 3.41Å
1139	C	90.5	Very high	72.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.292	C	S	.	.			trans	-67.4	121.9	169	178.2	0	0	0	0	110.1	I1141 C1142 Q1143 H1144 V1159 C1161 C1164	C1139-I1141 PolarHBondContact O-N 3.23Å; C1139-C1142 VanDerWaalsContact SG-SG 3.64Å; C1139-Q1143 VanDerWaalsContact O-CA 3.24Å; C1139-Q1143 WeakPolarHBondContact O-CA 3.24Å; C1139-Q1143 PolarHBondContact O-N 3.15Å; C1139-H1144 PolarHBondContact N-O 3.39Å; C1139-V1159 CarbonylContact C-O 3.58Å; C1139-V1159 WeakPolarHBondContact CA-O 3.43Å; C1139-C1161 HydrophobicContact CB-CB 4.07Å; C1139-C1161 PolarHBondContact SG-N 3.13Å; C1139-C1164 VanDerWaalsContact SG-CB 3.56Å; C1139-C1164 VanDerWaalsContact SG-SG 3.66Å
1140	Q	89.4	Confident	75.1	Confident	98 Å²	98	55.8 Å²	55.8	46%	0.458	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-29.7	-179.7	-176.2	62.9	13.7	0	0	113.6	R1138 Q1143 V1158 V1159	R1138-Q1140 PolarHBondContact O-N 3.45Å; Q1140-Q1143 PolarHBondContact O-NE2 2.95Å; Q1140-V1158 HydrophobicContact CB-CG1 3.71Å; Q1140-V1158 HydrophobicContact CG-CG1 4.03Å; Q1140-V1159 PolarHBondContact N-O 3.37Å
1141	I	89	Confident	77.3	Confident	74 Å²	74	51.9 Å²	51.9	38%	0.379	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-74.2	176.1	-59.8	178	0	0	0	109.9	H1051 C1139 Q1143 F1160 C1164	H1051-I1141 PolarHBondContact CD2-O 3.08Å; H1051-I1141 VanDerWaalsContact CD2-O 3.3Å; C1139-I1141 PolarHBondContact O-N 3.23Å; I1141-Q1143 PolarHBondContact O-N 2.66Å; I1141-F1160 HydrophobicContact CD1-CD1 4.07Å; I1141-F1160 HydrophobicContact CD1-CE1 3.94Å; I1141-F1160 HydrophobicContact CG1-CD1 4.28Å; I1141-F1160 HydrophobicContact CG1-CE1 4.14Å; I1141-C1164 HydrophobicContact CB-CB 4.36Å; I1141-C1164 HydrophobicContact CD1-CB 4.21Å
1142	C	89.1	Confident	79.8	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.007	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	8.4	-168.8	64	0	0	0	0	116.1	K1048 C1139 H1144	K1048-C1142 HydrophobicContact CG-CB 4.17Å; C1139-C1142 VanDerWaalsContact SG-SG 3.64Å; C1142-H1144 PolarHBondContact O-N 2.86Å
1143	Q	88.3	Confident	81.9	Confident	44 Å²	44	41.3 Å²	41.3	21%	0.206	21%	0.207	C	C	.	.			trans	56.3	5.7	179.9	-61.5	-58.8	-34.7	0	0	116.9	A1053 R1138 C1139 Q1140 I1141	A1053-Q1143 HydrophobicContact CB-CB 4.01Å; R1138-Q1143 PolarHBondContact NH1-O 3.11Å; C1139-Q1143 VanDerWaalsContact O-CA 3.24Å; C1139-Q1143 WeakPolarHBondContact O-CA 3.24Å; C1139-Q1143 PolarHBondContact O-N 3.15Å; Q1140-Q1143 PolarHBondContact O-NE2 2.95Å; I1141-Q1143 PolarHBondContact O-N 2.66Å
1144	H	89.3	Confident	83.1	Confident	12 Å²	12	38 Å²	38	6%	0.056	19%	0.191	C	C	.	.			trans	-66.1	130	178.5	177.7	55.3	0	0	0	112	K1048 K1054 E1059 R1138 C1139 C1142 C1146	K1048-H1144 HydrophobicContact CG-CB 4.09Å; K1054-H1144 PolarHBondContact NZ-ND1 3Å; E1059-H1144 IonicContact OE1-CD2 3.35Å; E1059-H1144 IonicContact OE1-CE1 2.75Å; E1059-H1144 PolarHBondContact OE1-CE1 2.86Å; E1059-H1144 IonicContact OE1-NE2 2.66Å; E1059-H1144 PolarHBondContact OE1-NE2 3.47Å; R1138-H1144 CarbonylContact C-O 3.48Å; R1138-H1144 WeakPolarHBondContact CA-O 3.49Å; C1139-H1144 PolarHBondContact N-O 3.39Å; C1142-H1144 PolarHBondContact O-N 2.86Å; H1144-C1146 PolarHBondContact O-N 3.14Å; H1144-C1146 PolarHBondContact O-SG 2.99Å; H1144-C1146 VanDerWaalsContact O-SG 3.41Å
1145	L	89.4	Confident	84.2	Confident	25 Å²	25	38.6 Å²	38.6	13%	0.131	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-83	104.7	-179.5	-161.5	157.6	0	0	0	109.5	S1057	S1057-L1145 VanDerWaalsContact CB-O 3.23Å; S1057-L1145 WeakPolarHBondContact CB-O 3.43Å; S1057-L1145 PolarHBondContact OG-O 3.19Å
1146	C	89.8	Confident	85.5	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.02	20%	0.195	C	C	.	.			trans	-81.2	130.1	-171.6	-56.7	0	0	0	0	110.5	R1137 H1144 M1150 C1161	R1137-C1146 PolarHBondContact O-N 3.42Å; H1144-C1146 PolarHBondContact O-N 3.14Å; H1144-C1146 PolarHBondContact O-SG 2.99Å; H1144-C1146 VanDerWaalsContact O-SG 3.41Å; C1146-M1150 HydrophobicContact CB-CB 3.93Å; C1146-M1150 HydrophobicContact CB-CE 3.87Å; C1146-C1161 VanDerWaalsContact SG-CB 3.54Å
1147	Y	90.1	Very high	86.4	Confident	21 Å²	21	40.7 Å²	40.7	8%	0.082	20%	0.196	C	C	.	.	S	Bend	trans	-127	-32.9	-177.2	171	-93.9	0	0	0	114.8	E1059 K1060 Y1063 Q1064 Y1110 R1183 Y1184	E1059-Y1147 HydrophobicContact CB-CD1 4.18Å; E1059-Y1147 WeakPolarHBondContact OE2-CA 3.26Å; E1059-Y1147 PolarHBondContact OE2-N 3.47Å; K1060-Y1147 VanDerWaalsContact CA-CD1 3.47Å; K1060-Y1147 HydrophobicContact CB-CD1 3.91Å; K1060-Y1147 HydrophobicContact CB-CD2 3.66Å; K1060-Y1147 HydrophobicContact CB-CE1 4.21Å; K1060-Y1147 HydrophobicContact CB-CE2 3.98Å; K1060-Y1147 HydrophobicContact CB-CG 3.62Å; K1060-Y1147 HydrophobicContact CD-CD2 4.28Å; K1060-Y1147 HydrophobicContact CD-CE2 4.29Å; K1060-Y1147 HydrophobicContact CG-CD2 3.86Å; K1060-Y1147 HydrophobicContact CG-CE2 3.72Å; K1060-Y1147 HydrophobicContact CG-CG 4.3Å; Y1063-Y1147 HydrophobicContact CG-CE1 4.42Å; Q1064-Y1147 PolarHBondContact NE2-OH 3.43Å; Y1110-Y1147 VanDerWaalsContact OH-C 3.23Å; Y1110-Y1147 PolarHBondContact OH-O 3.41Å; Y1147-R1183 VanDerWaalsContact CE2-NE 3.31Å; Y1147-R1183 PolarHBondContact O-NE 3.12Å; Y1147-Y1184 HydrophobicContact CE1-CE2 4.25Å
1148	L	91	Very high	86.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.198	C	C	.	.	S	Bend	trans	-80.6	-60.9	173.9	-60.3	-179.6	0	0	0	110.8	E1059 Y1063 L1088 E1092 Y1110 R1183 Y1184	E1059-L1148 HydrophobicContact CB-CD1 4.44Å; E1059-L1148 HydrophobicContact CB-CG 4.11Å; E1059-L1148 PolarHBondContact OE2-N 2.84Å; Y1063-L1148 HydrophobicContact CD1-CD2 3.85Å; Y1063-L1148 HydrophobicContact CD2-CD2 3.89Å; Y1063-L1148 HydrophobicContact CE1-CD2 3.58Å; Y1063-L1148 HydrophobicContact CE2-CD1 3.74Å; Y1063-L1148 HydrophobicContact CE2-CD2 3.64Å; Y1063-L1148 HydrophobicContact CE2-CG 4.3Å; Y1063-L1148 HydrophobicContact CG-CD2 3.99Å; Y1063-L1148 VanDerWaalsContact CZ-CD2 3.46Å; L1088-L1148 HydrophobicContact CD1-CD1 3.88Å; L1088-L1148 HydrophobicContact CD2-CD1 4.2Å; L1088-L1148 HydrophobicContact CG-CD1 3.94Å; E1092-L1148 HydrophobicContact CB-CD1 4.41Å; E1092-L1148 HydrophobicContact CG-CB 4.47Å; E1092-L1148 HydrophobicContact CG-CD1 4.27Å; Y1110-L1148 PolarHBondContact OH-O 3Å; L1148-R1183 WeakPolarHBondContact O-CB 3.21Å; L1148-R1183 PolarHBondContact O-N 3.42Å; L1148-Y1184 HydrophobicContact CD2-CD2 4.09Å; L1148-Y1184 HydrophobicContact CD2-CE2 4.48Å
1149	S	92.9	Very high	86.9	Confident	4 Å²	4	37.6 Å²	37.6	3%	0.028	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	161.8	175.2	-59.3	0	0	0	0	113	E1092 R1096 M1181 Y1182	E1092-S1149 VanDerWaalsContact OE1-CB 3.25Å; E1092-S1149 WeakPolarHBondContact OE1-CB 3.14Å; E1092-S1149 PolarHBondContact OE1-OG 3.41Å; R1096-S1149 PolarHBondContact NE-OG 3.31Å; R1096-S1149 PolarHBondContact NH2-OG 3.4Å; R1096-S1149 VanDerWaalsContact NH2-OG 3.12Å; S1149-M1181 CarbonylContact C-O 3.59Å; S1149-M1181 VanDerWaalsContact CA-O 3.23Å; S1149-M1181 WeakPolarHBondContact CA-O 3.3Å; S1149-M1181 WeakPolarHBondContact CB-O 3.44Å; S1149-Y1182 VanDerWaalsContact OG-CB 3.31Å; S1149-Y1182 WeakPolarHBondContact OG-CB 3.48Å
1150	M	93.3	Very high	87	Confident	1 Å²	1	38 Å²	38	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	160.1	171	62.2	-162.7	75.3	0	0	109.2	Y1110 R1137 C1146 V1152 V1159 F1160 M1181	Y1110-M1150 HydrophobicContact CE1-CE 4.08Å; Y1110-M1150 HydrophobicContact CE2-CE 3.87Å; Y1110-M1150 VanDerWaalsContact CZ-CE 3.5Å; Y1110-M1150 VanDerWaalsContact OH-CE 3.28Å; Y1110-M1150 WeakPolarHBondContact OH-CE 3.43Å; R1137-M1150 HydrophobicContact CB-CE 4.02Å; R1137-M1150 HydrophobicContact CB-SD 4.31Å; R1137-M1150 HydrophobicContact CG-CE 4.03Å; R1137-M1150 HydrophobicContact CG-SD 4.06Å; C1146-M1150 HydrophobicContact CB-CB 3.93Å; C1146-M1150 HydrophobicContact CB-CE 3.87Å; M1150-V1152 HydrophobicContact CG-CG2 3.97Å; M1150-V1152 HydrophobicContact SD-CG2 4.32Å; M1150-V1159 HydrophobicContact CB-CG1 3.9Å; M1150-V1159 HydrophobicContact CG-CG1 4.12Å; M1150-V1159 HydrophobicContact SD-CG1 3.68Å; M1150-F1160 CarbonylContact C-O 3.59Å; M1150-F1160 VanDerWaalsContact CA-O 3.32Å; M1150-F1160 WeakPolarHBondContact CA-O 3.25Å; M1150-F1160 WeakPolarHBondContact CB-O 3.25Å; M1150-M1181 HydrophobicContact CG-CB 4Å; M1150-M1181 PolarHBondContact N-O 2.88Å; M1150-M1181 PolarHBondContact O-N 3.14Å; M1150-M1181 VanDerWaalsContact O-O 3.07Å
1151	V	93.2	Very high	87.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130.6	166	-178.8	0	0	0	0	108.3	L1099 L1104 F1160 L1162 A1165 L1178 K1179 L1180	L1099-V1151 HydrophobicContact CD1-CG2 3.79Å; L1104-V1151 HydrophobicContact CD2-CB 4.43Å; L1104-V1151 HydrophobicContact CD2-CG1 3.88Å; L1104-V1151 HydrophobicContact CD2-CG2 3.61Å; V1151-F1160 HydrophobicContact CB-CB 4.48Å; V1151-F1160 PolarHBondContact N-O 2.91Å; V1151-F1160 PolarHBondContact O-N 2.85Å; V1151-L1162 HydrophobicContact CG2-CD2 4.04Å; V1151-A1165 HydrophobicContact CB-CB 3.55Å; V1151-A1165 HydrophobicContact CG1-CB 4.14Å; V1151-A1165 HydrophobicContact CG2-CB 3.4Å; V1151-A1165 VanDerWaalsContact CG2-CB 3.4Å; V1151-L1178 HydrophobicContact CG1-CB 3.83Å; V1151-L1178 HydrophobicContact CG1-CD1 4.44Å; V1151-L1178 HydrophobicContact CG1-CD2 4.18Å; V1151-L1178 HydrophobicContact CG1-CG 4.38Å; V1151-K1179 CarbonylContact C-O 3.53Å; V1151-K1179 VanDerWaalsContact CA-O 3.31Å; V1151-K1179 WeakPolarHBondContact CA-O 3.28Å; V1151-L1180 HydrophobicContact CG2-CD1 4.33Å
1152	V	90.9	Very high	87.5	Confident	8 Å²	8	30.3 Å²	30.3	5%	0.048	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	136.9	178.6	-175.7	0	0	0	0	109.3	W1129 M1150 V1158 V1159 L1178 K1179 M1181	W1129-V1152 HydrophobicContact CH2-CB 4.46Å; W1129-V1152 HydrophobicContact CH2-CG1 3.79Å; W1129-V1152 HydrophobicContact CH2-CG2 3.76Å; W1129-V1152 HydrophobicContact CZ2-CG1 3.81Å; W1129-V1152 HydrophobicContact CZ3-CG2 4.11Å; M1150-V1152 HydrophobicContact CG-CG2 3.97Å; M1150-V1152 HydrophobicContact SD-CG2 4.32Å; V1152-V1158 WeakPolarHBondContact CA-O 3.43Å; V1152-V1159 HydrophobicContact CG2-CG2 4.4Å; V1152-L1178 CarbonylContact O-C 3.51Å; V1152-K1179 PolarHBondContact N-O 3.36Å; V1152-K1179 PolarHBondContact O-N 3.1Å; V1152-M1181 HydrophobicContact CB-CG 4.13Å; V1152-M1181 HydrophobicContact CG2-CB 4.27Å; V1152-M1181 HydrophobicContact CG2-CG 3.59Å
1153	Q	86.1	Confident	87.7	Confident	24 Å²	24	33.2 Å²	33.2	11%	0.112	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	99.1	172.8	-171	169	-18.4	0	0	108.5	N1155 E1156 N1157 V1158 G1177 L1178	Q1153-N1155 PolarHBondContact O-N 3.45Å; Q1153-E1156 HydrophobicContact CG-CB 4.36Å; Q1153-E1156 PolarHBondContact NE2-OE1 2.74Å; Q1153-E1156 PolarHBondContact NE2-OE2 2.55Å; Q1153-E1156 PolarHBondContact O-N 3.44Å; Q1153-E1156 VanDerWaalsContact O-N 3.08Å; Q1153-N1157 PolarHBondContact O-N 2.86Å; Q1153-N1157 VanDerWaalsContact O-N 3.08Å; Q1153-V1158 HydrophobicContact CB-CB 4.35Å; Q1153-V1158 PolarHBondContact N-O 2.84Å; Q1153-G1177 WeakPolarHBondContact CA-O 3.36Å; Q1153-L1178 HydrophobicContact CB-CD2 3.87Å; Q1153-L1178 HydrophobicContact CG-CD2 4.05Å
1154	E	72.3	Confident	87.9	Confident	86 Å²	86	31.1 Å²	31.1	40%	0.402	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.1	-170.3	-71.6	-159.2	-176.1	0	0	112.9	R1127 G1177 K1179	R1127-E1154 IonicContact CZ-OE2 3.57Å; R1127-E1154 IonicContact NH1-OE1 2.69Å; R1127-E1154 PolarHBondContact NH1-OE1 3.14Å; R1127-E1154 IonicContact NH1-OE2 3.52Å; R1127-E1154 PolarHBondContact NH1-OE2 2.88Å; R1127-E1154 IonicContact NH2-OE2 3.76Å; E1154-G1177 PolarHBondContact N-O 2.95Å; E1154-G1177 VanDerWaalsContact N-O 3.14Å; E1154-K1179 HydrophobicContact CG-CD 4.4Å; E1154-K1179 WeakPolarHBondContact OE1-CD 3.32Å; E1154-K1179 WeakPolarHBondContact OE1-CE 3.45Å; E1154-K1179 IonicContact OE1-NZ 2.67Å; E1154-K1179 PolarHBondContact OE1-NZ 3.1Å
1155	N	73.7	Confident	88.1	Confident	131 Å²	131	30.6 Å²	30.6	70%	0.701	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-26.4	179.3	-65.3	-2.7	0	0	0	114.6	Q1153	Q1153-N1155 PolarHBondContact O-N 3.45Å
1156	E	73.1	Confident	88.2	Confident	119 Å²	119	30.4 Å²	30.4	56%	0.556	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.1	-3.2	-167.4	-71.3	168.6	-143.4	0	0	113.2	Q1153 V1158	Q1153-E1156 HydrophobicContact CG-CB 4.36Å; Q1153-E1156 PolarHBondContact NE2-OE1 2.74Å; Q1153-E1156 PolarHBondContact NE2-OE2 2.55Å; Q1153-E1156 PolarHBondContact O-N 3.44Å; Q1153-E1156 VanDerWaalsContact O-N 3.08Å; E1156-V1158 HydrophobicContact CB-CG2 3.84Å; E1156-V1158 PolarHBondContact O-N 3.27Å; E1156-V1158 VanDerWaalsContact O-N 3.13Å
1157	N	76.9	Confident	88.3	Confident	101 Å²	101	35.3 Å²	35.3	54%	0.54	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	10	-171.2	-61.1	-77.4	0	0	0	114.9	W1129 Q1153	W1129-N1157 PolarHBondContact NE1-OD1 3.27Å; Q1153-N1157 PolarHBondContact O-N 2.86Å; Q1153-N1157 VanDerWaalsContact O-N 3.08Å
1158	V	86.8	Confident	88.2	Confident	30 Å²	30	36.4 Å²	36.4	18%	0.182	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	135.8	179	-178.9	0	0	0	0	110.6	Q1140 V1152 Q1153 E1156 F1160	Q1140-V1158 HydrophobicContact CB-CG1 3.71Å; Q1140-V1158 HydrophobicContact CG-CG1 4.03Å; V1152-V1158 WeakPolarHBondContact CA-O 3.43Å; Q1153-V1158 HydrophobicContact CB-CB 4.35Å; Q1153-V1158 PolarHBondContact N-O 2.84Å; E1156-V1158 HydrophobicContact CB-CG2 3.84Å; E1156-V1158 PolarHBondContact O-N 3.27Å; E1156-V1158 VanDerWaalsContact O-N 3.13Å; V1158-F1160 HydrophobicContact CB-CE2 4.28Å; V1158-F1160 HydrophobicContact CB-CZ 4.41Å; V1158-F1160 HydrophobicContact CG1-CD2 4.26Å; V1158-F1160 HydrophobicContact CG1-CE1 3.91Å; V1158-F1160 HydrophobicContact CG1-CE2 3.61Å; V1158-F1160 HydrophobicContact CG1-CZ 3.41Å; V1158-F1160 VanDerWaalsContact CG1-CZ 3.41Å
1159	V	90.2	Very high	88.2	Confident	8 Å²	8	36.8 Å²	36.8	5%	0.048	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	135.5	178.5	179.5	0	0	0	0	110.1	W1129 R1138 C1139 Q1140 M1150 V1152	W1129-V1159 HydrophobicContact CH2-CG2 3.87Å; W1129-V1159 HydrophobicContact CZ2-CG2 4.32Å; R1138-V1159 WeakPolarHBondContact O-CB 3.41Å; C1139-V1159 CarbonylContact C-O 3.58Å; C1139-V1159 WeakPolarHBondContact CA-O 3.43Å; Q1140-V1159 PolarHBondContact N-O 3.37Å; M1150-V1159 HydrophobicContact CB-CG1 3.9Å; M1150-V1159 HydrophobicContact CG-CG1 4.12Å; M1150-V1159 HydrophobicContact SD-CG1 3.68Å; V1152-V1159 HydrophobicContact CG2-CG2 4.4Å
1160	F	92.3	Very high	87.9	Confident	9 Å²	9	42 Å²	42	4%	0.039	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	141.2	174.6	-58	-79.1	0	0	0	110.8	I1141 M1150 V1151 V1158 C1164 A1165 H1168 L1178	I1141-F1160 HydrophobicContact CD1-CD1 4.07Å; I1141-F1160 HydrophobicContact CD1-CE1 3.94Å; I1141-F1160 HydrophobicContact CG1-CD1 4.28Å; I1141-F1160 HydrophobicContact CG1-CE1 4.14Å; M1150-F1160 CarbonylContact C-O 3.59Å; M1150-F1160 VanDerWaalsContact CA-O 3.32Å; M1150-F1160 WeakPolarHBondContact CA-O 3.25Å; M1150-F1160 WeakPolarHBondContact CB-O 3.25Å; V1151-F1160 HydrophobicContact CB-CB 4.48Å; V1151-F1160 PolarHBondContact N-O 2.91Å; V1151-F1160 PolarHBondContact O-N 2.85Å; V1158-F1160 HydrophobicContact CB-CE2 4.28Å; V1158-F1160 HydrophobicContact CB-CZ 4.41Å; V1158-F1160 HydrophobicContact CG1-CD2 4.26Å; V1158-F1160 HydrophobicContact CG1-CE1 3.91Å; V1158-F1160 HydrophobicContact CG1-CE2 3.61Å; V1158-F1160 HydrophobicContact CG1-CZ 3.41Å; V1158-F1160 VanDerWaalsContact CG1-CZ 3.41Å; F1160-C1164 HydrophobicContact CB-CB 4.44Å; F1160-C1164 HydrophobicContact CD1-CB 4.47Å; F1160-A1165 HydrophobicContact CB-CB 3.86Å; F1160-H1168 AromaticContact CZ-ND1 3.79Å; F1160-L1178 HydrophobicContact CE2-CD2 4.42Å
1161	C	93.8	Very high	87.7	Confident	4 Å²	4	50.3 Å²	50.3	3%	0.027	24%	0.24	C	C	.	.			trans	-71.6	157.7	160.4	80.5	0	0	0	0	109.4	K1048 C1139 C1146 E1163 C1164 A1165	K1048-C1161 WeakPolarHBondContact CE-SG 3.34Å; C1139-C1161 HydrophobicContact CB-CB 4.07Å; C1139-C1161 PolarHBondContact SG-N 3.13Å; C1146-C1161 VanDerWaalsContact SG-CB 3.54Å; C1161-E1163 PolarHBondContact O-N 2.93Å; C1161-C1164 WeakPolarHBondContact O-CA 3.47Å; C1161-C1164 PolarHBondContact O-N 3.38Å; C1161-A1165 PolarHBondContact O-N 2.97Å
1162	L	94.4	Very high	87.2	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.026	27%	0.267	C	S	.	.	H	α-helix	trans	-55.9	-46.2	-170.1	-52.7	-172.5	0	0	0	113.1	Q1095 R1096 L1099 V1151 C1164 A1165 L1166 L1180	Q1095-L1162 HydrophobicContact CB-CB 3.71Å; Q1095-L1162 HydrophobicContact CB-CD1 3.85Å; Q1095-L1162 HydrophobicContact CB-CG 4.44Å; R1096-L1162 HydrophobicContact CG-CD1 3.96Å; L1099-L1162 HydrophobicContact CD1-CB 3.78Å; L1099-L1162 HydrophobicContact CD1-CD2 3.77Å; L1099-L1162 HydrophobicContact CD1-CG 4.26Å; V1151-L1162 HydrophobicContact CG2-CD2 4.04Å; L1162-C1164 VanDerWaalsContact C-N 3.31Å; L1162-C1164 PolarHBondContact O-N 2.88Å; L1162-A1165 WeakPolarHBondContact O-CB 3.39Å; L1162-A1165 PolarHBondContact O-N 3.27Å; L1162-A1165 VanDerWaalsContact O-N 3.14Å; L1162-L1166 PolarHBondContact O-N 3.33Å; L1162-L1180 HydrophobicContact CD2-CD1 3.49Å; L1162-L1180 VanDerWaalsContact CD2-CD1 3.49Å
1163	E	93.3	Very high	86.7	Confident	62 Å²	62	65.2 Å²	65.2	29%	0.29	31%	0.306	S	S	.	.	H	α-helix	trans	-58.7	-33.5	174	-169.5	-154.8	113.5	0	0	114.7	K1048 C1161 R1167	K1048-E1163 WeakPolarHBondContact CE-OE2 3.42Å; K1048-E1163 IonicContact NZ-OE2 2.7Å; K1048-E1163 PolarHBondContact NZ-OE2 3.22Å; C1161-E1163 PolarHBondContact O-N 2.93Å; E1163-R1167 WeakPolarHBondContact O-CG 3.34Å; E1163-R1167 PolarHBondContact O-N 3.22Å; E1163-R1167 PolarHBondContact O-NE 2.82Å; E1163-R1167 VanDerWaalsContact O-NE 3.08Å; E1163-R1167 IonicContact OE1-CZ 3.21Å; E1163-R1167 IonicContact OE1-NE 2.74Å; E1163-R1167 IonicContact OE1-NH2 3.11Å; E1163-R1167 PolarHBondContact OE1-NH2 2.83Å
1164	C	92.9	Very high	86.5	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.007	32%	0.316	C	S	.	.	H	α-helix	trans	-80.8	-32.1	175.5	-72.2	0	0	0	0	111.7	C1139 I1141 F1160 C1161 L1162 R1167 H1168	C1139-C1164 VanDerWaalsContact SG-CB 3.56Å; C1139-C1164 VanDerWaalsContact SG-SG 3.66Å; I1141-C1164 HydrophobicContact CB-CB 4.36Å; I1141-C1164 HydrophobicContact CD1-CB 4.21Å; F1160-C1164 HydrophobicContact CB-CB 4.44Å; F1160-C1164 HydrophobicContact CD1-CB 4.47Å; C1161-C1164 WeakPolarHBondContact O-CA 3.47Å; C1161-C1164 PolarHBondContact O-N 3.38Å; L1162-C1164 VanDerWaalsContact C-N 3.31Å; L1162-C1164 PolarHBondContact O-N 2.88Å; C1164-R1167 PolarHBondContact SG-NH2 2.98Å; C1164-H1168 WeakPolarHBondContact O-CB 3.36Å; C1164-H1168 PolarHBondContact O-N 2.99Å; C1164-H1168 VanDerWaalsContact O-N 3.1Å
1165	A	93.5	Very high	86.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-68.2	-41.9	174.4	0	0	0	0	0	111.4	L1099 V1151 F1160 C1161 L1162 H1168 V1169	L1099-A1165 HydrophobicContact CD1-CB 4.45Å; L1099-A1165 HydrophobicContact CD2-CB 4.06Å; V1151-A1165 HydrophobicContact CB-CB 3.55Å; V1151-A1165 HydrophobicContact CG1-CB 4.14Å; V1151-A1165 HydrophobicContact CG2-CB 3.4Å; V1151-A1165 VanDerWaalsContact CG2-CB 3.4Å; F1160-A1165 HydrophobicContact CB-CB 3.86Å; C1161-A1165 PolarHBondContact O-N 2.97Å; L1162-A1165 WeakPolarHBondContact O-CB 3.39Å; L1162-A1165 PolarHBondContact O-N 3.27Å; L1162-A1165 VanDerWaalsContact O-N 3.14Å; A1165-H1168 WeakPolarHBondContact O-CA 3.39Å; A1165-H1168 WeakPolarHBondContact O-CB 3.19Å; A1165-H1168 PolarHBondContact O-N 3.45Å; A1165-V1169 WeakPolarHBondContact O-CG2 3.47Å; A1165-V1169 PolarHBondContact O-N 3.04Å
1166	L	92.1	Very high	87.3	Confident	21 Å²	21	68.2 Å²	68.2	11%	0.11	31%	0.314	C	S	.	.	H	α-helix	trans	-59.3	-51	177	-174	64.4	0	0	0	110.2	Q1098 L1099 A1102 L1162 H1168 V1169 E1170	Q1098-L1166 HydrophobicContact CB-CD1 4.13Å; Q1098-L1166 HydrophobicContact CB-CD2 3.87Å; L1099-L1166 HydrophobicContact CD2-CB 4.02Å; L1099-L1166 HydrophobicContact CD2-CD1 4.17Å; L1099-L1166 HydrophobicContact CG-CB 4.48Å; L1099-L1166 HydrophobicContact CG-CD1 4.49Å; A1102-L1166 HydrophobicContact CB-CD1 4.17Å; L1162-L1166 PolarHBondContact O-N 3.33Å; L1166-H1168 PolarHBondContact O-N 3.35Å; L1166-H1168 VanDerWaalsContact O-N 3.15Å; L1166-V1169 PolarHBondContact O-N 3.32Å; L1166-V1169 VanDerWaalsContact O-N 3.11Å; L1166-E1170 WeakPolarHBondContact O-CB 3.32Å; L1166-E1170 VanDerWaalsContact O-CG 3.28Å; L1166-E1170 WeakPolarHBondContact O-CG 3.49Å; L1166-E1170 PolarHBondContact O-N 3.48Å
1167	R	90.8	Very high	87.7	Confident	106 Å²	106	64.2 Å²	64.2	40%	0.4	30%	0.304	S	S	.	.	H	α-helix	trans	-63.7	-17.2	174.6	-68.8	-176.9	-69.5	168.7	-0.8	114.9	E1163 C1164 E1170 K1171	E1163-R1167 WeakPolarHBondContact O-CG 3.34Å; E1163-R1167 PolarHBondContact O-N 3.22Å; E1163-R1167 PolarHBondContact O-NE 2.82Å; E1163-R1167 VanDerWaalsContact O-NE 3.08Å; E1163-R1167 IonicContact OE1-CZ 3.21Å; E1163-R1167 IonicContact OE1-NE 2.74Å; E1163-R1167 IonicContact OE1-NH2 3.11Å; E1163-R1167 PolarHBondContact OE1-NH2 2.83Å; C1164-R1167 PolarHBondContact SG-NH2 2.98Å; R1167-E1170 WeakPolarHBondContact CA-OE2 3.23Å; R1167-K1171 WeakPolarHBondContact O-CD 3.4Å; R1167-K1171 VanDerWaalsContact O-CG 3.25Å; R1167-K1171 WeakPolarHBondContact O-CG 3.31Å
1168	H	89.4	Confident	88.3	Confident	45 Å²	45	59.8 Å²	59.8	21%	0.208	28%	0.28	C	S	.	.	H	α-helix	trans	-83.3	-46.8	171.1	-179.1	110.2	0	0	0	110.6	F1160 C1164 A1165 L1166 K1171 Q1172	F1160-H1168 AromaticContact CZ-ND1 3.79Å; C1164-H1168 WeakPolarHBondContact O-CB 3.36Å; C1164-H1168 PolarHBondContact O-N 2.99Å; C1164-H1168 VanDerWaalsContact O-N 3.1Å; A1165-H1168 WeakPolarHBondContact O-CA 3.39Å; A1165-H1168 WeakPolarHBondContact O-CB 3.19Å; A1165-H1168 PolarHBondContact O-N 3.45Å; L1166-H1168 PolarHBondContact O-N 3.35Å; L1166-H1168 VanDerWaalsContact O-N 3.15Å; H1168-K1171 PolarHBondContact O-N 3.03Å; H1168-Q1172 WeakPolarHBondContact O-CB 3.31Å; H1168-Q1172 WeakPolarHBondContact O-CG 3.48Å; H1168-Q1172 PolarHBondContact O-N 2.86Å
1169	V	89.6	Confident	88.6	Confident	7 Å²	7	59.9 Å²	59.9	4%	0.042	28%	0.278	C	S	.	.	H	α-helix	trans	-60	-45.7	176.7	170.4	0	0	0	0	111.4	A1102 A1165 L1166 K1171 Q1172 K1173 C1175 L1178	A1102-V1169 HydrophobicContact CB-CG1 3.8Å; A1165-V1169 WeakPolarHBondContact O-CG2 3.47Å; A1165-V1169 PolarHBondContact O-N 3.04Å; L1166-V1169 PolarHBondContact O-N 3.32Å; L1166-V1169 VanDerWaalsContact O-N 3.11Å; V1169-K1171 VanDerWaalsContact C-N 3.27Å; V1169-K1171 PolarHBondContact O-N 3.27Å; V1169-Q1172 PolarHBondContact O-N 3.02Å; V1169-K1173 WeakPolarHBondContact O-CA 3.32Å; V1169-K1173 PolarHBondContact O-N 2.84Å; V1169-C1175 WeakPolarHBondContact CG1-SG 3.39Å; V1169-C1175 VanDerWaalsContact CG2-SG 3.56Å; V1169-L1178 HydrophobicContact CG2-CD1 3.56Å
1170	E	88.1	Confident	88.7	Confident	115 Å²	115	60.3 Å²	60.3	54%	0.537	28%	0.28	S	S	.	.	H	α-helix	trans	-55.7	-41.1	175.9	-72.5	166.9	168.1	0	0	112.2	L1166 R1167	L1166-E1170 WeakPolarHBondContact O-CB 3.32Å; L1166-E1170 VanDerWaalsContact O-CG 3.28Å; L1166-E1170 WeakPolarHBondContact O-CG 3.49Å; L1166-E1170 PolarHBondContact O-N 3.48Å; R1167-E1170 WeakPolarHBondContact CA-OE2 3.23Å
1171	K	87.8	Confident	88.7	Confident	174 Å²	174	60.8 Å²	60.8	76%	0.757	28%	0.283	S	S	*	.	H	α-helix	trans	-75.9	-41.7	180	-72.2	178.3	-177.2	-174.6	0	113	R1167 H1168 V1169	R1167-K1171 WeakPolarHBondContact O-CD 3.4Å; R1167-K1171 VanDerWaalsContact O-CG 3.25Å; R1167-K1171 WeakPolarHBondContact O-CG 3.31Å; H1168-K1171 PolarHBondContact O-N 3.03Å; V1169-K1171 VanDerWaalsContact C-N 3.27Å; V1169-K1171 PolarHBondContact O-N 3.27Å
1172	Q	82.4	Confident	88.6	Confident	125 Å²	125	63 Å²	63	58%	0.584	29%	0.291	S	S	*	.	H	α-helix	trans	-84.4	-13.5	-178.3	-65.6	-64.9	-8.1	0	0	113.6	H1168 V1169 S1174	H1168-Q1172 WeakPolarHBondContact O-CB 3.31Å; H1168-Q1172 WeakPolarHBondContact O-CG 3.48Å; H1168-Q1172 PolarHBondContact O-N 2.86Å; V1169-Q1172 PolarHBondContact O-N 3.02Å; Q1172-S1174 PolarHBondContact O-N 3.35Å; Q1172-S1174 VanDerWaalsContact O-N 3.12Å
1173	K	82	Confident	88.4	Confident	197 Å²	197	65.2 Å²	65.2	86%	0.857	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	32.2	-172.3	-57.8	-174.7	179	-176.8	0	113.2	V1169	V1169-K1173 WeakPolarHBondContact O-CA 3.32Å; V1169-K1173 PolarHBondContact O-N 2.84Å
1174	S	81.6	Confident	88.3	Confident	46 Å²	46	63.7 Å²	63.7	32%	0.322	29%	0.29	S	S	.	.			trans	-155	129.1	-170.2	178	0	0	0	0	111.6	Q1172 R1176	Q1172-S1174 PolarHBondContact O-N 3.35Å; Q1172-S1174 VanDerWaalsContact O-N 3.12Å; S1174-R1176 PolarHBondContact OG-N 2.83Å
1175	C	80.2	Confident	88.2	Confident	26 Å²	26	65.8 Å²	65.8	18%	0.176	30%	0.302	C	S	.	.			trans	-95.3	8.4	169.2	-76.2	0	0	0	0	113.4	A1102 L1104 V1169 G1177 L1178	A1102-C1175 PolarHBondContact O-SG 3.24Å; L1104-C1175 HydrophobicContact CD1-CB 4.23Å; V1169-C1175 WeakPolarHBondContact CG1-SG 3.39Å; V1169-C1175 VanDerWaalsContact CG2-SG 3.56Å; C1175-G1177 PolarHBondContact O-N 2.92Å; C1175-L1178 PolarHBondContact O-N 2.79Å
1176	R	81.4	Confident	88.1	Confident	232 Å²	232	69.1 Å²	69.1	88%	0.875	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	125.2	-174.2	-67.9	-172.7	177.6	-148.4	0.2	111.5	S1174 L1178	S1174-R1176 PolarHBondContact OG-N 2.83Å; R1176-L1178 VanDerWaalsContact C-N 3.27Å; R1176-L1178 PolarHBondContact O-N 3.26Å
1177	G	82.7	Confident	88.1	Confident	34 Å²	34	75.8 Å²	75.8	35%	0.351	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	-6.2	-179.9	0	0	0	0	0	115	Q1153 E1154 C1175	Q1153-G1177 WeakPolarHBondContact CA-O 3.36Å; E1154-G1177 PolarHBondContact N-O 2.95Å; E1154-G1177 VanDerWaalsContact N-O 3.14Å; C1175-G1177 PolarHBondContact O-N 2.92Å
1178	L	89.9	Confident	88.1	Confident	8 Å²	8	74.7 Å²	74.7	4%	0.042	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	153.7	172.7	-61.6	-178	0	0	0	111.3	L1104 V1151 V1152 Q1153 F1160 V1169 C1175 R1176	L1104-L1178 HydrophobicContact CD1-CB 3.66Å; V1151-L1178 HydrophobicContact CG1-CB 3.83Å; V1151-L1178 HydrophobicContact CG1-CD1 4.44Å; V1151-L1178 HydrophobicContact CG1-CD2 4.18Å; V1151-L1178 HydrophobicContact CG1-CG 4.38Å; V1152-L1178 CarbonylContact O-C 3.51Å; Q1153-L1178 HydrophobicContact CB-CD2 3.87Å; Q1153-L1178 HydrophobicContact CG-CD2 4.05Å; F1160-L1178 HydrophobicContact CE2-CD2 4.42Å; V1169-L1178 HydrophobicContact CG2-CD1 3.56Å; C1175-L1178 PolarHBondContact O-N 2.79Å; R1176-L1178 VanDerWaalsContact C-N 3.27Å; R1176-L1178 PolarHBondContact O-N 3.26Å
1179	K	91.4	Very high	88.1	Confident	32 Å²	32	72.5 Å²	72.5	14%	0.139	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	128.2	179.3	-171.5	177	-165	-178.4	0	112.5	S1106 V1151 V1152 E1154 M1181	S1106-K1179 CarbonylContact O-C 3.54Å; S1106-K1179 WeakPolarHBondContact O-CA 3.38Å; V1151-K1179 CarbonylContact C-O 3.53Å; V1151-K1179 VanDerWaalsContact CA-O 3.31Å; V1151-K1179 WeakPolarHBondContact CA-O 3.28Å; V1152-K1179 PolarHBondContact N-O 3.36Å; V1152-K1179 PolarHBondContact O-N 3.1Å; E1154-K1179 HydrophobicContact CG-CD 4.4Å; E1154-K1179 WeakPolarHBondContact OE1-CD 3.32Å; E1154-K1179 WeakPolarHBondContact OE1-CE 3.45Å; E1154-K1179 IonicContact OE1-NZ 2.67Å; E1154-K1179 PolarHBondContact OE1-NZ 3.1Å; K1179-M1181 HydrophobicContact CD-SD 3.79Å; K1179-M1181 HydrophobicContact CG-SD 4Å; K1179-M1181 PolarHBondContact O-N 3.39Å
1180	L	92.6	Very high	88.2	Confident	17 Å²	17	75.2 Å²	75.2	9%	0.089	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	111.5	173.2	177.9	63.2	0	0	0	110.4	R1096 L1104 S1106 S1107 A1108 V1151 L1162 Y1182	R1096-L1180 HydrophobicContact CG-CD2 4.33Å; L1104-L1180 HydrophobicContact CD2-CB 4.05Å; L1104-L1180 HydrophobicContact CG-CB 4.43Å; S1106-L1180 PolarHBondContact O-N 3.5Å; S1107-L1180 CarbonylContact C-O 3.54Å; S1107-L1180 WeakPolarHBondContact CA-O 3.48Å; S1107-L1180 WeakPolarHBondContact CB-O 3.22Å; A1108-L1180 PolarHBondContact N-O 3.03Å; V1151-L1180 HydrophobicContact CG2-CD1 4.33Å; L1162-L1180 HydrophobicContact CD2-CD1 3.49Å; L1162-L1180 VanDerWaalsContact CD2-CD1 3.49Å; L1180-Y1182 HydrophobicContact CG-CD1 4.43Å
1181	M	92.3	Very high	88.3	Confident	20 Å²	20	73.3 Å²	73.3	10%	0.099	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.5	173.1	-60.7	-59.2	-60.8	0	0	108.7	A1108 Y1110 S1149 M1150 V1152 K1179	A1108-M1181 HydrophobicContact CB-CE 4.05Å; A1108-M1181 HydrophobicContact CB-SD 3.92Å; A1108-M1181 VanDerWaalsContact O-CA 3.32Å; A1108-M1181 WeakPolarHBondContact O-CA 3.11Å; Y1110-M1181 HydrophobicContact CD1-CB 3.79Å; Y1110-M1181 HydrophobicContact CE1-CB 4.24Å; Y1110-M1181 WeakPolarHBondContact CE1-O 3.11Å; S1149-M1181 CarbonylContact C-O 3.59Å; S1149-M1181 VanDerWaalsContact CA-O 3.23Å; S1149-M1181 WeakPolarHBondContact CA-O 3.3Å; S1149-M1181 WeakPolarHBondContact CB-O 3.44Å; M1150-M1181 HydrophobicContact CG-CB 4Å; M1150-M1181 PolarHBondContact N-O 2.88Å; M1150-M1181 PolarHBondContact O-N 3.14Å; M1150-M1181 VanDerWaalsContact O-O 3.07Å; V1152-M1181 HydrophobicContact CB-CG 4.13Å; V1152-M1181 HydrophobicContact CG2-CB 4.27Å; V1152-M1181 HydrophobicContact CG2-CG 3.59Å; K1179-M1181 HydrophobicContact CD-SD 3.79Å; K1179-M1181 HydrophobicContact CG-SD 4Å; K1179-M1181 PolarHBondContact O-N 3.39Å
1182	Y	92	Very high	88.4	Confident	49 Å²	49	66.1 Å²	66.1	19%	0.192	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	152.4	179.7	59.1	-98.5	0	0	0	112.7	A1108 R1109 Y1110 S1149 L1180 D1185	A1108-Y1182 PolarHBondContact O-N 3.37Å; A1108-Y1182 VanDerWaalsContact O-N 3.08Å; R1109-Y1182 CarbonylContact C-O 3.54Å; R1109-Y1182 WeakPolarHBondContact CA-O 3.49Å; R1109-Y1182 HydrophobicContact CB-CD2 4.38Å; R1109-Y1182 HydrophobicContact CB-CE2 3.9Å; R1109-Y1182 HydrophobicContact CG-CD2 4.11Å; R1109-Y1182 HydrophobicContact CG-CE2 3.91Å; R1109-Y1182 WeakPolarHBondContact CG-O 3.42Å; Y1110-Y1182 WeakPolarHBondContact CD1-O 3.31Å; Y1110-Y1182 PolarHBondContact N-O 2.87Å; S1149-Y1182 VanDerWaalsContact OG-CB 3.31Å; S1149-Y1182 WeakPolarHBondContact OG-CB 3.48Å; L1180-Y1182 HydrophobicContact CG-CD1 4.43Å; Y1182-D1185 WeakPolarHBondContact CE2-OD1 3.47Å
1183	R	90.4	Very high	88.6	Confident	52 Å²	52	60.2 Å²	60.2	20%	0.196	29%	0.292	C	S	.	.	S	Bend	trans	-89.7	-48.8	175.1	175.8	-179.4	-74.1	-79.5	3.2	112.2	R1109 Y1110 G1111 Y1147 L1148	R1109-R1183 PolarHBondContact NE-O 3.03Å; Y1110-R1183 HydrophobicContact CE1-CB 4.32Å; G1111-R1183 PolarHBondContact O-NH1 2.85Å; G1111-R1183 VanDerWaalsContact O-NH1 3.14Å; Y1147-R1183 VanDerWaalsContact CE2-NE 3.31Å; Y1147-R1183 PolarHBondContact O-NE 3.12Å; L1148-R1183 WeakPolarHBondContact O-CB 3.21Å; L1148-R1183 PolarHBondContact O-N 3.42Å
1184	Y	90.3	Very high	88.9	Confident	30 Å²	30	55.2 Å²	55.2	12%	0.118	28%	0.275	C	S	.	.	S	Bend	trans	-116.3	143.4	-175.6	-60.8	-65.7	0	0	0	110.7	Y1063 Q1067 R1096 Y1147 L1148	Y1063-Y1184 AromaticContact CD1-CD2 3.9Å; Y1063-Y1184 HydrophobicContact CD1-CD2 3.9Å; Y1063-Y1184 AromaticContact CD1-CE2 3.63Å; Y1063-Y1184 HydrophobicContact CD1-CE2 3.63Å; Y1063-Y1184 AromaticContact CE1-CD2 3.78Å; Y1063-Y1184 HydrophobicContact CE1-CD2 3.78Å; Y1063-Y1184 HydrophobicContact CE1-CE2 4.02Å; Q1067-Y1184 PolarHBondContact NE2-OH 2.65Å; R1096-Y1184 PolarHBondContact NH1-O 3.08Å; R1096-Y1184 PolarHBondContact NH2-O 2.78Å; Y1147-Y1184 HydrophobicContact CE1-CE2 4.25Å; L1148-Y1184 HydrophobicContact CD2-CD2 4.09Å; L1148-Y1184 HydrophobicContact CD2-CE2 4.48Å
1185	D	91.4	Very high	89.2	Confident	45 Å²	45	57.4 Å²	57.4	24%	0.241	28%	0.28	C	S	.	.			trans	-74.3	159.6	175.4	-45.8	-53.1	0	0	0	110	R1109 Y1182 E1187 Q1188 I1189	R1109-D1185 IonicContact CZ-OD1 2.7Å; R1109-D1185 IonicContact CZ-OD2 3.74Å; R1109-D1185 IonicContact NH1-OD1 2.85Å; R1109-D1185 PolarHBondContact NH1-OD1 3Å; R1109-D1185 IonicContact NH1-OD2 3.02Å; R1109-D1185 PolarHBondContact NH1-OD2 3.31Å; R1109-D1185 VanDerWaalsContact NH2-CG 3.31Å; R1109-D1185 IonicContact NH2-OD1 3.25Å; R1109-D1185 PolarHBondContact NH2-OD1 2.99Å; R1109-D1185 IonicContact NH2-OD2 2.79Å; R1109-D1185 PolarHBondContact NH2-OD2 2.9Å; Y1182-D1185 WeakPolarHBondContact CE2-OD1 3.47Å; D1185-E1187 VanDerWaalsContact C-N 3.32Å; D1185-E1187 PolarHBondContact O-N 2.93Å; D1185-Q1188 HydrophobicContact CB-CG 4.16Å; D1185-Q1188 WeakPolarHBondContact O-CB 3.21Å; D1185-Q1188 PolarHBondContact O-N 2.87Å; D1185-Q1188 VanDerWaalsContact O-N 3.1Å; D1185-Q1188 VanDerWaalsContact OD2-CD 3.29Å; D1185-Q1188 PolarHBondContact OD2-NE2 2.93Å; D1185-Q1188 PolarHBondContact OD2-OE1 3.13Å; D1185-I1189 PolarHBondContact O-N 3.08Å; D1185-I1189 VanDerWaalsContact O-N 3.1Å
1186	E	91.6	Very high	89.5	Confident	70 Å²	70	56.1 Å²	56.1	33%	0.327	27%	0.272	S	S	.	.	H	α-helix	trans	-61.6	-41.4	-176.7	-57.4	-160.2	172.4	0	0	111.8	L1093 R1096 Q1188 I1189 I1190	L1093-E1186 HydrophobicContact CD2-CB 3.62Å; L1093-E1186 HydrophobicContact CD2-CG 3.51Å; R1096-E1186 WeakPolarHBondContact CD-OE1 3.48Å; E1186-Q1188 VanDerWaalsContact C-N 3.31Å; E1186-Q1188 PolarHBondContact O-N 2.89Å; E1186-I1189 PolarHBondContact O-N 3Å; E1186-I1190 WeakPolarHBondContact O-CB 3.32Å; E1186-I1190 WeakPolarHBondContact O-CD1 3.1Å; E1186-I1190 VanDerWaalsContact O-CG1 3.25Å; E1186-I1190 WeakPolarHBondContact O-CG1 3.32Å; E1186-I1190 PolarHBondContact O-N 3.25Å
1187	E	91.4	Very high	89.6	Confident	161 Å²	161	46.3 Å²	46.3	75%	0.752	24%	0.238	S	C	*	.	H	α-helix	trans	-58.1	-39.1	173.6	-63	178.1	-179.9	0	0	113	D1185 S1191	D1185-E1187 VanDerWaalsContact C-N 3.32Å; D1185-E1187 PolarHBondContact O-N 2.93Å; E1187-S1191 WeakPolarHBondContact O-CB 3.34Å; E1187-S1191 PolarHBondContact O-N 2.97Å
1188	Q	90.6	Very high	89.5	Confident	83 Å²	83	46.2 Å²	46.2	39%	0.388	24%	0.237	S	C	.	.	H	α-helix	trans	-69.9	-39	179.8	-65.8	-177.9	-22.1	0	0	111.7	R1109 D1185 E1186 L1192	R1109-Q1188 VanDerWaalsContact NH2-NE2 3.13Å; D1185-Q1188 HydrophobicContact CB-CG 4.16Å; D1185-Q1188 WeakPolarHBondContact O-CB 3.21Å; D1185-Q1188 PolarHBondContact O-N 2.87Å; D1185-Q1188 VanDerWaalsContact O-N 3.1Å; D1185-Q1188 VanDerWaalsContact OD2-CD 3.29Å; D1185-Q1188 PolarHBondContact OD2-NE2 2.93Å; D1185-Q1188 PolarHBondContact OD2-OE1 3.13Å; E1186-Q1188 VanDerWaalsContact C-N 3.31Å; E1186-Q1188 PolarHBondContact O-N 2.89Å; Q1188-L1192 WeakPolarHBondContact O-CB 3.46Å; Q1188-L1192 PolarHBondContact O-N 3.34Å
1189	I	90.4	Very high	88.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-50.9	175	-68.2	178.3	0	0	0	109.6	Y1063 R1089 E1092 D1185 E1186 S1191 L1192 V1193	Y1063-I1189 HydrophobicContact CE1-CG1 4.39Å; Y1063-I1189 WeakPolarHBondContact OH-CG1 3.22Å; Y1063-I1189 VanDerWaalsContact OH-CG2 3.3Å; Y1063-I1189 WeakPolarHBondContact OH-CG2 3.47Å; R1089-I1189 HydrophobicContact CB-CG2 3.94Å; R1089-I1189 HydrophobicContact CG-CG2 3.8Å; E1092-I1189 HydrophobicContact CG-CD1 4.02Å; D1185-I1189 PolarHBondContact O-N 3.08Å; D1185-I1189 VanDerWaalsContact O-N 3.1Å; E1186-I1189 PolarHBondContact O-N 3Å; I1189-S1191 PolarHBondContact O-N 3.08Å; I1189-L1192 PolarHBondContact O-N 3.26Å; I1189-V1193 WeakPolarHBondContact O-CG2 3.45Å; I1189-V1193 PolarHBondContact O-N 3.2Å; I1189-V1193 VanDerWaalsContact O-N 3.14Å
1190	I	91.9	Very high	88.3	Confident	64 Å²	64	50.3 Å²	50.3	33%	0.328	26%	0.258	S	S	.	.	H	α-helix	trans	-58.8	-47.5	178.3	-67.7	161.2	0	0	0	110.4	L1093 E1186 V1193 N1194	L1093-I1190 HydrophobicContact CD1-CD1 4.05Å; L1093-I1190 HydrophobicContact CD1-CG1 3.88Å; E1186-I1190 WeakPolarHBondContact O-CB 3.32Å; E1186-I1190 WeakPolarHBondContact O-CD1 3.1Å; E1186-I1190 VanDerWaalsContact O-CG1 3.25Å; E1186-I1190 WeakPolarHBondContact O-CG1 3.32Å; E1186-I1190 PolarHBondContact O-N 3.25Å; I1190-V1193 PolarHBondContact O-N 3.31Å; I1190-N1194 WeakPolarHBondContact CG2-ND2 3.19Å; I1190-N1194 VanDerWaalsContact O-CB 3.24Å; I1190-N1194 WeakPolarHBondContact O-CB 3.48Å; I1190-N1194 PolarHBondContact O-N 2.86Å; I1190-N1194 PolarHBondContact O-OD1 3.24Å
1191	S	90.9	Very high	87.2	Confident	74 Å²	74	53.6 Å²	53.6	52%	0.517	28%	0.282	S	S	.	.	H	α-helix	trans	-61	-46.4	180	-175.8	0	0	0	0	112.6	E1187 I1189 V1193 N1194 Q1195	E1187-S1191 WeakPolarHBondContact O-CB 3.34Å; E1187-S1191 PolarHBondContact O-N 2.97Å; I1189-S1191 PolarHBondContact O-N 3.08Å; S1191-V1193 PolarHBondContact O-N 3.21Å; S1191-N1194 PolarHBondContact O-N 2.91Å; S1191-Q1195 VanDerWaalsContact O-CB 3.26Å; S1191-Q1195 WeakPolarHBondContact O-CB 3.47Å; S1191-Q1195 PolarHBondContact O-N 3.12Å
1192	L	88.9	Confident	85.7	Confident	24 Å²	24	55.5 Å²	55.5	13%	0.126	31%	0.307	C	S	.	.	H	α-helix	trans	-62.2	-43.9	178.8	177.7	61.2	0	0	0	112.3	Y1063 A1066 Q1067 Q1188 I1189 I1196	Y1063-L1192 HydrophobicContact CD1-CD2 3.95Å; Y1063-L1192 HydrophobicContact CE1-CD2 4.07Å; A1066-L1192 HydrophobicContact CB-CD1 4.49Å; A1066-L1192 HydrophobicContact CB-CD2 4.33Å; Q1067-L1192 HydrophobicContact CG-CD1 4.3Å; Q1067-L1192 HydrophobicContact CG-CD2 4.02Å; Q1188-L1192 WeakPolarHBondContact O-CB 3.46Å; Q1188-L1192 PolarHBondContact O-N 3.34Å; I1189-L1192 PolarHBondContact O-N 3.26Å; L1192-I1196 HydrophobicContact CD1-CD1 4.04Å; L1192-I1196 HydrophobicContact CG-CD1 4.33Å; L1192-I1196 WeakPolarHBondContact O-CG1 3.34Å; L1192-I1196 PolarHBondContact O-N 2.96Å
1193	V	87.6	Confident	83.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-70.8	-43.8	179	-176	0	0	0	0	110.6	L1085 D1086 R1089 I1189 I1190 S1191 Q1195 I1196 C1197	L1085-V1193 HydrophobicContact CB-CG1 4.17Å; L1085-V1193 HydrophobicContact CB-CG2 4.04Å; D1086-V1193 WeakPolarHBondContact OD1-CG1 3.4Å; R1089-V1193 HydrophobicContact CB-CG2 4.23Å; R1089-V1193 VanDerWaalsContact NH1-CG1 3.32Å; I1189-V1193 WeakPolarHBondContact O-CG2 3.45Å; I1189-V1193 PolarHBondContact O-N 3.2Å; I1189-V1193 VanDerWaalsContact O-N 3.14Å; I1190-V1193 PolarHBondContact O-N 3.31Å; S1191-V1193 PolarHBondContact O-N 3.21Å; V1193-Q1195 VanDerWaalsContact C-N 3.31Å; V1193-Q1195 PolarHBondContact O-N 3.47Å; V1193-I1196 PolarHBondContact O-N 3.27Å; V1193-C1197 PolarHBondContact O-N 2.7Å; V1193-C1197 PolarHBondContact O-SG 3.46Å; V1193-C1197 VanDerWaalsContact O-SG 3.38Å
1194	N	88.2	Confident	81	Confident	92 Å²	92	67 Å²	67	49%	0.492	37%	0.368	S	S	.	.	H	α-helix	trans	-61.5	-37.9	176.8	-69.7	1	0	0	0	112.4	I1190 S1191 I1196 G1198	I1190-N1194 WeakPolarHBondContact CG2-ND2 3.19Å; I1190-N1194 VanDerWaalsContact O-CB 3.24Å; I1190-N1194 WeakPolarHBondContact O-CB 3.48Å; I1190-N1194 PolarHBondContact O-N 2.86Å; I1190-N1194 PolarHBondContact O-OD1 3.24Å; S1191-N1194 PolarHBondContact O-N 2.91Å; N1194-I1196 VanDerWaalsContact C-N 3.32Å; N1194-I1196 PolarHBondContact O-N 3.48Å; N1194-G1198 WeakPolarHBondContact O-CA 3.19Å; N1194-G1198 PolarHBondContact O-N 2.86Å
1195	Q	87.4	Confident	78.3	Confident	92 Å²	92	68.2 Å²	68.2	43%	0.43	39%	0.389	S	S	.	.	H	α-helix	trans	-60.9	-40.7	173.2	179.3	-176.3	-15.7	0	0	111.6	S1191 V1193 K1199	S1191-Q1195 VanDerWaalsContact O-CB 3.26Å; S1191-Q1195 WeakPolarHBondContact O-CB 3.47Å; S1191-Q1195 PolarHBondContact O-N 3.12Å; V1193-Q1195 VanDerWaalsContact C-N 3.31Å; V1193-Q1195 PolarHBondContact O-N 3.47Å; Q1195-K1199 WeakPolarHBondContact O-CB 3.46Å; Q1195-K1199 WeakPolarHBondContact O-CG 3.49Å; Q1195-K1199 PolarHBondContact O-N 3.25Å; Q1195-K1199 VanDerWaalsContact O-N 3.11Å
1196	I	86.1	Confident	75.5	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-73.9	-50.5	-179.2	-73	169.5	0	0	0	110.9	A1066 A1070 L1078 L1085 L1192 V1193 N1194 G1198 K1199 V1200	A1066-I1196 HydrophobicContact CB-CD1 3.4Å; A1066-I1196 VanDerWaalsContact CB-CD1 3.4Å; A1070-I1196 HydrophobicContact CB-CG1 4.15Å; L1078-I1196 HydrophobicContact CB-CG2 4.25Å; L1078-I1196 HydrophobicContact CD2-CD1 4.42Å; L1078-I1196 HydrophobicContact CD2-CG1 4.29Å; L1078-I1196 HydrophobicContact CD2-CG2 4.2Å; L1085-I1196 HydrophobicContact CD1-CD1 3.81Å; L1085-I1196 HydrophobicContact CD1-CG2 4.27Å; L1192-I1196 HydrophobicContact CD1-CD1 4.04Å; L1192-I1196 HydrophobicContact CG-CD1 4.33Å; L1192-I1196 WeakPolarHBondContact O-CG1 3.34Å; L1192-I1196 PolarHBondContact O-N 2.96Å; V1193-I1196 PolarHBondContact O-N 3.27Å; N1194-I1196 VanDerWaalsContact C-N 3.32Å; N1194-I1196 PolarHBondContact O-N 3.48Å; I1196-G1198 VanDerWaalsContact C-N 3.26Å; I1196-G1198 PolarHBondContact O-N 3.32Å; I1196-K1199 PolarHBondContact O-N 3.44Å; I1196-K1199 VanDerWaalsContact O-N 3.16Å; I1196-V1200 WeakPolarHBondContact O-CG2 3.09Å; I1196-V1200 PolarHBondContact O-N 2.9Å
1197	C	83.4	Confident	72.8	Confident	25 Å²	25	75.3 Å²	75.3	17%	0.169	44%	0.436	C	S	.	.	H	α-helix	trans	-65	-32.5	179.3	-58.5	0	0	0	0	111.4	D1086 V1193 V1200 S1201	D1086-C1197 PolarHBondContact OD2-SG 2.78Å; V1193-C1197 PolarHBondContact O-N 2.7Å; V1193-C1197 PolarHBondContact O-SG 3.46Å; V1193-C1197 VanDerWaalsContact O-SG 3.38Å; C1197-V1200 PolarHBondContact O-N 3.32Å; C1197-S1201 VanDerWaalsContact O-CB 3.3Å; C1197-S1201 WeakPolarHBondContact O-CB 3.42Å; C1197-S1201 PolarHBondContact O-N 2.7Å; C1197-S1201 PolarHBondContact O-OG 3Å
1198	G	79.6	Confident	70	Confident	32 Å²	32	75.4 Å²	75.4	33%	0.33	44%	0.437	S	S	.	.	H	α-helix	trans	-63.6	-45.3	170.1	0	0	0	0	0	113.7	N1194 I1196 S1201	N1194-G1198 WeakPolarHBondContact O-CA 3.19Å; N1194-G1198 PolarHBondContact O-N 2.86Å; I1196-G1198 VanDerWaalsContact C-N 3.26Å; I1196-G1198 PolarHBondContact O-N 3.32Å; G1198-S1201 PolarHBondContact O-N 3.14Å
1199	K	79.3	Confident	67.2	Low	80 Å²	80	78 Å²	78	35%	0.348	45%	0.454	S	S	.	.	H	α-helix	trans	-64.2	-39.9	173.8	-80.7	-169.3	174.8	-156.2	0	112.8	A1070 E1073 Q1195 I1196 S1201 G1202	A1070-K1199 PolarHBondContact O-NZ 3.09Å; E1073-K1199 IonicContact OE1-NZ 2.67Å; E1073-K1199 PolarHBondContact OE1-NZ 3.11Å; Q1195-K1199 WeakPolarHBondContact O-CB 3.46Å; Q1195-K1199 WeakPolarHBondContact O-CG 3.49Å; Q1195-K1199 PolarHBondContact O-N 3.25Å; Q1195-K1199 VanDerWaalsContact O-N 3.11Å; I1196-K1199 PolarHBondContact O-N 3.44Å; I1196-K1199 VanDerWaalsContact O-N 3.16Å; K1199-S1201 VanDerWaalsContact C-N 3.32Å; K1199-G1202 PolarHBondContact O-N 2.88Å
1200	V	77.1	Confident	64.2	Low	47 Å²	47	84 Å²	84	29%	0.285	49%	0.493	S	S	.	.	H	α-helix	trans	-65.1	-36.4	174.8	171.5	0	0	0	0	111.6	L1078 I1196 C1197 G1202	L1078-V1200 HydrophobicContact CB-CG2 3.79Å; I1196-V1200 WeakPolarHBondContact O-CG2 3.09Å; I1196-V1200 PolarHBondContact O-N 2.9Å; C1197-V1200 PolarHBondContact O-N 3.32Å; V1200-G1202 PolarHBondContact O-N 3.43Å; V1200-G1202 VanDerWaalsContact O-N 3.17Å
1201	S	70.8	Confident	61.4	Low	85 Å²	85	88 Å²	88	59%	0.594	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	6.3	-180	-56.8	0	0	0	0	114.6	C1197 G1198 K1199 K1203	C1197-S1201 VanDerWaalsContact O-CB 3.3Å; C1197-S1201 WeakPolarHBondContact O-CB 3.42Å; C1197-S1201 PolarHBondContact O-N 2.7Å; C1197-S1201 PolarHBondContact O-OG 3Å; G1198-S1201 PolarHBondContact O-N 3.14Å; K1199-S1201 VanDerWaalsContact C-N 3.32Å; S1201-K1203 PolarHBondContact O-N 3.5Å
1202	G	59.7	Low	58.4	Low	60 Å²	60	89.7 Å²	89.7	62%	0.619	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	9.1	176.5	0	0	0	0	0	115.7	K1199 V1200 N1204	K1199-G1202 PolarHBondContact O-N 2.88Å; V1200-G1202 PolarHBondContact O-N 3.43Å; V1200-G1202 VanDerWaalsContact O-N 3.17Å; G1202-N1204 VanDerWaalsContact C-N 3.28Å; G1202-N1204 PolarHBondContact O-N 2.88Å
1203	K	43.9	Very low	55.5	Low	180 Å²	180	97.9 Å²	97.9	78%	0.783	56%	0.561	S	S	*	*			trans	-78.4	75.6	-178.1	-77.4	-171	175.6	-179.7	0	111.5	S1201 G1205	S1201-K1203 PolarHBondContact O-N 3.5Å; K1203-G1205 PolarHBondContact O-N 3.5Å
1204	N	40.9	Very low	52.8	Low	163 Å²	163	103.8 Å²	103.8	87%	0.872	60%	0.599	S	S	*	*			trans	-70.3	60	155.6	-77.3	-2	0	0	0	110.2	G1202	G1202-N1204 VanDerWaalsContact C-N 3.28Å; G1202-N1204 PolarHBondContact O-N 2.88Å
1205	G	33.9	Very low	50	Low	56 Å²	56	104.7 Å²	104.7	58%	0.577	61%	0.609	S	S	*	*			trans	-68.7	133.8	161.6	0	0	0	0	0	108.5	K1203 I1207	K1203-G1205 PolarHBondContact O-N 3.5Å; G1205-I1207 PolarHBondContact O-N 3.35Å; G1205-I1207 VanDerWaalsContact O-N 3.15Å
1206	S	31.6	Very low	47.3	Very low	108 Å²	108	106.6 Å²	106.6	76%	0.755	63%	0.629	S	S	*	*			trans	-54.6	119.1	-176.4	-171.7	0	0	0	0	111.4	E1208	S1206-E1208 PolarHBondContact O-N 2.79Å
1207	I	35.2	Very low	44.6	Very low	155 Å²	155	115.6 Å²	115.6	80%	0.795	67%	0.668	S	S	*	*			trans	-83.6	92.6	163	-58.8	179.1	0	0	0	106.3	G1205	G1205-I1207 PolarHBondContact O-N 3.35Å; G1205-I1207 VanDerWaalsContact O-N 3.15Å
1208	E	31.7	Very low	42.1	Very low	164 Å²	164	126.1 Å²	126.1	77%	0.766	70%	0.704	S	S	*	*			trans	-62.9	134.7	168.4	-70.6	-165.7	118	0	0	110.3	S1206 C1210	S1206-E1208 PolarHBondContact O-N 2.79Å; E1208-C1210 PolarHBondContact O-N 3.02Å
1209	N	32.9	Very low	39.6	Very low	138 Å²	138	128.2 Å²	128.2	74%	0.738	73%	0.725	S	S	*	*			trans	-76.9	84	-175	-85.1	-50.2	0	0	0	112	L1211	N1209-L1211 PolarHBondContact O-N 2.88Å
1210	C	27.6	Very low	37.4	Very low	124 Å²	124	130.2 Å²	130.2	84%	0.838	75%	0.747	S	S	*	*			trans	-74.6	59.4	163.3	-77.9	0	0	0	0	112.1	E1208 S1212	E1208-C1210 PolarHBondContact O-N 3.02Å; C1210-S1212 PolarHBondContact O-N 3.05Å
1211	L	32.9	Very low	35.1	Very low	150 Å²	150	139 Å²	139	79%	0.785	78%	0.775	S	S	*	*			trans	-91.4	83.6	172.3	-85.1	174.5	0	0	0	111.2	N1209	N1209-L1211 PolarHBondContact O-N 2.88Å
1212	S	27.9	Very low	33.2	Very low	109 Å²	109	143.8 Å²	143.8	76%	0.762	79%	0.785	S	S	*	*			trans	-124.2	71.4	175	53.5	0	0	0	0	112.5	C1210	C1210-S1212 PolarHBondContact O-N 3.05Å
1213	K	28.8	Very low	31.7	Very low	196 Å²	196	152.4 Å²	152.4	85%	0.852	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-81.3	123.8	164.4	-81.3	-172	176	-179.5	0	110.1
1214	P	30	Very low	31	Very low	123 Å²	123	147.3 Å²	147.3	80%	0.799	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-73.7	136.3	177.2	29.6	-34	0	0	0	111.5
1215	T	28.6	Very low	30.5	Very low	112 Å²	112	145.6 Å²	145.6	69%	0.687	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-83.3	132.1	171.1	55.8	0	0	0	0	110.9	K1217	T1215-K1217 PolarHBondContact O-N 3.31Å
1216	P	30.5	Very low	30.3	Very low	132 Å²	132	148.7 Å²	148.7	86%	0.857	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-72.6	118.6	172.3	29.7	-32.7	0	0	0	110.4
1217	K	31.1	Very low	30.2	Very low	189 Å²	189	150.7 Å²	150.7	82%	0.822	80%	0.796	S	S	*	*			trans	-111.5	143.6	166.6	-78.4	-172.1	176.5	179.7	0	110.4	T1215	T1215-K1217 PolarHBondContact O-N 3.31Å
1218	R	30.7	Very low	29.9	Very low	246 Å²	246	149.3 Å²	149.3	93%	0.928	79%	0.794	S	S	*	*			trans	-62.3	133.7	179.3	-63.3	169.7	175.2	160.8	-4.7	110
1219	G	26.2	Very low	30.3	Very low	75 Å²	75	147.1 Å²	147.1	77%	0.773	79%	0.794	S	S	*	*			trans	-77.8	154.1	167.3	0	0	0	0	0	112
1220	P	33.3	Very low	31	Very low	122 Å²	122	145.7 Å²	145.7	79%	0.792	79%	0.792	S	S	*	*			trans	-129.8	123.6	136.3	34.6	-24.9	0	0	0	113.3
1221	R	28.7	Very low	31	Very low	231 Å²	231	145.2 Å²	145.2	87%	0.872	79%	0.791	S	S	*	*			trans	42.2	120.4	140.7	-92.2	179.5	170.4	177.7	-2.7	121.4
1222	K	30.8	Very low	30.9	Very low	187 Å²	187	148.6 Å²	148.6	81%	0.813	79%	0.793	S	S	*	*			trans	107.4	125.1	136	-70.6	172.9	174.7	-177.3	0	119.2
1223	R	29.2	Very low	30.9	Very low	240 Å²	240	150.3 Å²	150.3	91%	0.906	79%	0.792	S	S	*	*			trans	63.2	137.6	132.3	-175.2	-173.4	-83.2	-170.3	-7.1	118.2
1224	A	29.5	Very low	30.9	Very low	73 Å²	73	146.5 Å²	146.5	60%	0.603	79%	0.79	S	S	*	*			cis	-171	-176.6	-21.5	0	0	0	0	0	107.8
1225	T	30.4	Very low	30.8	Very low	127 Å²	127	145.2 Å²	145.2	78%	0.779	79%	0.791	S	S	*	*			trans	62.3	114.1	168.5	37	0	0	0	0	115.5
1226	V	29.6	Very low	30.8	Very low	121 Å²	121	146 Å²	146	73%	0.733	80%	0.801	S	S	*	*				66.6	107.5	76.3	174.1	0	0	0	0	111.3
1227	D	28	Very low	30.8	Very low	151 Å²	151	143.5 Å²	143.5	81%	0.807	80%	0.798	S	S	*	*				-161.1	160.4	108.7	-116.7	-40.6	0	0	0	114.6
1228	V	28.8	Very low	30.6	Very low	125 Å²	125	140 Å²	140	76%	0.758	80%	0.798	S	S	*	*			trans	-163.3	136.5	-170.4	142.7	0	0	0	0	104.6
1229	P	41.3	Very low	30.5	Very low	119 Å²	119	133.1 Å²	133.1	77%	0.773	79%	0.787	S	S	*	*				-146.9	-120.6	58.8	30.3	-0.8	0	0	0	115.9
1230	P	47.4	Very low	30.7	Very low	108 Å²	108	139.2 Å²	139.2	70%	0.701	79%	0.793	S	S	*	*				-140.9	175	-115.9	46.2	-26.7	0	0	0	118.2
1231	S	28.2	Very low	30.6	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	79%	0.794	S	S	*	*			trans	176.1	126.9	131	34.4	0	0	0	0	108.3
1232	R	29.8	Very low	30.8	Very low	221 Å²	221	132 Å²	132	83%	0.834	79%	0.786	S	S	*	*				88.6	99.9	54.8	-86.6	-158.9	177.3	-143.6	2.7	114.8
1233	L	28.8	Very low	30.9	Very low	144 Å²	144	129.2 Å²	129.2	75%	0.754	79%	0.79	S	S	*	*			trans	86.4	165	134.6	-62.4	171.3	0	0	0	120.7
1234	S	28.1	Very low	31	Very low	116 Å²	116	123.1 Å²	123.1	81%	0.811	78%	0.784	S	S	*	*			trans	83.3	87.6	163	-56.3	0	0	0	0	117.9
1235	A	28.5	Very low	31.6	Very low	97 Å²	97	124.8 Å²	124.8	80%	0.802	79%	0.791	S	S	*	*			trans	-68.2	159.9	162.6	0	0	0	0	0	113.2
1236	S	28.9	Very low	32.1	Very low	128 Å²	128	128.3 Å²	128.3	90%	0.895	82%	0.821	S	S	*	*			trans	171.5	-178.5	133.4	53.3	0	0	0	0	110.4
1237	G	28.7	Very low	32.2	Very low	79 Å²	79	128.7 Å²	128.7	81%	0.814	83%	0.825	S	S	*	*			trans	93.4	91.7	161.6	0	0	0	0	0	115.6
1238	S	28.4	Very low	32.4	Very low	115 Å²	115	127.5 Å²	127.5	80%	0.804	83%	0.826	S	S	*	*			trans	-91.8	147.8	167.2	52.4	0	0	0	0	112
1239	S	28.8	Very low	32.6	Very low	102 Å²	102	127.6 Å²	127.6	71%	0.713	83%	0.83	S	S	*	*			trans	123.4	133.8	134.6	79.6	0	0	0	0	119.7
1240	K	30.1	Very low	32.1	Very low	203 Å²	203	128.1 Å²	128.1	88%	0.883	83%	0.834	S	S	*	*			trans	54.4	96.6	140.8	-66	175.4	178.4	-179.8	0	121.1
1241	S	30.6	Very low	31.2	Very low	116 Å²	116	129.4 Å²	129.4	81%	0.811	84%	0.842	S	S	*	*				-156	134.9	122.3	38.2	0	0	0	0	107.6
1242	A	32.9	Very low	31.4	Very low	87 Å²	87	130.4 Å²	130.4	72%	0.719	85%	0.845	S	S	*	*			cis	83.5	113.4	30.5	0	0	0	0	0	113.4
1243	S	32.9	Very low	31.5	Very low	127 Å²	127	123.9 Å²	123.9	89%	0.888	85%	0.846	S	S	*	*			trans	56.8	148.4	-175.7	66.1	0	0	0	0	115.5
1244	S	31.9	Very low	31.7	Very low	113 Å²	113	122.4 Å²	122.4	79%	0.79	85%	0.853	S	S	*	*			cis	-145.5	173.9	19.2	51.5	0	0	0	0	113.1
1245	S	41.2	Very low	32	Very low	107 Å²	107	122.9 Å²	122.9	75%	0.748	86%	0.856	S	S	*	*			trans	-67.9	138.5	-175	47.9	0	0	0	0	115.9
1246	S	41.2	Very low	32.3	Very low	201 Å²	201	125.3 Å²	125.3	100%	1.406	86%	0.861	S	S	*	*			trans	-152.4	0	141.7	-71.4	0	0	0	0	108.6

Retrieved 1,246 of 1,246 residues in 364.2 ms (Link to these results)

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