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Androgen receptor

Steroid hormone receptors are ligand-activated transcription factors that regulate eukaryotic gene expression and affect cellular proliferation and differentiation in target tissues. Transcription factor activity is modulated by bound coactivator and corepressor proteins like ZBTB7A that recruits NCOR1 and NCOR2 to the androgen response elements/ARE on target genes, negatively regulating androgen receptor signaling and androgen-induced cell proliferation. Transcription activation is also down-regulated by NR0B2. Activated, but not phosphorylated, by HIPK3 and ZIPK/DAPK3.

AlphaFold DB , UniProt , Accession X5DNC5, Species HUMAN (Homo sapiens, Human), Gene AR, Length 919 aa.

						>X5DNC5_HUMAN|X5DNC5|AR
MEVQLGLGRVYPRPPSKTYRGAFQNLFQSVREVIQNPGPRHPEAASAAPPGASLLLLQQQQQQQQQQQQQQQQQQQQQQETSPRQQQQQQGEDGSPQAHRRGPTGYLVLDEEQQPSQPQSALECHPERGCVPEPGAAVAASKGLPQQLPAPPDEDDSAAPSTLSLLGPTFPGLSSCSADLKDILSEASTMQLLQQQQQEAVSEGSSSGRAREASGAPTSSKDNYLGGTSTISDNAKELCKAVSVSMGLGVEALEHLSPGEQLRGDCMYAPLLGVPPAVRPTPCAPLAECKGSLLDDSAGKSTEDTAEYSPFKGGYTKGLEGESLGCSGSAAAGSSGTLELPSTLSLYKSGALDEAAAYQSRDYYNFPLALAGPPPPPPPPHPHARIKLENPLDYGSAWAAAAAQCRYGDLASLHGAGAAGPGSGSPSAAASSSWHTLFTAEEGQLYGPCGGGGGGGGGGGGGGGGGGGGGGGEAGAVAPYGYTRPPQGLAGQESDFTAPDVWYPGGMVSRVPYPSPTCVKSEMGPWMDSYSGPYGDMRLETARDHVLPIDYYFPPQKTCLICGDEASGCHYGALTCGSCKVFFKRAAEGKQKYLCASRNDCTIDKFRRKNCPSCRLRKCYEAGMTLGARKLKKLGNLKLQEEGEASSTTSPTEETTQKLTVSHIEGYECQPIFLNVLEAIEPGVVCAGHDNNQPDSFAALLSSLNELGERQLVHVVKWAKALPGFRNLHVDDQMAVIQYSWMGLMVFAMGWRSFTNVNSRMLYFAPDLVFNEYRMHKSRMYSQCVRMRHLSQEFGWLQITPQEFLCMKALLLFSIIPVDGLKNQKFFDELRMNYIKELDRIIACKRKIPTSCSRRFYQLTKLLDSVQPIARELHQFTFDLLIKSHMVSVDFPEMMAEIISVQVPKILSGKVKPIYFHTQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.2	Very low	27.5	Very low	245 Å²	245	157 Å²	157	100%	1.207	83%	0.832	S	S	*	*				0	131.7	0	-78.5	171	163.3	0	0	107.6
2	E	26.2	Very low	27.6	Very low	173 Å²	173	154.1 Å²	154.1	81%	0.808	83%	0.829	S	S	*	*			trans	-72.6	172.1	159.7	-62.5	176.6	114.1	0	0	107.8
3	V	24.3	Very low	27.8	Very low	130 Å²	130	157.3 Å²	157.3	79%	0.788	82%	0.822	S	S	*	*			cis	-149.8	159.2	49.6	167.8	0	0	0	0	111.6
4	Q	25.6	Very low	28.2	Very low	143 Å²	143	153.4 Å²	153.4	67%	0.668	81%	0.811	S	S	*	*			trans	-39.7	150.2	175	-78.3	76.3	-3.6	0	0	115.8
5	L	28.2	Very low	28.6	Very low	184 Å²	184	152.3 Å²	152.3	96%	0.963	82%	0.816	S	S	*	*				-135	127	118.2	-108.2	171.4	0	0	0	109.4
6	G	27.2	Very low	28.6	Very low	61 Å²	61	148.2 Å²	148.2	63%	0.629	80%	0.803	S	S	*	*			trans	-157.1	136.9	178	0	0	0	0	0	111.6
7	L	30.8	Very low	29	Very low	187 Å²	187	151.5 Å²	151.5	98%	0.979	81%	0.808	S	S	*	*			trans	-158.5	128.5	164	-105.6	171	0	0	0	107
8	G	25.8	Very low	29.3	Very low	72 Å²	72	150.6 Å²	150.6	74%	0.742	81%	0.809	S	S	*	*			trans	-109.3	153.9	-170.8	0	0	0	0	0	114.2
9	R	29.9	Very low	29.9	Very low	210 Å²	210	154 Å²	154	79%	0.792	81%	0.811	S	S	*	*			trans	-134.9	124.6	148.5	-84	-166.2	173.2	-165.6	-0.6	109	Y11	R9-Y11 HydrophobicContact CB-CE2 4.39Å
10	V	27.8	Very low	30.4	Very low	146 Å²	146	154.9 Å²	154.9	89%	0.885	80%	0.803	S	S	*	*			trans	-92.1	127.9	170.6	178.5	0	0	0	0	107.7
11	Y	28.9	Very low	30.5	Very low	176 Å²	176	149.9 Å²	149.9	69%	0.69	79%	0.789	S	S	*	*			trans	-108.4	135.4	165.7	-70.8	-78.8	0	0	0	108.8	R9	R9-Y11 HydrophobicContact CB-CE2 4.39Å
12	P	28.4	Very low	31	Very low	122 Å²	122	141.9 Å²	141.9	79%	0.792	76%	0.761	S	S	*	*			trans	-67	140.7	173.8	29.2	-34	0	0	0	110.1
13	R	30.7	Very low	31.5	Very low	196 Å²	196	140.7 Å²	140.7	74%	0.74	75%	0.754	S	S	*	*			trans	-107.7	123.3	-176.7	-171.2	-177.5	-178.8	-170.4	-0.9	110.2
14	P	32.6	Very low	32.2	Very low	103 Å²	103	140.6 Å²	140.6	67%	0.669	75%	0.745	S	S	*	*			trans	-67.8	153.8	172.3	29.1	-34.2	0	0	0	111.1	S16	P14-S16 PolarHBondContact O-N 3.47Å
15	P	34.3	Very low	32.7	Very low	137 Å²	137	139.2 Å²	139.2	89%	0.89	74%	0.742	S	S	*	*			trans	-75.7	121.1	-169.4	29.1	-34.7	0	0	0	112.7
16	S	29.1	Very low	33.5	Very low	86 Å²	86	135.6 Å²	135.6	60%	0.601	72%	0.723	S	S	*	*			trans	-139.6	112.2	169.6	51.7	0	0	0	0	113.1	P14	P14-S16 PolarHBondContact O-N 3.47Å
17	K	35.2	Very low	34.4	Very low	205 Å²	205	139.4 Å²	139.4	89%	0.891	72%	0.722	S	S	*	*			trans	13	118.1	163.4	-59.5	-179.4	-178.8	179.9	0	117.9
18	T	33.5	Very low	35	Very low	134 Å²	134	134.7 Å²	134.7	82%	0.822	70%	0.695	S	S	*	*			trans	-82.7	110.4	-174.8	44.6	0	0	0	0	114.5
19	Y	41.1	Very low	35.8	Very low	216 Å²	216	134.3 Å²	134.3	85%	0.847	68%	0.682	S	S	*	*			trans	-123.1	25	162	-86.7	-77.5	0	0	0	112.8
20	R	39.6	Very low	36.7	Very low	172 Å²	172	128 Å²	128	65%	0.649	67%	0.666	S	S	*	*			trans	-91	-16.6	-166.5	-139.3	174.5	-155.5	-112.3	1.8	116.3
21	G	32.8	Very low	37.6	Very low	49 Å²	49	128.6 Å²	128.6	51%	0.505	65%	0.652	S	S	.	*	H	α-helix	trans	-75.2	-50.3	-172.1	0	0	0	0	0	114.9	F23 Q24 N25	G21-F23 PolarHBondContact O-N 3.03Å; G21-Q24 PolarHBondContact O-N 3.31Å; G21-N25 PolarHBondContact O-N 3.45Å
22	A	39.6	Very low	38.2	Very low	77 Å²	77	124.9 Å²	124.9	64%	0.636	64%	0.642	S	S	*	*	H	α-helix	trans	-60.6	-46	-169	0	0	0	0	0	113.6	Q24 L26	A22-Q24 VanDerWaalsContact C-N 3.34Å; A22-Q24 PolarHBondContact O-N 3.28Å; A22-L26 PolarHBondContact O-N 3.48Å
23	F	36.6	Very low	39.2	Very low	149 Å²	149	124.4 Å²	124.4	65%	0.654	64%	0.636	S	S	*	*	H	α-helix	trans	-67.3	-31.8	-178.4	-76.9	-83.8	0	0	0	113.5	G21 F27	G21-F23 PolarHBondContact O-N 3.03Å; F23-F27 PolarHBondContact O-N 3.12Å
24	Q	37.8	Very low	40.1	Very low	128 Å²	128	121.3 Å²	121.3	60%	0.598	63%	0.633	S	S	*	*	H	α-helix	trans	-73.1	-39.8	-178.8	-130.2	173.7	-31.5	0	0	111.4	G21 A22 F27 Q28	G21-Q24 PolarHBondContact O-N 3.31Å; A22-Q24 VanDerWaalsContact C-N 3.34Å; A22-Q24 PolarHBondContact O-N 3.28Å; Q24-F27 PolarHBondContact O-N 3.48Å; Q24-Q28 PolarHBondContact O-N 3.34Å; Q24-Q28 VanDerWaalsContact O-N 3.17Å
25	N	37.9	Very low	40.7	Very low	114 Å²	114	122.6 Å²	122.6	61%	0.61	63%	0.63	S	S	*	*	H	α-helix	trans	-65.6	-42	174.4	-69.8	-8.2	0	0	0	111.9	G21 F27 Q28 S29	G21-N25 PolarHBondContact O-N 3.45Å; N25-F27 VanDerWaalsContact C-N 3.34Å; N25-F27 PolarHBondContact O-N 3.49Å; N25-Q28 PolarHBondContact O-N 3.06Å; N25-Q28 VanDerWaalsContact O-N 3.15Å; N25-S29 PolarHBondContact O-N 3.41Å; N25-S29 PolarHBondContact O-OG 3.39Å
26	L	44.8	Very low	41	Very low	108 Å²	108	122.5 Å²	122.5	57%	0.565	62%	0.622	S	S	*	*	H	α-helix	trans	-58.9	-44.4	177.6	-174.2	66.7	0	0	0	112	A22 Q28 V30	A22-L26 PolarHBondContact O-N 3.48Å; L26-Q28 VanDerWaalsContact C-N 3.34Å; L26-Q28 PolarHBondContact O-N 3.15Å; L26-V30 WeakPolarHBondContact O-CB 3.49Å; L26-V30 VanDerWaalsContact O-CG2 3.27Å; L26-V30 WeakPolarHBondContact O-CG2 3.44Å; L26-V30 PolarHBondContact O-N 2.97Å
27	F	45.2	Very low	41.5	Very low	140 Å²	140	124.2 Å²	124.2	61%	0.614	63%	0.631	S	S	*	*	H	α-helix	trans	-65	-35.7	176.2	-98.4	-88.1	0	0	0	113.1	F23 Q24 N25 R31	F23-F27 PolarHBondContact O-N 3.12Å; Q24-F27 PolarHBondContact O-N 3.48Å; N25-F27 VanDerWaalsContact C-N 3.34Å; N25-F27 PolarHBondContact O-N 3.49Å; F27-R31 WeakPolarHBondContact O-CB 3.32Å; F27-R31 PolarHBondContact O-N 3.39Å
28	Q	44.7	Very low	42	Very low	88 Å²	88	117.3 Å²	117.3	41%	0.411	62%	0.618	S	S	.	*	H	α-helix	trans	-70.9	-47.3	178.2	-173.4	60.3	22.2	0	0	111.7	Q24 N25 L26 V30 R31 E32	Q24-Q28 PolarHBondContact O-N 3.34Å; Q24-Q28 VanDerWaalsContact O-N 3.17Å; N25-Q28 PolarHBondContact O-N 3.06Å; N25-Q28 VanDerWaalsContact O-N 3.15Å; L26-Q28 VanDerWaalsContact C-N 3.34Å; L26-Q28 PolarHBondContact O-N 3.15Å; Q28-V30 VanDerWaalsContact C-N 3.35Å; Q28-V30 PolarHBondContact O-N 3.06Å; Q28-R31 WeakPolarHBondContact O-CA 3.47Å; Q28-R31 VanDerWaalsContact O-CB 3.31Å; Q28-R31 WeakPolarHBondContact O-CB 3.34Å; Q28-R31 PolarHBondContact O-N 3.06Å; Q28-E32 WeakPolarHBondContact CG-OE1 3.5Å; Q28-E32 PolarHBondContact NE2-OE1 3.07Å; Q28-E32 PolarHBondContact O-N 3.17Å
29	S	42.1	Very low	42.1	Very low	65 Å²	65	117.7 Å²	117.7	46%	0.455	62%	0.623	S	S	.	*	H	α-helix	trans	-62.9	-38	176.9	-59.8	0	0	0	0	112.8	N25 R31 E32 V33	N25-S29 PolarHBondContact O-N 3.41Å; N25-S29 PolarHBondContact O-OG 3.39Å; S29-R31 VanDerWaalsContact C-N 3.28Å; S29-R31 PolarHBondContact O-N 3.43Å; S29-E32 PolarHBondContact O-N 2.99Å; S29-V33 WeakPolarHBondContact O-CB 3.39Å; S29-V33 VanDerWaalsContact O-CG2 3.29Å; S29-V33 WeakPolarHBondContact O-CG2 3.11Å; S29-V33 PolarHBondContact O-N 3.36Å
30	V	48.1	Very low	42	Very low	77 Å²	77	118.5 Å²	118.5	47%	0.467	62%	0.624	S	S	.	*	H	α-helix	trans	-63	-36.3	173.3	168.7	0	0	0	0	111.3	L26 Q28 I34	L26-V30 WeakPolarHBondContact O-CB 3.49Å; L26-V30 VanDerWaalsContact O-CG2 3.27Å; L26-V30 WeakPolarHBondContact O-CG2 3.44Å; L26-V30 PolarHBondContact O-N 2.97Å; Q28-V30 VanDerWaalsContact C-N 3.35Å; Q28-V30 PolarHBondContact O-N 3.06Å; V30-I34 HydrophobicContact CG1-CD1 3.87Å; V30-I34 WeakPolarHBondContact O-CB 3.44Å; V30-I34 WeakPolarHBondContact O-CD1 3.47Å; V30-I34 WeakPolarHBondContact O-CG1 2.85Å; V30-I34 PolarHBondContact O-N 3.39Å
31	R	47.6	Very low	41.5	Very low	158 Å²	158	119.3 Å²	119.3	60%	0.596	64%	0.635	S	S	*	*	H	α-helix	trans	-68	-42.3	177.2	-159	178.9	-154.7	162.8	5.2	112.3	F27 Q28 S29 I34 Q35	F27-R31 WeakPolarHBondContact O-CB 3.32Å; F27-R31 PolarHBondContact O-N 3.39Å; Q28-R31 WeakPolarHBondContact O-CA 3.47Å; Q28-R31 VanDerWaalsContact O-CB 3.31Å; Q28-R31 WeakPolarHBondContact O-CB 3.34Å; Q28-R31 PolarHBondContact O-N 3.06Å; S29-R31 VanDerWaalsContact C-N 3.28Å; S29-R31 PolarHBondContact O-N 3.43Å; R31-I34 PolarHBondContact O-N 3.35Å; R31-Q35 WeakPolarHBondContact O-CG 3.4Å; R31-Q35 PolarHBondContact O-N 3.23Å
32	E	41.8	Very low	41.9	Very low	99 Å²	99	122.6 Å²	122.6	46%	0.463	65%	0.647	S	S	.	*	H	α-helix	trans	-69	-43.1	179.5	-72.9	164	-177.1	0	0	112.1	Q28 S29 I34 Q35 N36	Q28-E32 WeakPolarHBondContact CG-OE1 3.5Å; Q28-E32 PolarHBondContact NE2-OE1 3.07Å; Q28-E32 PolarHBondContact O-N 3.17Å; S29-E32 PolarHBondContact O-N 2.99Å; E32-I34 VanDerWaalsContact C-N 3.27Å; E32-I34 PolarHBondContact O-N 3.14Å; E32-Q35 PolarHBondContact O-N 3.26Å; E32-N36 PolarHBondContact O-N 3.42Å
33	V	48	Very low	41.7	Very low	111 Å²	111	128.4 Å²	128.4	67%	0.673	66%	0.661	S	S	*	*	H	α-helix	trans	-64.5	-30.1	176	170.4	0	0	0	0	112.4	S29	S29-V33 WeakPolarHBondContact O-CB 3.39Å; S29-V33 VanDerWaalsContact O-CG2 3.29Å; S29-V33 WeakPolarHBondContact O-CG2 3.11Å; S29-V33 PolarHBondContact O-N 3.36Å
34	I	51.1	Low	41.2	Very low	132 Å²	132	126.3 Å²	126.3	68%	0.677	67%	0.672	S	S	*	*	H	α-helix	trans	-75.1	-26.8	173.4	-71.9	169.1	0	0	0	111.9	V30 R31 E32	V30-I34 HydrophobicContact CG1-CD1 3.87Å; V30-I34 WeakPolarHBondContact O-CB 3.44Å; V30-I34 WeakPolarHBondContact O-CD1 3.47Å; V30-I34 WeakPolarHBondContact O-CG1 2.85Å; V30-I34 PolarHBondContact O-N 3.39Å; R31-I34 PolarHBondContact O-N 3.35Å; E32-I34 VanDerWaalsContact C-N 3.27Å; E32-I34 PolarHBondContact O-N 3.14Å
35	Q	43.5	Very low	40.8	Very low	129 Å²	129	125 Å²	125	60%	0.603	68%	0.682	S	S	*	*	H	α-helix	trans	-91.5	-21.3	-175.8	-73.5	179.3	-12.8	0	0	114.3	R31 E32	R31-Q35 WeakPolarHBondContact O-CG 3.4Å; R31-Q35 PolarHBondContact O-N 3.23Å; E32-Q35 PolarHBondContact O-N 3.26Å
36	N	40.4	Very low	40.5	Very low	136 Å²	136	125.4 Å²	125.4	73%	0.727	70%	0.695	S	S	*	*			trans	-135.6	86.7	178	-74.9	-67.7	0	0	0	112.9	E32 G38	E32-N36 PolarHBondContact O-N 3.42Å; N36-G38 PolarHBondContact O-N 3.4Å
37	P	40	Very low	39.8	Very low	121 Å²	121	125.1 Å²	125.1	79%	0.786	71%	0.708	S	S	*	*			trans	-77.5	100.3	175	30.7	-33.4	0	0	0	112
38	G	45.3	Very low	39	Very low	60 Å²	60	122.9 Å²	122.9	62%	0.619	72%	0.715	S	S	*	*			trans	-68.6	158.3	172.8	0	0	0	0	0	114.1	N36	N36-G38 PolarHBondContact O-N 3.4Å
39	P	36.1	Very low	39.7	Very low	142 Å²	142	124.5 Å²	124.5	92%	0.922	73%	0.733	S	S	*	*			trans	-71.8	153.1	-174.4	29.5	-35.6	0	0	0	113.8
40	R	38.3	Very low	39.9	Very low	233 Å²	233	127.5 Å²	127.5	88%	0.879	75%	0.751	S	S	*	*			trans	-113.7	146.3	-179.9	-64.5	178.8	174.2	-177	-2.3	112.3
41	H	30.2	Very low	39.4	Very low	189 Å²	189	126.8 Å²	126.8	88%	0.875	76%	0.759	S	S	*	*			trans	173.5	163.6	148.9	-97.3	-64.6	0	0	0	109.2
42	P	40.4	Very low	39.2	Very low	118 Å²	118	123.3 Å²	123.3	77%	0.766	76%	0.764	S	S	*	*			cis	-126.6	-167	-46.1	34	-15.2	0	0	0	112.2
43	E	35.5	Very low	39.6	Very low	199 Å²	199	123.4 Å²	123.4	93%	0.93	78%	0.776	S	S	*	*			trans	-84.1	162.3	-173.4	-58.6	164.9	107.1	0	0	115.7
44	A	26.9	Very low	39.9	Very low	105 Å²	105	124.5 Å²	124.5	87%	0.868	78%	0.777	S	S	*	*			trans	-152.4	156.3	158.8	0	0	0	0	0	110.2
45	A	28.7	Very low	40.2	Very low	100 Å²	100	124.5 Å²	124.5	83%	0.826	78%	0.778	S	S	*	*			trans	-143.1	148.5	-165.6	0	0	0	0	0	116.8
46	S	32.9	Very low	41	Very low	124 Å²	124	124 Å²	124	87%	0.867	78%	0.779	S	S	*	*			trans	58.4	113.7	146.7	179.2	0	0	0	0	121.9
47	A	28.1	Very low	42.2	Very low	102 Å²	102	123.1 Å²	123.1	84%	0.843	77%	0.774	S	S	*	*			trans	-164.7	143.3	136.8	0	0	0	0	0	113.4
48	A	29.6	Very low	43.9	Very low	93 Å²	93	123 Å²	123	77%	0.769	76%	0.762	S	S	*	*			trans	-172.9	-178.3	171.3	0	0	0	0	0	107.5
49	P	59.7	Low	45.4	Very low	121 Å²	121	126 Å²	126	79%	0.786	76%	0.76	S	S	*	*			cis	-110.4	-130.5	-12.8	38.8	-18.8	0	0	0	107.2
50	P	46.1	Very low	47.4	Very low	129 Å²	129	124.6 Å²	124.6	84%	0.838	74%	0.742	S	S	*	*			cis	-121.9	-155.2	-15	42.6	-24.5	0	0	0	112.8
51	G	37.8	Very low	49.3	Very low	61 Å²	61	119.5 Å²	119.5	63%	0.629	73%	0.728	S	S	*	*	S	Bend	trans	142.3	-106.9	165.3	0	0	0	0	0	114.9
52	A	43	Very low	51.7	Low	85 Å²	85	116.6 Å²	116.6	70%	0.702	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-29.3	-161.9	0	0	0	0	0	116.3	L54 L55	A52-L54 PolarHBondContact O-N 3.02Å; A52-L54 VanDerWaalsContact O-N 3.07Å; A52-L55 PolarHBondContact O-N 3.41Å
53	S	51	Low	53.6	Low	102 Å²	102	116.8 Å²	116.8	71%	0.713	71%	0.705	S	S	*	*	H	α-helix	trans	-63.9	-21.3	-167.2	-44.7	0	0	0	0	115.1	L57	S53-L57 PolarHBondContact O-N 3.05Å; S53-L57 VanDerWaalsContact O-N 3.17Å
54	L	52.7	Low	55.7	Low	134 Å²	134	113.4 Å²	113.4	70%	0.702	69%	0.689	S	S	*	*	H	α-helix	trans	-75.4	-36.9	-172.6	-147.8	153.7	0	0	0	112.1	A52 Q58	A52-L54 PolarHBondContact O-N 3.02Å; A52-L54 VanDerWaalsContact O-N 3.07Å; L54-Q58 WeakPolarHBondContact O-CB 3.31Å; L54-Q58 PolarHBondContact O-N 3.24Å; L54-Q58 VanDerWaalsContact O-N 3.15Å
55	L	57.7	Low	58.4	Low	132 Å²	132	114.3 Å²	114.3	69%	0.691	68%	0.676	S	S	*	*	H	α-helix	trans	-68.3	-37.6	174.7	-75.9	168.8	0	0	0	112.3	A52 Q58 Q59	A52-L55 PolarHBondContact O-N 3.41Å; L55-Q58 PolarHBondContact O-N 3.12Å; L55-Q59 PolarHBondContact O-N 3.13Å
56	L	59.7	Low	60.9	Low	119 Å²	119	115.5 Å²	115.5	62%	0.623	66%	0.664	S	S	*	*	H	α-helix	trans	-72.3	-38.7	-178.3	-149.2	158.1	0	0	0	111.1	Q58 Q59 Q60	L56-Q58 VanDerWaalsContact C-N 3.33Å; L56-Q58 PolarHBondContact O-N 2.77Å; L56-Q59 PolarHBondContact O-N 3.34Å; L56-Q60 PolarHBondContact O-N 2.97Å
57	L	65.5	Low	63.3	Low	117 Å²	117	116 Å²	116	61%	0.613	65%	0.652	S	S	*	*	H	α-helix	trans	-61.4	-41.2	170.8	-160.9	80.3	0	0	0	111.7	S53 Q60 Q61	S53-L57 PolarHBondContact O-N 3.05Å; S53-L57 VanDerWaalsContact O-N 3.17Å; L57-Q60 PolarHBondContact O-N 3.01Å; L57-Q61 WeakPolarHBondContact O-CB 3.44Å; L57-Q61 PolarHBondContact O-N 3.31Å
58	Q	77	Confident	65.6	Low	117 Å²	117	117.3 Å²	117.3	55%	0.547	64%	0.641	S	S	.	*	H	α-helix	trans	-66.7	-39.5	178.4	-168	168.2	23.4	0	0	112.3	L54 L55 L56 Q61 Q62	L54-Q58 WeakPolarHBondContact O-CB 3.31Å; L54-Q58 PolarHBondContact O-N 3.24Å; L54-Q58 VanDerWaalsContact O-N 3.15Å; L55-Q58 PolarHBondContact O-N 3.12Å; L56-Q58 VanDerWaalsContact C-N 3.33Å; L56-Q58 PolarHBondContact O-N 2.77Å; Q58-Q61 PolarHBondContact O-N 3.4Å; Q58-Q62 PolarHBondContact O-N 3.04Å
59	Q	75.9	Confident	68.2	Low	123 Å²	123	119.1 Å²	119.1	58%	0.575	63%	0.634	S	S	*	*	H	α-helix	trans	-63.9	-42.8	174.6	-173.6	175.2	97.2	0	0	112.1	L55 L56 Q61 Q62 Q63	L55-Q59 PolarHBondContact O-N 3.13Å; L56-Q59 PolarHBondContact O-N 3.34Å; Q59-Q61 PolarHBondContact O-N 3.03Å; Q59-Q62 PolarHBondContact O-N 3.43Å; Q59-Q63 PolarHBondContact O-N 3.42Å; Q59-Q63 VanDerWaalsContact O-N 3.12Å
60	Q	78.6	Confident	69.3	Low	114 Å²	114	119.7 Å²	119.7	53%	0.533	63%	0.626	S	S	.	*	H	α-helix	trans	-63.9	-40.2	176.8	-174.7	171.4	68.9	0	0	112	L56 L57 Q62 Q63 Q64	L56-Q60 PolarHBondContact O-N 2.97Å; L57-Q60 PolarHBondContact O-N 3.01Å; Q60-Q62 VanDerWaalsContact C-N 3.33Å; Q60-Q62 PolarHBondContact O-N 3.02Å; Q60-Q63 PolarHBondContact O-N 3.41Å; Q60-Q64 PolarHBondContact O-N 3.39Å
61	Q	77.9	Confident	70.9	Confident	125 Å²	125	119.7 Å²	119.7	58%	0.584	62%	0.615	S	S	*	*	H	α-helix	trans	-65.8	-34.8	176	-172.1	166.3	75.8	0	0	112.4	L57 Q58 Q59 Q65	L57-Q61 WeakPolarHBondContact O-CB 3.44Å; L57-Q61 PolarHBondContact O-N 3.31Å; Q58-Q61 PolarHBondContact O-N 3.4Å; Q59-Q61 PolarHBondContact O-N 3.03Å; Q61-Q65 PolarHBondContact O-N 3.48Å
62	Q	80.8	Confident	72.9	Confident	129 Å²	129	122.9 Å²	122.9	60%	0.603	61%	0.614	S	S	*	*	H	α-helix	trans	-70.9	-35.2	177.1	-160.6	168.4	38.1	0	0	112.6	Q58 Q59 Q60 Q65 Q66	Q58-Q62 PolarHBondContact O-N 3.04Å; Q59-Q62 PolarHBondContact O-N 3.43Å; Q60-Q62 VanDerWaalsContact C-N 3.33Å; Q60-Q62 PolarHBondContact O-N 3.02Å; Q62-Q65 PolarHBondContact O-N 3Å; Q62-Q66 PolarHBondContact O-N 3.06Å
63	Q	81.1	Confident	74.6	Confident	122 Å²	122	124.8 Å²	124.8	57%	0.57	61%	0.608	S	S	*	*	H	α-helix	trans	-67.3	-38.8	173.7	-74.3	-176	-10.5	0	0	112.8	Q59 Q60 Q65 Q66 Q67	Q59-Q63 PolarHBondContact O-N 3.42Å; Q59-Q63 VanDerWaalsContact O-N 3.12Å; Q60-Q63 PolarHBondContact O-N 3.41Å; Q63-Q65 VanDerWaalsContact C-N 3.32Å; Q63-Q65 PolarHBondContact O-N 3.12Å; Q63-Q66 PolarHBondContact O-N 3.21Å; Q63-Q67 PolarHBondContact O-N 3.48Å; Q63-Q67 VanDerWaalsContact O-N 3.14Å
64	Q	78.9	Confident	75.9	Confident	127 Å²	127	125.6 Å²	125.6	59%	0.593	60%	0.6	S	S	*	*	H	α-helix	trans	-62.9	-36.4	175.6	-76.9	-171.5	-15.1	0	0	112.7	Q60 Q67 Q68	Q60-Q64 PolarHBondContact O-N 3.39Å; Q64-Q67 PolarHBondContact O-N 3.25Å; Q64-Q68 PolarHBondContact O-N 3.39Å; Q64-Q68 VanDerWaalsContact O-N 3.12Å
65	Q	83.3	Confident	76.7	Confident	125 Å²	125	125.4 Å²	125.4	58%	0.584	60%	0.596	S	S	*	*	H	α-helix	trans	-66	-38.3	175.1	-72.7	-174.2	-10.4	0	0	112.7	Q61 Q62 Q63 Q68 Q69	Q61-Q65 PolarHBondContact O-N 3.48Å; Q62-Q65 PolarHBondContact O-N 3Å; Q63-Q65 VanDerWaalsContact C-N 3.32Å; Q63-Q65 PolarHBondContact O-N 3.12Å; Q65-Q68 PolarHBondContact O-N 3.24Å; Q65-Q69 PolarHBondContact O-N 2.87Å
66	Q	82.6	Confident	77.3	Confident	125 Å²	125	125.5 Å²	125.5	58%	0.584	59%	0.593	S	S	*	*	H	α-helix	trans	-65.5	-39.3	175.7	-73.7	-173.5	-16.5	0	0	112.5	Q62 Q63 Q69 Q70	Q62-Q66 PolarHBondContact O-N 3.06Å; Q63-Q66 PolarHBondContact O-N 3.21Å; Q66-Q69 PolarHBondContact O-N 3.12Å; Q66-Q70 PolarHBondContact O-N 2.96Å
67	Q	81.7	Confident	77.5	Confident	133 Å²	133	126.2 Å²	126.2	62%	0.621	59%	0.593	S	S	*	*	H	α-helix	trans	-65	-39.7	175	-75.4	-172.1	-17.2	0	0	112.7	Q63 Q64 Q70 Q71	Q63-Q67 PolarHBondContact O-N 3.48Å; Q63-Q67 VanDerWaalsContact O-N 3.14Å; Q64-Q67 PolarHBondContact O-N 3.25Å; Q67-Q70 PolarHBondContact O-N 3.07Å; Q67-Q71 PolarHBondContact O-N 3.5Å
68	Q	77.9	Confident	77.4	Confident	131 Å²	131	127.5 Å²	127.5	61%	0.612	60%	0.596	S	S	*	*	H	α-helix	trans	-65.7	-38.6	175.5	-75	-172.3	-12.8	0	0	112.7	Q64 Q65 Q71 Q72	Q64-Q68 PolarHBondContact O-N 3.39Å; Q64-Q68 VanDerWaalsContact O-N 3.12Å; Q65-Q68 PolarHBondContact O-N 3.24Å; Q68-Q71 PolarHBondContact O-N 3.1Å; Q68-Q72 PolarHBondContact O-N 3.26Å
69	Q	83.6	Confident	76.5	Confident	131 Å²	131	129.9 Å²	129.9	61%	0.612	61%	0.607	S	S	*	*	H	α-helix	trans	-65.3	-39.7	174.7	-75.7	-172.8	-12.8	0	0	112.6	Q65 Q66 Q72 Q73	Q65-Q69 PolarHBondContact O-N 2.87Å; Q66-Q69 PolarHBondContact O-N 3.12Å; Q69-Q72 PolarHBondContact O-N 3.41Å; Q69-Q73 PolarHBondContact O-N 3.21Å
70	Q	82.5	Confident	75.8	Confident	132 Å²	132	132.1 Å²	132.1	62%	0.617	62%	0.617	S	S	*	*	H	α-helix	trans	-64.7	-40.4	175.3	-75.1	-174.3	-11.4	0	0	112.4	Q66 Q67 Q73 Q74	Q66-Q70 PolarHBondContact O-N 2.96Å; Q67-Q70 PolarHBondContact O-N 3.07Å; Q70-Q73 PolarHBondContact O-N 2.94Å; Q70-Q74 WeakPolarHBondContact O-CG 3.26Å; Q70-Q74 PolarHBondContact O-N 3.41Å
71	Q	80.3	Confident	74.7	Confident	129 Å²	129	131.6 Å²	131.6	60%	0.603	62%	0.622	S	S	*	*	H	α-helix	trans	-65.5	-38.7	175	-75.1	-172.8	-13	0	0	112.6	Q67 Q68 Q74 Q75	Q67-Q71 PolarHBondContact O-N 3.5Å; Q68-Q71 PolarHBondContact O-N 3.1Å; Q71-Q74 PolarHBondContact O-N 2.96Å; Q71-Q75 PolarHBondContact O-N 3.14Å
72	Q	79.3	Confident	73.3	Confident	129 Å²	129	130.6 Å²	130.6	60%	0.603	63%	0.629	S	S	*	*	H	α-helix	trans	-67	-39.6	175.6	-75.6	-174.4	-13.4	0	0	112.6	Q68 Q69 Q75 Q76	Q68-Q72 PolarHBondContact O-N 3.26Å; Q69-Q72 PolarHBondContact O-N 3.41Å; Q72-Q75 PolarHBondContact O-N 3.2Å; Q72-Q76 PolarHBondContact O-N 3.39Å
73	Q	79.3	Confident	71.9	Confident	125 Å²	125	130.2 Å²	130.2	58%	0.584	64%	0.638	S	S	*	*	H	α-helix	trans	-64.5	-39.1	174	-76	-173.4	-13.5	0	0	112.4	Q69 Q70 Q76 Q77	Q69-Q73 PolarHBondContact O-N 3.21Å; Q70-Q73 PolarHBondContact O-N 2.94Å; Q73-Q76 PolarHBondContact O-N 2.98Å; Q73-Q77 WeakPolarHBondContact O-CG 3.24Å; Q73-Q77 PolarHBondContact O-N 2.93Å
74	Q	77.1	Confident	70.1	Confident	119 Å²	119	136 Å²	136	56%	0.556	65%	0.654	S	S	*	*	H	α-helix	trans	-65	-38.9	174.2	-75.2	-175.5	-9.9	0	0	112.5	Q70 Q71 Q78	Q70-Q74 WeakPolarHBondContact O-CG 3.26Å; Q70-Q74 PolarHBondContact O-N 3.41Å; Q71-Q74 PolarHBondContact O-N 2.96Å; Q74-Q78 WeakPolarHBondContact O-CG 3.45Å; Q74-Q78 PolarHBondContact O-N 2.67Å; Q74-Q78 VanDerWaalsContact O-N 3.13Å
75	Q	69.8	Low	68.3	Low	130 Å²	130	138.2 Å²	138.2	61%	0.607	67%	0.665	S	S	*	*	H	α-helix	trans	-69	-36.3	175.7	-74.6	-174.2	-8.1	0	0	113	Q71 Q72 Q78 Q79	Q71-Q75 PolarHBondContact O-N 3.14Å; Q72-Q75 PolarHBondContact O-N 3.2Å; Q75-Q78 PolarHBondContact O-N 2.68Å; Q75-Q79 PolarHBondContact O-N 3.1Å
76	Q	70.2	Confident	66.1	Low	134 Å²	134	141.8 Å²	141.8	63%	0.626	68%	0.681	S	S	*	*	H	α-helix	trans	-65.7	-44.7	173.5	-76.8	-175.8	-34.6	0	0	112.1	Q72 Q73 Q78 Q79 E80	Q72-Q76 PolarHBondContact O-N 3.39Å; Q73-Q76 PolarHBondContact O-N 2.98Å; Q76-Q78 PolarHBondContact O-N 3.21Å; Q76-Q79 PolarHBondContact O-N 3.28Å; Q76-E80 PolarHBondContact O-N 3.02Å; Q76-E80 VanDerWaalsContact O-N 3.12Å
77	Q	64.6	Low	64.2	Low	134 Å²	134	144.9 Å²	144.9	63%	0.626	70%	0.696	S	S	*	*	H	α-helix	trans	-60.9	-29.6	175.2	-73.8	-177	-6.2	0	0	113.2	Q73 T81	Q73-Q77 WeakPolarHBondContact O-CG 3.24Å; Q73-Q77 PolarHBondContact O-N 2.93Å; Q77-T81 VanDerWaalsContact O-CG2 3.32Å; Q77-T81 WeakPolarHBondContact O-CG2 3.35Å; Q77-T81 PolarHBondContact O-OG1 3.38Å
78	Q	62.3	Low	62.2	Low	143 Å²	143	147 Å²	147	67%	0.668	71%	0.706	S	S	*	*	H	α-helix	trans	-79	-18.5	175.5	-72.9	177.2	12.5	0	0	114.1	Q74 Q75 Q76	Q74-Q78 WeakPolarHBondContact O-CG 3.45Å; Q74-Q78 PolarHBondContact O-N 2.67Å; Q74-Q78 VanDerWaalsContact O-N 3.13Å; Q75-Q78 PolarHBondContact O-N 2.68Å; Q76-Q78 PolarHBondContact O-N 3.21Å
79	Q	59.8	Low	60.1	Low	167 Å²	167	149.8 Å²	149.8	78%	0.78	72%	0.719	S	S	*	*	H	α-helix	trans	-94.6	-27.9	176.9	-72.5	-169.1	-9.9	0	0	113.9	Q75 Q76	Q75-Q79 PolarHBondContact O-N 3.1Å; Q76-Q79 PolarHBondContact O-N 3.28Å
80	E	59.9	Low	57.7	Low	171 Å²	171	153.4 Å²	153.4	80%	0.799	74%	0.736	S	S	*	*	H	α-helix	trans	-79.9	-15.2	176.7	-68.5	-165.3	125.1	0	0	114.4	Q76	Q76-E80 PolarHBondContact O-N 3.02Å; Q76-E80 VanDerWaalsContact O-N 3.12Å
81	T	55.4	Low	55.3	Low	102 Å²	102	150.5 Å²	150.5	63%	0.626	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	2	-170.9	45.9	0	0	0	0	115.6	Q77	Q77-T81 VanDerWaalsContact O-CG2 3.32Å; Q77-T81 WeakPolarHBondContact O-CG2 3.35Å; Q77-T81 PolarHBondContact O-OG1 3.38Å
82	S	48.9	Very low	53	Low	104 Å²	104	153.7 Å²	153.7	73%	0.727	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	61.1	-177.4	-158.8	0	0	0	0	112.6
83	P	50.7	Low	50.7	Low	122 Å²	122	156 Å²	156	79%	0.792	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn		-149.4	71.2	101.8	38.7	-21.3	0	0	0	114.2
84	R	44	Very low	48.2	Very low	243 Å²	243	153.7 Å²	153.7	92%	0.917	78%	0.782	S	S	*	*	S	Bend	trans	-148.2	9.3	167.4	-132.3	-172.7	176.4	-155.3	-6.2	120.1
85	Q	40.7	Very low	46.1	Very low	174 Å²	174	153.7 Å²	153.7	81%	0.813	80%	0.795	S	S	*	*	S	Bend	trans	-144.9	64.9	-179.5	-144.4	169	29.1	0	0	116.9
86	Q	37.9	Very low	45.3	Very low	199 Å²	199	152.6 Å²	152.6	93%	0.93	80%	0.799	S	S	*	*	S	Bend	trans	-143.8	43.5	141.9	-124.7	172.9	32.8	0	0	113.9
87	Q	42.1	Very low	43.4	Very low	190 Å²	190	155 Å²	155	89%	0.888	81%	0.811	S	S	*	*	S	Bend	trans	-123.2	43.5	163.5	-159.4	-174.8	10.6	0	0	111.2
88	Q	39.3	Very low	41.7	Very low	179 Å²	179	152.9 Å²	152.9	84%	0.836	82%	0.816	S	S	*	*			trans	-160.7	67.6	169.9	-128	170.4	2.3	0	0	113.2
89	Q	35.2	Very low	40.1	Very low	188 Å²	188	154.6 Å²	154.6	88%	0.879	82%	0.824	S	S	*	*	S	Bend	trans	-152.7	50.5	163.9	-139.2	172.4	54	0	0	114.2
90	Q	32.5	Very low	38.6	Very low	208 Å²	208	158 Å²	158	97%	0.972	83%	0.829	S	S	*	*			trans	-168.1	120.9	147.6	-109.1	161.6	30.9	0	0	111.8
91	G	31.5	Very low	36.9	Very low	71 Å²	71	161.5 Å²	161.5	73%	0.732	84%	0.835	S	S	*	*			trans	-163	149	163.4	0	0	0	0	0	105.9
92	E	32.8	Very low	35.4	Very low	196 Å²	196	160.2 Å²	160.2	92%	0.916	84%	0.842	S	S	*	*			cis	-144.6	146.9	-1.5	-62.9	176.8	84.2	0	0	108.1
93	D	30.1	Very low	35.7	Very low	178 Å²	178	161 Å²	161	95%	0.952	85%	0.845	S	S	*	*			trans	-166.2	148.6	140.4	-128.8	-33.4	0	0	0	111.3
94	G	28.4	Very low	34.5	Very low	76 Å²	76	161.9 Å²	161.9	78%	0.784	85%	0.848	S	S	*	*			trans	109.6	93.8	177.4	0	0	0	0	0	116.1
95	S	32.8	Very low	33.6	Very low	118 Å²	118	153.7 Å²	153.7	83%	0.825	84%	0.839	S	S	*	*			trans	-115.3	174.7	179.9	-112.4	0	0	0	0	111.5
96	P	53.3	Low	32.9	Very low	107 Å²	107	155.7 Å²	155.7	70%	0.695	84%	0.841	S	S	*	*			cis	-138.9	-153.5	-37.8	35.9	-15	0	0	0	112
97	Q	28.8	Very low	32.5	Very low	186 Å²	186	153.4 Å²	153.4	87%	0.869	83%	0.834	S	S	*	*			trans	89.9	136.4	168.5	-59.4	-167	-0.1	0	0	117.1
98	A	28.9	Very low	31.7	Very low	89 Å²	89	150 Å²	150	74%	0.736	83%	0.826	S	S	*	*			cis	-154.6	179	-8	0	0	0	0	0	113
99	H	28.5	Very low	31.1	Very low	179 Å²	179	148.2 Å²	148.2	83%	0.829	82%	0.822	S	S	*	*			trans	-41.3	162.3	172.1	-56.5	-36.5	0	0	0	115.7
100	R	28.2	Very low	30.6	Very low	238 Å²	238	146.2 Å²	146.2	90%	0.898	82%	0.817	S	S	*	*			cis	-174.7	177.7	45.6	-148.1	174.2	-155.4	-157.4	7.7	112.6
101	R	24	Very low	30.2	Very low	245 Å²	245	144.3 Å²	144.3	93%	0.925	81%	0.808	S	S	*	*			trans	-68.3	151.5	162.1	-59.3	173.4	177.5	165.6	-3.1	111.8
102	G	24.7	Very low	29.9	Very low	74 Å²	74	149.4 Å²	149.4	76%	0.763	81%	0.813	S	S	*	*			trans	166.6	132.4	160	0	0	0	0	0	115.4
103	P	55.1	Low	29.5	Very low	122 Å²	122	147 Å²	147	79%	0.792	80%	0.801	S	S	*	*			trans	-122.7	-175.2	176.5	40.8	-28.7	0	0	0	114.9
104	T	24.9	Very low	29.1	Very low	140 Å²	140	146.2 Å²	146.2	86%	0.859	79%	0.792	S	S	*	*			trans	90.7	146.7	160.8	-13.2	0	0	0	0	118.9
105	G	25.5	Very low	29.8	Very low	71 Å²	71	147.2 Å²	147.2	73%	0.732	79%	0.785	S	S	*	*			trans	101.7	105	-179.7	0	0	0	0	0	112.5
106	Y	25.7	Very low	29.4	Very low	215 Å²	215	147.2 Å²	147.2	84%	0.843	79%	0.785	S	S	*	*			cis	89	138.4	18.1	-131.3	-74.9	0	0	0	115.7
107	L	29.6	Very low	28.2	Very low	152 Å²	152	150.8 Å²	150.8	80%	0.796	79%	0.792	S	S	*	*			trans	73.9	147.5	-174.3	-49.3	176.2	0	0	0	113.5
108	V	25.9	Very low	28.5	Very low	117 Å²	117	148.1 Å²	148.1	71%	0.709	79%	0.791	S	S	*	*			cis	-158.1	162.1	1.8	94.9	0	0	0	0	107.7
109	L	26.2	Very low	28.2	Very low	143 Å²	143	152.2 Å²	152.2	75%	0.749	80%	0.795	S	S	*	*			cis	-110.3	-137.5	-4.8	-98	168.9	0	0	0	108.3
110	D	25	Very low	28	Very low	146 Å²	146	148.9 Å²	148.9	78%	0.781	79%	0.792	S	S	*	*			cis	-158.8	174.4	-0.2	-133.6	-38.1	0	0	0	111
111	E	24.4	Very low	27.6	Very low	168 Å²	168	141.8 Å²	141.8	79%	0.785	78%	0.784	S	S	*	*			trans	-135.3	-175	-168.1	-141.3	171.4	104.7	0	0	116.6
112	E	24.1	Very low	27.5	Very low	178 Å²	178	137.5 Å²	137.5	83%	0.832	78%	0.778	S	S	*	*			trans	66.2	121.4	177.8	-56.8	-159.9	92.4	0	0	118.3
113	Q	24.5	Very low	27.4	Very low	144 Å²	144	141.8 Å²	141.8	67%	0.673	78%	0.779	S	S	*	*			cis	103.9	109.9	4.8	-159.6	171.5	-31.5	0	0	117.8
114	Q	22.1	Very low	25.7	Very low	162 Å²	162	140.9 Å²	140.9	76%	0.757	77%	0.774	S	S	*	*			trans	68.4	171.7	156.9	-86.3	179.7	-62.8	0	0	119
115	P	42.6	Very low	25.7	Very low	97 Å²	97	142.9 Å²	142.9	63%	0.63	77%	0.773	S	S	*	*			cis	-136.6	172.7	-23.9	30.3	-10.1	0	0	0	116.8
116	S	24.7	Very low	26.6	Very low	118 Å²	118	144.9 Å²	144.9	83%	0.825	77%	0.774	S	S	*	*			trans	75.8	154.5	143.5	52.2	0	0	0	0	122.8
117	Q	28.2	Very low	26.8	Very low	183 Å²	183	141 Å²	141	86%	0.855	76%	0.763	S	S	*	*			trans	-83.1	168.5	-177.7	-58.5	174.2	-30.2	0	0	112.7
118	P	35.1	Very low	26.7	Very low	129 Å²	129	143.2 Å²	143.2	84%	0.838	76%	0.761	S	S	*	*				-146	-152.6	103.5	41.9	-26.8	0	0	0	114.6
119	Q	24.3	Very low	26.8	Very low	175 Å²	175	140.7 Å²	140.7	82%	0.818	76%	0.759	S	S	*	*			trans	-103.8	158.5	-165.3	-56.9	160.3	-92.6	0	0	114.4
120	S	22.8	Very low	26.7	Very low	110 Å²	110	139.5 Å²	139.5	77%	0.769	76%	0.761	S	S	*	*			trans	59.6	134.3	139.9	63	0	0	0	0	123.3
121	A	21.1	Very low	26.8	Very low	89 Å²	89	138.7 Å²	138.7	74%	0.736	76%	0.761	S	S	*	*			trans	88.6	127.5	143.3	0	0	0	0	0	121.3
122	L	21.5	Very low	27.9	Very low	154 Å²	154	136.5 Å²	136.5	81%	0.806	76%	0.761	S	S	*	*			trans	64.1	145.8	142.4	-99.4	68.6	0	0	0	124.1
123	E	21.9	Very low	28.3	Very low	165 Å²	165	135.6 Å²	135.6	77%	0.771	76%	0.757	S	S	*	*			trans	90.2	139.8	142.1	-82.2	-179.6	126.5	0	0	124.8
124	C	20.3	Very low	29.4	Very low	102 Å²	102	134.7 Å²	134.7	69%	0.689	76%	0.764	S	S	*	*			trans	63.7	126.2	156.6	-66.5	0	0	0	0	121
125	H	24.7	Very low	29.6	Very low	182 Å²	182	130.2 Å²	130.2	84%	0.843	76%	0.761	S	S	*	*				57.4	159.9	54	-75.7	-47.3	0	0	0	115
126	P	43.4	Very low	28.9	Very low	114 Å²	114	130.4 Å²	130.4	74%	0.74	77%	0.771	S	S	*	*			cis	-114.7	-156.6	0.1	46.1	-35	0	0	0	111
127	E	30.7	Very low	29.1	Very low	133 Å²	133	129.1 Å²	129.1	62%	0.621	77%	0.768	S	S	*	*			cis	-139.7	166.1	-6.1	-97.8	-157.4	134.9	0	0	105.9
128	R	27.4	Very low	29	Very low	198 Å²	198	126.9 Å²	126.9	75%	0.747	77%	0.766	S	S	*	*			cis	-142.9	-171.7	3.1	-121.3	168.9	-158.7	157.3	21.6	106.6
129	G	27.8	Very low	28.6	Very low	65 Å²	65	125 Å²	125	67%	0.67	76%	0.762	S	S	*	*			cis	119.3	135.6	14.5	0	0	0	0	0	110.2
130	C	24.2	Very low	28.7	Very low	117 Å²	117	121 Å²	121	79%	0.791	76%	0.759	S	S	*	*			cis	-136.3	-121.2	8.3	-63.6	0	0	0	0	113.2
131	V	27.7	Very low	28.8	Very low	130 Å²	130	120.9 Å²	120.9	79%	0.788	76%	0.758	S	S	*	*			trans	-160.3	178.1	-158.7	-113	0	0	0	0	109.7
132	P	46	Very low	29.2	Very low	122 Å²	122	126.6 Å²	126.6	79%	0.792	77%	0.766	S	S	*	*			cis	-140.9	167	25.8	41.2	-20.5	0	0	0	120.9
133	E	33.5	Very low	29.4	Very low	159 Å²	159	122.9 Å²	122.9	74%	0.743	77%	0.765	S	S	*	*			trans	-40.7	174.2	149.5	-82	-77	118.9	0	0	115.9
134	P	46.7	Very low	29.8	Very low	124 Å²	124	121.9 Å²	121.9	81%	0.805	76%	0.764	S	S	*	*			cis	-142.8	176	21.5	43	-24.4	0	0	0	119
135	G	27.5	Very low	30.9	Very low	68 Å²	68	122.3 Å²	122.3	70%	0.701	77%	0.765	S	S	*	*			trans	166.9	144.1	155.6	0	0	0	0	0	115.9
136	A	28.5	Very low	31.1	Very low	102 Å²	102	120.7 Å²	120.7	84%	0.843	76%	0.758	S	S	*	*			trans	-141.5	160.8	-172.6	0	0	0	0	0	115.9
137	A	27.1	Very low	30.3	Very low	91 Å²	91	123.2 Å²	123.2	75%	0.752	76%	0.76	S	S	*	*			trans	76.9	128.9	148.2	0	0	0	0	0	122.3
138	V	27	Very low	30.1	Very low	135 Å²	135	123.8 Å²	123.8	82%	0.818	77%	0.766	S	S	*	*			trans	66.4	110	130.8	179.7	0	0	0	0	121.1
139	A	26.1	Very low	30.8	Very low	91 Å²	91	120.5 Å²	120.5	75%	0.752	77%	0.771	S	S	*	*			trans	44.4	135.4	133	0	0	0	0	0	124.6
140	A	26.2	Very low	30.9	Very low	91 Å²	91	121.5 Å²	121.5	75%	0.752	77%	0.773	S	S	*	*			trans	75.8	104.6	135.2	0	0	0	0	0	121.9
141	S	26.3	Very low	32.7	Very low	107 Å²	107	121.2 Å²	121.2	75%	0.748	77%	0.77	S	S	*	*				133.4	147.1	101.3	72.8	0	0	0	0	118.7
142	K	28.4	Very low	33.8	Very low	208 Å²	208	121 Å²	121	90%	0.904	77%	0.771	S	S	*	*			trans	70.9	114	156.8	-71.4	176.9	178.9	177.3	0	121.3
143	G	27	Very low	33.2	Very low	76 Å²	76	121.9 Å²	121.9	78%	0.784	77%	0.769	S	S	*	*			trans	-160.1	117.5	150.5	0	0	0	0	0	110.5
144	L	30	Very low	33.3	Very low	144 Å²	144	122 Å²	122	75%	0.754	77%	0.77	S	S	*	*			trans	-99.4	176.3	169.7	-105.2	79.4	0	0	0	109.2
145	P	43.5	Very low	32.5	Very low	111 Å²	111	122.2 Å²	122.2	72%	0.721	76%	0.764	S	S	*	*			cis	-113.5	163.3	8.6	6.2	20.8	0	0	0	113.8
146	Q	27.4	Very low	32.6	Very low	149 Å²	149	125 Å²	125	70%	0.696	76%	0.763	S	S	*	*				77	126.3	54.4	-164.6	171.7	-0.3	0	0	112.3
147	Q	27	Very low	32.7	Very low	166 Å²	166	125.4 Å²	125.4	78%	0.776	76%	0.759	S	S	*	*			cis	-155.1	172	8	-146.8	164.6	-46.1	0	0	114.3
148	L	27.6	Very low	32.8	Very low	145 Å²	145	125.7 Å²	125.7	76%	0.759	76%	0.762	S	S	*	*			trans	-68.1	163.8	162.5	-110.2	95.8	0	0	0	113
149	P	41.9	Very low	33.2	Very low	129 Å²	129	123.9 Å²	123.9	84%	0.838	76%	0.761	S	S	*	*				-150	-161.6	74.3	42.4	-21.3	0	0	0	116.3
150	A	29.3	Very low	34.1	Very low	87 Å²	87	124.9 Å²	124.9	72%	0.719	76%	0.76	S	S	*	*			trans	-117.7	-140.5	-169	0	0	0	0	0	114.8
151	P	62.6	Low	34.4	Very low	110 Å²	110	125.6 Å²	125.6	71%	0.714	76%	0.759	S	S	*	*			trans	-87.2	-178.6	-135.5	42.2	-40.3	0	0	0	116.1
152	P	50.3	Low	34.6	Very low	126 Å²	126	126.4 Å²	126.4	82%	0.818	76%	0.76	S	S	*	*				-144.5	158.8	126.7	39.5	-25.7	0	0	0	118.1
153	D	33.4	Very low	34.7	Very low	140 Å²	140	124 Å²	124	75%	0.749	76%	0.756	S	S	*	*			trans	-75.6	-176.7	176.1	-53	-85.5	0	0	0	117.8
154	E	35.5	Very low	34.8	Very low	162 Å²	162	124.9 Å²	124.9	76%	0.757	75%	0.75	S	S	*	*			trans	71	144.9	152.3	-56.9	-130.4	130.7	0	0	118.1
155	D	30.2	Very low	34.9	Very low	128 Å²	128	125.2 Å²	125.2	68%	0.684	75%	0.752	S	S	*	*			cis	-159.1	-177.4	-11.2	-156.2	-8.6	0	0	0	110.8
156	D	29.2	Very low	34.2	Very low	127 Å²	127	127.8 Å²	127.8	68%	0.679	76%	0.759	S	S	*	*			trans	90.6	105.7	141.4	-120.7	-20.2	0	0	0	123.5
157	S	30.3	Very low	34.2	Very low	110 Å²	110	124 Å²	124	77%	0.769	76%	0.76	S	S	*	*				81.3	152.1	126.8	-85.7	0	0	0	0	126.8
158	A	29.2	Very low	35.6	Very low	98 Å²	98	121.9 Å²	121.9	81%	0.81	76%	0.761	S	S	*	*			trans	72.1	101.3	153.9	0	0	0	0	0	121.4
159	A	36.2	Very low	35.6	Very low	96 Å²	96	121.1 Å²	121.1	79%	0.793	76%	0.762	S	S	*	*			trans	-88.1	156.2	137	0	0	0	0	0	108.7
160	P	45.3	Very low	35.4	Very low	112 Å²	112	124.3 Å²	124.3	73%	0.727	76%	0.763	S	S	*	*				-156.3	156.6	79.6	40.8	-20.9	0	0	0	118.9
161	S	31.8	Very low	36.1	Very low	106 Å²	106	126.4 Å²	126.4	74%	0.741	77%	0.769	S	S	*	*			trans	63.7	150.2	134.9	-63.9	0	0	0	0	125.8
162	T	31.1	Very low	34.5	Very low	124 Å²	124	124.5 Å²	124.5	76%	0.761	77%	0.77	S	S	*	*			trans	79.8	96.3	144.9	36.6	0	0	0	0	123.3
163	L	29.4	Very low	33.6	Very low	158 Å²	158	126.7 Å²	126.7	83%	0.827	77%	0.774	S	S	*	*				63.2	145.3	113.1	-91	170.7	0	0	0	124
164	S	30.7	Very low	33.4	Very low	95 Å²	95	125.4 Å²	125.4	66%	0.664	78%	0.775	S	S	*	*			trans	78.2	145.6	154.6	-64.6	0	0	0	0	118
165	L	31.3	Very low	33.1	Very low	150 Å²	150	123.4 Å²	123.4	79%	0.785	78%	0.779	S	S	*	*			cis	-159.8	-178.4	-0.5	-122.9	170.4	0	0	0	111.9
166	L	28.5	Very low	32.9	Very low	165 Å²	165	122.8 Å²	122.8	86%	0.864	78%	0.784	S	S	*	*			trans	93.2	124.8	166.7	-51.8	179	0	0	0	119.1
167	G	27.6	Very low	32.9	Very low	70 Å²	70	122.6 Å²	122.6	72%	0.722	79%	0.793	S	S	*	*			trans	-121	-150	158.5	0	0	0	0	0	109.1
168	P	56.8	Low	32.9	Very low	122 Å²	122	122.3 Å²	122.3	79%	0.792	80%	0.797	S	S	*	*			cis	-112.9	-165.1	1.6	28.5	-5	0	0	0	111.2
169	T	28.1	Very low	33.1	Very low	128 Å²	128	124.9 Å²	124.9	79%	0.785	80%	0.797	S	S	*	*			cis	-163	164.6	34.9	-39.8	0	0	0	0	112.8
170	F	35.9	Very low	32.7	Very low	196 Å²	196	127.1 Å²	127.1	86%	0.86	80%	0.795	S	S	*	*			trans	-73.3	160.3	-178.8	-82.8	-82.1	0	0	0	115.6
171	P	44.2	Very low	31.8	Very low	131 Å²	131	129.7 Å²	129.7	85%	0.851	79%	0.794	S	S	*	*				-144.8	-171.8	81.1	40.6	-22.6	0	0	0	115.6
172	G	29.6	Very low	31.7	Very low	70 Å²	70	130 Å²	130	72%	0.722	79%	0.788	S	S	*	*			trans	-175.8	-170.2	173.1	0	0	0	0	0	115.5
173	L	30.6	Very low	31.6	Very low	172 Å²	172	130.5 Å²	130.5	90%	0.901	78%	0.784	S	S	*	*			trans	87.5	121.8	172.8	-60.3	175.3	0	0	0	121
174	S	29.7	Very low	31.6	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	79%	0.789	S	S	*	*			trans	52.5	129.2	138.7	64.4	0	0	0	0	123.3
175	S	29.5	Very low	31.5	Very low	120 Å²	120	131 Å²	131	84%	0.839	79%	0.787	S	S	*	*				-178.4	-173.5	100	-158.6	0	0	0	0	112.1
176	C	26.8	Very low	31.6	Very low	115 Å²	115	133 Å²	133	78%	0.777	79%	0.792	S	S	*	*			trans	-118.7	160	-162.6	-50.7	0	0	0	0	115.3
177	S	28.6	Very low	31.6	Very low	124 Å²	124	129.6 Å²	129.6	87%	0.867	79%	0.788	S	S	*	*				148.5	140.5	128.6	58.4	0	0	0	0	114.4
178	A	30.8	Very low	31.5	Very low	103 Å²	103	131.5 Å²	131.5	85%	0.851	79%	0.79	S	S	*	*			trans	-175.7	138.7	148.9	0	0	0	0	0	112
179	D	32	Very low	30.3	Very low	152 Å²	152	132 Å²	132	81%	0.813	79%	0.791	S	S	*	*			trans	-83.7	173	170.7	-87.9	-52.5	0	0	0	111.7
180	L	28.1	Very low	30.3	Very low	143 Å²	143	133.1 Å²	133.1	75%	0.749	79%	0.789	S	S	*	*			cis	-174.8	-171.7	-21.9	-155.9	175.7	0	0	0	104.7
181	K	27.2	Very low	30.1	Very low	166 Å²	166	130.4 Å²	130.4	72%	0.722	78%	0.779	S	S	*	*			trans	83.9	148.9	165.2	-63.2	-175	152.4	-119.5	0	117.4
182	D	29.8	Very low	29.4	Very low	113 Å²	113	132 Å²	132	60%	0.604	78%	0.78	S	S	*	*			cis	-151.8	166.9	-11.6	-109.9	-25.8	0	0	0	105.8
183	I	28.8	Very low	29.4	Very low	134 Å²	134	134.5 Å²	134.5	69%	0.687	78%	0.776	S	S	*	*			cis	-153.6	164.6	16.4	-150.6	165.9	0	0	0	110.9
184	L	28	Very low	29.4	Very low	176 Å²	176	133.2 Å²	133.2	92%	0.921	77%	0.765	S	S	*	*			trans	-144.9	143.5	149	-91.8	-176.9	0	0	0	109.4
185	S	29.7	Very low	29.6	Very low	89 Å²	89	135.1 Å²	135.1	62%	0.622	76%	0.762	S	S	*	*			trans	-113	136.7	-165.9	55	0	0	0	0	114
186	E	33.1	Very low	29.6	Very low	191 Å²	191	137.9 Å²	137.9	89%	0.893	76%	0.761	S	S	*	*			trans	58.8	142.2	135.9	-65.9	-179	167.9	0	0	120.7
187	A	28	Very low	29.8	Very low	94 Å²	94	140 Å²	140	78%	0.777	76%	0.76	S	S	*	*			cis	-155.5	160	-10.8	0	0	0	0	0	111.7
188	S	25.7	Very low	30	Very low	110 Å²	110	140.2 Å²	140.2	77%	0.769	75%	0.747	S	S	*	*			trans	-65.7	162.7	175.6	-43.9	0	0	0	0	113.8
189	T	31.5	Very low	29.8	Very low	131 Å²	131	143 Å²	143	80%	0.804	74%	0.742	S	S	*	*				-164.7	138.2	124.4	24.5	0	0	0	0	113.2
190	M	29.7	Very low	29.5	Very low	153 Å²	153	139.8 Å²	139.8	75%	0.754	74%	0.737	S	S	*	*			trans	49	146.5	143.2	-51	-58.8	-82.7	0	0	121.3
191	Q	30.8	Very low	29.5	Very low	138 Å²	138	139 Å²	139	65%	0.645	74%	0.738	S	S	*	*			cis	146.5	127	-19.4	165.9	175.6	-14.7	0	0	107.7
192	L	29.3	Very low	29.5	Very low	166 Å²	166	135.6 Å²	135.6	87%	0.869	74%	0.735	S	S	*	*			trans	-152.5	161	148.8	-141.4	79.4	0	0	0	112.4
193	L	29.1	Very low	29.3	Very low	121 Å²	121	139 Å²	139	63%	0.634	75%	0.747	S	S	*	*			trans	-76.6	176.4	-175.4	-80.5	77.8	0	0	0	113.3
194	Q	32	Very low	29.2	Very low	145 Å²	145	135.8 Å²	135.8	68%	0.678	75%	0.747	S	S	*	*			cis	179.6	176.7	-27.4	-179.6	163.2	-9.2	0	0	107.5
195	Q	32.9	Very low	29.1	Very low	154 Å²	154	133.4 Å²	133.4	72%	0.72	75%	0.745	S	S	*	*			trans	77.9	147.4	169.7	-111.2	102.6	38.8	0	0	115.4
196	Q	29.8	Very low	29.1	Very low	177 Å²	177	133.9 Å²	133.9	83%	0.827	75%	0.749	S	S	*	*			cis	-144.6	159.3	8.6	-160.7	163.4	32.6	0	0	113
197	Q	30.5	Very low	28.8	Very low	160 Å²	160	130.5 Å²	130.5	75%	0.748	75%	0.746	S	S	*	*			trans	-82.8	179.3	171.9	-67	165.1	-95.9	0	0	110.7
198	Q	32.6	Very low	28.9	Very low	129 Å²	129	129.4 Å²	129.4	60%	0.603	74%	0.744	S	S	*	*			cis	-164.7	166.3	15	-145.8	153.8	-56.9	0	0	111.6
199	E	28.1	Very low	29	Very low	161 Å²	161	135.3 Å²	135.3	75%	0.752	75%	0.749	S	S	*	*			trans	61.1	157.3	152.4	-86.2	142.7	-147.8	0	0	120.4
200	A	25.2	Very low	28.8	Very low	85 Å²	85	133.4 Å²	133.4	70%	0.702	75%	0.747	S	S	*	*			cis	-144.1	141.1	-3.8	0	0	0	0	0	109.6
201	V	27.7	Very low	28.8	Very low	125 Å²	125	137.4 Å²	137.4	76%	0.758	75%	0.753	S	S	*	*				79.1	125.3	86.9	176.7	0	0	0	0	116.5
202	S	26.4	Very low	28.7	Very low	96 Å²	96	138.9 Å²	138.9	67%	0.671	76%	0.76	S	S	*	*			trans	63.9	159.9	160.5	-76.3	0	0	0	0	120.1
203	E	26.8	Very low	28.7	Very low	184 Å²	184	135.1 Å²	135.1	86%	0.86	75%	0.753	S	S	*	*			cis	-170	174.5	-37.2	-123.6	179.1	142.3	0	0	109.9
204	G	26	Very low	28.5	Very low	67 Å²	67	135.5 Å²	135.5	69%	0.691	77%	0.766	S	S	*	*			trans	90.8	130.4	174.1	0	0	0	0	0	113.5
205	S	26.3	Very low	28.3	Very low	125 Å²	125	132.5 Å²	132.5	87%	0.874	77%	0.774	S	S	*	*			cis	62.9	129.9	25.3	-144.8	0	0	0	0	112.5
206	S	29.3	Very low	28.1	Very low	99 Å²	99	129.7 Å²	129.7	69%	0.692	78%	0.777	S	S	*	*			cis	-150.9	152.2	17	76.1	0	0	0	0	111.2
207	S	27.2	Very low	28.7	Very low	120 Å²	120	126.6 Å²	126.6	84%	0.839	77%	0.772	S	S	*	*				69.8	141.8	98.5	-162.8	0	0	0	0	117.2
208	G	29	Very low	28.6	Very low	71 Å²	71	124.9 Å²	124.9	73%	0.732	77%	0.773	S	S	*	*			trans	116.5	76.5	179.6	0	0	0	0	0	113.3
209	R	28.1	Very low	28.4	Very low	235 Å²	235	124.4 Å²	124.4	89%	0.887	78%	0.784	S	S	*	*				83.6	92.9	54.3	-163.6	-174.6	-170.2	-177.7	5	114.4
210	A	28.3	Very low	28.6	Very low	90 Å²	90	121.6 Å²	121.6	74%	0.744	78%	0.782	S	S	*	*			trans	58.9	128.7	147.7	0	0	0	0	0	121.1
211	R	30.2	Very low	28.9	Very low	238 Å²	238	125.7 Å²	125.7	90%	0.898	78%	0.784	S	S	*	*				-163.5	161.1	97.4	-113	176.3	171.8	149.2	-1.8	113.7
212	E	27.8	Very low	29	Very low	169 Å²	169	124.6 Å²	124.6	79%	0.79	77%	0.774	S	S	*	*			trans	-73.7	156.8	167.9	-44.7	104.1	108.8	0	0	111.8
213	A	29.1	Very low	29.2	Very low	87 Å²	87	126.4 Å²	126.4	72%	0.719	78%	0.776	S	S	*	*				163.6	129.8	107.4	0	0	0	0	0	113.7
214	S	26.1	Very low	29.2	Very low	128 Å²	128	127.8 Å²	127.8	90%	0.895	78%	0.775	S	S	*	*			trans	39.7	116.1	136.9	-50.9	0	0	0	0	121.3
215	G	26.8	Very low	29.4	Very low	82 Å²	82	132.1 Å²	132.1	85%	0.845	78%	0.781	S	S	*	*			trans	172.3	74.5	164.5	0	0	0	0	0	117
216	A	27.9	Very low	29.5	Very low	95 Å²	95	130.3 Å²	130.3	79%	0.785	78%	0.782	S	S	*	*			trans	-82.7	157.2	155.2	0	0	0	0	0	108.3
217	P	43.5	Very low	29.4	Very low	112 Å²	112	129.4 Å²	129.4	73%	0.727	79%	0.789	S	S	*	*				-154.2	-164.3	55.2	42.1	-19.1	0	0	0	117.3
218	T	27.7	Very low	29.7	Very low	125 Å²	125	130.6 Å²	130.6	77%	0.767	79%	0.791	S	S	*	*			trans	72.5	106.2	158	52.7	0	0	0	0	122
219	S	29.3	Very low	29.8	Very low	119 Å²	119	132.9 Å²	132.9	83%	0.832	80%	0.796	S	S	*	*				64.8	137.9	112.3	-150.7	0	0	0	0	123.7
220	S	31.9	Very low	30.5	Very low	102 Å²	102	128 Å²	128	71%	0.713	79%	0.793	S	S	*	*			trans	88.4	88.2	145	-162.4	0	0	0	0	122.2
221	K	31.9	Very low	31.1	Very low	170 Å²	170	129.6 Å²	129.6	74%	0.739	79%	0.787	S	S	*	*				69.6	150.2	114.8	-141.1	-178.9	166.5	-94.1	0	122.4
222	D	30	Very low	32.4	Very low	103 Å²	103	121.7 Å²	121.7	55%	0.551	77%	0.769	S	S	*	*			trans	82	90.1	157.7	-64.4	-46.1	0	0	0	121.9
223	N	30.5	Very low	33.2	Very low	133 Å²	133	118.4 Å²	118.4	71%	0.711	76%	0.756	S	S	*	*				81.4	149.2	122.4	-66.1	-43.6	0	0	0	125.2
224	Y	26.8	Very low	34.4	Very low	213 Å²	213	120.5 Å²	120.5	84%	0.835	76%	0.755	S	S	*	*			trans	98.1	135.9	145.1	-93.6	-64.2	0	0	0	122.7
225	L	30.8	Very low	35.4	Very low	158 Å²	158	116 Å²	116	83%	0.827	73%	0.726	S	S	*	*			trans	74	98	160.1	-60.8	175.2	0	0	0	120.5
226	G	27.7	Very low	36.2	Very low	87 Å²	87	117 Å²	117	90%	0.897	71%	0.707	S	S	*	*				74.7	107.7	103.6	0	0	0	0	0	119.5
227	G	27	Very low	37.3	Very low	81 Å²	81	117.4 Å²	117.4	84%	0.835	69%	0.693	S	S	*	*			trans	-160.5	119	165	0	0	0	0	0	112
228	T	33.1	Very low	37.7	Very low	144 Å²	144	117.7 Å²	117.7	88%	0.883	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-82.3	129.2	178.5	48.9	0	0	0	0	111.6
229	S	30.5	Very low	38.4	Very low	120 Å²	120	115.7 Å²	115.7	84%	0.839	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-103.9	117.5	165.1	47.7	0	0	0	0	110.6
230	T	42.7	Very low	39.4	Very low	133 Å²	133	115 Å²	115	82%	0.816	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-76.6	145.9	171.8	41.9	0	0	0	0	110.7	S232	T230-S232 PolarHBondContact O-N 2.93Å
231	I	42.2	Very low	40.3	Very low	122 Å²	122	112.8 Å²	112.8	63%	0.626	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-67	125.4	173.4	-67.4	178	0	0	0	108.9	A235	I231-A235 HydrophobicContact CG2-CB 3.61Å
232	S	56.8	Low	41.2	Very low	73 Å²	73	108.6 Å²	108.6	51%	0.51	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-66.7	150.6	-179.7	59.1	0	0	0	0	112.2	T230 N234 A235 K236	T230-S232 PolarHBondContact O-N 2.93Å; S232-N234 VanDerWaalsContact C-N 3.26Å; S232-N234 PolarHBondContact O-N 3.16Å; S232-A235 WeakPolarHBondContact O-CB 3.49Å; S232-A235 PolarHBondContact O-N 3.24Å; S232-K236 PolarHBondContact O-N 3.44Å
233	D	44.1	Very low	42.3	Very low	99 Å²	99	105.4 Å²	105.4	53%	0.529	62%	0.622	S	S	.	*	H	α-helix	trans	-65.2	-28.4	-171.4	-57.6	-72.5	0	0	0	113.3	A235 K236 E237	D233-A235 PolarHBondContact O-N 2.82Å; D233-K236 WeakPolarHBondContact O-CB 3.49Å; D233-K236 PolarHBondContact O-N 2.93Å; D233-K236 WeakPolarHBondContact OD1-CD 3.4Å; D233-K236 WeakPolarHBondContact OD1-CE 3.39Å; D233-K236 IonicContact OD1-NZ 2.68Å; D233-K236 PolarHBondContact OD1-NZ 2.91Å; D233-E237 PolarHBondContact O-N 3.4Å
234	N	54.7	Low	43.3	Very low	131 Å²	131	104.2 Å²	104.2	70%	0.701	62%	0.619	S	S	*	*	H	α-helix	trans	-55.2	-35.4	169.4	-68.5	42.1	0	0	0	112.9	S232 L238	S232-N234 VanDerWaalsContact C-N 3.26Å; S232-N234 PolarHBondContact O-N 3.16Å; N234-L238 WeakPolarHBondContact O-CG 3.47Å; N234-L238 PolarHBondContact O-N 2.87Å; N234-L238 VanDerWaalsContact O-N 3.09Å
235	A	48.3	Very low	44.1	Very low	34 Å²	34	99 Å²	99	28%	0.281	61%	0.614	S	S	.	*	H	α-helix	trans	-77.8	-28	177.1	0	0	0	0	0	112.3	I231 S232 D233 C239	I231-A235 HydrophobicContact CG2-CB 3.61Å; S232-A235 WeakPolarHBondContact O-CB 3.49Å; S232-A235 PolarHBondContact O-N 3.24Å; D233-A235 PolarHBondContact O-N 2.82Å; A235-C239 PolarHBondContact O-N 2.94Å; A235-C239 PolarHBondContact O-SG 2.96Å; A235-C239 VanDerWaalsContact O-SG 3.37Å
236	K	42.5	Very low	45.1	Very low	103 Å²	103	98 Å²	98	45%	0.448	61%	0.606	S	S	.	*	H	α-helix	trans	-67.3	-43.6	170.7	-58.9	176.9	-168.6	160.7	0	111.1	S232 D233 C239 K240	S232-K236 PolarHBondContact O-N 3.44Å; D233-K236 WeakPolarHBondContact O-CB 3.49Å; D233-K236 PolarHBondContact O-N 2.93Å; D233-K236 WeakPolarHBondContact OD1-CD 3.4Å; D233-K236 WeakPolarHBondContact OD1-CE 3.39Å; D233-K236 IonicContact OD1-NZ 2.68Å; D233-K236 PolarHBondContact OD1-NZ 2.91Å; K236-C239 PolarHBondContact O-N 3.27Å; K236-K240 PolarHBondContact O-N 3.12Å
237	E	52.1	Low	46	Very low	103 Å²	103	97 Å²	97	48%	0.481	60%	0.597	S	S	.	*	H	α-helix	trans	-66.4	-36.9	176.2	-64.6	-49.5	121.5	0	0	112.5	D233 K240 A241	D233-E237 PolarHBondContact O-N 3.4Å; E237-K240 PolarHBondContact O-N 3.11Å; E237-K240 WeakPolarHBondContact OE1-CD 3.35Å; E237-K240 WeakPolarHBondContact OE1-CE 3.28Å; E237-K240 IonicContact OE1-NZ 2.67Å; E237-K240 PolarHBondContact OE1-NZ 3.37Å; E237-K240 WeakPolarHBondContact OE2-CD 3.5Å; E237-K240 IonicContact OE2-NZ 3.35Å; E237-A241 WeakPolarHBondContact O-CB 3.46Å; E237-A241 PolarHBondContact O-N 3.11Å
238	L	51.2	Low	46.7	Very low	119 Å²	119	98.3 Å²	98.3	62%	0.623	58%	0.584	S	S	*	*	H	α-helix	trans	-61.6	-43.4	170.7	-76.5	168.3	0	0	0	112	N234 A241 V242	N234-L238 WeakPolarHBondContact O-CG 3.47Å; N234-L238 PolarHBondContact O-N 2.87Å; N234-L238 VanDerWaalsContact O-N 3.09Å; L238-A241 PolarHBondContact O-N 2.89Å; L238-V242 WeakPolarHBondContact O-CG2 3.33Å; L238-V242 PolarHBondContact O-N 2.76Å
239	C	43.2	Very low	47	Very low	83 Å²	83	95.2 Å²	95.2	56%	0.561	58%	0.581	S	S	*	*	H	α-helix	trans	-63.2	-41.8	175	-73	0	0	0	0	112.5	A235 K236 V242 S243	A235-C239 PolarHBondContact O-N 2.94Å; A235-C239 PolarHBondContact O-SG 2.96Å; A235-C239 VanDerWaalsContact O-SG 3.37Å; K236-C239 PolarHBondContact O-N 3.27Å; C239-V242 PolarHBondContact O-N 3.25Å; C239-S243 PolarHBondContact O-N 3.3Å; C239-S243 PolarHBondContact O-OG 3.23Å
240	K	49	Very low	47.9	Very low	105 Å²	105	94.5 Å²	94.5	46%	0.457	57%	0.571	S	S	.	*	H	α-helix	trans	-58.5	-48.3	172.9	-73.2	174.6	-177.7	171.7	0	111.6	K236 E237 V242 S243 V244	K236-K240 PolarHBondContact O-N 3.12Å; E237-K240 PolarHBondContact O-N 3.11Å; E237-K240 WeakPolarHBondContact OE1-CD 3.35Å; E237-K240 WeakPolarHBondContact OE1-CE 3.28Å; E237-K240 IonicContact OE1-NZ 2.67Å; E237-K240 PolarHBondContact OE1-NZ 3.37Å; E237-K240 WeakPolarHBondContact OE2-CD 3.5Å; E237-K240 IonicContact OE2-NZ 3.35Å; K240-V242 VanDerWaalsContact C-N 3.3Å; K240-V242 PolarHBondContact O-N 3.45Å; K240-S243 PolarHBondContact O-N 3.2Å; K240-V244 WeakPolarHBondContact O-CB 3.42Å; K240-V244 WeakPolarHBondContact O-CG2 3.49Å; K240-V244 PolarHBondContact O-N 3.21Å
241	A	51.8	Low	47.5	Very low	54 Å²	54	97 Å²	97	45%	0.446	57%	0.574	S	S	.	*	H	α-helix	trans	-60.9	-38.2	179.9	0	0	0	0	0	112.4	E237 L238 S245	E237-A241 WeakPolarHBondContact O-CB 3.46Å; E237-A241 PolarHBondContact O-N 3.11Å; L238-A241 PolarHBondContact O-N 2.89Å; A241-S245 VanDerWaalsContact O-CB 3.31Å; A241-S245 WeakPolarHBondContact O-CB 3.12Å; A241-S245 PolarHBondContact O-N 3.35Å; A241-S245 PolarHBondContact O-OG 3Å
242	V	49.2	Very low	47.1	Very low	83 Å²	83	95.9 Å²	95.9	50%	0.503	58%	0.582	S	S	.	*	H	α-helix	trans	-68.3	-47.8	174.5	172.1	0	0	0	0	111.4	L238 C239 K240 V244 S245 M246	L238-V242 WeakPolarHBondContact O-CG2 3.33Å; L238-V242 PolarHBondContact O-N 2.76Å; C239-V242 PolarHBondContact O-N 3.25Å; K240-V242 VanDerWaalsContact C-N 3.3Å; K240-V242 PolarHBondContact O-N 3.45Å; V242-V244 PolarHBondContact O-N 2.66Å; V242-S245 CarbonylContact O-C 3.55Å; V242-S245 PolarHBondContact O-N 3.35Å; V242-S245 VanDerWaalsContact O-N 3.13Å; V242-M246 HydrophobicContact CG1-SD 4.12Å; V242-M246 WeakPolarHBondContact O-CG 3.36Å; V242-M246 PolarHBondContact O-N 3.34Å
243	S	53.7	Low	45.6	Very low	35 Å²	35	101 Å²	101	25%	0.245	60%	0.603	C	S	.	*	H	α-helix	trans	-59.6	-42.9	178.4	-66.1	0	0	0	0	112.7	C239 K240 M246 G247 L248	C239-S243 PolarHBondContact O-N 3.3Å; C239-S243 PolarHBondContact O-OG 3.23Å; K240-S243 PolarHBondContact O-N 3.2Å; S243-M246 CarbonylContact O-C 3.51Å; S243-M246 PolarHBondContact O-N 2.69Å; S243-G247 PolarHBondContact O-N 3.03Å; S243-G247 VanDerWaalsContact O-N 3.14Å; S243-L248 PolarHBondContact O-N 3.13Å
244	V	52.3	Low	44.9	Very low	108 Å²	108	104.3 Å²	104.3	66%	0.655	62%	0.616	S	S	*	*	H	α-helix	trans	-63.7	-42.1	174.5	171.1	0	0	0	0	111.1	K240 V242 M246 G247	K240-V244 WeakPolarHBondContact O-CB 3.42Å; K240-V244 WeakPolarHBondContact O-CG2 3.49Å; K240-V244 PolarHBondContact O-N 3.21Å; V242-V244 PolarHBondContact O-N 2.66Å; V244-M246 PolarHBondContact O-N 3.11Å; V244-G247 PolarHBondContact O-N 2.93Å; V244-G247 VanDerWaalsContact O-N 3.1Å
245	S	43.3	Very low	43.8	Very low	104 Å²	104	105.8 Å²	105.8	73%	0.727	62%	0.618	S	S	*	*	H	α-helix	trans	-66.3	-19.8	176.5	-58.5	0	0	0	0	113.6	A241 V242	A241-S245 VanDerWaalsContact O-CB 3.31Å; A241-S245 WeakPolarHBondContact O-CB 3.12Å; A241-S245 PolarHBondContact O-N 3.35Å; A241-S245 PolarHBondContact O-OG 3Å; V242-S245 CarbonylContact O-C 3.55Å; V242-S245 PolarHBondContact O-N 3.35Å; V242-S245 VanDerWaalsContact O-N 3.13Å
246	M	51.6	Low	42.7	Very low	136 Å²	136	111.1 Å²	111.1	67%	0.67	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	4.4	174.9	-66	-174.4	68.5	0	0	113.4	V242 S243 V244 L248	V242-M246 HydrophobicContact CG1-SD 4.12Å; V242-M246 WeakPolarHBondContact O-CG 3.36Å; V242-M246 PolarHBondContact O-N 3.34Å; S243-M246 CarbonylContact O-C 3.51Å; S243-M246 PolarHBondContact O-N 2.69Å; V244-M246 PolarHBondContact O-N 3.11Å; M246-L248 VanDerWaalsContact C-N 3.28Å; M246-L248 HydrophobicContact CB-CG 4.38Å; M246-L248 PolarHBondContact O-N 2.94Å
247	G	46.1	Very low	41.9	Very low	68 Å²	68	111.5 Å²	111.5	70%	0.701	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.5	17.8	178.5	0	0	0	0	0	115	S243 V244	S243-G247 PolarHBondContact O-N 3.03Å; S243-G247 VanDerWaalsContact O-N 3.14Å; V244-G247 PolarHBondContact O-N 2.93Å; V244-G247 VanDerWaalsContact O-N 3.1Å
248	L	42.6	Very low	41.2	Very low	107 Å²	107	112.9 Å²	112.9	56%	0.56	68%	0.675	S	S	*	*			trans	-86.4	114	178.7	-61.6	179.5	0	0	0	110.1	S243 M246 V250	S243-L248 PolarHBondContact O-N 3.13Å; M246-L248 VanDerWaalsContact C-N 3.28Å; M246-L248 HydrophobicContact CB-CG 4.38Å; M246-L248 PolarHBondContact O-N 2.94Å; L248-V250 PolarHBondContact O-N 3.09Å
249	G	39.7	Very low	40	Very low	80 Å²	80	110.9 Å²	110.9	83%	0.825	68%	0.682	S	S	*	*			trans	-62.9	130.9	174.5	0	0	0	0	0	111.6
250	V	48.7	Very low	39.1	Very low	104 Å²	104	115.6 Å²	115.6	63%	0.63	70%	0.696	S	S	*	*			trans	-107.3	98.5	179.3	-178.7	0	0	0	0	108.7	L248	L248-V250 PolarHBondContact O-N 3.09Å
251	E	34.8	Very low	37.9	Very low	186 Å²	186	118.2 Å²	118.2	87%	0.869	71%	0.71	S	S	*	*			trans	-117.5	143.4	167.9	-69.2	-158.2	136.7	0	0	111.4
252	A	33.3	Very low	36.7	Very low	98 Å²	98	123 Å²	123	81%	0.81	73%	0.727	S	S	*	*			trans	39.9	97.6	162.5	0	0	0	0	0	118.7
253	L	26.1	Very low	35.4	Very low	181 Å²	181	129.8 Å²	129.8	95%	0.948	74%	0.744	S	S	*	*			trans	-130.8	73.4	143.1	-167.4	73	0	0	0	110.4
254	E	29.6	Very low	34	Very low	169 Å²	169	130.9 Å²	130.9	79%	0.79	76%	0.761	S	S	*	*			trans	-117.9	161.7	159.8	-67.8	-162.9	118.5	0	0	109.5
255	H	30	Very low	32.8	Very low	162 Å²	162	132.7 Å²	132.7	75%	0.75	77%	0.767	S	S	*	*			trans	85.3	99	176.7	-55.8	-72.7	0	0	0	119.9
256	L	25.8	Very low	32	Very low	145 Å²	145	133.4 Å²	133.4	76%	0.759	77%	0.77	S	S	*	*				70.7	104.3	123.2	-61.9	169.7	0	0	0	120.9
257	S	25.5	Very low	30.7	Very low	112 Å²	112	134 Å²	134	78%	0.783	77%	0.773	S	S	*	*				54.2	153.2	110.5	-64.3	0	0	0	0	122.9
258	P	37.5	Very low	29.8	Very low	132 Å²	132	140.9 Å²	140.9	86%	0.857	78%	0.78	S	S	*	*			trans	-97.9	155.6	-164.8	38.5	-36	0	0	0	115.5
259	G	26.3	Very low	29	Very low	76 Å²	76	139.4 Å²	139.4	78%	0.784	78%	0.783	S	S	*	*			trans	-175.8	116.8	170.3	0	0	0	0	0	115.6
260	E	23.6	Very low	29	Very low	183 Å²	183	141.1 Å²	141.1	86%	0.855	78%	0.779	S	S	*	*			trans	23.4	121.3	148.3	-68.9	-175.7	102.3	0	0	124
261	Q	25	Very low	27.9	Very low	160 Å²	160	143.2 Å²	143.2	75%	0.748	79%	0.786	S	S	*	*				72.9	143.5	112.8	-143	77.2	-23.3	0	0	122.8
262	L	25.3	Very low	27.6	Very low	153 Å²	153	142.4 Å²	142.4	80%	0.801	79%	0.787	S	S	*	*			trans	82.4	157	162.4	-51.8	174.5	0	0	0	119.1
263	R	22.1	Very low	27.1	Very low	226 Å²	226	140.6 Å²	140.6	85%	0.853	78%	0.778	S	S	*	*			cis	-171	134.5	-41.7	-172.8	176.4	-173.9	-151.3	1.6	109.9
264	G	24.9	Very low	27.6	Very low	59 Å²	59	139.1 Å²	139.1	61%	0.608	78%	0.776	S	S	*	*			trans	81.9	162.7	163	0	0	0	0	0	116.2
265	D	27.1	Very low	28	Very low	146 Å²	146	136.2 Å²	136.2	78%	0.781	77%	0.772	S	S	*	*			cis	-161.4	161.5	-10.5	-102.4	-39.1	0	0	0	111.4
266	C	25.6	Very low	28.6	Very low	118 Å²	118	134 Å²	134	80%	0.797	77%	0.772	S	S	*	*			trans	67.1	154.4	164.8	-65	0	0	0	0	119.1
267	M	25.3	Very low	28.9	Very low	149 Å²	149	131.2 Å²	131.2	73%	0.734	77%	0.77	S	S	*	*			cis	-162.6	155.6	-20.4	-112.8	-68.8	-123.6	0	0	110.5
268	Y	27.4	Very low	29.1	Very low	213 Å²	213	131.6 Å²	131.6	84%	0.835	77%	0.767	S	S	*	*			trans	66.3	139.3	165.5	-98.7	-95.6	0	0	0	121.2
269	A	26.4	Very low	28.6	Very low	75 Å²	75	136.4 Å²	136.4	62%	0.62	77%	0.769	S	S	*	*			trans	-115.3	178.9	171.2	0	0	0	0	0	110.2
270	P	39	Very low	28.9	Very low	116 Å²	116	138.4 Å²	138.4	75%	0.753	77%	0.768	S	S	*	*				-128.5	139.5	83.9	4	19.1	0	0	0	114.3
271	L	26.2	Very low	29.3	Very low	149 Å²	149	136.2 Å²	136.2	78%	0.78	77%	0.767	S	S	*	*				60.6	121.3	97	-55.3	176.4	0	0	0	113.8
272	L	27.6	Very low	30	Very low	168 Å²	168	133.9 Å²	133.9	88%	0.88	77%	0.766	S	S	*	*			cis	-143	154.1	20.7	-68.8	169.5	0	0	0	112.3
273	G	23.5	Very low	29.9	Very low	61 Å²	61	132.4 Å²	132.4	63%	0.629	77%	0.767	S	S	*	*			trans	-169.5	97.3	172.5	0	0	0	0	0	116
274	V	36	Very low	30	Very low	149 Å²	149	126.4 Å²	126.4	90%	0.903	77%	0.766	S	S	*	*			trans	55	-146.7	165.3	-133	0	0	0	0	111.7
275	P	38.4	Very low	30.3	Very low	109 Å²	109	129 Å²	129	71%	0.708	77%	0.772	S	S	*	*			cis	-120.4	-135.6	-5	32	-5.7	0	0	0	112.6
276	P	43.2	Very low	30.1	Very low	116 Å²	116	129.5 Å²	129.5	75%	0.753	77%	0.773	S	S	*	*				-130.4	-172.3	-103.9	43.2	-25.9	0	0	0	114.8
277	A	32.1	Very low	30.1	Very low	86 Å²	86	129 Å²	129	71%	0.711	78%	0.777	S	S	*	*			trans	-81.2	158.4	160.2	0	0	0	0	0	111.8
278	V	29.2	Very low	30.3	Very low	120 Å²	120	130.1 Å²	130.1	73%	0.727	78%	0.781	S	S	*	*			trans	166.5	117.3	133	152.5	0	0	0	0	112.7
279	R	26.3	Very low	30.1	Very low	233 Å²	233	125.9 Å²	125.9	88%	0.879	78%	0.781	S	S	*	*			trans	62	176.2	152.1	-72.3	177.4	-173.8	165	-0.5	118.5
280	P	33.4	Very low	30.3	Very low	118 Å²	118	132.3 Å²	132.3	77%	0.766	80%	0.795	S	S	*	*			cis	-133.4	161.5	-48.7	37.6	-23.3	0	0	0	114.4
281	T	31.1	Very low	29.7	Very low	136 Å²	136	130.3 Å²	130.3	83%	0.834	80%	0.796	S	S	*	*			trans	-78.7	165.9	156.1	28	0	0	0	0	111
282	P	40.6	Very low	29.7	Very low	112 Å²	112	128.9 Å²	128.9	73%	0.727	80%	0.798	S	S	*	*			cis	-144.3	-169.7	28.7	42.9	-22.5	0	0	0	117.8
283	C	22.1	Very low	29.6	Very low	122 Å²	122	128.3 Å²	128.3	82%	0.824	80%	0.795	S	S	*	*			trans	90.7	143.1	153.2	-71	0	0	0	0	122
284	A	24	Very low	29.9	Very low	100 Å²	100	132.6 Å²	132.6	83%	0.826	80%	0.803	S	S	*	*			trans	77.5	141.8	168.3	0	0	0	0	0	119.1
285	P	31.9	Very low	29.4	Very low	114 Å²	114	131.9 Å²	131.9	74%	0.74	79%	0.794	S	S	*	*			trans	-135.5	175.5	-155.6	39.7	-18.9	0	0	0	117.7
286	L	23.2	Very low	28.8	Very low	155 Å²	155	133 Å²	133	81%	0.812	79%	0.794	S	S	*	*			trans	63.6	111.3	155.4	-78.5	164.8	0	0	0	120.6
287	A	25	Very low	28	Very low	107 Å²	107	132 Å²	132	88%	0.884	79%	0.79	S	S	*	*			trans	-157.7	126.2	139.1	0	0	0	0	0	108.9
288	E	30.3	Very low	27.8	Very low	174 Å²	174	132.9 Å²	132.9	81%	0.813	80%	0.797	S	S	*	*			trans	-118.5	159.1	-176.3	-66.4	-172.4	127.9	0	0	112.6
289	C	22.9	Very low	27.6	Very low	124 Å²	124	130.7 Å²	130.7	84%	0.838	80%	0.799	S	S	*	*			trans	-153.6	137.8	165.3	-98.6	0	0	0	0	112
290	K	29.5	Very low	27.6	Very low	209 Å²	209	129.7 Å²	129.7	91%	0.909	80%	0.801	S	S	*	*			trans	76	113.9	-159.6	-54.2	173.9	178.7	179.7	0	112
291	G	27.3	Very low	27.1	Very low	75 Å²	75	129 Å²	129	77%	0.773	80%	0.799	S	S	*	*			cis	115.4	132.6	8.5	0	0	0	0	0	110.5
292	S	26.2	Very low	26.8	Very low	118 Å²	118	127.6 Å²	127.6	83%	0.825	79%	0.79	S	S	*	*			cis	-139.7	140.2	10.6	-66	0	0	0	0	108.9
293	L	25.7	Very low	26	Very low	157 Å²	157	130.6 Å²	130.6	82%	0.822	80%	0.795	S	S	*	*				80.7	141.6	67.6	-151	151	0	0	0	112.9
294	L	28.7	Very low	26.1	Very low	150 Å²	150	131.7 Å²	131.7	79%	0.785	79%	0.792	S	S	*	*			trans	83.2	123.8	-160.2	-50.9	177.4	0	0	0	111.9
295	D	26	Very low	26.2	Very low	135 Å²	135	132.4 Å²	132.4	72%	0.722	79%	0.786	S	S	*	*			cis	-143.5	159.1	8.1	-138.3	-123.4	0	0	0	113.3
296	D	26.4	Very low	25.9	Very low	133 Å²	133	131 Å²	131	71%	0.711	78%	0.784	S	S	*	*			trans	-24.7	168.2	168.6	-85.6	-111.4	0	0	0	121.5
297	S	26.4	Very low	26	Very low	93 Å²	93	131.5 Å²	131.5	65%	0.65	78%	0.783	S	S	*	*			cis	-177	163.7	-21.9	-104.7	0	0	0	0	110.6
298	A	27.2	Very low	26.1	Very low	106 Å²	106	136 Å²	136	88%	0.876	78%	0.778	S	S	*	*			trans	60.1	-180	157.6	0	0	0	0	0	116.1
299	G	26.4	Very low	25.8	Very low	74 Å²	74	132.6 Å²	132.6	76%	0.763	77%	0.773	S	S	*	*			cis	-174.7	152.6	-4.6	0	0	0	0	0	110.1
300	K	25.3	Very low	26.8	Very low	212 Å²	212	131.4 Å²	131.4	92%	0.922	76%	0.764	S	S	*	*			trans	-131.3	103.1	-170.1	177.1	-164	175.5	-175.5	0	112.5
301	S	22.1	Very low	26.5	Very low	102 Å²	102	130.3 Å²	130.3	71%	0.713	76%	0.76	S	S	*	*			trans	-170.2	164	162	61.9	0	0	0	0	112.7
302	T	25.9	Very low	26.8	Very low	108 Å²	108	135.8 Å²	135.8	66%	0.663	76%	0.762	S	S	*	*			trans	52.9	110.6	149.3	49.7	0	0	0	0	118.5
303	E	24.4	Very low	26.9	Very low	174 Å²	174	134 Å²	134	81%	0.813	76%	0.763	S	S	*	*				96.9	107.6	67.1	-95.6	171.8	107.7	0	0	114.1
304	D	23.5	Very low	27	Very low	146 Å²	146	129.7 Å²	129.7	78%	0.781	76%	0.756	S	S	*	*			trans	79.2	157.3	133	-132.3	-15.1	0	0	0	122.7
305	T	26.3	Very low	26.8	Very low	114 Å²	114	132.6 Å²	132.6	70%	0.699	76%	0.758	S	S	*	*			trans	76.8	104.1	157.8	-48.9	0	0	0	0	120.4
306	A	25.6	Very low	27.2	Very low	84 Å²	84	131.9 Å²	131.9	69%	0.694	76%	0.759	S	S	*	*			trans	70	160.2	137.3	0	0	0	0	0	119.4
307	E	25.2	Very low	27.5	Very low	167 Å²	167	134.9 Å²	134.9	78%	0.78	77%	0.765	S	S	*	*			cis	-157	177.9	-2.5	-137.9	172.5	-157.7	0	0	112.9
308	Y	26.6	Very low	27.5	Very low	202 Å²	202	133.4 Å²	133.4	79%	0.792	77%	0.765	S	S	*	*			trans	69.8	109.6	154.7	-103	-106.7	0	0	0	122.2
309	S	24.8	Very low	27.7	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	76%	0.757	S	S	*	*			trans	-68.9	-164.8	145.1	-44	0	0	0	0	110.4
310	P	43.4	Very low	27.7	Very low	100 Å²	100	139.9 Å²	139.9	65%	0.649	76%	0.761	S	S	*	*			cis	-136	-149.2	-6.3	40.5	-18.7	0	0	0	113.9
311	F	23.5	Very low	27.8	Very low	185 Å²	185	133.2 Å²	133.2	81%	0.811	75%	0.753	S	S	*	*			trans	88.8	148.8	175.8	-71.6	-94.8	0	0	0	118.1
312	K	32.1	Very low	28.1	Very low	190 Å²	190	137.6 Å²	137.6	83%	0.826	76%	0.762	S	S	*	*			cis	150.5	131.7	-42.6	174.8	-176.7	177.5	-176.2	0	112.7
313	G	28.6	Very low	28.1	Very low	81 Å²	81	136.6 Å²	136.6	84%	0.835	76%	0.759	S	S	*	*			trans	96.8	150.1	163.9	0	0	0	0	0	114.9
314	G	28	Very low	28.2	Very low	66 Å²	66	136.6 Å²	136.6	68%	0.68	76%	0.764	S	S	*	*			cis	-153.7	-166.4	-6.1	0	0	0	0	0	108.8
315	Y	26	Very low	28.2	Very low	212 Å²	212	133.1 Å²	133.1	83%	0.831	76%	0.763	S	S	*	*			cis	-152.2	136.3	4.1	-84.7	-93	0	0	0	107.8
316	T	33.1	Very low	28.1	Very low	120 Å²	120	133.4 Å²	133.4	74%	0.736	77%	0.768	S	S	*	*				44.8	140.7	99.3	81.8	0	0	0	0	117.2
317	K	34.2	Very low	28.2	Very low	195 Å²	195	135.6 Å²	135.6	85%	0.848	78%	0.778	S	S	*	*			cis	-166.5	165	9.7	-144.7	-174.8	178	-171.8	0	112.1
318	G	25.7	Very low	28.2	Very low	62 Å²	62	131.7 Å²	131.7	64%	0.639	78%	0.782	S	S	*	*			trans	144.7	99.6	167.4	0	0	0	0	0	111.8
319	L	32	Very low	28.3	Very low	137 Å²	137	127.8 Å²	127.8	72%	0.717	79%	0.785	S	S	*	*				63.6	129.4	77.2	-57.7	-176.6	0	0	0	112.6
320	E	26.3	Very low	28.4	Very low	179 Å²	179	127.8 Å²	127.8	84%	0.836	79%	0.791	S	S	*	*			cis	-163.3	170.3	4	-138.5	159.8	-143.3	0	0	110
321	G	26.7	Very low	27.7	Very low	73 Å²	73	128.2 Å²	128.2	75%	0.753	80%	0.803	S	S	*	*			trans	110.6	117.9	155.9	0	0	0	0	0	120.7
322	E	27.4	Very low	28	Very low	194 Å²	194	124.6 Å²	124.6	91%	0.907	81%	0.807	S	S	*	*			trans	-21.8	174.5	146.2	-68.7	-176	110	0	0	121
323	S	27.1	Very low	27.7	Very low	87 Å²	87	119.4 Å²	119.4	61%	0.608	81%	0.807	S	S	*	*			cis	175.9	148.1	-24.6	-174.9	0	0	0	0	109.6
324	L	26.3	Very low	27.7	Very low	173 Å²	173	121 Å²	121	91%	0.906	81%	0.806	S	S	*	*			trans	56	158.8	160.7	-69.7	162.5	0	0	0	120.4
325	G	24.3	Very low	27.7	Very low	74 Å²	74	123.6 Å²	123.6	76%	0.763	81%	0.814	S	S	*	*			trans	158.8	114	167.1	0	0	0	0	0	114.9
326	C	23.9	Very low	27.8	Very low	120 Å²	120	117 Å²	117	81%	0.811	81%	0.81	S	S	*	*			trans	-111.1	159.2	178.7	-64.2	0	0	0	0	112.4
327	S	27	Very low	27.5	Very low	130 Å²	130	116.9 Å²	116.9	91%	0.909	81%	0.809	S	S	*	*			trans	63.5	124.8	151.8	-58.2	0	0	0	0	119.7
328	G	26.3	Very low	27.1	Very low	84 Å²	84	115.1 Å²	115.1	87%	0.866	81%	0.808	S	S	*	*			trans	-157.8	126.5	161.8	0	0	0	0	0	109.6
329	S	28.1	Very low	27	Very low	121 Å²	121	120.7 Å²	120.7	85%	0.846	82%	0.818	S	S	*	*			trans	-127.7	154.8	-172.9	-169.8	0	0	0	0	111.9
330	A	25.8	Very low	26.9	Very low	100 Å²	100	121.8 Å²	121.8	83%	0.826	82%	0.823	S	S	*	*			trans	59.2	116.9	162.9	0	0	0	0	0	119.3
331	A	30.2	Very low	27.5	Very low	109 Å²	109	118.2 Å²	118.2	90%	0.901	82%	0.816	S	S	*	*			trans	-146.8	145.3	137.8	0	0	0	0	0	108.9
332	A	28.6	Very low	27.5	Very low	109 Å²	109	119.9 Å²	119.9	90%	0.901	82%	0.816	S	S	*	*			trans	-111	151.2	173.3	0	0	0	0	0	109.8
333	G	26.1	Very low	27.6	Very low	81 Å²	81	116.6 Å²	116.6	84%	0.835	81%	0.809	S	S	*	*			trans	-178.4	117.6	178.7	0	0	0	0	0	112.5
334	S	27.9	Very low	27.5	Very low	114 Å²	114	119.7 Å²	119.7	80%	0.797	82%	0.818	S	S	*	*			trans	-91.4	149.3	-168.8	54.2	0	0	0	0	115.5
335	S	29.6	Very low	27.5	Very low	122 Å²	122	116.3 Å²	116.3	85%	0.853	81%	0.809	S	S	*	*			trans	77.9	138.1	151.6	-151.5	0	0	0	0	118.7
336	G	26.6	Very low	27.6	Very low	72 Å²	72	119.7 Å²	119.7	74%	0.742	81%	0.808	S	S	*	*			trans	169.3	40	-176.4	0	0	0	0	0	118.3
337	T	27	Very low	27.7	Very low	119 Å²	119	123.2 Å²	123.2	73%	0.73	81%	0.806	S	S	*	*			trans	-3	124.1	160.1	-51.6	0	0	0	0	121.2
338	L	25.3	Very low	27.6	Very low	157 Å²	157	125.5 Å²	125.5	82%	0.822	80%	0.8	S	S	*	*			trans	66.1	157.6	157.2	-66.4	171.9	0	0	0	117.7
339	E	24.2	Very low	27.8	Very low	180 Å²	180	127 Å²	127	84%	0.841	80%	0.797	S	S	*	*			cis	-130.9	-178.1	11.7	-81.4	-162.6	110.8	0	0	114.4
340	L	30.7	Very low	27.6	Very low	159 Å²	159	125 Å²	125	83%	0.832	80%	0.796	S	S	*	*			trans	-66.3	-177.9	157	-116.3	74.5	0	0	0	111.2
341	P	38.9	Very low	27.8	Very low	105 Å²	105	125 Å²	125	68%	0.682	80%	0.796	S	S	*	*			cis	-149.4	-166.7	30.9	37.4	-12.2	0	0	0	117.7
342	S	26.1	Very low	27.6	Very low	107 Å²	107	128.6 Å²	128.6	75%	0.748	80%	0.799	S	S	*	*			trans	77.9	156.2	159.9	-29.7	0	0	0	0	117
343	T	30.2	Very low	27.5	Very low	125 Å²	125	130.7 Å²	130.7	77%	0.767	80%	0.795	S	S	*	*			cis	-128.1	150.5	-5.7	36.4	0	0	0	0	109
344	L	25.3	Very low	27.6	Very low	153 Å²	153	135.8 Å²	135.8	80%	0.801	80%	0.797	S	S	*	*				70.9	129.4	62.6	-126.7	-178.4	0	0	0	114.9
345	S	25.3	Very low	27.5	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	80%	0.796	S	S	*	*			trans	77.6	158.9	168.5	88.9	0	0	0	0	117
346	L	26.4	Very low	27.3	Very low	145 Å²	145	133.8 Å²	133.8	76%	0.759	80%	0.795	S	S	*	*			cis	-159	151.5	-9.7	-124.8	165.5	0	0	0	111.4
347	Y	26.3	Very low	27.3	Very low	195 Å²	195	134.6 Å²	134.6	77%	0.765	80%	0.795	S	S	*	*			trans	49.2	124.1	147.5	-109.9	-137.5	0	0	0	124.8
348	K	25	Very low	27.1	Very low	177 Å²	177	138.4 Å²	138.4	77%	0.77	80%	0.797	S	S	*	*				79.4	143.7	121.1	-169	174.2	177	-175.3	0	120.4
349	S	30.3	Very low	27	Very low	116 Å²	116	138.8 Å²	138.8	81%	0.811	80%	0.795	S	S	*	*			trans	-68.6	144.3	-176.8	-34.8	0	0	0	0	114.9
350	G	24.3	Very low	27	Very low	80 Å²	80	134.5 Å²	134.5	83%	0.825	78%	0.784	S	S	*	*			trans	-116.7	154.4	146.1	0	0	0	0	0	109.3
351	A	29.6	Very low	26.8	Very low	100 Å²	100	136.9 Å²	136.9	83%	0.826	78%	0.782	S	S	*	*			trans	-130.1	138.7	172.2	0	0	0	0	0	108.8
352	L	27	Very low	26.3	Very low	184 Å²	184	136.8 Å²	136.8	96%	0.963	78%	0.776	S	S	*	*			trans	-159	166.7	160.8	-113.1	170.6	0	0	0	109.2
353	D	25.7	Very low	26.4	Very low	153 Å²	153	140.7 Å²	140.7	82%	0.818	78%	0.776	S	S	*	*			trans	-117.3	-170.4	-165.1	-147.7	-43.5	0	0	0	111.1
354	E	27.1	Very low	26.3	Very low	187 Å²	187	144.2 Å²	144.2	87%	0.874	78%	0.776	S	S	*	*			trans	84.9	155.9	162.7	-140.1	169.1	156.3	0	0	117.8
355	A	25.9	Very low	26.3	Very low	95 Å²	95	143.3 Å²	143.3	79%	0.785	77%	0.772	S	S	*	*			trans	-149.4	150.4	-159.3	0	0	0	0	0	112.7
356	A	26.8	Very low	26.4	Very low	99 Å²	99	147.2 Å²	147.2	82%	0.818	78%	0.777	S	S	*	*			trans	-161.4	130.6	155	0	0	0	0	0	114.5
357	A	25	Very low	27	Very low	90 Å²	90	145.4 Å²	145.4	74%	0.744	77%	0.774	S	S	*	*			trans	42.8	130.8	135.4	0	0	0	0	0	124.4
358	Y	23.4	Very low	27.4	Very low	199 Å²	199	144.5 Å²	144.5	78%	0.78	78%	0.781	S	S	*	*				88.9	120.1	128.7	-97.9	-132.8	0	0	0	123
359	Q	24	Very low	27.6	Very low	165 Å²	165	140.6 Å²	140.6	77%	0.771	78%	0.782	S	S	*	*			trans	65.2	157.1	144	-67.8	-172.5	11.8	0	0	118.8
360	S	22.9	Very low	27.8	Very low	89 Å²	89	143.8 Å²	143.8	62%	0.622	79%	0.789	S	S	*	*			cis	-169.7	144.7	-23.4	172.4	0	0	0	0	109.2
361	R	26.5	Very low	28.6	Very low	210 Å²	210	145 Å²	145	79%	0.792	79%	0.792	S	S	*	*			trans	27.8	144.3	145.7	-67.1	172	62.2	-166	-8	120.5
362	D	28.2	Very low	28.8	Very low	103 Å²	103	143.5 Å²	143.5	55%	0.551	79%	0.785	S	S	*	*			cis	-165.2	-175.6	16.3	-110.3	-24.4	0	0	0	110.8
363	Y	28.4	Very low	29.6	Very low	188 Å²	188	140.5 Å²	140.5	74%	0.737	78%	0.777	S	S	*	*			trans	81.5	143.9	167.3	-69.7	-86.6	0	0	0	118.5
364	Y	27.9	Very low	30.3	Very low	200 Å²	200	139 Å²	139	78%	0.784	78%	0.776	S	S	*	*			cis	-120.1	163.5	6.7	-115.4	-81.1	0	0	0	114.3
365	N	25.9	Very low	31.1	Very low	134 Å²	134	135.8 Å²	135.8	72%	0.717	77%	0.771	S	S	*	*			trans	-103.7	164.9	-177.2	-120.2	-83.4	0	0	0	112.6
366	F	27.2	Very low	31.8	Very low	183 Å²	183	136.9 Å²	136.9	80%	0.803	77%	0.77	S	S	*	*			trans	178.5	161.9	131.8	-98.7	-53.8	0	0	0	112.5
367	P	39.6	Very low	32.6	Very low	106 Å²	106	137.8 Å²	137.8	69%	0.688	77%	0.767	S	S	*	*				-122.7	174	-106.7	44.3	-33.9	0	0	0	116.6
368	L	34.7	Very low	33.5	Very low	176 Å²	176	139.2 Å²	139.2	92%	0.921	77%	0.769	S	S	*	*			trans	-99.8	151	157.4	-90.9	162.4	0	0	0	110.6
369	A	29.1	Very low	34.2	Very low	96 Å²	96	135.7 Å²	135.7	79%	0.793	77%	0.771	S	S	*	*			trans	-122.4	145.8	173.9	0	0	0	0	0	111.1
370	L	34.2	Very low	35.1	Very low	182 Å²	182	132.7 Å²	132.7	95%	0.953	77%	0.765	S	S	*	*			trans	-97.1	167.8	177.9	-78.1	165.6	0	0	0	111.8
371	A	40.6	Very low	35.4	Very low	107 Å²	107	136.5 Å²	136.5	88%	0.884	77%	0.773	S	S	*	*			trans	-71.2	156	-167.3	0	0	0	0	0	115.4
372	G	35	Very low	36.1	Very low	67 Å²	67	131 Å²	131	69%	0.691	77%	0.765	S	S	*	*			trans	-135.1	168.3	167.8	0	0	0	0	0	111.6
373	P	44.2	Very low	36.2	Very low	122 Å²	122	135 Å²	135	79%	0.792	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-76.9	158.1	-171.3	31.5	-36.4	0	0	0	114.3
374	P	40.7	Very low	36.3	Very low	121 Å²	121	131.3 Å²	131.3	79%	0.786	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-77.3	142.6	-177.3	31.2	-35.4	0	0	0	113.6
375	P	43.7	Very low	36.3	Very low	119 Å²	119	132.3 Å²	132.3	77%	0.773	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80.3	163	173.3	33	-35.1	0	0	0	113.7
376	P	40.4	Very low	36.4	Very low	119 Å²	119	134 Å²	134	77%	0.773	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-82.5	163.7	-170.9	33.5	-37.5	0	0	0	115.3
377	P	42.4	Very low	36.3	Very low	117 Å²	117	132.4 Å²	132.4	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-85.8	155.5	-177.7	34.9	-36.6	0	0	0	114.5
378	P	43.5	Very low	35.8	Very low	120 Å²	120	135.6 Å²	135.6	78%	0.779	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-83	160.2	171.1	33.8	-34.7	0	0	0	113.9
379	P	39	Very low	35.3	Very low	126 Å²	126	134.1 Å²	134.1	82%	0.818	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-85	172.1	-173.7	-9.4	30	0	0	0	115.1
380	P	42.9	Very low	35.5	Very low	101 Å²	101	136.7 Å²	136.7	66%	0.656	79%	0.79	S	S	*	*			trans	-122.2	-172.7	-153.2	26.3	-4.1	0	0	0	116.9
381	H	30	Very low	35.6	Very low	169 Å²	169	133 Å²	133	78%	0.782	78%	0.776	S	S	*	*			trans	108.6	148.2	156.3	-64.9	-67.1	0	0	0	118.8
382	P	41	Very low	34.9	Very low	95 Å²	95	134.9 Å²	134.9	62%	0.617	77%	0.771	S	S	*	*			cis	-142.6	174.7	-23	37.7	-18.7	0	0	0	117.5
383	H	30.2	Very low	34.4	Very low	187 Å²	187	137.8 Å²	137.8	87%	0.866	77%	0.77	S	S	*	*			trans	59.9	106.1	155.9	-55.6	-52.3	0	0	0	122.1
384	A	29.4	Very low	33.5	Very low	110 Å²	110	142.3 Å²	142.3	91%	0.909	77%	0.773	S	S	*	*				-157.6	149.2	122.2	0	0	0	0	0	109.9
385	R	28.3	Very low	32.7	Very low	221 Å²	221	139 Å²	139	83%	0.834	76%	0.761	S	S	*	*			trans	-111.8	127	-170.7	-178.3	-169.7	-87.3	-174.1	-11.2	110.3
386	I	29	Very low	32	Very low	170 Å²	170	139.4 Å²	139.4	87%	0.872	77%	0.767	S	S	*	*			trans	-92.9	133.3	168.6	-66	179.7	0	0	0	108.9
387	K	24	Very low	31.5	Very low	150 Å²	150	138.3 Å²	138.3	65%	0.652	77%	0.768	S	S	*	*			trans	-96.8	142.2	177.3	-158.2	-175.8	-176.8	-155.1	0	109.4	E389	K387-E389 WeakPolarHBondContact CD-OE2 3.17Å; K387-E389 VanDerWaalsContact CE-CD 3.47Å; K387-E389 VanDerWaalsContact CE-OE2 3.23Å; K387-E389 WeakPolarHBondContact CE-OE2 3.48Å; K387-E389 IonicContact NZ-OE1 2.8Å; K387-E389 PolarHBondContact NZ-OE1 2.96Å; K387-E389 IonicContact NZ-OE2 2.67Å; K387-E389 PolarHBondContact NZ-OE2 3.25Å
388	L	30.1	Very low	30.6	Very low	173 Å²	173	144 Å²	144	91%	0.906	78%	0.775	S	S	*	*			trans	-110.4	104.7	174	-176.1	72.4	0	0	0	109.6
389	E	23.1	Very low	29.9	Very low	144 Å²	144	142.5 Å²	142.5	67%	0.673	77%	0.772	S	S	*	*			trans	-132.9	143.5	169	-79.2	171.8	143.3	0	0	109.3	K387	K387-E389 WeakPolarHBondContact CD-OE2 3.17Å; K387-E389 VanDerWaalsContact CE-CD 3.47Å; K387-E389 VanDerWaalsContact CE-OE2 3.23Å; K387-E389 WeakPolarHBondContact CE-OE2 3.48Å; K387-E389 IonicContact NZ-OE1 2.8Å; K387-E389 PolarHBondContact NZ-OE1 2.96Å; K387-E389 IonicContact NZ-OE2 2.67Å; K387-E389 PolarHBondContact NZ-OE2 3.25Å
390	N	33.7	Very low	29.4	Very low	151 Å²	151	140.7 Å²	140.7	81%	0.807	77%	0.768	S	S	*	*			trans	-106.2	145.3	-177.6	-161	40.3	0	0	0	108.5
391	P	35.9	Very low	28.5	Very low	104 Å²	104	141.2 Å²	141.2	68%	0.675	78%	0.78	S	S	*	*				-153.1	162.6	112.9	38.1	-20.9	0	0	0	116.7
392	L	25.8	Very low	28.4	Very low	147 Å²	147	137.6 Å²	137.6	77%	0.77	78%	0.78	S	S	*	*			trans	26.2	148.4	131.9	-50.3	175	0	0	0	120.3
393	D	25	Very low	27.7	Very low	127 Å²	127	138.2 Å²	138.2	68%	0.679	79%	0.793	S	S	*	*			cis	-162	173.9	28	-142	-35.3	0	0	0	114.9
394	Y	25.1	Very low	27.5	Very low	217 Å²	217	137.2 Å²	137.2	85%	0.851	79%	0.789	S	S	*	*			trans	72.3	157.4	168.4	-92.6	-118.4	0	0	0	119.6
395	G	24.6	Very low	27.2	Very low	51 Å²	51	138.4 Å²	138.4	53%	0.526	79%	0.789	S	S	.	*			cis	171.2	42.5	-5	0	0	0	0	0	120.9
396	S	29.5	Very low	27	Very low	129 Å²	129	138.7 Å²	138.7	90%	0.902	79%	0.79	S	S	*	*			trans	67.8	164.6	170.4	78.6	0	0	0	0	117.3
397	A	28.3	Very low	26.8	Very low	96 Å²	96	141.8 Å²	141.8	79%	0.793	79%	0.792	S	S	*	*			cis	-139.6	161.4	1.7	0	0	0	0	0	110
398	W	25.2	Very low	26.9	Very low	237 Å²	237	138.2 Å²	138.2	90%	0.898	80%	0.798	S	S	*	*				-143.3	164	66.9	85.1	-55.9	0	0	0	114.7
399	A	28.2	Very low	26.7	Very low	88 Å²	88	137.2 Å²	137.2	73%	0.727	79%	0.794	S	S	*	*			trans	-157.4	159.4	176.6	0	0	0	0	0	108.2
400	A	28.5	Very low	26.8	Very low	88 Å²	88	138.2 Å²	138.2	73%	0.727	80%	0.803	S	S	*	*			cis	-162.4	161.4	-21.9	0	0	0	0	0	108.2
401	A	24.5	Very low	26.4	Very low	111 Å²	111	135.1 Å²	135.1	92%	0.917	80%	0.798	S	S	*	*			trans	-141.3	73	173.8	0	0	0	0	0	111.1
402	A	26.3	Very low	26.1	Very low	94 Å²	94	134.9 Å²	134.9	78%	0.777	80%	0.799	S	S	*	*			trans	-126	110.3	175.2	0	0	0	0	0	109.7	Q404	A402-Q404 PolarHBondContact O-N 3.22Å
403	A	27.9	Very low	26.2	Very low	108 Å²	108	134.6 Å²	134.6	89%	0.893	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-80.4	116.4	178.3	0	0	0	0	0	110.7
404	Q	26.2	Very low	26.4	Very low	165 Å²	165	137.3 Å²	137.3	77%	0.771	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-93.4	124	167.7	-64.7	-177.2	4.3	0	0	109.2	A402	A402-Q404 PolarHBondContact O-N 3.22Å
405	C	22.7	Very low	26.4	Very low	136 Å²	136	130.2 Å²	130.2	92%	0.919	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-80.3	127.8	160.4	-70.4	0	0	0	0	108.6
406	R	24.5	Very low	26.5	Very low	226 Å²	226	133.4 Å²	133.4	85%	0.853	82%	0.82	S	S	*	*			trans	-120.1	135.1	166.3	-88.3	-154.4	174.9	-149.7	0.7	110.7
407	Y	24.2	Very low	26.3	Very low	236 Å²	236	131.2 Å²	131.2	93%	0.925	82%	0.818	S	S	*	*			trans	-64.2	149.1	158	-121	-106	0	0	0	109.5
408	G	26.2	Very low	26.3	Very low	75 Å²	75	131.9 Å²	131.9	77%	0.773	82%	0.823	S	S	*	*			trans	-149.1	133.4	171.6	0	0	0	0	0	109.4
409	D	25.4	Very low	26.3	Very low	151 Å²	151	125.5 Å²	125.5	81%	0.807	82%	0.821	S	S	*	*			trans	-150.4	139.4	-176.7	-173.3	15	0	0	0	108.9
410	L	26	Very low	26.3	Very low	165 Å²	165	124.7 Å²	124.7	86%	0.864	82%	0.822	S	S	*	*			trans	-171	122.4	177.6	-116.3	163.5	0	0	0	111.5
411	A	25.5	Very low	26.9	Very low	86 Å²	86	127 Å²	127	71%	0.711	83%	0.829	S	S	*	*			trans	-92.8	179.7	171.7	0	0	0	0	0	110.8
412	S	29.1	Very low	27	Very low	99 Å²	99	125.6 Å²	125.6	69%	0.692	83%	0.825	S	S	*	*			cis	-158.2	164.5	8.2	-161.7	0	0	0	0	107.5
413	L	28.4	Very low	27.1	Very low	141 Å²	141	127.1 Å²	127.1	74%	0.738	83%	0.83	S	S	*	*				179.4	142.1	76.6	-79.9	169.8	0	0	0	111.2
414	H	28.9	Very low	27	Very low	184 Å²	184	125.6 Å²	125.6	85%	0.852	83%	0.826	S	S	*	*			trans	54.3	135.3	150.9	-69.6	-122	0	0	0	121.5
415	G	24.3	Very low	27	Very low	69 Å²	69	123.1 Å²	123.1	71%	0.711	83%	0.826	S	S	*	*			cis	168.6	172.9	-7.6	0	0	0	0	0	115.8
416	A	27	Very low	27.4	Very low	118 Å²	118	122.7 Å²	122.7	98%	0.975	82%	0.822	S	S	*	*			trans	73.2	133	170.6	0	0	0	0	0	120
417	G	25.4	Very low	27.5	Very low	83 Å²	83	117.6 Å²	117.6	86%	0.856	82%	0.821	S	S	*	*			trans	139.2	98.9	171.2	0	0	0	0	0	113.8
418	A	27.2	Very low	27.9	Very low	109 Å²	109	111.7 Å²	111.7	90%	0.901	82%	0.821	S	S	*	*			trans	-99	139.4	-165.9	0	0	0	0	0	115.9
419	A	26.6	Very low	28.2	Very low	104 Å²	104	112.6 Å²	112.6	86%	0.86	82%	0.821	S	S	*	*			trans	-172.5	155.7	145.2	0	0	0	0	0	111.4
420	G	27.4	Very low	28.4	Very low	71 Å²	71	109.9 Å²	109.9	73%	0.732	82%	0.819	S	S	*	*			trans	-96.7	-161.8	166.3	0	0	0	0	0	112.3
421	P	41.9	Very low	28.9	Very low	135 Å²	135	106.4 Å²	106.4	88%	0.877	81%	0.809	S	S	*	*			cis	-139.7	-176.4	12.5	43.8	-26.4	0	0	0	116.3
422	G	25.5	Very low	30.1	Very low	82 Å²	82	104.2 Å²	104.2	85%	0.845	79%	0.789	S	S	*	*			trans	85	97.2	139.2	0	0	0	0	0	119.5
423	S	29.5	Very low	31.9	Very low	126 Å²	126	101.6 Å²	101.6	88%	0.881	77%	0.77	S	S	*	*			trans	-108	114.6	166.9	51.1	0	0	0	0	112.1
424	G	25.2	Very low	33.7	Very low	77 Å²	77	94.9 Å²	94.9	79%	0.794	74%	0.735	S	S	*	*			trans	-126.6	94.5	174.9	0	0	0	0	0	111.5
425	S	26.4	Very low	35.9	Very low	112 Å²	112	91.3 Å²	91.3	78%	0.783	72%	0.718	S	S	*	*			trans	-88.4	129.5	176.2	-60.4	0	0	0	0	111	S427	S425-S427 PolarHBondContact O-N 3.01Å
426	P	31.3	Very low	38.5	Very low	128 Å²	128	91.6 Å²	91.6	83%	0.831	71%	0.707	S	S	*	*			trans	-78.9	116.7	178.4	30.2	-33	0	0	0	111.8	A428	P426-A428 PolarHBondContact O-N 3.06Å
427	S	26.5	Very low	40.8	Very low	119 Å²	119	87.6 Å²	87.6	83%	0.832	67%	0.668	S	S	*	*			trans	-72	107.3	172.7	-65	0	0	0	0	111.5	S425 A429	S425-S427 PolarHBondContact O-N 3.01Å; S427-A429 VanDerWaalsContact C-N 3.28Å; S427-A429 PolarHBondContact O-N 3.37Å
428	A	31.6	Very low	42.7	Very low	111 Å²	111	84.4 Å²	84.4	92%	0.917	63%	0.631	S	S	*	*			trans	-77.6	72.7	172.4	0	0	0	0	0	111.8	P426	P426-A428 PolarHBondContact O-N 3.06Å
429	A	32.2	Very low	44.3	Very low	94 Å²	94	84.2 Å²	84.2	78%	0.777	62%	0.619	S	S	*	*			trans	-117.8	74.9	176.6	0	0	0	0	0	111	S427	S427-A429 VanDerWaalsContact C-N 3.28Å; S427-A429 PolarHBondContact O-N 3.37Å
430	A	30.8	Very low	45.4	Very low	94 Å²	94	82.2 Å²	82.2	78%	0.777	60%	0.602	S	S	*	*			trans	-95.7	113.6	170.4	0	0	0	0	0	109.5	S432	A430-S432 PolarHBondContact O-N 2.92Å
431	S	35.5	Very low	46	Very low	93 Å²	93	85.9 Å²	85.9	65%	0.65	60%	0.6	S	S	*	*			trans	-65.6	105.7	-179.8	40.9	0	0	0	0	111.4	S433 E893	S431-S433 PolarHBondContact O-N 3.43Å; S431-E893 WeakPolarHBondContact CB-OE2 3.19Å
432	S	52.2	Low	46.2	Very low	40 Å²	40	86.8 Å²	86.8	28%	0.28	59%	0.593	S	S	.	*			trans	-82.7	77.8	-178.8	57.7	0	0	0	0	111.7	A430 M894	A430-S432 PolarHBondContact O-N 2.92Å; S432-M894 WeakPolarHBondContact O-CE 3.45Å; S432-M894 WeakPolarHBondContact OG-CE 3.43Å
433	S	65.1	Low	46.5	Very low	43 Å²	43	86.3 Å²	86.3	30%	0.301	59%	0.588	S	S	.	*			trans	-53.2	143.8	170.5	176.9	0	0	0	0	111.4	S431 H435 T436 L437	S431-S433 PolarHBondContact O-N 3.43Å; S433-H435 PolarHBondContact O-N 2.69Å; S433-T436 WeakPolarHBondContact O-CB 3.38Å; S433-T436 PolarHBondContact O-N 2.72Å; S433-L437 PolarHBondContact O-N 2.79Å
434	W	68.1	Low	46.8	Very low	1 Å²	1	88.7 Å²	88.7	0%	0.004	59%	0.585	C	S	.	*	H	α-helix	trans	-49.1	-45.2	177.2	-88.9	101.6	0	0	0	112.9	T436 L437 F438 L712 V716 I737 M894 I898	W434-T436 VanDerWaalsContact C-N 3.32Å; W434-T436 PolarHBondContact O-N 3.45Å; W434-L437 PolarHBondContact O-N 3.31Å; W434-F438 AromaticContact CE3-CE2 3.96Å; W434-F438 HydrophobicContact CE3-CE2 3.96Å; W434-F438 HydrophobicContact CZ3-CE2 4.12Å; W434-F438 WeakPolarHBondContact O-CD2 3.48Å; W434-F438 PolarHBondContact O-N 3.23Å; W434-L712 HydrophobicContact CH2-CB 4.25Å; W434-L712 HydrophobicContact CH2-CD2 4.07Å; W434-L712 HydrophobicContact CZ2-CB 4.3Å; W434-L712 HydrophobicContact CZ2-CD1 4.22Å; W434-L712 HydrophobicContact CZ2-CD2 4.17Å; W434-L712 HydrophobicContact CZ2-CG 4.45Å; W434-V716 HydrophobicContact CH2-CG2 3.92Å; W434-V716 HydrophobicContact CZ3-CG2 3.48Å; W434-V716 VanDerWaalsContact CZ3-CG2 3.48Å; W434-I737 HydrophobicContact CH2-CG2 4.47Å; W434-I737 HydrophobicContact CZ3-CG2 4.36Å; W434-M894 HydrophobicContact CD2-CG 4.05Å; W434-M894 HydrophobicContact CG-CG 4.28Å; W434-M894 HydrophobicContact CH2-CG 4.41Å; W434-M894 HydrophobicContact CH2-SD 4.25Å; W434-M894 HydrophobicContact CZ2-CG 3.4Å; W434-M894 VanDerWaalsContact CZ2-CG 3.4Å; W434-M894 HydrophobicContact CZ2-SD 3.74Å; W434-M894 PolarHBondContact NE1-O 3.37Å; W434-I898 HydrophobicContact CH2-CD1 3.75Å; W434-I898 HydrophobicContact CZ2-CD1 3.17Å; W434-I898 HydrophobicContact CZ2-CG1 3.88Å
435	H	74.7	Confident	47.3	Very low	109 Å²	109	92.8 Å²	92.8	51%	0.505	59%	0.588	S	S	.	*	H	α-helix	trans	-61.3	-41.2	-179.8	-70.5	-69.5	0	0	0	112	S433 L437 F438 T439	S433-H435 PolarHBondContact O-N 2.69Å; H435-L437 VanDerWaalsContact C-N 3.31Å; H435-L437 PolarHBondContact O-N 2.88Å; H435-F438 PolarHBondContact O-N 2.68Å; H435-T439 PolarHBondContact O-N 2.84Å; H435-T439 PolarHBondContact O-OG1 3.19Å
436	T	78.5	Confident	47.6	Very low	75 Å²	75	98.4 Å²	98.4	46%	0.46	59%	0.594	S	S	.	*	H	α-helix	trans	-59.8	-38	177.4	-48.4	0	0	0	0	112.3	S433 W434 F438 A440	S433-T436 WeakPolarHBondContact O-CB 3.38Å; S433-T436 PolarHBondContact O-N 2.72Å; W434-T436 VanDerWaalsContact C-N 3.32Å; W434-T436 PolarHBondContact O-N 3.45Å; T436-F438 PolarHBondContact O-N 2.8Å; T436-A440 WeakPolarHBondContact O-CB 3.31Å; T436-A440 PolarHBondContact O-N 3.19Å
437	L	75.6	Confident	47.3	Very low	33 Å²	33	95.3 Å²	95.3	17%	0.173	59%	0.585	C	S	.	*	H	α-helix	trans	-65.2	-24	175.4	-66.6	-175.8	0	0	0	113.4	S433 W434 H435 V713 V716 K720 M894	S433-L437 PolarHBondContact O-N 2.79Å; W434-L437 PolarHBondContact O-N 3.31Å; H435-L437 VanDerWaalsContact C-N 3.31Å; H435-L437 PolarHBondContact O-N 2.88Å; L437-V713 HydrophobicContact CD1-CG2 4.37Å; L437-V716 HydrophobicContact CB-CG1 4.28Å; L437-V716 HydrophobicContact CD1-CG2 4.29Å; L437-K720 PolarHBondContact O-NZ 3.09Å; L437-M894 HydrophobicContact CD1-CE 3.63Å; L437-M894 HydrophobicContact CD1-SD 4Å; L437-M894 HydrophobicContact CG-CE 4.47Å
438	F	65.9	Low	47.7	Very low	17 Å²	17	95.8 Å²	95.8	8%	0.075	59%	0.585	C	S	.	*	H	α-helix	trans	-91.9	-42.3	175.9	-77.4	-90.5	0	0	0	112.8	W434 H435 T436 V716 K720 V730 Q733 M734 I737	W434-F438 AromaticContact CE3-CE2 3.96Å; W434-F438 HydrophobicContact CE3-CE2 3.96Å; W434-F438 HydrophobicContact CZ3-CE2 4.12Å; W434-F438 WeakPolarHBondContact O-CD2 3.48Å; W434-F438 PolarHBondContact O-N 3.23Å; H435-F438 PolarHBondContact O-N 2.68Å; T436-F438 PolarHBondContact O-N 2.8Å; F438-V716 HydrophobicContact CE2-CG1 4.1Å; F438-V716 HydrophobicContact CE2-CG2 4.38Å; F438-V716 HydrophobicContact CZ-CG1 4.08Å; F438-K720 PolarHBondContact O-NZ 3.35Å; F438-K720 VanDerWaalsContact O-NZ 3.13Å; F438-V730 HydrophobicContact CB-CG1 4.35Å; F438-V730 HydrophobicContact CD1-CG1 4.25Å; F438-Q733 HydrophobicContact CE1-CB 3.98Å; F438-M734 HydrophobicContact CB-SD 4.46Å; F438-M734 HydrophobicContact CD1-CG 3.81Å; F438-M734 HydrophobicContact CD2-CG 3.73Å; F438-M734 HydrophobicContact CD2-SD 4.12Å; F438-M734 HydrophobicContact CE1-CG 3.82Å; F438-M734 HydrophobicContact CE2-CG 3.75Å; F438-M734 HydrophobicContact CG-CG 3.76Å; F438-M734 HydrophobicContact CG-SD 4.15Å; F438-M734 HydrophobicContact CZ-CB 4.46Å; F438-M734 HydrophobicContact CZ-CG 3.79Å; F438-I737 HydrophobicContact CE1-CD1 4.29Å; F438-I737 HydrophobicContact CZ-CD1 3.75Å
439	T	59.2	Low	47.5	Very low	105 Å²	105	97 Å²	97	64%	0.644	59%	0.585	S	S	*	*	H	α-helix	trans	-82.5	-13.5	-177.4	59.7	0	0	0	0	115	H435 E441	H435-T439 PolarHBondContact O-N 2.84Å; H435-T439 PolarHBondContact O-OG1 3.19Å; T439-E441 VanDerWaalsContact C-N 3.27Å; T439-E441 PolarHBondContact O-N 2.85Å
440	A	50.4	Low	47.2	Very low	61 Å²	61	96 Å²	96	50%	0.504	58%	0.584	S	S	.	*			trans	-67.2	86.1	166.8	0	0	0	0	0	110.7	T436	T436-A440 WeakPolarHBondContact O-CB 3.31Å; T436-A440 PolarHBondContact O-N 3.19Å
441	E	39.3	Very low	47.2	Very low	148 Å²	148	95.7 Å²	95.7	69%	0.692	59%	0.59	S	S	*	*			trans	-68.3	152.3	162.2	-82.5	-82.6	91.7	0	0	110.6	T439 G443 R726	T439-E441 VanDerWaalsContact C-N 3.27Å; T439-E441 PolarHBondContact O-N 2.85Å; E441-G443 PolarHBondContact O-N 3.49Å; E441-R726 IonicContact OE1-NH2 2.69Å
442	E	46	Very low	46.7	Very low	154 Å²	154	95.3 Å²	95.3	72%	0.72	60%	0.601	S	S	*	*			trans	-79	58.4	-179.8	-64.3	165.6	91.3	0	0	110.6	Q444 R726	E442-Q444 PolarHBondContact O-N 3.34Å; E442-R726 IonicContact OE2-CZ 2.68Å; E442-R726 IonicContact OE2-NH1 2.74Å; E442-R726 PolarHBondContact OE2-NH1 3.23Å; E442-R726 IonicContact OE2-NH2 3.11Å; E442-R726 PolarHBondContact OE2-NH2 3.3Å; E442-R726 VanDerWaalsContact OE2-NH2 3.15Å
443	G	32.7	Very low	45.6	Very low	73 Å²	73	97.4 Å²	97.4	75%	0.753	63%	0.629	S	S	*	*			trans	-71.4	31.8	-165.1	0	0	0	0	0	117.3	E441	E441-G443 PolarHBondContact O-N 3.49Å
444	Q	36.2	Very low	43.8	Very low	176 Å²	176	99.5 Å²	99.5	82%	0.822	66%	0.657	S	S	*	*			trans	-150.4	58.5	-176.8	-153.8	117.8	40.9	0	0	115.5	E442	E442-Q444 PolarHBondContact O-N 3.34Å
445	L	35.9	Very low	41.9	Very low	162 Å²	162	103.4 Å²	103.4	85%	0.848	70%	0.698	S	S	*	*	S	Bend	trans	-162.2	83.8	144.2	-135.7	80.1	0	0	0	113
446	Y	31.8	Very low	39.8	Very low	231 Å²	231	102.4 Å²	102.4	91%	0.906	72%	0.717	S	S	*	*			trans	175.4	96.6	141.2	-115.1	-89.3	0	0	0	109.7
447	G	25.6	Very low	37.4	Very low	62 Å²	62	102.8 Å²	102.8	64%	0.639	74%	0.736	S	S	*	*			trans	-102	132.6	169	0	0	0	0	0	110.4	C449	G447-C449 PolarHBondContact O-N 2.94Å
448	P	35.3	Very low	35.3	Very low	129 Å²	129	105.4 Å²	105.4	84%	0.838	77%	0.771	S	S	*	*			trans	-81.8	117.2	179.8	31.1	-32.4	0	0	0	111.3	G450	P448-G450 PolarHBondContact O-N 3.01Å
449	C	26	Very low	33.6	Very low	136 Å²	136	108.5 Å²	108.5	92%	0.919	81%	0.807	S	S	*	*			trans	-72.5	94.4	173.8	-62.7	0	0	0	0	111.2	G447	G447-C449 PolarHBondContact O-N 2.94Å
450	G	27.3	Very low	32.3	Very low	73 Å²	73	107.7 Å²	107.7	75%	0.753	82%	0.82	S	S	*	*			trans	-66.1	142.8	161.8	0	0	0	0	0	110.8	P448	P448-G450 PolarHBondContact O-N 3.01Å
451	G	29.2	Very low	31.4	Very low	88 Å²	88	108.7 Å²	108.7	91%	0.907	84%	0.836	S	S	*	*			trans	-82.4	148.1	-169.7	0	0	0	0	0	115.2
452	G	26.1	Very low	31	Very low	86 Å²	86	106 Å²	106	89%	0.887	85%	0.848	S	S	*	*			trans	-125.3	138.3	157.4	0	0	0	0	0	108.5
453	G	28.2	Very low	30.4	Very low	84 Å²	84	102.5 Å²	102.5	87%	0.866	85%	0.853	S	S	*	*			trans	-124.2	159.5	-171.6	0	0	0	0	0	114.1
454	G	28.1	Very low	30.3	Very low	86 Å²	86	103 Å²	103	89%	0.887	86%	0.859	S	S	*	*			trans	101.4	136.9	-179.5	0	0	0	0	0	113.1
455	G	28.7	Very low	30.1	Very low	83 Å²	83	98.9 Å²	98.9	86%	0.856	86%	0.863	S	S	*	*			cis	169.9	156	-9.3	0	0	0	0	0	114.3
456	G	29.2	Very low	29.8	Very low	89 Å²	89	95 Å²	95	92%	0.918	86%	0.862	S	S	*	*			trans	94.1	150.4	169.3	0	0	0	0	0	116.2
457	G	29.6	Very low	29.6	Very low	82 Å²	82	88.2 Å²	88.2	85%	0.845	86%	0.863	S	S	*	*			trans	155	-21.2	156.7	0	0	0	0	0	122.8
458	G	29.9	Very low	29.7	Very low	88 Å²	88	89.1 Å²	89.1	91%	0.907	87%	0.873	S	S	*	*			trans	69.2	175.1	-177.8	0	0	0	0	0	115.7
459	G	30.8	Very low	29.3	Very low	82 Å²	82	87.2 Å²	87.2	85%	0.845	88%	0.876	S	S	*	*			cis	176.8	129.6	-10.4	0	0	0	0	0	114
460	G	31.3	Very low	29.4	Very low	88 Å²	88	84.8 Å²	84.8	91%	0.907	87%	0.874	S	S	*	*			trans	83	148.4	173	0	0	0	0	0	116.5
461	G	32.1	Very low	29.4	Very low	82 Å²	82	85.6 Å²	85.6	85%	0.845	88%	0.883	S	S	*	*			cis	173.7	145.4	-11	0	0	0	0	0	114.8
462	G	31.9	Very low	29.3	Very low	91 Å²	91	85 Å²	85	94%	0.938	88%	0.876	S	S	*	*			trans	83.6	148.6	169.8	0	0	0	0	0	117.3
463	G	31.6	Very low	29.5	Very low	81 Å²	81	90.7 Å²	90.7	84%	0.835	88%	0.879	S	S	*	*			cis	167.8	140.8	-11.4	0	0	0	0	0	114.4
464	G	31.5	Very low	29.5	Very low	84 Å²	84	91.2 Å²	91.2	87%	0.866	88%	0.876	S	S	*	*			trans	77.8	154.1	174.5	0	0	0	0	0	116.2
465	G	31.3	Very low	29.4	Very low	89 Å²	89	90.7 Å²	90.7	92%	0.918	87%	0.87	S	S	*	*			cis	100.4	131.9	-1.8	0	0	0	0	0	114.5
466	G	30	Very low	29.3	Very low	80 Å²	80	91.5 Å²	91.5	83%	0.825	87%	0.869	S	S	*	*			cis	163.2	129.5	-10	0	0	0	0	0	113.7
467	G	28.6	Very low	29.2	Very low	89 Å²	89	94.3 Å²	94.3	92%	0.918	87%	0.868	S	S	*	*			trans	79.4	164.3	178.2	0	0	0	0	0	115.7
468	G	28	Very low	29.3	Very low	82 Å²	82	94.9 Å²	94.9	85%	0.845	87%	0.865	S	S	*	*			cis	169.4	143	-10.5	0	0	0	0	0	114
469	G	27	Very low	30	Very low	89 Å²	89	95 Å²	95	92%	0.918	85%	0.85	S	S	*	*			trans	84.9	160.2	174.8	0	0	0	0	0	116.4
470	G	27.1	Very low	29.8	Very low	84 Å²	84	102 Å²	102	87%	0.866	85%	0.852	S	S	*	*			cis	166.6	127.1	-12.6	0	0	0	0	0	114.9
471	G	27.4	Very low	29.5	Very low	91 Å²	91	100.9 Å²	100.9	94%	0.938	84%	0.841	S	S	*	*			trans	79.8	155.4	173.2	0	0	0	0	0	116.5
472	G	27.8	Very low	29.2	Very low	74 Å²	74	107.3 Å²	107.3	76%	0.763	84%	0.841	S	S	*	*			cis	172.8	137	-11	0	0	0	0	0	113.7
473	E	30.4	Very low	28.8	Very low	206 Å²	206	108.6 Å²	108.6	96%	0.963	83%	0.831	S	S	*	*			trans	57.4	158.4	168.8	-59.2	-172	81.2	0	0	118.3
474	A	27.7	Very low	28.4	Very low	95 Å²	95	115.6 Å²	115.6	79%	0.785	83%	0.832	S	S	*	*			cis	-153.1	173.5	16.2	0	0	0	0	0	113.1
475	G	25.8	Very low	29.1	Very low	75 Å²	75	116.2 Å²	116.2	77%	0.773	82%	0.821	S	S	*	*			trans	82.5	104	164.4	0	0	0	0	0	115.8
476	A	26.9	Very low	29.2	Very low	101 Å²	101	117.5 Å²	117.5	84%	0.835	81%	0.813	S	S	*	*			cis	85.9	118.4	39	0	0	0	0	0	115.3
477	V	26.6	Very low	29	Very low	148 Å²	148	122.4 Å²	122.4	90%	0.897	81%	0.814	S	S	*	*			trans	173.6	133.9	134.5	149.9	0	0	0	0	110.8
478	A	31.9	Very low	28.8	Very low	94 Å²	94	121.4 Å²	121.4	78%	0.777	80%	0.804	S	S	*	*			trans	-153.7	148	158.6	0	0	0	0	0	107.3
479	P	44.7	Very low	28.6	Very low	90 Å²	90	126 Å²	126	58%	0.584	81%	0.808	S	S	*	*			trans	-156.2	165.3	137	37.6	-18.8	0	0	0	118.9
480	Y	26.3	Very low	28.5	Very low	228 Å²	228	126 Å²	126	89%	0.894	80%	0.799	S	S	*	*			trans	76.5	147.1	157.8	-48.2	-52.4	0	0	0	120.6
481	G	25.4	Very low	28.4	Very low	65 Å²	65	125.8 Å²	125.8	67%	0.67	80%	0.797	S	S	*	*			cis	171.3	136.7	-12.4	0	0	0	0	0	117.5
482	Y	25.2	Very low	28.3	Very low	218 Å²	218	130.1 Å²	130.1	86%	0.855	79%	0.793	S	S	*	*			trans	55.3	124.2	143.8	-80.8	-100.8	0	0	0	126.3
483	T	24	Very low	28.1	Very low	117 Å²	117	135.6 Å²	135.6	72%	0.718	80%	0.799	S	S	*	*			trans	61.9	112.8	137.7	49.7	0	0	0	0	126.9
484	R	23.4	Very low	27.8	Very low	229 Å²	229	130.3 Å²	130.3	86%	0.864	78%	0.784	S	S	*	*				43.7	151.9	99.2	-159.7	-176.4	-164.2	-160.6	5.9	121.3
485	P	45	Very low	27.5	Very low	97 Å²	97	133.3 Å²	133.3	63%	0.63	79%	0.787	S	S	*	*			cis	-112.1	-117.1	-38.5	40.3	-22	0	0	0	109.3
486	P	34.1	Very low	27.5	Very low	116 Å²	116	138 Å²	138	75%	0.753	79%	0.787	S	S	*	*			cis	-96.4	-175.2	-19.9	41.6	-34.5	0	0	0	113
487	Q	25.7	Very low	27.3	Very low	183 Å²	183	139.8 Å²	139.8	86%	0.855	79%	0.787	S	S	*	*			cis	109.8	103.1	-8.5	-164	173	-25.2	0	0	119.5
488	G	24.7	Very low	27.4	Very low	67 Å²	67	136.8 Å²	136.8	69%	0.691	78%	0.778	S	S	*	*			trans	149.2	136.2	173.4	0	0	0	0	0	109.7
489	L	24.4	Very low	27.7	Very low	178 Å²	178	137.4 Å²	137.4	93%	0.932	77%	0.774	S	S	*	*			cis	72.1	139.4	34	-59.5	176.2	0	0	0	115.1
490	A	24.1	Very low	26.7	Very low	90 Å²	90	140 Å²	140	74%	0.744	78%	0.783	S	S	*	*			cis	-173	153.8	-23.9	0	0	0	0	0	110
491	G	25.3	Very low	26.6	Very low	79 Å²	79	134.5 Å²	134.5	81%	0.814	77%	0.773	S	S	*	*			trans	71.9	177.9	172.4	0	0	0	0	0	115.2
492	Q	25.6	Very low	26.4	Very low	182 Å²	182	143.1 Å²	143.1	85%	0.85	79%	0.786	S	S	*	*			cis	-161.2	160.2	-17.2	-176.1	167.1	-12.3	0	0	107.8
493	E	22.5	Very low	26.3	Very low	190 Å²	190	142.7 Å²	142.7	89%	0.888	78%	0.784	S	S	*	*			trans	155.2	165.1	132.3	-81.1	-173.8	154.8	0	0	112.4
494	S	24	Very low	26.7	Very low	95 Å²	95	143.3 Å²	143.3	66%	0.664	79%	0.79	S	S	*	*			trans	-147.4	153.3	-159.1	55.7	0	0	0	0	111.9
495	D	23	Very low	26.7	Very low	157 Å²	157	135.7 Å²	135.7	84%	0.84	78%	0.783	S	S	*	*			trans	-150.9	165.5	151.8	-125.9	-34	0	0	0	113.6
496	F	24.2	Very low	25.7	Very low	175 Å²	175	134.8 Å²	134.8	77%	0.768	79%	0.791	S	S	*	*			trans	-91.1	174.4	-161	-69.5	-98.6	0	0	0	113.8
497	T	24	Very low	25.3	Very low	137 Å²	137	138 Å²	138	84%	0.84	80%	0.798	S	S	*	*			cis	-158.9	167.2	33.5	-41.2	0	0	0	0	112.6
498	A	27.5	Very low	25.4	Very low	86 Å²	86	135.2 Å²	135.2	71%	0.711	79%	0.793	S	S	*	*			trans	-96.4	-170.1	-179.1	0	0	0	0	0	113.1
499	P	39.3	Very low	25.4	Very low	107 Å²	107	136.8 Å²	136.8	70%	0.695	79%	0.794	S	S	*	*			cis	-147.9	179.4	48.2	44.9	-24.5	0	0	0	118.6
500	D	22.7	Very low	25.4	Very low	144 Å²	144	139.9 Å²	139.9	77%	0.77	79%	0.793	S	S	*	*			trans	62.2	162	145.4	-68.6	-22.4	0	0	0	123.8
501	V	24.1	Very low	25.5	Very low	112 Å²	112	142.3 Å²	142.3	68%	0.679	80%	0.798	S	S	*	*			cis	-167.1	142.7	-47.7	111.7	0	0	0	0	112
502	W	22	Very low	25.8	Very low	247 Å²	247	144.2 Å²	144.2	94%	0.936	80%	0.796	S	S	*	*			trans	73.8	165.6	160.1	-79.1	49.1	0	0	0	123.2
503	Y	23.3	Very low	25.8	Very low	209 Å²	209	146.4 Å²	146.4	82%	0.82	80%	0.798	S	S	*	*			trans	-101.4	158.1	-169.6	-119.5	-97	0	0	0	112.3
504	P	32.3	Very low	26.4	Very low	129 Å²	129	142.7 Å²	142.7	84%	0.838	79%	0.791	S	S	*	*				-141.5	173.3	100	38.6	-25.4	0	0	0	113.5
505	G	22.9	Very low	26.5	Very low	70 Å²	70	143.6 Å²	143.6	72%	0.722	80%	0.797	S	S	*	*			trans	-137.9	173.7	-173.5	0	0	0	0	0	115.8
506	G	23.5	Very low	27	Very low	78 Å²	78	142.4 Å²	142.4	80%	0.804	80%	0.798	S	S	*	*			trans	168.8	145.8	173.2	0	0	0	0	0	115.8
507	M	26.3	Very low	27	Very low	184 Å²	184	141 Å²	141	91%	0.906	80%	0.804	S	S	*	*			trans	66.7	104.8	161.8	-85.4	-175.8	171.5	0	0	123.3
508	V	27.1	Very low	27.3	Very low	123 Å²	123	140.3 Å²	140.3	75%	0.745	80%	0.803	S	S	*	*				65.8	123	114.9	176.2	0	0	0	0	122
509	S	24.4	Very low	27.2	Very low	101 Å²	101	142.5 Å²	142.5	71%	0.706	81%	0.808	S	S	*	*			trans	83.8	126.7	149.5	-76.9	0	0	0	0	123.7
510	R	26.4	Very low	26.5	Very low	242 Å²	242	144.3 Å²	144.3	91%	0.913	80%	0.804	S	S	*	*			trans	48.4	107	142.5	-63.6	-176.8	178.1	-176.5	-0.6	120.4
511	V	25.1	Very low	26.6	Very low	141 Å²	141	143.1 Å²	143.1	86%	0.855	81%	0.808	S	S	*	*			trans	-140.4	148.6	147.2	-179.3	0	0	0	0	109.4
512	P	32.1	Very low	26.7	Very low	119 Å²	119	143.9 Å²	143.9	77%	0.773	80%	0.804	S	S	*	*			trans	-91.8	-179.1	-176	-3.8	25.1	0	0	0	115.6
513	Y	26	Very low	26.8	Very low	228 Å²	228	140.5 Å²	140.5	89%	0.894	80%	0.801	S	S	*	*			trans	-61.7	143.6	170	-105	-100.6	0	0	0	113.5
514	P	33.5	Very low	27	Very low	113 Å²	113	133.6 Å²	133.6	73%	0.734	79%	0.793	S	S	*	*			trans	-96.5	155.8	162.5	36.6	-31.8	0	0	0	112.9
515	S	26.1	Very low	28.1	Very low	113 Å²	113	133.1 Å²	133.1	79%	0.79	79%	0.789	S	S	*	*			trans	-122.4	141.1	170.6	-59.3	0	0	0	0	110.4
516	P	34.3	Very low	28.2	Very low	133 Å²	133	141.4 Å²	141.4	86%	0.864	80%	0.799	S	S	*	*			trans	-79.1	152.9	169.5	-12.6	29.7	0	0	0	112.9
517	T	24.3	Very low	28.4	Very low	146 Å²	146	145.5 Å²	145.5	90%	0.896	80%	0.799	S	S	*	*			trans	-110.9	176	-177.7	43.5	0	0	0	0	113.5
518	C	29.2	Very low	28.5	Very low	121 Å²	121	142.5 Å²	142.5	82%	0.818	79%	0.787	S	S	*	*			trans	-133	135.1	-174.3	173.2	0	0	0	0	112.3
519	V	26.9	Very low	28.7	Very low	133 Å²	133	141.3 Å²	141.3	81%	0.806	78%	0.784	S	S	*	*			trans	-152.8	124	167.7	-173.7	0	0	0	0	104.9
520	K	25.1	Very low	28.9	Very low	144 Å²	144	146.3 Å²	146.3	63%	0.626	79%	0.789	S	S	*	*			cis	99.2	118.3	35	-167.3	-138.3	-178.8	-159.7	0	112.5	E522	K520-E522 WeakPolarHBondContact CE-OE1 3.46Å; K520-E522 WeakPolarHBondContact CE-OE2 3.43Å; K520-E522 IonicContact NZ-OE1 2.66Å; K520-E522 PolarHBondContact NZ-OE1 2.89Å; K520-E522 IonicContact NZ-OE2 2.67Å; K520-E522 PolarHBondContact NZ-OE2 2.84Å
521	S	23.8	Very low	29	Very low	120 Å²	120	140.4 Å²	140.4	84%	0.839	79%	0.785	S	S	*	*			trans	-154.6	173.4	156.2	-163.5	0	0	0	0	110.2
522	E	25.3	Very low	29	Very low	128 Å²	128	137 Å²	137	60%	0.598	78%	0.778	S	S	*	*				-155.7	167.8	-123.8	-164.2	156.4	-152.8	0	0	113.9	K520	K520-E522 WeakPolarHBondContact CE-OE1 3.46Å; K520-E522 WeakPolarHBondContact CE-OE2 3.43Å; K520-E522 IonicContact NZ-OE1 2.66Å; K520-E522 PolarHBondContact NZ-OE1 2.89Å; K520-E522 IonicContact NZ-OE2 2.67Å; K520-E522 PolarHBondContact NZ-OE2 2.84Å
523	M	24.1	Very low	30	Very low	176 Å²	176	136.8 Å²	136.8	87%	0.867	78%	0.777	S	S	*	*			trans	79.1	139.8	166.4	-116.9	62	179.8	0	0	121.8
524	G	27.5	Very low	30.2	Very low	63 Å²	63	136.9 Å²	136.9	65%	0.649	78%	0.777	S	S	*	*			trans	-115.8	-140.1	154.5	0	0	0	0	0	108.8
525	P	56.4	Low	29.9	Very low	119 Å²	119	135 Å²	135	77%	0.773	78%	0.779	S	S	*	*			cis	-128.2	-169	-14.5	43.2	-28	0	0	0	112.3
526	W	24.7	Very low	29.9	Very low	244 Å²	244	137.7 Å²	137.7	92%	0.924	78%	0.784	S	S	*	*			trans	-166	168.4	147	-93.9	106	0	0	0	110.7
527	M	28.3	Very low	29.4	Very low	164 Å²	164	137.7 Å²	137.7	81%	0.808	77%	0.774	S	S	*	*			trans	-83.8	175.6	-169.8	-64.4	172.1	150	0	0	114
528	D	29	Very low	29.6	Very low	122 Å²	122	141 Å²	141	65%	0.652	77%	0.77	S	S	*	*			cis	-149.5	-166.5	12.5	-150.8	31.1	0	0	0	109.9
529	S	29.6	Very low	29.5	Very low	97 Å²	97	142 Å²	142	68%	0.678	77%	0.767	S	S	*	*			cis	-159.9	-161	12.7	-155.8	0	0	0	0	113.8
530	Y	30.4	Very low	29.7	Very low	207 Å²	207	143.5 Å²	143.5	81%	0.812	77%	0.765	S	S	*	*			trans	-98.9	172	-171.4	-76.9	-99	0	0	0	114.1
531	S	28.4	Very low	29.8	Very low	118 Å²	118	142.5 Å²	142.5	83%	0.825	77%	0.771	S	S	*	*			cis	-155.6	164	33.2	-55.5	0	0	0	0	115.2
532	G	25.1	Very low	30	Very low	69 Å²	69	141.5 Å²	141.5	71%	0.711	77%	0.77	S	S	*	*			trans	-113	-137.9	166.1	0	0	0	0	0	112.1
533	P	51.5	Low	30.2	Very low	115 Å²	115	145.8 Å²	145.8	75%	0.747	78%	0.781	S	S	*	*			cis	-145.2	-170.4	-11	29.4	-3.1	0	0	0	116.4
534	Y	30.2	Very low	30.3	Very low	229 Å²	229	145.2 Å²	145.2	90%	0.898	78%	0.782	S	S	*	*			trans	92.5	133.6	158.5	-78.6	-74.3	0	0	0	124.7
535	G	27.6	Very low	31	Very low	75 Å²	75	150 Å²	150	77%	0.773	79%	0.787	S	S	*	*			trans	86.9	154.6	155	0	0	0	0	0	118.2
536	D	26.5	Very low	29.8	Very low	169 Å²	169	150.6 Å²	150.6	90%	0.904	79%	0.788	S	S	*	*			cis	-159.4	-167.8	-28.4	-161.9	1.5	0	0	0	109.6
537	M	24.6	Very low	30.3	Very low	132 Å²	132	146.7 Å²	146.7	65%	0.65	78%	0.784	S	S	*	*			trans	-107.5	147	-157.7	171.5	-177.3	55.8	0	0	117.2
538	R	27.8	Very low	30.9	Very low	215 Å²	215	143.9 Å²	143.9	81%	0.811	78%	0.778	S	S	*	*			trans	68.2	160.9	163.6	-82.5	169.3	162.5	150	-7.9	116.5
539	L	26.4	Very low	30.9	Very low	144 Å²	144	144.3 Å²	144.3	75%	0.754	78%	0.779	S	S	*	*			cis	-142.9	178.6	8.8	-164.5	53.3	0	0	0	112
540	E	31.6	Very low	31	Very low	163 Å²	163	146.2 Å²	146.2	76%	0.762	78%	0.781	S	S	*	*			trans	-65.3	178.3	171.6	-49.5	178.5	121.6	0	0	113.4
541	T	27.1	Very low	31.1	Very low	124 Å²	124	147.2 Å²	147.2	76%	0.761	79%	0.785	S	S	*	*			cis	-156.6	141.1	18.3	-36.5	0	0	0	0	112.2
542	A	27.1	Very low	31.3	Very low	99 Å²	99	151.4 Å²	151.4	82%	0.818	78%	0.784	S	S	*	*			trans	-159.8	106.6	156.6	0	0	0	0	0	113.6
543	R	30.2	Very low	31.4	Very low	217 Å²	217	155.6 Å²	155.6	82%	0.819	78%	0.783	S	S	*	*			trans	10.9	122.3	160.3	-67.3	175.9	172.6	159.9	-1.7	119.9
544	D	27.5	Very low	30.7	Very low	165 Å²	165	154.5 Å²	154.5	88%	0.882	78%	0.777	S	S	*	*			trans	-131.1	141.7	141.7	-115.9	-41.4	0	0	0	109.9
545	H	40.9	Very low	31.5	Very low	163 Å²	163	149.3 Å²	149.3	76%	0.755	77%	0.771	S	S	*	*			trans	-130.8	77.8	-174.5	-82.7	-69.1	0	0	0	111.9
546	V	30.8	Very low	32.6	Very low	131 Å²	131	153.4 Å²	153.4	79%	0.794	77%	0.77	S	S	*	*			trans	-143.3	120.5	161.3	-173.4	0	0	0	0	112.2
547	L	36.8	Very low	35.1	Very low	163 Å²	163	151.7 Å²	151.7	85%	0.853	75%	0.754	S	S	*	*			trans	-113	158.4	140.6	-61.4	177	0	0	0	105.1
548	P	40.8	Very low	38.2	Very low	104 Å²	104	149.2 Å²	149.2	68%	0.675	75%	0.746	S	S	*	*			cis	-149.4	-157.4	31.5	35.9	-9.9	0	0	0	115
549	I	29.2	Very low	41.4	Very low	131 Å²	131	139 Å²	139	67%	0.672	71%	0.708	S	S	*	*			trans	75.1	111.3	161.4	-57.3	156.3	0	0	0	117.2
550	D	30.1	Very low	44.4	Very low	137 Å²	137	136.3 Å²	136.3	73%	0.733	69%	0.694	S	S	*	*			trans	-149.8	0.2	142.2	-125.9	-20.9	0	0	0	114.1	Y552	D550-Y552 VanDerWaalsContact C-N 3.28Å; D550-Y552 PolarHBondContact O-N 2.79Å; D550-Y552 VanDerWaalsContact O-N 3.17Å
551	Y	32.7	Very low	47.4	Very low	229 Å²	229	128.5 Å²	128.5	90%	0.898	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	16.5	-171.1	-117.5	-88.5	0	0	0	115.6
552	Y	32.3	Very low	50.6	Low	205 Å²	205	122.8 Å²	122.8	80%	0.804	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.8	8	-167.2	-102	-76.6	0	0	0	116.4	D550 P554	D550-Y552 VanDerWaalsContact C-N 3.28Å; D550-Y552 PolarHBondContact O-N 2.79Å; D550-Y552 VanDerWaalsContact O-N 3.17Å; Y552-P554 WeakPolarHBondContact O-CD 3.37Å
553	F	27.5	Very low	53.6	Low	157 Å²	157	120.6 Å²	120.6	69%	0.689	61%	0.609	S	S	*	*			trans	-103.9	108.1	173.2	-71.2	-72	0	0	0	112
554	P	38.3	Very low	56.6	Low	93 Å²	93	111.3 Å²	111.3	60%	0.604	58%	0.576	S	S	*	*			trans	-56.4	145.5	161.1	-20.4	32.3	0	0	0	109.7	Y552 Q556	Y552-P554 WeakPolarHBondContact O-CD 3.37Å; P554-Q556 PolarHBondContact O-N 3.42Å; P554-Q556 VanDerWaalsContact O-N 3.1Å
555	P	45.6	Very low	59.7	Low	119 Å²	119	110.6 Å²	110.6	77%	0.773	57%	0.567	S	S	*	*			trans	-54.4	122.4	-179	21.6	-33.1	0	0	0	110.1	K557	P555-K557 PolarHBondContact O-N 2.97Å
556	Q	51.8	Low	62.1	Low	162 Å²	162	103.4 Å²	103.4	76%	0.757	54%	0.537	S	S	*	.			trans	-56.6	113.1	-170.3	-69.6	-173	4.1	0	0	110.1	P554 T558	P554-Q556 PolarHBondContact O-N 3.42Å; P554-Q556 VanDerWaalsContact O-N 3.1Å; Q556-T558 PolarHBondContact O-N 3.17Å; Q556-T558 VanDerWaalsContact O-N 3.11Å
557	K	77.9	Confident	64.7	Low	133 Å²	133	100.6 Å²	100.6	58%	0.578	52%	0.523	S	S	*	.			trans	-70.4	110.9	-173.7	-68.2	178.1	-178.2	173.1	0	108.4	P555 A566 L574	P555-K557 PolarHBondContact O-N 2.97Å; K557-A566 HydrophobicContact CB-CB 4.34Å; K557-A566 WeakPolarHBondContact O-CA 3.29Å; K557-A566 WeakPolarHBondContact O-CB 3.45Å; K557-A566 PolarHBondContact O-N 3.46Å; K557-L574 HydrophobicContact CB-CD1 4.3Å; K557-L574 HydrophobicContact CB-CD2 4.23Å
558	T	90.1	Very high	66.7	Low	79 Å²	79	94.2 Å²	94.2	49%	0.485	50%	0.496	S	S	.	.	B	Isolated β-bridge	trans	-93.3	149.4	-177.5	53.4	0	0	0	0	112.2	Q556 L560	Q556-T558 PolarHBondContact O-N 3.17Å; Q556-T558 VanDerWaalsContact O-N 3.11Å; T558-L560 PolarHBondContact O-N 3.48Å
559	C	93.7	Very high	68.8	Low	2 Å²	2	93.2 Å²	93.2	1%	0.014	49%	0.491	C	S	.	.			trans	-78.1	115.6	-179.4	174.9	0	0	0	0	110.7	I561 C562 G563 D564 A566 C576	C559-I561 PolarHBondContact O-N 3.28Å; C559-C562 PolarHBondContact O-N 3.42Å; C559-G563 PolarHBondContact O-N 3.31Å; C559-D564 WeakPolarHBondContact CA-O 3.04Å; C559-D564 WeakPolarHBondContact CB-O 3.22Å; C559-D564 PolarHBondContact N-O 3.12Å; C559-A566 HydrophobicContact CB-CB 4.44Å; C559-C576 HydrophobicContact CB-CB 3.93Å; C559-C576 PolarHBondContact SG-N 3.4Å
560	L	90.7	Very high	71.4	Confident	86 Å²	86	88.4 Å²	88.4	45%	0.45	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-27.8	-178.3	-58.3	176.5	0	0	0	113.4	T558 L574 K618	T558-L560 PolarHBondContact O-N 3.48Å; L560-L574 HydrophobicContact CD1-CB 4.22Å; L560-L574 HydrophobicContact CG-CB 4.27Å; L560-L574 PolarHBondContact N-O 3.45Å; L560-K618 VanDerWaalsContact O-CE 3.23Å; L560-K618 WeakPolarHBondContact O-CE 3.37Å; L560-K618 PolarHBondContact O-NZ 3.14Å
561	I	95.1	Very high	73.9	Confident	0 Å²	0	85.3 Å²	85.3	0%	0	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-38.9	178.7	-44.8	-52.9	0	0	0	112.3	C559 T575 C579 I603 R615 K618 C619 A622 M624	C559-I561 PolarHBondContact O-N 3.28Å; I561-T575 HydrophobicContact CD1-CG2 4.43Å; I561-T575 HydrophobicContact CG1-CG2 3.75Å; I561-C579 HydrophobicContact CB-CB 4.37Å; I561-C579 HydrophobicContact CG1-CB 4.16Å; I561-I603 HydrophobicContact CG2-CG2 4.18Å; I561-I603 VanDerWaalsContact O-CG2 3.3Å; I561-I603 WeakPolarHBondContact O-CG2 3.49Å; I561-R615 HydrophobicContact CG2-CG 4.15Å; I561-K618 WeakPolarHBondContact CD1-O 3.24Å; I561-K618 HydrophobicContact CG2-CG 4.5Å; I561-K618 WeakPolarHBondContact O-CD 3.41Å; I561-K618 VanDerWaalsContact O-CE 3.3Å; I561-K618 WeakPolarHBondContact O-CE 3.34Å; I561-K618 PolarHBondContact O-NZ 3.42Å; I561-C619 HydrophobicContact CD1-CB 4.43Å; I561-A622 HydrophobicContact CD1-CB 3.45Å; I561-A622 VanDerWaalsContact CD1-CB 3.45Å; I561-M624 HydrophobicContact CD1-SD 4.15Å; I561-M624 HydrophobicContact CG1-SD 4.31Å
562	C	94.3	Very high	75.9	Confident	4 Å²	4	76.2 Å²	76.2	3%	0.027	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-148.6	11.8	-163.9	69.2	0	0	0	0	117.1	C559 D564 C576 I603 D604 K605 R608	C559-C562 PolarHBondContact O-N 3.42Å; C562-D564 PolarHBondContact O-N 3.28Å; C562-C576 VanDerWaalsContact SG-SG 3.61Å; C562-I603 HydrophobicContact CB-CG2 4.08Å; C562-D604 CarbonylContact O-C 3.57Å; C562-D604 VanDerWaalsContact O-C 3.28Å; C562-D604 WeakPolarHBondContact O-CA 3.42Å; C562-K605 PolarHBondContact O-N 2.85Å; C562-R608 HydrophobicContact CB-CB 4.35Å; C562-R608 PolarHBondContact SG-NH1 3.15Å
563	G	88.4	Confident	78.1	Confident	52 Å²	52	66.5 Å²	66.5	54%	0.536	38%	0.382	S	S	.	.	S	Bend	trans	71.2	-24.7	178.3	0	0	0	0	0	116	C559	C559-G563 PolarHBondContact O-N 3.31Å
564	D	93.8	Very high	80.8	Confident	22 Å²	22	61.4 Å²	61.4	12%	0.118	36%	0.362	C	S	.	.	S	Bend	trans	-55.2	157.5	174.6	-162.8	20.3	0	0	0	113.1	C559 C562 A566 C576 K605 R608	C559-D564 WeakPolarHBondContact CA-O 3.04Å; C559-D564 WeakPolarHBondContact CB-O 3.22Å; C559-D564 PolarHBondContact N-O 3.12Å; C562-D564 PolarHBondContact O-N 3.28Å; D564-A566 PolarHBondContact O-N 3.37Å; D564-C576 HydrophobicContact CB-CB 4.23Å; D564-K605 HydrophobicContact CB-CB 4.14Å; D564-K605 HydrophobicContact CB-CD 4.18Å; D564-K605 HydrophobicContact CB-CG 4.02Å; D564-K605 WeakPolarHBondContact OD1-CD 3.48Å; D564-K605 WeakPolarHBondContact OD1-CE 3.49Å; D564-K605 IonicContact OD1-NZ 3.66Å; D564-K605 PolarHBondContact OD1-NZ 2.81Å; D564-R608 IonicContact OD2-CZ 2.81Å; D564-R608 IonicContact OD2-NH1 3.15Å; D564-R608 PolarHBondContact OD2-NH1 3.49Å; D564-R608 IonicContact OD2-NH2 3.91Å; D564-R608 PolarHBondContact OD2-NH2 3.36Å
565	E	92.9	Very high	83.4	Confident	150 Å²	150	57 Å²	57	70%	0.701	33%	0.333	S	S	*	.	B	Isolated β-bridge	trans	-58.2	129.5	-174.6	-166.4	-175.8	167.5	0	0	112.6	C576	E565-C576 VanDerWaalsContact O-CA 3.29Å; E565-C576 WeakPolarHBondContact O-CA 3.46Å; E565-C576 WeakPolarHBondContact O-CB 2.97Å
566	A	90.5	Very high	85.8	Confident	13 Å²	13	51.4 Å²	51.4	11%	0.107	30%	0.297	C	S	.	.			trans	-92.2	111.4	-174.9	0	0	0	0	0	112.4	K557 C559 D564 G568 L574	K557-A566 HydrophobicContact CB-CB 4.34Å; K557-A566 WeakPolarHBondContact O-CA 3.29Å; K557-A566 WeakPolarHBondContact O-CB 3.45Å; K557-A566 PolarHBondContact O-N 3.46Å; C559-A566 HydrophobicContact CB-CB 4.44Å; D564-A566 PolarHBondContact O-N 3.37Å; A566-G568 PolarHBondContact O-N 3.36Å; A566-L574 HydrophobicContact CB-CD1 3.64Å; A566-L574 HydrophobicContact CB-CD2 4.49Å; A566-L574 HydrophobicContact CB-CG 3.7Å
567	S	86.2	Confident	87.8	Confident	72 Å²	72	45.3 Å²	45.3	50%	0.503	28%	0.277	S	S	.	.			trans	-71.5	34.8	172.6	53.2	0	0	0	0	113.9	H570 T575 G577	S567-H570 PolarHBondContact O-CE1 3.03Å; S567-H570 PolarHBondContact O-NE2 3.45Å; S567-T575 PolarHBondContact N-O 3.3Å; S567-T575 PolarHBondContact OG-O 2.86Å; S567-G577 PolarHBondContact OG-N 2.83Å
568	G	78.8	Confident	88.6	Confident	29 Å²	29	41.2 Å²	41.2	30%	0.299	27%	0.265	S	S	.	.	S	Bend	trans	92.8	-170.8	-176.8	0	0	0	0	0	115.6	A566 H570 T575	A566-G568 PolarHBondContact O-N 3.36Å; G568-H570 PolarHBondContact O-CD2 2.9Å; G568-H570 VanDerWaalsContact O-CD2 3.28Å; G568-H570 PolarHBondContact O-NE2 3.32Å; G568-T575 PolarHBondContact O-N 3.12Å
569	C	84.2	Confident	88.9	Confident	82 Å²	82	37.4 Å²	37.4	55%	0.554	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	128.6	179	-174.2	0	0	0	0	111	G572 A573	C569-G572 VanDerWaalsContact SG-C 3.52Å; C569-A573 WeakPolarHBondContact CA-O 3.17Å
570	H	84.1	Confident	89	Confident	31 Å²	31	41.1 Å²	41.1	14%	0.144	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	134	176	-52.3	-77.6	0	0	0	109.5	S567 G568 G572 A573 T575 K580	S567-H570 PolarHBondContact O-CE1 3.03Å; S567-H570 PolarHBondContact O-NE2 3.45Å; G568-H570 PolarHBondContact O-CD2 2.9Å; G568-H570 VanDerWaalsContact O-CD2 3.28Å; G568-H570 PolarHBondContact O-NE2 3.32Å; H570-G572 PolarHBondContact O-N 2.94Å; H570-A573 PolarHBondContact N-O 2.88Å; H570-A573 PolarHBondContact O-N 3.15Å; H570-A573 VanDerWaalsContact O-N 3.09Å; H570-T575 PolarHBondContact CD2-O 2.88Å; H570-T575 PolarHBondContact CD2-OG1 3.09Å; H570-K580 HydrophobicContact CB-CB 3.98Å; H570-K580 HydrophobicContact CB-CD 4.22Å; H570-K580 HydrophobicContact CB-CG 3.85Å; H570-K580 PolarHBondContact CE1-NZ 2.95Å; H570-K580 VanDerWaalsContact CE1-NZ 3.27Å; H570-K580 VanDerWaalsContact ND1-CD 3.35Å; H570-K580 WeakPolarHBondContact ND1-CD 3.4Å; H570-K580 VanDerWaalsContact ND1-CE 3.33Å; H570-K580 WeakPolarHBondContact ND1-CE 3.49Å; H570-K580 PolarHBondContact ND1-NZ 3.07Å
571	Y	83.8	Confident	89.2	Confident	71 Å²	71	40.2 Å²	40.2	28%	0.278	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	13.9	-179.8	-56.9	-73.9	0	0	0	116	K580 F583 K584 M624 T625 L626	Y571-K580 HydrophobicContact CD2-CG 4.49Å; Y571-K580 HydrophobicContact CE2-CG 3.87Å; Y571-K580 WeakPolarHBondContact CE2-O 3.39Å; Y571-F583 HydrophobicContact CD1-CD1 4.19Å; Y571-F583 HydrophobicContact CD1-CE1 4.2Å; Y571-F583 AromaticContact CD2-CD1 3.72Å; Y571-F583 HydrophobicContact CD2-CD1 3.72Å; Y571-F583 HydrophobicContact CD2-CE1 4.46Å; Y571-F583 HydrophobicContact CE2-CD1 4.33Å; Y571-F583 AromaticContact CG-CD1 3.64Å; Y571-F583 HydrophobicContact CG-CD1 3.64Å; Y571-F583 AromaticContact CG-CE1 3.92Å; Y571-F583 HydrophobicContact CG-CE1 3.92Å; Y571-K584 HydrophobicContact CE2-CB 4.27Å; Y571-K584 WeakPolarHBondContact OH-CB 3.44Å; Y571-K584 WeakPolarHBondContact OH-CD 3.43Å; Y571-K584 WeakPolarHBondContact OH-CG 3.35Å; Y571-M624 HydrophobicContact CD2-CE 3.87Å; Y571-M624 HydrophobicContact CG-CE 4.37Å; Y571-M624 CarbonylContact O-C 3.39Å; Y571-M624 WeakPolarHBondContact O-CA 3.43Å; Y571-T625 WeakPolarHBondContact CB-O 3.49Å; Y571-T625 WeakPolarHBondContact CD1-O 3.48Å; Y571-T625 PolarHBondContact O-N 2.84Å; Y571-L626 HydrophobicContact CD1-CD2 3.92Å; Y571-L626 HydrophobicContact CE1-CD2 3.73Å
572	G	73.3	Confident	89.2	Confident	39 Å²	39	41.8 Å²	41.8	40%	0.402	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	112	-12.3	-177.5	0	0	0	0	0	114.6	C569 H570 I672	C569-G572 VanDerWaalsContact SG-C 3.52Å; H570-G572 PolarHBondContact O-N 2.94Å; G572-I672 VanDerWaalsContact O-CD1 3.24Å; G572-I672 WeakPolarHBondContact O-CD1 3.43Å
573	A	78.9	Confident	89.2	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	144.8	-175.4	0	0	0	0	0	113.9	C569 H570 T575 A622 M624	C569-A573 WeakPolarHBondContact CA-O 3.17Å; H570-A573 PolarHBondContact N-O 2.88Å; H570-A573 PolarHBondContact O-N 3.15Å; H570-A573 VanDerWaalsContact O-N 3.09Å; A573-T575 HydrophobicContact CB-CG2 4.05Å; A573-T575 PolarHBondContact O-N 3.05Å; A573-T575 VanDerWaalsContact O-N 3.17Å; A573-T575 PolarHBondContact O-OG1 3.16Å; A573-A622 HydrophobicContact CB-CB 4.26Å; A573-A622 WeakPolarHBondContact CB-O 3.39Å; A573-M624 HydrophobicContact CB-CG 3.54Å; A573-M624 HydrophobicContact CB-SD 4.35Å
574	L	85	Confident	89.4	Confident	51 Å²	51	43.5 Å²	43.5	27%	0.267	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	109.6	173.1	-179.4	64	0	0	0	110.3	K557 L560 A566	K557-L574 HydrophobicContact CB-CD1 4.3Å; K557-L574 HydrophobicContact CB-CD2 4.23Å; L560-L574 HydrophobicContact CD1-CB 4.22Å; L560-L574 HydrophobicContact CG-CB 4.27Å; L560-L574 PolarHBondContact N-O 3.45Å; A566-L574 HydrophobicContact CB-CD1 3.64Å; A566-L574 HydrophobicContact CB-CD2 4.49Å; A566-L574 HydrophobicContact CB-CG 3.7Å
575	T	92.1	Very high	89.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.282	C	S	.	.			trans	-145.5	147.9	-167.5	50.8	0	0	0	0	115.4	I561 S567 G568 H570 A573 C579 M624	I561-T575 HydrophobicContact CD1-CG2 4.43Å; I561-T575 HydrophobicContact CG1-CG2 3.75Å; S567-T575 PolarHBondContact N-O 3.3Å; S567-T575 PolarHBondContact OG-O 2.86Å; G568-T575 PolarHBondContact O-N 3.12Å; H570-T575 PolarHBondContact CD2-O 2.88Å; H570-T575 PolarHBondContact CD2-OG1 3.09Å; A573-T575 HydrophobicContact CB-CG2 4.05Å; A573-T575 PolarHBondContact O-N 3.05Å; A573-T575 VanDerWaalsContact O-N 3.17Å; A573-T575 PolarHBondContact O-OG1 3.16Å; T575-C579 HydrophobicContact CG2-CB 4.3Å; T575-M624 HydrophobicContact CG2-CE 4.12Å; T575-M624 HydrophobicContact CG2-SD 3.97Å
576	C	95.6	Very high	89.2	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.014	25%	0.251	C	S	.	.			trans	-68.5	154.6	168.4	73.6	0	0	0	0	111.4	C559 C562 D564 E565 S578 C579 K580 R608	C559-C576 HydrophobicContact CB-CB 3.93Å; C559-C576 PolarHBondContact SG-N 3.4Å; C562-C576 VanDerWaalsContact SG-SG 3.61Å; D564-C576 HydrophobicContact CB-CB 4.23Å; E565-C576 VanDerWaalsContact O-CA 3.29Å; E565-C576 WeakPolarHBondContact O-CA 3.46Å; E565-C576 WeakPolarHBondContact O-CB 2.97Å; C576-S578 PolarHBondContact O-N 3.13Å; C576-S578 VanDerWaalsContact O-N 3.1Å; C576-S578 PolarHBondContact SG-OG 2.89Å; C576-C579 PolarHBondContact O-N 2.88Å; C576-C579 PolarHBondContact SG-N 2.96Å; C576-K580 PolarHBondContact O-N 3.34Å; C576-K580 VanDerWaalsContact O-N 3.11Å; C576-R608 PolarHBondContact SG-NH1 3.03Å
577	G	94.3	Very high	88.9	Confident	34 Å²	34	44.9 Å²	44.9	35%	0.351	26%	0.256	S	S	.	.	H	α-helix	trans	-55.4	-31.4	-179.6	0	0	0	0	0	114.2	S567 K580 V581	S567-G577 PolarHBondContact OG-N 2.83Å; G577-K580 WeakPolarHBondContact O-CB 3.1Å; G577-V581 WeakPolarHBondContact O-CG2 3.3Å; G577-V581 PolarHBondContact O-N 3.26Å; G577-V581 VanDerWaalsContact O-N 3.11Å
578	S	95.3	Very high	88.7	Confident	46 Å²	46	47 Å²	47	32%	0.322	26%	0.258	S	S	.	.	H	α-helix	trans	-70.1	-33.6	176.5	92	0	0	0	0	113	C576 F582 R608 R615	C576-S578 PolarHBondContact O-N 3.13Å; C576-S578 VanDerWaalsContact O-N 3.1Å; C576-S578 PolarHBondContact SG-OG 2.89Å; S578-F582 WeakPolarHBondContact O-CB 3.24Å; S578-F582 PolarHBondContact O-N 3.3Å; S578-R608 PolarHBondContact OG-NH1 3.47Å; S578-R615 VanDerWaalsContact C-NH2 3.34Å; S578-R615 PolarHBondContact O-NH2 2.93Å; S578-R615 PolarHBondContact OG-NH2 3.1Å
579	C	96.1	Very high	88.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-76.6	-36.4	176.7	-71.9	0	0	0	0	111.9	I561 T575 C576 F583 R615	I561-C579 HydrophobicContact CB-CB 4.37Å; I561-C579 HydrophobicContact CG1-CB 4.16Å; T575-C579 HydrophobicContact CG2-CB 4.3Å; C576-C579 PolarHBondContact O-N 2.88Å; C576-C579 PolarHBondContact SG-N 2.96Å; C579-F583 VanDerWaalsContact O-CB 3.28Å; C579-F583 WeakPolarHBondContact O-CB 3.28Å; C579-F583 PolarHBondContact O-N 3.1Å; C579-R615 PolarHBondContact SG-NH2 2.73Å
580	K	94.9	Very high	87.5	Confident	79 Å²	79	53.3 Å²	53.3	34%	0.343	28%	0.277	S	S	.	.	H	α-helix	trans	-52.2	-57.3	167.6	174.4	-171.9	-167.7	150.7	0	111.6	H570 Y571 C576 G577 F583 K584	H570-K580 HydrophobicContact CB-CB 3.98Å; H570-K580 HydrophobicContact CB-CD 4.22Å; H570-K580 HydrophobicContact CB-CG 3.85Å; H570-K580 PolarHBondContact CE1-NZ 2.95Å; H570-K580 VanDerWaalsContact CE1-NZ 3.27Å; H570-K580 VanDerWaalsContact ND1-CD 3.35Å; H570-K580 WeakPolarHBondContact ND1-CD 3.4Å; H570-K580 VanDerWaalsContact ND1-CE 3.33Å; H570-K580 WeakPolarHBondContact ND1-CE 3.49Å; H570-K580 PolarHBondContact ND1-NZ 3.07Å; Y571-K580 HydrophobicContact CD2-CG 4.49Å; Y571-K580 HydrophobicContact CE2-CG 3.87Å; Y571-K580 WeakPolarHBondContact CE2-O 3.39Å; C576-K580 PolarHBondContact O-N 3.34Å; C576-K580 VanDerWaalsContact O-N 3.11Å; G577-K580 WeakPolarHBondContact O-CB 3.1Å; K580-F583 PolarHBondContact O-N 2.85Å; K580-K584 PolarHBondContact O-N 3.29Å; K580-K584 VanDerWaalsContact O-N 3.12Å
581	V	94.9	Very high	87	Confident	68 Å²	68	58.6 Å²	58.6	41%	0.412	30%	0.302	S	S	.	.	H	α-helix	trans	-70.1	-36.8	-175.6	175.9	0	0	0	0	111.7	G577 R585	G577-V581 WeakPolarHBondContact O-CG2 3.3Å; G577-V581 PolarHBondContact O-N 3.26Å; G577-V581 VanDerWaalsContact O-N 3.11Å; V581-R585 WeakPolarHBondContact O-CG 3.46Å; V581-R585 PolarHBondContact O-N 3.13Å
582	F	96.1	Very high	86.7	Confident	33 Å²	33	64.5 Å²	64.5	15%	0.145	33%	0.329	C	S	.	.	H	α-helix	trans	-59.6	-54	172.4	171.7	-97.4	0	0	0	111.3	S578 K584 R585 A586 P612 R615 L616	S578-F582 WeakPolarHBondContact O-CB 3.24Å; S578-F582 PolarHBondContact O-N 3.3Å; F582-K584 VanDerWaalsContact C-N 3.34Å; F582-K584 PolarHBondContact O-N 3.41Å; F582-R585 PolarHBondContact O-N 2.89Å; F582-A586 HydrophobicContact CD1-CB 4.49Å; F582-A586 HydrophobicContact CE1-CB 4.07Å; F582-A586 HydrophobicContact CE2-CB 4.15Å; F582-A586 HydrophobicContact CZ-CB 3.88Å; F582-A586 WeakPolarHBondContact O-CB 3.37Å; F582-A586 PolarHBondContact O-N 2.84Å; F582-P612 HydrophobicContact CE2-CB 4.17Å; F582-P612 HydrophobicContact CZ-CB 4.33Å; F582-P612 WeakPolarHBondContact CZ-O 3.33Å; F582-R615 HydrophobicContact CD1-CG 3.83Å; F582-R615 HydrophobicContact CE1-CB 3.93Å; F582-R615 HydrophobicContact CE1-CG 3.55Å; F582-R615 HydrophobicContact CZ-CB 4.03Å; F582-R615 HydrophobicContact CZ-CG 4.05Å; F582-L616 HydrophobicContact CE1-CB 4.01Å; F582-L616 HydrophobicContact CZ-CB 4.05Å
583	F	94.6	Very high	87.5	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-58.6	-45.4	-177.5	-180	-102.9	0	0	0	111.8	Y571 C579 K580 R585 A586 A587 L616 C619 Y620 M624 L626	Y571-F583 HydrophobicContact CD1-CD1 4.19Å; Y571-F583 HydrophobicContact CD1-CE1 4.2Å; Y571-F583 AromaticContact CD2-CD1 3.72Å; Y571-F583 HydrophobicContact CD2-CD1 3.72Å; Y571-F583 HydrophobicContact CD2-CE1 4.46Å; Y571-F583 HydrophobicContact CE2-CD1 4.33Å; Y571-F583 AromaticContact CG-CD1 3.64Å; Y571-F583 HydrophobicContact CG-CD1 3.64Å; Y571-F583 AromaticContact CG-CE1 3.92Å; Y571-F583 HydrophobicContact CG-CE1 3.92Å; C579-F583 VanDerWaalsContact O-CB 3.28Å; C579-F583 WeakPolarHBondContact O-CB 3.28Å; C579-F583 PolarHBondContact O-N 3.1Å; K580-F583 PolarHBondContact O-N 2.85Å; F583-R585 PolarHBondContact O-N 2.87Å; F583-A586 PolarHBondContact O-N 3.13Å; F583-A587 HydrophobicContact CD2-CB 4.42Å; F583-A587 HydrophobicContact CE1-CB 4.29Å; F583-A587 HydrophobicContact CE2-CB 3.98Å; F583-A587 HydrophobicContact CZ-CB 3.89Å; F583-A587 WeakPolarHBondContact O-CB 3.41Å; F583-A587 PolarHBondContact O-N 2.89Å; F583-L616 HydrophobicContact CD2-CD1 4.02Å; F583-L616 HydrophobicContact CE2-CD1 4.22Å; F583-C619 HydrophobicContact CD2-CB 3.52Å; F583-C619 HydrophobicContact CE2-CB 4.11Å; F583-C619 HydrophobicContact CG-CB 4.39Å; F583-Y620 AromaticContact CE2-CD1 3.83Å; F583-Y620 HydrophobicContact CE2-CD1 3.83Å; F583-Y620 AromaticContact CE2-CE1 3.54Å; F583-Y620 HydrophobicContact CE2-CE1 3.54Å; F583-Y620 HydrophobicContact CZ-CD1 4.26Å; F583-Y620 AromaticContact CZ-CE1 3.84Å; F583-Y620 HydrophobicContact CZ-CE1 3.84Å; F583-M624 HydrophobicContact CB-CE 3.56Å; F583-M624 HydrophobicContact CB-SD 4.13Å; F583-M624 HydrophobicContact CD1-CB 3.96Å; F583-M624 HydrophobicContact CD1-CE 3.9Å; F583-M624 HydrophobicContact CD2-CB 3.85Å; F583-M624 HydrophobicContact CD2-CE 4.48Å; F583-M624 HydrophobicContact CD2-SD 4.29Å; F583-M624 HydrophobicContact CE1-CB 3.78Å; F583-M624 HydrophobicContact CE2-CB 3.65Å; F583-M624 HydrophobicContact CG-CB 3.99Å; F583-M624 HydrophobicContact CG-CE 3.71Å; F583-M624 HydrophobicContact CG-SD 4.09Å; F583-M624 HydrophobicContact CZ-CB 3.62Å; F583-M624 WeakPolarHBondContact CZ-O 3.28Å; F583-L626 HydrophobicContact CD1-CD2 4.18Å; F583-L626 HydrophobicContact CE1-CD2 3.75Å; F583-L626 HydrophobicContact CE1-CG 3.99Å; F583-L626 HydrophobicContact CZ-CG 4.45Å
584	K	92	Very high	88	Confident	92 Å²	92	73.5 Å²	73.5	40%	0.4	36%	0.362	S	S	.	.	H	α-helix	trans	-51.5	-56.7	175.2	-168.5	-173.8	178	-175.1	0	111.3	Y571 K580 F582 A586 E588	Y571-K584 HydrophobicContact CE2-CB 4.27Å; Y571-K584 WeakPolarHBondContact OH-CB 3.44Å; Y571-K584 WeakPolarHBondContact OH-CD 3.43Å; Y571-K584 WeakPolarHBondContact OH-CG 3.35Å; K580-K584 PolarHBondContact O-N 3.29Å; K580-K584 VanDerWaalsContact O-N 3.12Å; F582-K584 VanDerWaalsContact C-N 3.34Å; F582-K584 PolarHBondContact O-N 3.41Å; K584-A586 VanDerWaalsContact C-N 3.32Å; K584-A586 PolarHBondContact O-N 3.06Å; K584-E588 WeakPolarHBondContact CE-OE1 3.35Å; K584-E588 WeakPolarHBondContact CE-OE2 3.4Å; K584-E588 VanDerWaalsContact CG-CD 3.48Å; K584-E588 HydrophobicContact CG-CG 4.36Å; K584-E588 VanDerWaalsContact CG-OE1 3.31Å; K584-E588 WeakPolarHBondContact CG-OE1 3.46Å; K584-E588 IonicContact NZ-OE1 3.96Å; K584-E588 VanDerWaalsContact O-CB 3.24Å; K584-E588 WeakPolarHBondContact O-CB 3.1Å; K584-E588 VanDerWaalsContact O-CG 3.26Å; K584-E588 WeakPolarHBondContact O-CG 3.12Å; K584-E588 PolarHBondContact O-N 2.91Å
585	R	92.8	Very high	88.4	Confident	182 Å²	182	72.3 Å²	72.3	69%	0.687	36%	0.358	S	S	*	.	H	α-helix	trans	-64.5	-35.3	-178.1	-67.1	175	-179.3	-175	0.6	113	V581 F582 F583 G589	V581-R585 WeakPolarHBondContact O-CG 3.46Å; V581-R585 PolarHBondContact O-N 3.13Å; F582-R585 PolarHBondContact O-N 2.89Å; F583-R585 PolarHBondContact O-N 2.87Å; R585-G589 WeakPolarHBondContact O-CA 3.47Å; R585-G589 PolarHBondContact O-N 3.28Å; R585-G589 VanDerWaalsContact O-N 3.12Å
586	A	90.3	Very high	88.3	Confident	5 Å²	5	77.8 Å²	77.8	4%	0.041	40%	0.403	C	S	.	.	H	α-helix	trans	-82.2	-25.6	-174.1	0	0	0	0	0	113.7	F582 F583 K584 Y593 L616	F582-A586 HydrophobicContact CD1-CB 4.49Å; F582-A586 HydrophobicContact CE1-CB 4.07Å; F582-A586 HydrophobicContact CE2-CB 4.15Å; F582-A586 HydrophobicContact CZ-CB 3.88Å; F582-A586 WeakPolarHBondContact O-CB 3.37Å; F582-A586 PolarHBondContact O-N 2.84Å; F583-A586 PolarHBondContact O-N 3.13Å; K584-A586 VanDerWaalsContact C-N 3.32Å; K584-A586 PolarHBondContact O-N 3.06Å; A586-Y593 HydrophobicContact CB-CE2 3.64Å; A586-L616 HydrophobicContact CB-CD1 3.82Å; A586-L616 HydrophobicContact CB-CD2 4.18Å; A586-L616 HydrophobicContact CB-CG 4.44Å
587	A	84.4	Confident	87.9	Confident	26 Å²	26	80.3 Å²	80.3	22%	0.215	42%	0.421	C	S	.	.	H	α-helix	trans	-98.7	-26.1	176.5	0	0	0	0	0	113.3	F583 Y620 L626	F583-A587 HydrophobicContact CD2-CB 4.42Å; F583-A587 HydrophobicContact CE1-CB 4.29Å; F583-A587 HydrophobicContact CE2-CB 3.98Å; F583-A587 HydrophobicContact CZ-CB 3.89Å; F583-A587 WeakPolarHBondContact O-CB 3.41Å; F583-A587 PolarHBondContact O-N 2.89Å; A587-Y620 WeakPolarHBondContact CB-OH 3.43Å; A587-L626 VanDerWaalsContact C-CD1 3.44Å; A587-L626 HydrophobicContact CB-CD1 3.48Å; A587-L626 VanDerWaalsContact CB-CD1 3.48Å; A587-L626 HydrophobicContact CB-CD2 4.45Å; A587-L626 HydrophobicContact CB-CG 3.88Å
588	E	81.5	Confident	87.7	Confident	118 Å²	118	89.2 Å²	89.2	55%	0.551	44%	0.444	S	S	*	.	H	α-helix	trans	-79.6	-22.9	169	-66.7	175.5	176.4	0	0	112.1	K584 L626	K584-E588 WeakPolarHBondContact CE-OE1 3.35Å; K584-E588 WeakPolarHBondContact CE-OE2 3.4Å; K584-E588 VanDerWaalsContact CG-CD 3.48Å; K584-E588 HydrophobicContact CG-CG 4.36Å; K584-E588 VanDerWaalsContact CG-OE1 3.31Å; K584-E588 WeakPolarHBondContact CG-OE1 3.46Å; K584-E588 IonicContact NZ-OE1 3.96Å; K584-E588 VanDerWaalsContact O-CB 3.24Å; K584-E588 WeakPolarHBondContact O-CB 3.1Å; K584-E588 VanDerWaalsContact O-CG 3.26Å; K584-E588 WeakPolarHBondContact O-CG 3.12Å; K584-E588 PolarHBondContact O-N 2.91Å; E588-L626 HydrophobicContact CB-CD1 4.42Å; E588-L626 HydrophobicContact CG-CD1 3.58Å; E588-L626 HydrophobicContact CG-CD2 4.42Å
589	G	73.9	Confident	87.2	Confident	33 Å²	33	91.2 Å²	91.2	34%	0.34	45%	0.451	S	S	.	.	S	Bend	trans	-84.6	141.7	-175	0	0	0	0	0	114	R585 Q591	R585-G589 WeakPolarHBondContact O-CA 3.47Å; R585-G589 PolarHBondContact O-N 3.28Å; R585-G589 VanDerWaalsContact O-N 3.12Å; G589-Q591 PolarHBondContact O-N 3.21Å
590	K	63.6	Low	86.8	Confident	210 Å²	210	95.8 Å²	95.8	91%	0.913	48%	0.475	S	S	*	.			trans	-72.8	10.7	172.8	-61.7	-176.3	-180	179.9	0	114.2	K592	K590-K592 PolarHBondContact O-N 3.04Å
591	Q	73.8	Confident	86.7	Confident	142 Å²	142	93.9 Å²	93.9	66%	0.664	47%	0.472	S	S	*	.			trans	-84.4	115.4	-171.6	-65.9	-64.3	-6.1	0	0	111.2	G589 Y593	G589-Q591 PolarHBondContact O-N 3.21Å; Q591-Y593 HydrophobicContact CB-CE2 4.44Å; Q591-Y593 WeakPolarHBondContact O-CD2 3.48Å; Q591-Y593 PolarHBondContact O-N 3.25Å
592	K	77.8	Confident	86.5	Confident	194 Å²	194	94.8 Å²	94.8	84%	0.843	48%	0.477	S	S	*	.			trans	-81.3	99	177.8	-66.8	-175.8	-179.7	-178.9	0	110.3	K590 L594	K590-K592 PolarHBondContact O-N 3.04Å; K592-L594 PolarHBondContact O-N 2.85Å
593	Y	89.5	Confident	86.4	Confident	74 Å²	74	93.8 Å²	93.8	29%	0.29	47%	0.473	S	S	.	.			trans	-75.5	110.7	175.8	-57.1	-74.7	0	0	0	111.4	A586 Q591 P612 S613 L616	A586-Y593 HydrophobicContact CB-CE2 3.64Å; Q591-Y593 HydrophobicContact CB-CE2 4.44Å; Q591-Y593 WeakPolarHBondContact O-CD2 3.48Å; Q591-Y593 PolarHBondContact O-N 3.25Å; Y593-P612 HydrophobicContact CD1-CB 3.42Å; Y593-P612 VanDerWaalsContact CD1-CB 3.42Å; Y593-P612 HydrophobicContact CD1-CG 4.3Å; Y593-P612 HydrophobicContact CE1-CB 3.82Å; Y593-P612 HydrophobicContact CG-CB 3.94Å; Y593-S613 WeakPolarHBondContact O-CB 3.43Å; Y593-S613 PolarHBondContact O-OG 2.86Å; Y593-L616 HydrophobicContact CD2-CD2 3.76Å; Y593-L616 HydrophobicContact CE2-CD2 4.16Å
594	L	90.3	Very high	86.3	Confident	155 Å²	155	95.6 Å²	95.6	81%	0.812	48%	0.483	S	S	*	.			trans	-87.8	151.6	168.7	-59.6	178.3	0	0	0	110.4	K592 S613	K592-L594 PolarHBondContact O-N 2.85Å; L594-S613 VanDerWaalsContact C-CB 3.46Å; L594-S613 WeakPolarHBondContact O-CB 3.36Å
595	C	93	Very high	86.3	Confident	25 Å²	25	96 Å²	96	17%	0.169	49%	0.485	C	S	.	.			trans	-91	144.8	169.5	-168	0	0	0	0	110.1	S597 N599 C601 C611	C595-S597 PolarHBondContact SG-N 3.03Å; C595-S597 PolarHBondContact SG-OG 3.21Å; C595-S597 VanDerWaalsContact SG-OG 3.36Å; C595-N599 HydrophobicContact CB-CB 4.46Å; C595-N599 WeakPolarHBondContact CB-OD1 3.41Å; C595-C601 PolarHBondContact SG-SG 2.96Å; C595-C611 PolarHBondContact SG-SG 3Å
596	A	89.4	Confident	86.3	Confident	115 Å²	115	95.2 Å²	95.2	95%	0.95	49%	0.486	S	S	*	.	S	Bend	trans	-85.6	-6.9	171.3	0	0	0	0	0	113.4
597	S	88.4	Confident	86.3	Confident	55 Å²	55	100.3 Å²	100.3	39%	0.385	51%	0.505	S	S	.	.	S	Bend	trans	-123	-162.7	174.5	75.5	0	0	0	0	110.9	C595 N599 D600 C601	C595-S597 PolarHBondContact SG-N 3.03Å; C595-S597 PolarHBondContact SG-OG 3.21Å; C595-S597 VanDerWaalsContact SG-OG 3.36Å; S597-N599 PolarHBondContact O-N 2.74Å; S597-D600 WeakPolarHBondContact CB-OD1 3.18Å; S597-D600 PolarHBondContact OG-OD1 2.78Å; S597-C601 PolarHBondContact OG-SG 3.42Å
598	R	88.2	Confident	86.7	Confident	221 Å²	221	100.8 Å²	100.8	83%	0.834	50%	0.501	S	S	*	.	S	Bend	trans	-76.3	35.7	-175.8	-57.9	176.2	173.8	179.9	-2.9	113.7	D600	R598-D600 HydrophobicContact CB-CB 4.5Å; R598-D600 PolarHBondContact N-OD1 3.4Å; R598-D600 VanDerWaalsContact N-OD1 3.13Å; R598-D600 PolarHBondContact O-N 2.72Å
599	N	85.8	Confident	87.2	Confident	88 Å²	88	103.8 Å²	103.8	47%	0.471	51%	0.512	S	S	.	.	S	Bend	trans	55.9	23.9	-172.8	-61.4	-68.3	0	0	0	114.7	C595 S597 C614 R617	C595-N599 HydrophobicContact CB-CB 4.46Å; C595-N599 WeakPolarHBondContact CB-OD1 3.41Å; S597-N599 PolarHBondContact O-N 2.74Å; N599-C614 PolarHBondContact O-SG 3.39Å; N599-R617 VanDerWaalsContact O-CZ 3.3Å; N599-R617 PolarHBondContact O-NE 3.2Å; N599-R617 VanDerWaalsContact O-NE 3.13Å; N599-R617 PolarHBondContact O-NH2 2.78Å
600	D	88.6	Confident	88.1	Confident	97 Å²	97	108.1 Å²	108.1	52%	0.519	53%	0.528	S	S	.	.			trans	-111.3	-2.7	-164.6	56.3	-15.3	0	0	0	115	S597 R598 T602	S597-D600 WeakPolarHBondContact CB-OD1 3.18Å; S597-D600 PolarHBondContact OG-OD1 2.78Å; R598-D600 HydrophobicContact CB-CB 4.5Å; R598-D600 PolarHBondContact N-OD1 3.4Å; R598-D600 VanDerWaalsContact N-OD1 3.13Å; R598-D600 PolarHBondContact O-N 2.72Å; D600-T602 PolarHBondContact O-N 3.11Å
601	C	91.4	Very high	89.6	Confident	39 Å²	39	98.5 Å²	98.5	26%	0.264	49%	0.486	S	S	.	.			trans	-52.9	129.7	-172.4	-44.1	0	0	0	0	114.5	C595 S597 C611 C614	C595-C601 PolarHBondContact SG-SG 2.96Å; S597-C601 PolarHBondContact OG-SG 3.42Å; C601-C611 HydrophobicContact CB-CB 3.81Å; C601-C611 WeakPolarHBondContact SG-CB 3.47Å; C601-C614 HydrophobicContact CB-CB 3.97Å; C601-C614 VanDerWaalsContact SG-SG 3.62Å
602	T	90.5	Very high	90.6	Very high	86 Å²	86	93.9 Å²	93.9	53%	0.528	47%	0.469	S	S	.	.			trans	-63.2	132.8	172.1	-33.2	0	0	0	0	111.5	D600	D600-T602 PolarHBondContact O-N 3.11Å
603	I	94.6	Very high	91.4	Very high	12 Å²	12	85.6 Å²	85.6	6%	0.062	44%	0.435	C	S	.	.			trans	-113.9	112.1	-179.5	-52.9	-60.1	0	0	0	110	I561 C562 R608 C614 R615 K618	I561-I603 HydrophobicContact CG2-CG2 4.18Å; I561-I603 VanDerWaalsContact O-CG2 3.3Å; I561-I603 WeakPolarHBondContact O-CG2 3.49Å; C562-I603 HydrophobicContact CB-CG2 4.08Å; I603-R608 HydrophobicContact CG2-CB 3.85Å; I603-C614 HydrophobicContact CD1-CB 4.02Å; I603-C614 HydrophobicContact CG1-CB 4.43Å; I603-R615 HydrophobicContact CD1-CB 4.07Å; I603-R615 HydrophobicContact CG1-CB 4.48Å; I603-R615 HydrophobicContact CG2-CB 4.47Å; I603-R615 HydrophobicContact CG2-CG 4.19Å; I603-K618 HydrophobicContact CB-CD 4.14Å; I603-K618 HydrophobicContact CG1-CD 4.35Å
604	D	93.4	Very high	91.6	Very high	38 Å²	38	82.1 Å²	82.1	20%	0.203	42%	0.422	C	S	.	.			trans	-134.1	-177.7	175.4	64.1	48.5	0	0	0	111.9	C562 F606 R607 R608	C562-D604 CarbonylContact O-C 3.57Å; C562-D604 VanDerWaalsContact O-C 3.28Å; C562-D604 WeakPolarHBondContact O-CA 3.42Å; D604-F606 PolarHBondContact O-N 2.95Å; D604-F606 VanDerWaalsContact O-N 3.09Å; D604-F606 WeakPolarHBondContact OD1-CA 3.37Å; D604-F606 PolarHBondContact OD1-N 3.36Å; D604-R607 PolarHBondContact OD1-N 2.84Å; D604-R607 IonicContact OD2-CZ 2.68Å; D604-R607 IonicContact OD2-NE 3.38Å; D604-R607 PolarHBondContact OD2-NE 3Å; D604-R607 IonicContact OD2-NH2 3.75Å; D604-R607 PolarHBondContact OD2-NH2 2.79Å; D604-R608 WeakPolarHBondContact O-CB 3.41Å; D604-R608 WeakPolarHBondContact O-CD 2.93Å; D604-R608 WeakPolarHBondContact O-CG 3.18Å; D604-R608 PolarHBondContact O-N 3.3Å
605	K	92.2	Very high	91.9	Very high	102 Å²	102	75.5 Å²	75.5	44%	0.443	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-31.5	-177.3	-175	168.9	-177	146.6	0	113.7	C562 D564 R608	C562-K605 PolarHBondContact O-N 2.85Å; D564-K605 HydrophobicContact CB-CB 4.14Å; D564-K605 HydrophobicContact CB-CD 4.18Å; D564-K605 HydrophobicContact CB-CG 4.02Å; D564-K605 WeakPolarHBondContact OD1-CD 3.48Å; D564-K605 WeakPolarHBondContact OD1-CE 3.49Å; D564-K605 IonicContact OD1-NZ 3.66Å; D564-K605 PolarHBondContact OD1-NZ 2.81Å; K605-R608 PolarHBondContact O-NE 2.96Å; K605-R608 PolarHBondContact O-NH2 3.2Å
606	F	92	Very high	91.9	Very high	164 Å²	164	75.3 Å²	75.3	72%	0.719	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-52.5	-177.4	-53.8	-80.6	0	0	0	111.1	D604 R608	D604-F606 PolarHBondContact O-N 2.95Å; D604-F606 VanDerWaalsContact O-N 3.09Å; D604-F606 WeakPolarHBondContact OD1-CA 3.37Å; D604-F606 PolarHBondContact OD1-N 3.36Å; F606-R608 VanDerWaalsContact C-N 3.31Å; F606-R608 PolarHBondContact O-N 3.2Å
607	R	90.4	Very high	92	Very high	112 Å²	112	74.1 Å²	74.1	42%	0.423	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-75.7	-8.8	-174.9	-68.3	-175.9	-70.1	173.7	-1.9	114.9	D604 K609 N610	D604-R607 PolarHBondContact OD1-N 2.84Å; D604-R607 IonicContact OD2-CZ 2.68Å; D604-R607 IonicContact OD2-NE 3.38Å; D604-R607 PolarHBondContact OD2-NE 3Å; D604-R607 IonicContact OD2-NH2 3.75Å; D604-R607 PolarHBondContact OD2-NH2 2.79Å; R607-K609 PolarHBondContact O-N 3.13Å; R607-N610 WeakPolarHBondContact O-CB 3.48Å; R607-N610 PolarHBondContact O-N 3.34Å; R607-N610 PolarHBondContact O-OD1 2.57Å
608	R	92.9	Very high	92.2	Very high	36 Å²	36	74.6 Å²	74.6	14%	0.136	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-60.5	-1.6	173.3	65	-172.9	173.2	177.6	-4.2	116	C562 D564 C576 S578 I603 D604 K605 F606 R615	C562-R608 HydrophobicContact CB-CB 4.35Å; C562-R608 PolarHBondContact SG-NH1 3.15Å; D564-R608 IonicContact OD2-CZ 2.81Å; D564-R608 IonicContact OD2-NH1 3.15Å; D564-R608 PolarHBondContact OD2-NH1 3.49Å; D564-R608 IonicContact OD2-NH2 3.91Å; D564-R608 PolarHBondContact OD2-NH2 3.36Å; C576-R608 PolarHBondContact SG-NH1 3.03Å; S578-R608 PolarHBondContact OG-NH1 3.47Å; I603-R608 HydrophobicContact CG2-CB 3.85Å; D604-R608 WeakPolarHBondContact O-CB 3.41Å; D604-R608 WeakPolarHBondContact O-CD 2.93Å; D604-R608 WeakPolarHBondContact O-CG 3.18Å; D604-R608 PolarHBondContact O-N 3.3Å; K605-R608 PolarHBondContact O-NE 2.96Å; K605-R608 PolarHBondContact O-NH2 3.2Å; F606-R608 VanDerWaalsContact C-N 3.31Å; F606-R608 PolarHBondContact O-N 3.2Å; R608-R615 VanDerWaalsContact O-CD 3.28Å; R608-R615 WeakPolarHBondContact O-CD 3.36Å; R608-R615 PolarHBondContact O-NH1 2.69Å
609	K	92.3	Very high	92.3	Very high	182 Å²	182	64.1 Å²	64.1	79%	0.791	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-93.4	-26.3	167.9	-68.1	-178.2	179	178.1	0	112.6	R607	R607-K609 PolarHBondContact O-N 3.13Å
610	N	93.1	Very high	92.4	Very high	124 Å²	124	65.7 Å²	65.7	66%	0.663	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-34.7	-165	-57.4	30.9	0	0	0	112.9	R607	R607-N610 WeakPolarHBondContact O-CB 3.48Å; R607-N610 PolarHBondContact O-N 3.34Å; R607-N610 PolarHBondContact O-OD1 2.57Å
611	C	95.3	Very high	92.2	Very high	7 Å²	7	66.8 Å²	66.8	5%	0.047	31%	0.312	C	S	.	.			trans	-134.1	96.8	174.7	-171.7	0	0	0	0	112.1	C595 C601 S613 C614 R615	C595-C611 PolarHBondContact SG-SG 3Å; C601-C611 HydrophobicContact CB-CB 3.81Å; C601-C611 WeakPolarHBondContact SG-CB 3.47Å; C611-S613 VanDerWaalsContact C-N 3.25Å; C611-S613 PolarHBondContact O-N 3.28Å; C611-C614 HydrophobicContact CB-CB 4.18Å; C611-C614 PolarHBondContact SG-N 3.42Å; C611-C614 VanDerWaalsContact SG-N 3.36Å; C611-C614 PolarHBondContact SG-SG 3.04Å; C611-R615 WeakPolarHBondContact O-CB 3.3Å; C611-R615 PolarHBondContact O-N 3.02Å; C611-R615 VanDerWaalsContact O-N 3.12Å
612	P	93.4	Very high	91.7	Very high	46 Å²	46	66 Å²	66	30%	0.299	31%	0.308	S	S	.	.	H	α-helix	trans	-58.2	-33.9	171.2	-27.4	36.9	0	0	0	113.6	F582 Y593 R615 L616	F582-P612 HydrophobicContact CE2-CB 4.17Å; F582-P612 HydrophobicContact CZ-CB 4.33Å; F582-P612 WeakPolarHBondContact CZ-O 3.33Å; Y593-P612 HydrophobicContact CD1-CB 3.42Å; Y593-P612 VanDerWaalsContact CD1-CB 3.42Å; Y593-P612 HydrophobicContact CD1-CG 4.3Å; Y593-P612 HydrophobicContact CE1-CB 3.82Å; Y593-P612 HydrophobicContact CG-CB 3.94Å; P612-R615 PolarHBondContact O-N 3.48Å; P612-L616 WeakPolarHBondContact O-CB 3.23Å; P612-L616 PolarHBondContact O-N 3.13Å
613	S	94.1	Very high	91	Very high	19 Å²	19	63.9 Å²	63.9	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-56.2	-179.1	-172.2	0	0	0	0	111.8	Y593 L594 C611 R615 L616 R617	Y593-S613 WeakPolarHBondContact O-CB 3.43Å; Y593-S613 PolarHBondContact O-OG 2.86Å; L594-S613 VanDerWaalsContact C-CB 3.46Å; L594-S613 WeakPolarHBondContact O-CB 3.36Å; C611-S613 VanDerWaalsContact C-N 3.25Å; C611-S613 PolarHBondContact O-N 3.28Å; S613-R615 VanDerWaalsContact C-N 3.25Å; S613-R615 PolarHBondContact O-N 3.32Å; S613-L616 PolarHBondContact O-N 2.86Å; S613-L616 VanDerWaalsContact O-N 3.16Å; S613-R617 WeakPolarHBondContact O-CB 3.33Å; S613-R617 PolarHBondContact O-N 3.39Å
614	C	94.7	Very high	90.5	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.007	30%	0.301	C	S	.	.	H	α-helix	trans	-61.1	-32.9	175	-62.4	0	0	0	0	112.7	N599 C601 I603 C611 K618	N599-C614 PolarHBondContact O-SG 3.39Å; C601-C614 HydrophobicContact CB-CB 3.97Å; C601-C614 VanDerWaalsContact SG-SG 3.62Å; I603-C614 HydrophobicContact CD1-CB 4.02Å; I603-C614 HydrophobicContact CG1-CB 4.43Å; C611-C614 HydrophobicContact CB-CB 4.18Å; C611-C614 PolarHBondContact SG-N 3.42Å; C611-C614 VanDerWaalsContact SG-N 3.36Å; C611-C614 PolarHBondContact SG-SG 3.04Å; C614-K618 VanDerWaalsContact O-CB 3.31Å; C614-K618 WeakPolarHBondContact O-CB 3.36Å; C614-K618 PolarHBondContact O-N 3.07Å
615	R	96.2	Very high	90	Very high	16 Å²	16	65.4 Å²	65.4	6%	0.06	32%	0.315	C	S	.	.	H	α-helix	trans	-66.8	-44.5	174.3	-172	179	-177.4	174.4	-2.4	112.4	I561 S578 C579 F582 I603 R608 C611 P612 S613 K618 C619	I561-R615 HydrophobicContact CG2-CG 4.15Å; S578-R615 VanDerWaalsContact C-NH2 3.34Å; S578-R615 PolarHBondContact O-NH2 2.93Å; S578-R615 PolarHBondContact OG-NH2 3.1Å; C579-R615 PolarHBondContact SG-NH2 2.73Å; F582-R615 HydrophobicContact CD1-CG 3.83Å; F582-R615 HydrophobicContact CE1-CB 3.93Å; F582-R615 HydrophobicContact CE1-CG 3.55Å; F582-R615 HydrophobicContact CZ-CB 4.03Å; F582-R615 HydrophobicContact CZ-CG 4.05Å; I603-R615 HydrophobicContact CD1-CB 4.07Å; I603-R615 HydrophobicContact CG1-CB 4.48Å; I603-R615 HydrophobicContact CG2-CB 4.47Å; I603-R615 HydrophobicContact CG2-CG 4.19Å; R608-R615 VanDerWaalsContact O-CD 3.28Å; R608-R615 WeakPolarHBondContact O-CD 3.36Å; R608-R615 PolarHBondContact O-NH1 2.69Å; C611-R615 WeakPolarHBondContact O-CB 3.3Å; C611-R615 PolarHBondContact O-N 3.02Å; C611-R615 VanDerWaalsContact O-N 3.12Å; P612-R615 PolarHBondContact O-N 3.48Å; S613-R615 VanDerWaalsContact C-N 3.25Å; S613-R615 PolarHBondContact O-N 3.32Å; R615-K618 PolarHBondContact O-N 2.8Å; R615-C619 PolarHBondContact O-N 2.94Å; R615-C619 PolarHBondContact O-SG 3.49Å
616	L	94.3	Very high	89.4	Confident	22 Å²	22	64 Å²	64	12%	0.115	31%	0.312	C	S	.	.	H	α-helix	trans	-67.7	-42.1	177.4	179.5	59.9	0	0	0	111.2	F582 F583 A586 Y593 P612 S613 K618 C619 Y620	F582-L616 HydrophobicContact CE1-CB 4.01Å; F582-L616 HydrophobicContact CZ-CB 4.05Å; F583-L616 HydrophobicContact CD2-CD1 4.02Å; F583-L616 HydrophobicContact CE2-CD1 4.22Å; A586-L616 HydrophobicContact CB-CD1 3.82Å; A586-L616 HydrophobicContact CB-CD2 4.18Å; A586-L616 HydrophobicContact CB-CG 4.44Å; Y593-L616 HydrophobicContact CD2-CD2 3.76Å; Y593-L616 HydrophobicContact CE2-CD2 4.16Å; P612-L616 WeakPolarHBondContact O-CB 3.23Å; P612-L616 PolarHBondContact O-N 3.13Å; S613-L616 PolarHBondContact O-N 2.86Å; S613-L616 VanDerWaalsContact O-N 3.16Å; L616-K618 VanDerWaalsContact C-N 3.34Å; L616-K618 PolarHBondContact O-N 3.35Å; L616-C619 WeakPolarHBondContact O-CB 3.43Å; L616-C619 PolarHBondContact O-N 3.21Å; L616-C619 VanDerWaalsContact O-N 3.12Å; L616-Y620 HydrophobicContact CD1-CD2 4.14Å; L616-Y620 HydrophobicContact CD1-CE2 3.57Å; L616-Y620 HydrophobicContact CD2-CE2 4.01Å; L616-Y620 HydrophobicContact CG-CD2 4.03Å; L616-Y620 HydrophobicContact CG-CE2 3.54Å; L616-Y620 WeakPolarHBondContact O-CD2 3.35Å; L616-Y620 PolarHBondContact O-N 3.33Å
617	R	91.1	Very high	87.6	Confident	89 Å²	89	58.5 Å²	58.5	34%	0.336	30%	0.301	S	S	.	.	H	α-helix	trans	-53	-51.8	170.9	-177.1	-179.4	56.4	64.2	-1.3	110.6	N599 S613 C619 Y620 E621	N599-R617 VanDerWaalsContact O-CZ 3.3Å; N599-R617 PolarHBondContact O-NE 3.2Å; N599-R617 VanDerWaalsContact O-NE 3.13Å; N599-R617 PolarHBondContact O-NH2 2.78Å; S613-R617 WeakPolarHBondContact O-CB 3.33Å; S613-R617 PolarHBondContact O-N 3.39Å; R617-C619 VanDerWaalsContact C-N 3.29Å; R617-C619 PolarHBondContact O-N 3.03Å; R617-Y620 PolarHBondContact O-N 3.01Å; R617-Y620 VanDerWaalsContact O-N 3.1Å; R617-E621 WeakPolarHBondContact CD-OE1 3.13Å; R617-E621 VanDerWaalsContact CG-OE1 3.23Å; R617-E621 WeakPolarHBondContact CG-OE1 3.38Å; R617-E621 IonicContact CZ-OE1 3.77Å; R617-E621 IonicContact NE-OE1 3.15Å; R617-E621 IonicContact NH1-OE1 2.72Å; R617-E621 PolarHBondContact NH1-OE1 3.48Å; R617-E621 IonicContact NH1-OE2 3.51Å; R617-E621 PolarHBondContact NH1-OE2 3.21Å; R617-E621 WeakPolarHBondContact O-CG 3.3Å; R617-E621 PolarHBondContact O-N 2.99Å
618	K	92.1	Very high	85.4	Confident	66 Å²	66	57.8 Å²	57.8	29%	0.287	32%	0.319	S	S	.	.	H	α-helix	trans	-63.9	-28.8	177.5	-165.9	174	178.5	-167.7	0	113.8	L560 I561 I603 C614 R615 L616 E621 A622	L560-K618 VanDerWaalsContact O-CE 3.23Å; L560-K618 WeakPolarHBondContact O-CE 3.37Å; L560-K618 PolarHBondContact O-NZ 3.14Å; I561-K618 WeakPolarHBondContact CD1-O 3.24Å; I561-K618 HydrophobicContact CG2-CG 4.5Å; I561-K618 WeakPolarHBondContact O-CD 3.41Å; I561-K618 VanDerWaalsContact O-CE 3.3Å; I561-K618 WeakPolarHBondContact O-CE 3.34Å; I561-K618 PolarHBondContact O-NZ 3.42Å; I603-K618 HydrophobicContact CB-CD 4.14Å; I603-K618 HydrophobicContact CG1-CD 4.35Å; C614-K618 VanDerWaalsContact O-CB 3.31Å; C614-K618 WeakPolarHBondContact O-CB 3.36Å; C614-K618 PolarHBondContact O-N 3.07Å; R615-K618 PolarHBondContact O-N 2.8Å; L616-K618 VanDerWaalsContact C-N 3.34Å; L616-K618 PolarHBondContact O-N 3.35Å; K618-E621 WeakPolarHBondContact CA-OE2 3.31Å; K618-A622 WeakPolarHBondContact O-CB 3.23Å; K618-A622 PolarHBondContact O-N 3.3Å
619	C	90.6	Very high	83	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-65.9	-43.8	170.4	-73.3	0	0	0	0	112.5	I561 F583 R615 L616 R617 A622 G623 M624	I561-C619 HydrophobicContact CD1-CB 4.43Å; F583-C619 HydrophobicContact CD2-CB 3.52Å; F583-C619 HydrophobicContact CE2-CB 4.11Å; F583-C619 HydrophobicContact CG-CB 4.39Å; R615-C619 PolarHBondContact O-N 2.94Å; R615-C619 PolarHBondContact O-SG 3.49Å; L616-C619 WeakPolarHBondContact O-CB 3.43Å; L616-C619 PolarHBondContact O-N 3.21Å; L616-C619 VanDerWaalsContact O-N 3.12Å; R617-C619 VanDerWaalsContact C-N 3.29Å; R617-C619 PolarHBondContact O-N 3.03Å; C619-A622 PolarHBondContact O-N 2.88Å; C619-G623 PolarHBondContact O-N 3.3Å; C619-M624 HydrophobicContact CB-CB 4.38Å; C619-M624 HydrophobicContact CB-CG 4.36Å; C619-M624 HydrophobicContact CB-SD 3.66Å; C619-M624 VanDerWaalsContact O-CB 3.24Å; C619-M624 WeakPolarHBondContact O-CB 3.42Å; C619-M624 VanDerWaalsContact O-CG 3.3Å; C619-M624 WeakPolarHBondContact O-CG 3.25Å; C619-M624 PolarHBondContact O-N 2.93Å; C619-M624 VanDerWaalsContact SG-SD 3.63Å
620	Y	88.4	Confident	80.4	Confident	121 Å²	121	68.3 Å²	68.3	48%	0.475	36%	0.36	S	S	.	.	H	α-helix	trans	-68.8	-38.8	175.7	-68	-55.7	0	0	0	112.3	F583 A587 L616 R617 A622 G623	F583-Y620 AromaticContact CE2-CD1 3.83Å; F583-Y620 HydrophobicContact CE2-CD1 3.83Å; F583-Y620 AromaticContact CE2-CE1 3.54Å; F583-Y620 HydrophobicContact CE2-CE1 3.54Å; F583-Y620 HydrophobicContact CZ-CD1 4.26Å; F583-Y620 AromaticContact CZ-CE1 3.84Å; F583-Y620 HydrophobicContact CZ-CE1 3.84Å; A587-Y620 WeakPolarHBondContact CB-OH 3.43Å; L616-Y620 HydrophobicContact CD1-CD2 4.14Å; L616-Y620 HydrophobicContact CD1-CE2 3.57Å; L616-Y620 HydrophobicContact CD2-CE2 4.01Å; L616-Y620 HydrophobicContact CG-CD2 4.03Å; L616-Y620 HydrophobicContact CG-CE2 3.54Å; L616-Y620 WeakPolarHBondContact O-CD2 3.35Å; L616-Y620 PolarHBondContact O-N 3.33Å; R617-Y620 PolarHBondContact O-N 3.01Å; R617-Y620 VanDerWaalsContact O-N 3.1Å; Y620-A622 VanDerWaalsContact C-N 3.28Å; Y620-A622 PolarHBondContact O-N 3.47Å; Y620-G623 WeakPolarHBondContact O-CA 3.48Å; Y620-G623 PolarHBondContact O-N 2.93Å
621	E	84.3	Confident	77.6	Confident	121 Å²	121	70.5 Å²	70.5	57%	0.565	37%	0.37	S	S	*	.	H	α-helix	trans	-61.9	-34.4	174.1	-71.1	163.6	175.8	0	0	112.5	R617 K618 G623	R617-E621 WeakPolarHBondContact CD-OE1 3.13Å; R617-E621 VanDerWaalsContact CG-OE1 3.23Å; R617-E621 WeakPolarHBondContact CG-OE1 3.38Å; R617-E621 IonicContact CZ-OE1 3.77Å; R617-E621 IonicContact NE-OE1 3.15Å; R617-E621 IonicContact NH1-OE1 2.72Å; R617-E621 PolarHBondContact NH1-OE1 3.48Å; R617-E621 IonicContact NH1-OE2 3.51Å; R617-E621 PolarHBondContact NH1-OE2 3.21Å; R617-E621 WeakPolarHBondContact O-CG 3.3Å; R617-E621 PolarHBondContact O-N 2.99Å; K618-E621 WeakPolarHBondContact CA-OE2 3.31Å; E621-G623 PolarHBondContact O-N 3.45Å
622	A	79.8	Confident	74.9	Confident	22 Å²	22	79.5 Å²	79.5	18%	0.182	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	7.9	171.5	0	0	0	0	0	114	I561 A573 K618 C619 Y620	I561-A622 HydrophobicContact CD1-CB 3.45Å; I561-A622 VanDerWaalsContact CD1-CB 3.45Å; A573-A622 HydrophobicContact CB-CB 4.26Å; A573-A622 WeakPolarHBondContact CB-O 3.39Å; K618-A622 WeakPolarHBondContact O-CB 3.23Å; K618-A622 PolarHBondContact O-N 3.3Å; C619-A622 PolarHBondContact O-N 2.88Å; Y620-A622 VanDerWaalsContact C-N 3.28Å; Y620-A622 PolarHBondContact O-N 3.47Å
623	G	75.4	Confident	72.2	Confident	41 Å²	41	86.9 Å²	86.9	42%	0.423	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	15.3	175.7	0	0	0	0	0	115.9	C619 Y620 E621 T625	C619-G623 PolarHBondContact O-N 3.3Å; Y620-G623 WeakPolarHBondContact O-CA 3.48Å; Y620-G623 PolarHBondContact O-N 2.93Å; E621-G623 PolarHBondContact O-N 3.45Å; G623-T625 PolarHBondContact O-N 3.25Å
624	M	84.8	Confident	69.2	Low	1 Å²	1	94.4 Å²	94.4	1%	0.005	47%	0.474	C	S	.	.			trans	-69.5	129.8	179.1	-60.3	-177.2	78.4	0	0	111.5	I561 Y571 A573 T575 F583 C619	I561-M624 HydrophobicContact CD1-SD 4.15Å; I561-M624 HydrophobicContact CG1-SD 4.31Å; Y571-M624 HydrophobicContact CD2-CE 3.87Å; Y571-M624 HydrophobicContact CG-CE 4.37Å; Y571-M624 CarbonylContact O-C 3.39Å; Y571-M624 WeakPolarHBondContact O-CA 3.43Å; A573-M624 HydrophobicContact CB-CG 3.54Å; A573-M624 HydrophobicContact CB-SD 4.35Å; T575-M624 HydrophobicContact CG2-CE 4.12Å; T575-M624 HydrophobicContact CG2-SD 3.97Å; F583-M624 HydrophobicContact CB-CE 3.56Å; F583-M624 HydrophobicContact CB-SD 4.13Å; F583-M624 HydrophobicContact CD1-CB 3.96Å; F583-M624 HydrophobicContact CD1-CE 3.9Å; F583-M624 HydrophobicContact CD2-CB 3.85Å; F583-M624 HydrophobicContact CD2-CE 4.48Å; F583-M624 HydrophobicContact CD2-SD 4.29Å; F583-M624 HydrophobicContact CE1-CB 3.78Å; F583-M624 HydrophobicContact CE2-CB 3.65Å; F583-M624 HydrophobicContact CG-CB 3.99Å; F583-M624 HydrophobicContact CG-CE 3.71Å; F583-M624 HydrophobicContact CG-SD 4.09Å; F583-M624 HydrophobicContact CZ-CB 3.62Å; F583-M624 WeakPolarHBondContact CZ-O 3.28Å; C619-M624 HydrophobicContact CB-CB 4.38Å; C619-M624 HydrophobicContact CB-CG 4.36Å; C619-M624 HydrophobicContact CB-SD 3.66Å; C619-M624 VanDerWaalsContact O-CB 3.24Å; C619-M624 WeakPolarHBondContact O-CB 3.42Å; C619-M624 VanDerWaalsContact O-CG 3.3Å; C619-M624 WeakPolarHBondContact O-CG 3.25Å; C619-M624 PolarHBondContact O-N 2.93Å; C619-M624 VanDerWaalsContact SG-SD 3.63Å
625	T	82.5	Confident	66.1	Low	82 Å²	82	97.4 Å²	97.4	50%	0.503	51%	0.505	S	S	.	.			trans	-140.2	151.8	-179.7	59.4	0	0	0	0	112.9	Y571 G623 G627	Y571-T625 WeakPolarHBondContact CB-O 3.49Å; Y571-T625 WeakPolarHBondContact CD1-O 3.48Å; Y571-T625 PolarHBondContact O-N 2.84Å; G623-T625 PolarHBondContact O-N 3.25Å; T625-G627 PolarHBondContact O-N 3.32Å
626	L	79.2	Confident	62.8	Low	73 Å²	73	104.4 Å²	104.4	38%	0.382	54%	0.544	S	S	.	.	S	Bend	trans	-89	42.8	179.5	-66.3	-180	0	0	0	113.3	Y571 F583 A587 E588	Y571-L626 HydrophobicContact CD1-CD2 3.92Å; Y571-L626 HydrophobicContact CE1-CD2 3.73Å; F583-L626 HydrophobicContact CD1-CD2 4.18Å; F583-L626 HydrophobicContact CE1-CD2 3.75Å; F583-L626 HydrophobicContact CE1-CG 3.99Å; F583-L626 HydrophobicContact CZ-CG 4.45Å; A587-L626 VanDerWaalsContact C-CD1 3.44Å; A587-L626 HydrophobicContact CB-CD1 3.48Å; A587-L626 VanDerWaalsContact CB-CD1 3.48Å; A587-L626 HydrophobicContact CB-CD2 4.45Å; A587-L626 HydrophobicContact CB-CG 3.88Å; E588-L626 HydrophobicContact CB-CD1 4.42Å; E588-L626 HydrophobicContact CG-CD1 3.58Å; E588-L626 HydrophobicContact CG-CD2 4.42Å
627	G	55.6	Low	59.7	Low	48 Å²	48	111.1 Å²	111.1	50%	0.495	58%	0.579	S	S	.	*			trans	82.5	164.2	-176.1	0	0	0	0	0	113.4	T625	T625-G627 PolarHBondContact O-N 3.32Å
628	A	43.7	Very low	56.6	Low	97 Å²	97	116.3 Å²	116.3	80%	0.802	60%	0.604	S	S	*	*	S	Bend	cis	64.4	32.6	14.6	0	0	0	0	0	115.8
629	R	43.3	Very low	53.5	Low	235 Å²	235	121.3 Å²	121.3	89%	0.887	63%	0.633	S	S	*	*			trans	-169.5	142.6	142.5	-108.3	163.2	-76	-164.3	0.1	110.7
630	K	37.7	Very low	50.3	Low	204 Å²	204	129 Å²	129	89%	0.887	67%	0.669	S	S	*	*			trans	65.5	91.3	-175.2	-62.8	-176.6	177.5	178.5	0	116.7
631	L	34.2	Very low	47.2	Very low	169 Å²	169	131.1 Å²	131.1	89%	0.885	68%	0.683	S	S	*	*			trans	-119.5	74.6	138.6	-170.3	64.4	0	0	0	109.6
632	K	37.2	Very low	44.4	Very low	197 Å²	197	134.9 Å²	134.9	86%	0.857	70%	0.7	S	S	*	*			trans	-132.3	137.5	159.1	-82.3	-169.8	174.3	-176.4	0	106.7
633	K	37.1	Very low	41.8	Very low	201 Å²	201	137.5 Å²	137.5	87%	0.874	73%	0.73	S	S	*	*			trans	62.3	81.7	-164.2	-70.4	-170.7	171.6	-174.8	0	115.1
634	L	30.9	Very low	39.5	Very low	176 Å²	176	144.9 Å²	144.9	92%	0.921	75%	0.753	S	S	*	*				-130.6	111.4	115.8	-154.5	77	0	0	0	106.6
635	G	29.2	Very low	36.8	Very low	65 Å²	65	149.1 Å²	149.1	67%	0.67	79%	0.789	S	S	*	*			trans	162.3	50.2	-161.7	0	0	0	0	0	112.3
636	N	27.3	Very low	34.1	Very low	162 Å²	162	150.3 Å²	150.3	87%	0.866	80%	0.8	S	S	*	*			trans	178.2	103.2	157.2	-104.8	-14.2	0	0	0	108.8
637	L	29.8	Very low	31.6	Very low	163 Å²	163	151 Å²	151	85%	0.853	81%	0.811	S	S	*	*	S	Bend	trans	-163.7	114.4	149	-111.9	170.6	0	0	0	109.5
638	K	25.2	Very low	30.1	Very low	199 Å²	199	154.7 Å²	154.7	87%	0.865	83%	0.825	S	S	*	*			trans	68.1	105.9	170.8	-65.1	-161.1	168.9	-165	0	119.5
639	L	26.9	Very low	29.2	Very low	170 Å²	170	156.9 Å²	156.9	89%	0.89	83%	0.828	S	S	*	*			trans	-51.7	174.8	142.2	-165.6	76.5	0	0	0	112.4
640	Q	24	Very low	28.4	Very low	162 Å²	162	150.9 Å²	150.9	76%	0.757	82%	0.822	S	S	*	*			trans	86.4	124	174.5	-157.4	164.3	18	0	0	112.4
641	E	23.6	Very low	28.5	Very low	166 Å²	166	146.4 Å²	146.4	78%	0.776	81%	0.814	S	S	*	*			cis	-141.8	167.6	17.7	-153.1	143.5	-131.9	0	0	112.3
642	E	24.6	Very low	28.2	Very low	199 Å²	199	145.4 Å²	145.4	93%	0.93	82%	0.815	S	S	*	*			trans	-100.1	155.1	169.7	-65.3	-164.4	126.7	0	0	111
643	G	26	Very low	27.7	Very low	78 Å²	78	144.9 Å²	144.9	80%	0.804	82%	0.816	S	S	*	*			trans	178.3	141.5	176.8	0	0	0	0	0	113.6
644	E	27.2	Very low	27.3	Very low	195 Å²	195	144.7 Å²	144.7	91%	0.911	82%	0.818	S	S	*	*			trans	-91.3	173.8	-164.2	-59.4	172.6	79.6	0	0	116.2
645	A	27	Very low	27.3	Very low	91 Å²	91	141.8 Å²	141.8	75%	0.752	81%	0.808	S	S	*	*			trans	75.1	112.1	138.6	0	0	0	0	0	122.4
646	S	26.4	Very low	27.3	Very low	106 Å²	106	145.1 Å²	145.1	74%	0.741	82%	0.815	S	S	*	*				77.1	122.8	117.7	-152.7	0	0	0	0	123
647	S	26	Very low	27.4	Very low	88 Å²	88	145.1 Å²	145.1	62%	0.615	81%	0.81	S	S	*	*			trans	65.6	115.9	133.4	62.8	0	0	0	0	123.2
648	T	25.3	Very low	27.3	Very low	126 Å²	126	146.8 Å²	146.8	77%	0.773	81%	0.81	S	S	*	*				80	151.9	129.7	54.8	0	0	0	0	122.7
649	T	25.4	Very low	27.4	Very low	143 Å²	143	144.5 Å²	144.5	88%	0.877	81%	0.807	S	S	*	*			trans	76.4	130.5	169.3	62.3	0	0	0	0	119.4
650	S	25.7	Very low	27.4	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	80%	0.802	S	S	*	*			trans	-106.9	-176	158.6	62.1	0	0	0	0	107.5
651	P	39.1	Very low	27.7	Very low	110 Å²	110	141.3 Å²	141.3	71%	0.714	81%	0.805	S	S	*	*			cis	-131.7	165.5	-4.2	41.8	-27.2	0	0	0	114.8
652	T	28.1	Very low	27.8	Very low	148 Å²	148	138 Å²	138	91%	0.908	80%	0.801	S	S	*	*			trans	-157.9	153.7	141.8	-13.7	0	0	0	0	110.1
653	E	28	Very low	28.4	Very low	186 Å²	186	135.6 Å²	135.6	87%	0.869	79%	0.789	S	S	*	*			trans	-92.4	145.6	-179.6	-53.8	-175.8	134.4	0	0	111.5
654	E	27.8	Very low	28.9	Very low	196 Å²	196	138.7 Å²	138.7	92%	0.916	79%	0.786	S	S	*	*				-155.1	158	126.1	-128.3	-176.4	-156.2	0	0	111.9
655	T	31.1	Very low	29.1	Very low	116 Å²	116	135.7 Å²	135.7	71%	0.712	77%	0.772	S	S	*	*			trans	-95.3	124.7	-163.1	-68.6	0	0	0	0	113	Q657	T655-Q657 HydrophobicContact CG2-CG 3.98Å
656	T	27.8	Very low	29.5	Very low	134 Å²	134	134.6 Å²	134.6	82%	0.822	77%	0.769	S	S	*	*			trans	-131.7	106.5	159.1	-61.5	0	0	0	0	110.1	K658	T656-K658 PolarHBondContact O-N 3.03Å
657	Q	30.1	Very low	30	Very low	162 Å²	162	140.2 Å²	140.2	76%	0.757	78%	0.776	S	S	*	*			trans	-70.6	89.3	-175.8	-68	179.8	-7.6	0	0	112	T655 L659	T655-Q657 HydrophobicContact CG2-CG 3.98Å; Q657-L659 PolarHBondContact O-N 3.48Å
658	K	28.6	Very low	30.7	Very low	198 Å²	198	143 Å²	143	86%	0.861	78%	0.779	S	S	*	*			trans	-78.9	86.3	171.6	-164	174.8	-172.2	177.1	0	109.5	T656 T660	T656-K658 PolarHBondContact O-N 3.03Å; K658-T660 PolarHBondContact O-N 3.25Å
659	L	26.9	Very low	31.6	Very low	151 Å²	151	141.5 Å²	141.5	79%	0.791	77%	0.772	S	S	*	*			trans	-54.9	106.6	-176.8	-133.5	82.7	0	0	0	111.2	Q657 V661	Q657-L659 PolarHBondContact O-N 3.48Å; L659-V661 PolarHBondContact O-N 3.08Å
660	T	27.2	Very low	32.7	Very low	130 Å²	130	138.3 Å²	138.3	80%	0.798	75%	0.748	S	S	*	*			trans	-70.4	112.7	167.4	33.8	0	0	0	0	108.1	K658 S662	K658-T660 PolarHBondContact O-N 3.25Å; T660-S662 PolarHBondContact O-N 3.05Å; T660-S662 VanDerWaalsContact O-N 3.07Å
661	V	29.6	Very low	34.6	Very low	136 Å²	136	133.9 Å²	133.9	82%	0.824	72%	0.716	S	S	*	*			trans	-64.2	113.5	171.4	176.4	0	0	0	0	107.5	L659	L659-V661 PolarHBondContact O-N 3.08Å
662	S	26.5	Very low	36.2	Very low	97 Å²	97	132.2 Å²	132.2	68%	0.678	70%	0.7	S	S	*	*			trans	-64.7	150.1	179.6	43.4	0	0	0	0	111.3	T660 I664	T660-S662 PolarHBondContact O-N 3.05Å; T660-S662 VanDerWaalsContact O-N 3.07Å; S662-I664 PolarHBondContact O-N 3.31Å
663	H	37.3	Very low	38.8	Very low	147 Å²	147	127.6 Å²	127.6	68%	0.681	67%	0.668	S	S	*	*			trans	-68.1	96.7	-173.7	-174	-61.1	0	0	0	111.3	E665	H663-E665 WeakPolarHBondContact ND1-CG 3.48Å; H663-E665 PolarHBondContact O-N 3.45Å
664	I	35	Very low	41.5	Very low	144 Å²	144	119.1 Å²	119.1	74%	0.738	63%	0.628	S	S	*	*			trans	-75.7	103.3	171.2	-59.2	-179.5	0	0	0	108.8	S662	S662-I664 PolarHBondContact O-N 3.31Å
665	E	33.2	Very low	44.3	Very low	131 Å²	131	113.6 Å²	113.6	61%	0.612	61%	0.605	S	S	*	*			trans	-70.7	149.6	162.9	-60.1	-171	119.4	0	0	109.9	H663 K847	H663-E665 WeakPolarHBondContact ND1-CG 3.48Å; H663-E665 PolarHBondContact O-N 3.45Å; E665-K847 IonicContact OE1-NZ 3Å; E665-K847 PolarHBondContact OE1-NZ 3.26Å
666	G	34.2	Very low	47.1	Very low	68 Å²	68	110.6 Å²	110.6	70%	0.701	59%	0.587	S	S	*	*			trans	132.6	0.1	167.4	0	0	0	0	0	118.3
667	Y	38	Very low	50.1	Low	224 Å²	224	104.3 Å²	104.3	88%	0.878	55%	0.548	S	S	*	.			trans	-127.4	107.5	170.6	-70.9	-83.3	0	0	0	110.8	C669	Y667-C669 PolarHBondContact O-N 2.96Å
668	E	40.4	Very low	53	Low	148 Å²	148	102.4 Å²	102.4	69%	0.692	54%	0.539	S	S	*	.			trans	-63.4	121.2	169	-78.6	-155.8	132.9	0	0	109.9	Q670	E668-Q670 HydrophobicContact CB-CG 4.23Å; E668-Q670 PolarHBondContact O-N 3.5Å; E668-Q670 PolarHBondContact OE2-NE2 2.96Å
669	C	43.4	Very low	55.9	Low	93 Å²	93	97.2 Å²	97.2	63%	0.628	53%	0.533	S	S	*	.			trans	-77.1	70.3	167.5	-169.8	0	0	0	0	109.6	Y667 P671	Y667-C669 PolarHBondContact O-N 2.96Å; C669-P671 WeakPolarHBondContact O-CD 3.48Å
670	Q	48.7	Very low	59.1	Low	77 Å²	77	91.7 Å²	91.7	36%	0.36	50%	0.504	S	S	.	.			trans	-61	112.4	166.3	-71.5	-66	-10.1	0	0	107.7	E668	E668-Q670 HydrophobicContact CB-CG 4.23Å; E668-Q670 PolarHBondContact O-N 3.5Å; E668-Q670 PolarHBondContact OE2-NE2 2.96Å
671	P	64.6	Low	62.2	Low	15 Å²	15	88.5 Å²	88.5	10%	0.097	48%	0.48	C	S	.	.			trans	-73.4	143.2	-173.8	34.2	-38.4	0	0	0	109.8	C669 F673 L674 N675 E837	C669-P671 WeakPolarHBondContact O-CD 3.48Å; P671-F673 HydrophobicContact CB-CB 4.39Å; P671-F673 PolarHBondContact O-N 3.15Å; P671-L674 HydrophobicContact CG-CB 3.65Å; P671-L674 HydrophobicContact CG-CD1 3.63Å; P671-L674 HydrophobicContact CG-CG 3.55Å; P671-L674 PolarHBondContact O-N 2.81Å; P671-N675 PolarHBondContact O-N 3.17Å; P671-N675 PolarHBondContact O-OD1 3.1Å; P671-N675 VanDerWaalsContact O-OD1 3.11Å; P671-E837 WeakPolarHBondContact CG-OE1 3.49Å
672	I	73	Confident	65	Low	75 Å²	75	84 Å²	84	39%	0.385	45%	0.454	S	S	.	.	H	α-helix	trans	-52.4	-28.5	171.3	-61.4	172.3	0	0	0	111.1	G572 V676	G572-I672 VanDerWaalsContact O-CD1 3.24Å; G572-I672 WeakPolarHBondContact O-CD1 3.43Å; I672-V676 VanDerWaalsContact O-CG2 3.31Å; I672-V676 WeakPolarHBondContact O-CG2 3.28Å; I672-V676 PolarHBondContact O-N 3.06Å; I672-V676 VanDerWaalsContact O-N 3.17Å
673	F	82.4	Confident	67.6	Low	51 Å²	51	82 Å²	82	22%	0.224	45%	0.448	C	S	.	.	H	α-helix	trans	-65.2	-46.5	175.6	-156.4	-88.5	0	0	0	113.8	P671 V676 L677 P723 Y834 E837	P671-F673 HydrophobicContact CB-CB 4.39Å; P671-F673 PolarHBondContact O-N 3.15Å; F673-V676 PolarHBondContact O-N 3.03Å; F673-L677 HydrophobicContact CD1-CD1 4.01Å; F673-L677 HydrophobicContact CD1-CG 4.03Å; F673-L677 HydrophobicContact CE1-CD1 3.93Å; F673-L677 HydrophobicContact CE1-CD2 4.22Å; F673-L677 HydrophobicContact CE1-CG 4.14Å; F673-L677 WeakPolarHBondContact O-CG 3.24Å; F673-L677 PolarHBondContact O-N 3.22Å; F673-P723 HydrophobicContact CD2-CG 4.41Å; F673-P723 HydrophobicContact CE2-CB 3.9Å; F673-P723 HydrophobicContact CE2-CG 4.11Å; F673-P723 HydrophobicContact CZ-CB 4.44Å; F673-P723 HydrophobicContact CZ-CG 4.49Å; F673-Y834 AromaticContact CE1-CD1 3.7Å; F673-Y834 HydrophobicContact CE1-CD1 3.7Å; F673-Y834 AromaticContact CE1-CE1 3.46Å; F673-Y834 HydrophobicContact CE1-CE1 3.46Å; F673-Y834 VanDerWaalsContact CE1-CE1 3.46Å; F673-Y834 AromaticContact CZ-CD1 3.68Å; F673-Y834 HydrophobicContact CZ-CD1 3.68Å; F673-Y834 HydrophobicContact CZ-CD2 4.47Å; F673-Y834 AromaticContact CZ-CE1 3.33Å; F673-Y834 HydrophobicContact CZ-CE1 3.33Å; F673-Y834 HydrophobicContact CZ-CE2 4.16Å; F673-Y834 HydrophobicContact CZ-CG 4.23Å; F673-Y834 AromaticContact CZ-CZ 3.59Å; F673-E837 HydrophobicContact CB-CG 4.34Å; F673-E837 HydrophobicContact CD1-CB 4.38Å; F673-E837 HydrophobicContact CD1-CG 3.65Å; F673-E837 HydrophobicContact CE1-CB 4.36Å; F673-E837 HydrophobicContact CE1-CG 4.07Å; F673-E837 HydrophobicContact CG-CG 4.1Å
674	L	84.8	Confident	69.8	Low	8 Å²	8	79.9 Å²	79.9	4%	0.042	45%	0.445	C	S	.	.	H	α-helix	trans	-67.6	-42.6	177.9	-80.3	175.5	0	0	0	111.2	P671 V676 L677 E678 Q802 I841	P671-L674 HydrophobicContact CG-CB 3.65Å; P671-L674 HydrophobicContact CG-CD1 3.63Å; P671-L674 HydrophobicContact CG-CG 3.55Å; P671-L674 PolarHBondContact O-N 2.81Å; L674-V676 PolarHBondContact O-N 3.17Å; L674-L677 PolarHBondContact O-N 3.17Å; L674-E678 WeakPolarHBondContact O-CB 3.36Å; L674-E678 PolarHBondContact O-N 3.49Å; L674-Q802 HydrophobicContact CD1-CB 3.64Å; L674-Q802 HydrophobicContact CD1-CG 3.56Å; L674-Q802 HydrophobicContact CD2-CB 3.99Å; L674-Q802 HydrophobicContact CD2-CG 4.39Å; L674-Q802 HydrophobicContact CG-CB 4.5Å; L674-I841 HydrophobicContact CD1-CD1 4.11Å; L674-I841 HydrophobicContact CD1-CG1 3.96Å; L674-I841 HydrophobicContact CD2-CD1 3.74Å; L674-I841 HydrophobicContact CD2-CG1 4.5Å; L674-I841 HydrophobicContact CG-CD1 4.04Å; L674-I841 HydrophobicContact CG-CG1 4.34Å
675	N	86.7	Confident	72.4	Confident	81 Å²	81	74 Å²	74	43%	0.433	42%	0.416	S	S	.	.	H	α-helix	trans	-58.2	-31.6	176.6	-61.7	29.9	0	0	0	111.4	P671 A679	P671-N675 PolarHBondContact O-N 3.17Å; P671-N675 PolarHBondContact O-OD1 3.1Å; P671-N675 VanDerWaalsContact O-OD1 3.11Å; N675-A679 WeakPolarHBondContact O-CB 3.46Å; N675-A679 PolarHBondContact O-N 2.9Å; N675-A679 VanDerWaalsContact O-N 3.15Å
676	V	90.1	Very high	75.1	Confident	52 Å²	52	70.9 Å²	70.9	32%	0.315	41%	0.408	S	S	.	.	H	α-helix	trans	-73.2	-47.8	170.7	171.5	0	0	0	0	111.5	I672 F673 L674 E678 A679 I680 P723	I672-V676 VanDerWaalsContact O-CG2 3.31Å; I672-V676 WeakPolarHBondContact O-CG2 3.28Å; I672-V676 PolarHBondContact O-N 3.06Å; I672-V676 VanDerWaalsContact O-N 3.17Å; F673-V676 PolarHBondContact O-N 3.03Å; L674-V676 PolarHBondContact O-N 3.17Å; V676-E678 VanDerWaalsContact C-N 3.26Å; V676-E678 PolarHBondContact O-N 3.27Å; V676-A679 PolarHBondContact O-N 3.41Å; V676-I680 HydrophobicContact CG1-CG2 4.35Å; V676-I680 WeakPolarHBondContact O-CG1 3.17Å; V676-I680 WeakPolarHBondContact O-CG2 3.14Å; V676-I680 PolarHBondContact O-N 3.25Å; V676-I680 VanDerWaalsContact O-N 3.08Å; V676-P723 HydrophobicContact CG1-CG 3.82Å
677	L	91	Very high	77.6	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.016	38%	0.375	C	S	.	.	H	α-helix	trans	-59.8	-36	179	-64.7	-168.5	0	0	0	113.1	F673 L674 I680 E681 L722 L805 C806 Y834	F673-L677 HydrophobicContact CD1-CD1 4.01Å; F673-L677 HydrophobicContact CD1-CG 4.03Å; F673-L677 HydrophobicContact CE1-CD1 3.93Å; F673-L677 HydrophobicContact CE1-CD2 4.22Å; F673-L677 HydrophobicContact CE1-CG 4.14Å; F673-L677 WeakPolarHBondContact O-CG 3.24Å; F673-L677 PolarHBondContact O-N 3.22Å; L674-L677 PolarHBondContact O-N 3.17Å; L677-I680 HydrophobicContact CD2-CD1 4.26Å; L677-I680 WeakPolarHBondContact O-CG1 3.33Å; L677-E681 PolarHBondContact O-N 3.46Å; L677-L722 HydrophobicContact CD2-CD2 3.52Å; L677-L805 HydrophobicContact CB-CB 4.09Å; L677-L805 HydrophobicContact CB-CD1 4.35Å; L677-L805 HydrophobicContact CD1-CB 4.17Å; L677-C806 HydrophobicContact CD1-CB 4.44Å; L677-Y834 HydrophobicContact CD2-CE1 4.22Å
678	E	91.4	Very high	79.8	Confident	122 Å²	122	59.9 Å²	59.9	57%	0.57	36%	0.363	S	S	*	.	H	α-helix	trans	-71.1	-46.7	175.8	-175.2	169.4	-145.9	0	0	111.2	L674 V676 I680 E681 L805	L674-E678 WeakPolarHBondContact O-CB 3.36Å; L674-E678 PolarHBondContact O-N 3.49Å; V676-E678 VanDerWaalsContact C-N 3.26Å; V676-E678 PolarHBondContact O-N 3.27Å; E678-I680 PolarHBondContact O-N 2.93Å; E678-E681 WeakPolarHBondContact O-CB 3.46Å; E678-E681 PolarHBondContact O-N 2.93Å; E678-L805 HydrophobicContact CB-CD1 3.97Å
679	A	90.4	Very high	82	Confident	88 Å²	88	53.6 Å²	53.6	73%	0.727	33%	0.334	S	S	*	.	H	α-helix	trans	-68.9	-15.8	-179.7	0	0	0	0	0	114.9	N675 V676	N675-A679 WeakPolarHBondContact O-CB 3.46Å; N675-A679 PolarHBondContact O-N 2.9Å; N675-A679 VanDerWaalsContact O-N 3.15Å; V676-A679 PolarHBondContact O-N 3.41Å
680	I	93.1	Very high	83.9	Confident	36 Å²	36	52.6 Å²	52.6	19%	0.185	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-5.5	175.3	70.5	178.9	0	0	0	113.5	V676 L677 E678 A721 L722	V676-I680 HydrophobicContact CG1-CG2 4.35Å; V676-I680 WeakPolarHBondContact O-CG1 3.17Å; V676-I680 WeakPolarHBondContact O-CG2 3.14Å; V676-I680 PolarHBondContact O-N 3.25Å; V676-I680 VanDerWaalsContact O-N 3.08Å; L677-I680 HydrophobicContact CD2-CD1 4.26Å; L677-I680 WeakPolarHBondContact O-CG1 3.33Å; E678-I680 PolarHBondContact O-N 2.93Å; I680-A721 HydrophobicContact CB-CB 3.93Å; I680-A721 HydrophobicContact CD1-CB 4.25Å; I680-A721 HydrophobicContact CG2-CB 3.66Å; I680-L722 HydrophobicContact CD1-CD2 3.73Å; I680-L722 HydrophobicContact CD1-CG 4.09Å
681	E	92.4	Very high	85.4	Confident	62 Å²	62	52.7 Å²	52.7	29%	0.29	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-63.2	123.5	-175.2	-175.1	61.3	-165.8	0	0	110	L677 E678 G683 W718 L805 K808	L677-E681 PolarHBondContact O-N 3.46Å; E678-E681 WeakPolarHBondContact O-CB 3.46Å; E678-E681 PolarHBondContact O-N 2.93Å; E681-G683 PolarHBondContact O-N 2.85Å; E681-W718 PolarHBondContact OE2-NE1 2.98Å; E681-L805 HydrophobicContact CB-CD2 4.19Å; E681-L805 HydrophobicContact CG-CD2 4.11Å; E681-K808 IonicContact OE1-NZ 3.16Å; E681-K808 PolarHBondContact OE1-NZ 3.07Å; E681-K808 IonicContact OE2-NZ 2.74Å; E681-K808 PolarHBondContact OE2-NZ 2.76Å
682	P	89	Confident	86.2	Confident	42 Å²	42	59 Å²	59	27%	0.273	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-65.8	133.6	-173.1	24.5	-34.4	0	0	0	111.5	H714 W718	P682-H714 HydrophobicContact CB-CB 3.99Å; P682-W718 HydrophobicContact CG-CB 4.45Å
683	G	81.1	Confident	86.6	Confident	55 Å²	55	61.1 Å²	61.1	57%	0.567	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-56.3	157.8	171.7	0	0	0	0	0	112.8	E681 V685	E681-G683 PolarHBondContact O-N 2.85Å; G683-V685 PolarHBondContact O-N 3.08Å
684	V	83.8	Confident	86.8	Confident	102 Å²	102	63.8 Å²	63.8	62%	0.618	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-63.3	130.4	-175.1	-175.7	0	0	0	0	111	P766	V684-P766 HydrophobicContact CG1-CG 3.53Å
685	V	89.5	Confident	87.1	Confident	22 Å²	22	64.7 Å²	64.7	13%	0.133	39%	0.393	C	S	.	.			trans	-105.7	131.6	179.6	-179.7	0	0	0	0	109.5	G683 L707 R710 Q711 A765	G683-V685 PolarHBondContact O-N 3.08Å; V685-L707 HydrophobicContact CB-CD1 4.44Å; V685-L707 HydrophobicContact CG1-CD1 4.08Å; V685-R710 HydrophobicContact CG1-CB 3.65Å; V685-Q711 HydrophobicContact CB-CG 4.21Å; V685-Q711 HydrophobicContact CG1-CG 4.44Å; V685-Q711 HydrophobicContact CG2-CG 4.48Å; V685-A765 WeakPolarHBondContact O-CB 3.46Å
686	C	88.9	Confident	87.4	Confident	64 Å²	64	63 Å²	63	43%	0.432	39%	0.388	S	S	.	.			trans	-89	150.5	175.9	-59.9	0	0	0	0	112.2	R710 D767	C686-R710 PolarHBondContact O-NH1 3.34Å; C686-D767 WeakPolarHBondContact CA-OD1 3.45Å
687	A	87.6	Confident	87.6	Confident	2 Å²	2	62.4 Å²	62.4	2%	0.017	38%	0.381	C	S	.	.			trans	-77.4	-22.6	178.8	0	0	0	0	0	113.3	H689 L707 R710 A765 D767 L768	A687-H689 VanDerWaalsContact C-N 3.34Å; A687-H689 HydrophobicContact CB-CB 4.1Å; A687-L707 HydrophobicContact CB-CB 4.01Å; A687-L707 HydrophobicContact CB-CD1 4.28Å; A687-L707 HydrophobicContact CB-CD2 4.33Å; A687-L707 HydrophobicContact CB-CG 4.44Å; A687-R710 PolarHBondContact O-NH1 2.93Å; A687-A765 HydrophobicContact CB-CB 4.35Å; A687-D767 WeakPolarHBondContact CA-OD2 3.29Å; A687-D767 VanDerWaalsContact N-CG 3.34Å; A687-D767 PolarHBondContact N-OD1 3.2Å; A687-D767 PolarHBondContact N-OD2 3.15Å; A687-L768 HydrophobicContact CB-CB 3.76Å; A687-L768 HydrophobicContact CB-CD2 3.73Å; A687-L768 HydrophobicContact CB-CG 4.33Å
688	G	83.6	Confident	87.8	Confident	60 Å²	60	63.5 Å²	63.5	62%	0.619	39%	0.39	S	S	*	.			trans	73.6	27.8	-166	0	0	0	0	0	112.2	D690 D767	G688-D690 PolarHBondContact O-N 3.41Å; G688-D767 WeakPolarHBondContact CA-OD2 3.42Å; G688-D767 PolarHBondContact N-OD2 3.03Å
689	H	86.7	Confident	87.9	Confident	16 Å²	16	59.5 Å²	59.5	7%	0.074	38%	0.378	C	S	.	.			trans	-85.2	112.6	-173	-176.1	66.8	0	0	0	111.7	A687 N691 D695 S703 D767 L768 R774	A687-H689 VanDerWaalsContact C-N 3.34Å; A687-H689 HydrophobicContact CB-CB 4.1Å; H689-N691 PolarHBondContact CD2-ND2 3.29Å; H689-N691 PolarHBondContact O-N 2.85Å; H689-N691 PolarHBondContact O-ND2 3.01Å; H689-D695 IonicContact NE2-OD1 2.67Å; H689-S703 PolarHBondContact ND1-OG 3.07Å; H689-D767 PolarHBondContact N-OD2 3.12Å; H689-L768 HydrophobicContact CB-CB 4.49Å; H689-L768 HydrophobicContact CB-CD1 4.02Å; H689-R774 PolarHBondContact NE2-NH2 3.4Å
690	D	82.8	Confident	88.1	Confident	71 Å²	71	55.3 Å²	55.3	38%	0.38	34%	0.344	S	S	.	.			trans	-73.7	97.3	176.1	-175.2	10.8	0	0	0	111.2	G688 N692 Q693	G688-D690 PolarHBondContact O-N 3.41Å; D690-N692 PolarHBondContact O-N 3.18Å; D690-N692 VanDerWaalsContact OD1-CB 3.25Å; D690-N692 WeakPolarHBondContact OD1-CB 3.38Å; D690-N692 PolarHBondContact OD1-N 2.97Å; D690-N692 PolarHBondContact OD1-ND2 2.84Å; D690-Q693 HydrophobicContact CB-CG 4.12Å; D690-Q693 PolarHBondContact O-N 2.96Å; D690-Q693 WeakPolarHBondContact OD2-CG 3.34Å; D690-Q693 PolarHBondContact OD2-NE2 3.42Å
691	N	80.7	Confident	88.2	Confident	79 Å²	79	53.7 Å²	53.7	42%	0.422	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-2	178	-72	-98.6	0	0	0	113.3	H689 D767 R774	H689-N691 PolarHBondContact CD2-ND2 3.29Å; H689-N691 PolarHBondContact O-N 2.85Å; H689-N691 PolarHBondContact O-ND2 3.01Å; N691-D767 PolarHBondContact ND2-O 2.96Å; N691-R774 PolarHBondContact OD1-NH1 3.05Å; N691-R774 PolarHBondContact OD1-NH2 2.94Å
692	N	81	Confident	88.4	Confident	147 Å²	147	51.6 Å²	51.6	79%	0.786	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-17.4	170.9	-52.2	-78	0	0	0	112	D690	D690-N692 PolarHBondContact O-N 3.18Å; D690-N692 VanDerWaalsContact OD1-CB 3.25Å; D690-N692 WeakPolarHBondContact OD1-CB 3.38Å; D690-N692 PolarHBondContact OD1-N 2.97Å; D690-N692 PolarHBondContact OD1-ND2 2.84Å
693	Q	81.7	Confident	88.7	Confident	120 Å²	120	50.4 Å²	50.4	56%	0.561	32%	0.32	S	S	*	.	S	Bend	trans	-82.6	150.5	173.8	-58.7	-52.9	-37.5	0	0	111.6	D690 D695	D690-Q693 HydrophobicContact CB-CG 4.12Å; D690-Q693 PolarHBondContact O-N 2.96Å; D690-Q693 WeakPolarHBondContact OD2-CG 3.34Å; D690-Q693 PolarHBondContact OD2-NE2 3.42Å; Q693-D695 PolarHBondContact O-N 3.44Å
694	P	86.4	Confident	89.4	Confident	108 Å²	108	48.9 Å²	48.9	70%	0.701	30%	0.299	S	S	*	.			trans	-66.8	121.8	173.9	27.4	-34	0	0	0	111	S696	P694-S696 PolarHBondContact O-N 2.99Å
695	D	90.9	Very high	90	Very high	27 Å²	27	44.4 Å²	44.4	14%	0.144	27%	0.272	C	S	.	.			trans	-44.1	126.3	173.1	-80.8	-14.3	0	0	0	111	H689 Q693 L700 Y773 R774 K777	H689-D695 IonicContact NE2-OD1 2.67Å; Q693-D695 PolarHBondContact O-N 3.44Å; D695-L700 HydrophobicContact CB-CD1 4.26Å; D695-Y773 HydrophobicContact CB-CE1 4Å; D695-R774 VanDerWaalsContact CG-NE 3.34Å; D695-R774 IonicContact OD1-CZ 3.25Å; D695-R774 IonicContact OD1-NE 2.66Å; D695-R774 PolarHBondContact OD1-NE 2.67Å; D695-R774 VanDerWaalsContact OD1-NE 3.1Å; D695-R774 IonicContact OD1-NH2 3.1Å; D695-R774 PolarHBondContact OD1-NH2 3.25Å; D695-R774 WeakPolarHBondContact OD2-CG 3.4Å; D695-R774 IonicContact OD2-CZ 2.69Å; D695-R774 IonicContact OD2-NE 2.65Å; D695-R774 PolarHBondContact OD2-NE 3.37Å; D695-R774 IonicContact OD2-NH2 2.82Å; D695-K777 HydrophobicContact CB-CG 4.38Å; D695-K777 WeakPolarHBondContact O-CE 3.14Å; D695-K777 PolarHBondContact O-NZ 3.2Å
696	S	93.9	Very high	90.3	Very high	46 Å²	46	46.3 Å²	46.3	32%	0.322	28%	0.279	S	S	.	.			trans	-130.4	156.7	172	75.5	0	0	0	0	110.5	P694 A698 A699 L700	P694-S696 PolarHBondContact O-N 2.99Å; S696-A698 VanDerWaalsContact C-N 3.25Å; S696-A698 PolarHBondContact O-N 3.26Å; S696-A699 PolarHBondContact O-N 2.85Å; S696-A699 VanDerWaalsContact OG-CB 3.25Å; S696-A699 WeakPolarHBondContact OG-CB 3.31Å; S696-A699 PolarHBondContact OG-N 3.08Å; S696-L700 WeakPolarHBondContact O-CB 3.46Å; S696-L700 VanDerWaalsContact O-CG 3.31Å; S696-L700 WeakPolarHBondContact O-CG 3.38Å; S696-L700 PolarHBondContact O-N 3.39Å
697	F	94.6	Very high	90.6	Very high	39 Å²	39	43.5 Å²	43.5	17%	0.171	26%	0.26	C	S	.	.	H	α-helix	trans	-54.1	-46	175.3	168.8	-93.6	0	0	0	111.2	L701 S778 R779 L880 V887 V889	F697-L701 HydrophobicContact CD1-CD1 4.49Å; F697-L701 HydrophobicContact CD2-CD1 3.97Å; F697-L701 HydrophobicContact CE1-CD1 3.93Å; F697-L701 HydrophobicContact CE2-CD1 3.34Å; F697-L701 HydrophobicContact CE2-CG 4.41Å; F697-L701 HydrophobicContact CZ-CD1 3.33Å; F697-L701 WeakPolarHBondContact O-CG 3.23Å; F697-L701 PolarHBondContact O-N 2.65Å; F697-S778 WeakPolarHBondContact CD2-O 3.4Å; F697-S778 VanDerWaalsContact CE2-O 3.25Å; F697-S778 WeakPolarHBondContact CE2-O 3.2Å; F697-R779 HydrophobicContact CD2-CB 4.11Å; F697-R779 HydrophobicContact CD2-CG 3.7Å; F697-R779 HydrophobicContact CE2-CB 3.86Å; F697-R779 HydrophobicContact CE2-CG 3.85Å; F697-L880 HydrophobicContact CZ-CD1 4.11Å; F697-V887 HydrophobicContact CE1-CB 3.9Å; F697-V887 HydrophobicContact CE1-CG2 3.99Å; F697-V889 HydrophobicContact CD1-CG2 4.39Å; F697-V889 HydrophobicContact CE1-CG2 3.95Å
698	A	93.8	Very high	91	Very high	25 Å²	25	43.6 Å²	43.6	21%	0.207	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-60.3	177	0	0	0	0	0	111.6	S696 L700 L701 S702 S888	S696-A698 VanDerWaalsContact C-N 3.25Å; S696-A698 PolarHBondContact O-N 3.26Å; A698-L700 VanDerWaalsContact C-N 3.35Å; A698-L700 PolarHBondContact O-N 3.34Å; A698-L701 PolarHBondContact O-N 3.28Å; A698-L701 VanDerWaalsContact O-N 3.12Å; A698-S702 PolarHBondContact O-N 3.23Å; A698-S702 PolarHBondContact O-OG 3.04Å; A698-S888 VanDerWaalsContact CB-O 3.24Å; A698-S888 WeakPolarHBondContact CB-O 3.44Å
699	A	93.8	Very high	91.6	Very high	38 Å²	38	42.5 Å²	42.5	31%	0.314	24%	0.24	S	C	.	.	H	α-helix	trans	-60.6	-40.5	-174.4	0	0	0	0	0	113	S696 L701 S703	S696-A699 PolarHBondContact O-N 2.85Å; S696-A699 VanDerWaalsContact OG-CB 3.25Å; S696-A699 WeakPolarHBondContact OG-CB 3.31Å; S696-A699 PolarHBondContact OG-N 3.08Å; A699-L701 PolarHBondContact O-N 3.24Å; A699-S703 VanDerWaalsContact O-CB 3.23Å; A699-S703 WeakPolarHBondContact O-CB 3.45Å; A699-S703 PolarHBondContact O-N 3.19Å; A699-S703 PolarHBondContact O-OG 3.31Å
700	L	95.3	Very high	92	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-38.6	177.8	-72.4	172	0	0	0	112.2	D695 S696 A698 L704 L768 F770 R774 K777	D695-L700 HydrophobicContact CB-CD1 4.26Å; S696-L700 WeakPolarHBondContact O-CB 3.46Å; S696-L700 VanDerWaalsContact O-CG 3.31Å; S696-L700 WeakPolarHBondContact O-CG 3.38Å; S696-L700 PolarHBondContact O-N 3.39Å; A698-L700 VanDerWaalsContact C-N 3.35Å; A698-L700 PolarHBondContact O-N 3.34Å; L700-L704 WeakPolarHBondContact O-CG 3.25Å; L700-L704 PolarHBondContact O-N 2.95Å; L700-L704 VanDerWaalsContact O-N 3.14Å; L700-L768 HydrophobicContact CD2-CD1 4.42Å; L700-F770 HydrophobicContact CB-CZ 4.16Å; L700-F770 HydrophobicContact CD2-CE1 3.87Å; L700-F770 HydrophobicContact CD2-CZ 4.21Å; L700-R774 HydrophobicContact CD1-CB 4.46Å; L700-R774 HydrophobicContact CD1-CG 4.31Å; L700-R774 HydrophobicContact CD2-CG 4.21Å; L700-K777 HydrophobicContact CD1-CB 3.96Å; L700-K777 HydrophobicContact CD1-CG 3.85Å
701	L	95.8	Very high	92.6	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-80.9	-39.9	-179.7	-64.2	-174.9	0	0	0	112.7	F697 A698 A699 S703 L704 N705 M780 F876 L880 V889	F697-L701 HydrophobicContact CD1-CD1 4.49Å; F697-L701 HydrophobicContact CD2-CD1 3.97Å; F697-L701 HydrophobicContact CE1-CD1 3.93Å; F697-L701 HydrophobicContact CE2-CD1 3.34Å; F697-L701 HydrophobicContact CE2-CG 4.41Å; F697-L701 HydrophobicContact CZ-CD1 3.33Å; F697-L701 WeakPolarHBondContact O-CG 3.23Å; F697-L701 PolarHBondContact O-N 2.65Å; A698-L701 PolarHBondContact O-N 3.28Å; A698-L701 VanDerWaalsContact O-N 3.12Å; A699-L701 PolarHBondContact O-N 3.24Å; L701-S703 VanDerWaalsContact C-N 3.27Å; L701-S703 PolarHBondContact O-N 3.43Å; L701-L704 HydrophobicContact CD2-CD1 4.09Å; L701-L704 PolarHBondContact O-N 2.91Å; L701-L704 VanDerWaalsContact O-N 3.16Å; L701-N705 PolarHBondContact O-N 3.44Å; L701-M780 HydrophobicContact CD2-CG 3.97Å; L701-M780 HydrophobicContact CD2-SD 3.45Å; L701-M780 WeakPolarHBondContact CD2-SD 3.48Å; L701-F876 HydrophobicContact CD1-CZ 4.34Å; L701-L880 HydrophobicContact CB-CD2 4.41Å; L701-L880 HydrophobicContact CD1-CD1 3.89Å; L701-L880 HydrophobicContact CD1-CD2 3.82Å; L701-V889 HydrophobicContact CB-CG1 3.83Å; L701-V889 HydrophobicContact CB-CG2 3.88Å; L701-V889 HydrophobicContact CD1-CG2 4.23Å
702	S	95.1	Very high	93.3	Very high	19 Å²	19	39.8 Å²	39.8	13%	0.133	22%	0.218	C	C	.	.	H	α-helix	trans	-57.4	-42.6	169.5	-62.2	0	0	0	0	110.6	A698 L704 N705 E706 D890	A698-S702 PolarHBondContact O-N 3.23Å; A698-S702 PolarHBondContact O-OG 3.04Å; S702-L704 VanDerWaalsContact C-N 3.34Å; S702-L704 PolarHBondContact O-N 3.2Å; S702-N705 PolarHBondContact O-N 2.99Å; S702-E706 VanDerWaalsContact O-CB 3.27Å; S702-E706 WeakPolarHBondContact O-CB 3.09Å; S702-E706 PolarHBondContact O-N 3.44Å; S702-D890 WeakPolarHBondContact CB-OD2 3.31Å; S702-D890 PolarHBondContact OG-N 3.38Å; S702-D890 PolarHBondContact OG-OD2 3.19Å
703	S	95.6	Very high	93.9	Very high	17 Å²	17	34.1 Å²	34.1	12%	0.119	19%	0.189	C	C	.	.	H	α-helix	trans	-64.4	-33.9	176.5	-56.6	0	0	0	0	113.4	H689 A699 L701 L707	H689-S703 PolarHBondContact ND1-OG 3.07Å; A699-S703 VanDerWaalsContact O-CB 3.23Å; A699-S703 WeakPolarHBondContact O-CB 3.45Å; A699-S703 PolarHBondContact O-N 3.19Å; A699-S703 PolarHBondContact O-OG 3.31Å; L701-S703 VanDerWaalsContact C-N 3.27Å; L701-S703 PolarHBondContact O-N 3.43Å; S703-L707 VanDerWaalsContact O-CB 3.27Å; S703-L707 WeakPolarHBondContact O-CB 3.2Å; S703-L707 PolarHBondContact O-N 3.42Å; S703-L707 VanDerWaalsContact O-N 3.08Å
704	L	96.6	Very high	94.5	Very high	22 Å²	22	31.4 Å²	31.4	12%	0.115	18%	0.177	C	C	.	.	H	α-helix	trans	-71.9	-38.9	173.7	-80.6	174.9	0	0	0	112.4	L700 L701 S702 G708 F764 L768 F770 M780	L700-L704 WeakPolarHBondContact O-CG 3.25Å; L700-L704 PolarHBondContact O-N 2.95Å; L700-L704 VanDerWaalsContact O-N 3.14Å; L701-L704 HydrophobicContact CD2-CD1 4.09Å; L701-L704 PolarHBondContact O-N 2.91Å; L701-L704 VanDerWaalsContact O-N 3.16Å; S702-L704 VanDerWaalsContact C-N 3.34Å; S702-L704 PolarHBondContact O-N 3.2Å; L704-G708 PolarHBondContact O-N 3.17Å; L704-F764 HydrophobicContact CD2-CB 4.03Å; L704-F764 HydrophobicContact CD2-CD1 3.51Å; L704-F764 HydrophobicContact CD2-CD2 3.99Å; L704-F764 HydrophobicContact CD2-CE1 3.87Å; L704-F764 HydrophobicContact CD2-CE2 4.3Å; L704-F764 HydrophobicContact CD2-CG 3.58Å; L704-F764 HydrophobicContact CD2-CZ 4.25Å; L704-L768 HydrophobicContact CD2-CD2 3.65Å; L704-L768 HydrophobicContact CG-CD2 3.96Å; L704-F770 HydrophobicContact CD1-CE1 4.42Å; L704-F770 HydrophobicContact CD1-CE2 3.95Å; L704-F770 HydrophobicContact CD1-CZ 3.59Å; L704-F770 HydrophobicContact CG-CZ 4.12Å; L704-M780 HydrophobicContact CD1-SD 3.85Å
705	N	95.8	Very high	95	Very high	8 Å²	8	26.9 Å²	26.9	4%	0.043	15%	0.147	C	C	.	.	H	α-helix	trans	-67.7	-43.7	177.6	-70.5	-20.2	0	0	0	111.4	L701 S702 G708 E709 V889 D890 F891 M895	L701-N705 PolarHBondContact O-N 3.44Å; S702-N705 PolarHBondContact O-N 2.99Å; N705-G708 CarbonylContact O-C 3.44Å; N705-G708 VanDerWaalsContact O-CA 3.31Å; N705-G708 WeakPolarHBondContact O-CA 3.47Å; N705-G708 PolarHBondContact O-N 3.28Å; N705-E709 PolarHBondContact O-N 3.2Å; N705-V889 WeakPolarHBondContact ND2-CG1 3.28Å; N705-D890 PolarHBondContact ND2-O 3.49Å; N705-F891 HydrophobicContact CB-CD1 4.46Å; N705-F891 WeakPolarHBondContact ND2-CD1 3.37Å; N705-F891 VanDerWaalsContact ND2-CE1 3.26Å; N705-F891 WeakPolarHBondContact ND2-CE1 3.43Å; N705-F891 WeakPolarHBondContact ND2-CZ 3.44Å; N705-M895 HydrophobicContact CB-SD 3.83Å; N705-M895 VanDerWaalsContact O-SD 3.35Å
706	E	95.4	Very high	95.2	Very high	63 Å²	63	25.8 Å²	25.8	29%	0.294	14%	0.141	S	C	.	.	H	α-helix	trans	-60.3	-46.1	174.4	-178.5	60.1	-154.7	0	0	112	S702 G708 E709 R710 P892	S702-E706 VanDerWaalsContact O-CB 3.27Å; S702-E706 WeakPolarHBondContact O-CB 3.09Å; S702-E706 PolarHBondContact O-N 3.44Å; E706-G708 PolarHBondContact O-N 3.35Å; E706-E709 PolarHBondContact O-N 2.99Å; E706-R710 VanDerWaalsContact CD-NH2 3.32Å; E706-R710 WeakPolarHBondContact O-CG 3.47Å; E706-R710 PolarHBondContact O-N 2.76Å; E706-R710 IonicContact OE1-CZ 2.78Å; E706-R710 IonicContact OE1-NE 3.91Å; E706-R710 PolarHBondContact OE1-NE 3.14Å; E706-R710 IonicContact OE1-NH2 3.82Å; E706-R710 PolarHBondContact OE1-NH2 3.39Å; E706-P892 WeakPolarHBondContact OE2-CG 3.44Å
707	L	96.3	Very high	95.2	Very high	5 Å²	5	29.8 Å²	29.8	3%	0.026	15%	0.153	C	C	.	.	H	α-helix	trans	-59.6	-36.3	170.5	-179	63.5	0	0	0	111.9	V685 A687 S703 Q711 F764 A765 L768	V685-L707 HydrophobicContact CB-CD1 4.44Å; V685-L707 HydrophobicContact CG1-CD1 4.08Å; A687-L707 HydrophobicContact CB-CB 4.01Å; A687-L707 HydrophobicContact CB-CD1 4.28Å; A687-L707 HydrophobicContact CB-CD2 4.33Å; A687-L707 HydrophobicContact CB-CG 4.44Å; S703-L707 VanDerWaalsContact O-CB 3.27Å; S703-L707 WeakPolarHBondContact O-CB 3.2Å; S703-L707 PolarHBondContact O-N 3.42Å; S703-L707 VanDerWaalsContact O-N 3.08Å; L707-Q711 HydrophobicContact CD1-CG 4.27Å; L707-Q711 VanDerWaalsContact CD1-NE2 3.28Å; L707-Q711 HydrophobicContact CG-CG 4.47Å; L707-Q711 WeakPolarHBondContact O-CB 3.28Å; L707-Q711 WeakPolarHBondContact O-CG 3.41Å; L707-Q711 PolarHBondContact O-N 3.15Å; L707-F764 HydrophobicContact CD2-CB 3.76Å; L707-A765 HydrophobicContact CD1-CB 3.9Å; L707-A765 HydrophobicContact CD2-CB 3.78Å; L707-L768 HydrophobicContact CD2-CD2 4.14Å
708	G	95.9	Very high	95.3	Very high	4 Å²	4	28.2 Å²	28.2	4%	0.041	15%	0.146	C	C	.	.	H	α-helix	trans	-60.8	-51	177.1	0	0	0	0	0	113	L704 N705 E706 Q711 L712 M745	L704-G708 PolarHBondContact O-N 3.17Å; N705-G708 CarbonylContact O-C 3.44Å; N705-G708 VanDerWaalsContact O-CA 3.31Å; N705-G708 WeakPolarHBondContact O-CA 3.47Å; N705-G708 PolarHBondContact O-N 3.28Å; E706-G708 PolarHBondContact O-N 3.35Å; G708-Q711 PolarHBondContact O-N 3.4Å; G708-L712 WeakPolarHBondContact O-CG 3.36Å; G708-L712 PolarHBondContact O-N 3.17Å; G708-M745 WeakPolarHBondContact O-CE 3.32Å
709	E	94.9	Very high	95.5	Very high	36 Å²	36	27 Å²	27	17%	0.168	14%	0.136	C	C	.	.	H	α-helix	trans	-60	-47.8	176.6	-178.4	171.5	-92.6	0	0	111.8	N705 E706 Q711 L712 V713 P892 E893 M894	N705-E709 PolarHBondContact O-N 3.2Å; E706-E709 PolarHBondContact O-N 2.99Å; E709-Q711 VanDerWaalsContact C-N 3.28Å; E709-Q711 PolarHBondContact O-N 3.06Å; E709-L712 WeakPolarHBondContact O-CB 3.11Å; E709-L712 PolarHBondContact O-N 3.48Å; E709-V713 PolarHBondContact O-N 3.31Å; E709-V713 VanDerWaalsContact O-N 3.11Å; E709-P892 HydrophobicContact CB-CB 3.8Å; E709-P892 HydrophobicContact CB-CG 4.06Å; E709-P892 HydrophobicContact CG-CB 4.11Å; E709-P892 WeakPolarHBondContact OE1-CB 3.22Å; E709-P892 WeakPolarHBondContact OE2-CB 3.04Å; E709-E893 PolarHBondContact OE1-N 3.26Å; E709-M894 HydrophobicContact CG-CB 3.95Å; E709-M894 HydrophobicContact CG-CE 4.24Å; E709-M894 HydrophobicContact CG-SD 4.12Å; E709-M894 WeakPolarHBondContact OE1-CB 3.24Å; E709-M894 PolarHBondContact OE1-N 3.12Å
710	R	95	Very high	95.5	Very high	86 Å²	86	27 Å²	27	33%	0.325	13%	0.128	S	C	.	.	H	α-helix	trans	-60.9	-38.7	178.1	-61.1	173.5	-168.3	168.6	3.4	111.8	V685 C686 A687 E706 H714	V685-R710 HydrophobicContact CG1-CB 3.65Å; C686-R710 PolarHBondContact O-NH1 3.34Å; A687-R710 PolarHBondContact O-NH1 2.93Å; E706-R710 VanDerWaalsContact CD-NH2 3.32Å; E706-R710 WeakPolarHBondContact O-CG 3.47Å; E706-R710 PolarHBondContact O-N 2.76Å; E706-R710 IonicContact OE1-CZ 2.78Å; E706-R710 IonicContact OE1-NE 3.91Å; E706-R710 PolarHBondContact OE1-NE 3.14Å; E706-R710 IonicContact OE1-NH2 3.82Å; E706-R710 PolarHBondContact OE1-NH2 3.39Å; R710-H714 PolarHBondContact O-CD2 3.21Å; R710-H714 VanDerWaalsContact O-CD2 3.3Å; R710-H714 PolarHBondContact O-N 2.87Å
711	Q	95.7	Very high	95.4	Very high	23 Å²	23	29.1 Å²	29.1	11%	0.107	15%	0.146	C	C	.	.	H	α-helix	trans	-69.8	-32.2	173.6	-74.6	-176.3	26.3	0	0	112.7	V685 L707 G708 E709 H714 V715 M745	V685-Q711 HydrophobicContact CB-CG 4.21Å; V685-Q711 HydrophobicContact CG1-CG 4.44Å; V685-Q711 HydrophobicContact CG2-CG 4.48Å; L707-Q711 HydrophobicContact CD1-CG 4.27Å; L707-Q711 VanDerWaalsContact CD1-NE2 3.28Å; L707-Q711 HydrophobicContact CG-CG 4.47Å; L707-Q711 WeakPolarHBondContact O-CB 3.28Å; L707-Q711 WeakPolarHBondContact O-CG 3.41Å; L707-Q711 PolarHBondContact O-N 3.15Å; G708-Q711 PolarHBondContact O-N 3.4Å; E709-Q711 VanDerWaalsContact C-N 3.28Å; E709-Q711 PolarHBondContact O-N 3.06Å; Q711-H714 PolarHBondContact O-N 3.43Å; Q711-V715 WeakPolarHBondContact O-CG2 3.3Å; Q711-V715 PolarHBondContact O-N 3.48Å; Q711-M745 HydrophobicContact CB-CE 3.97Å
712	L	95.4	Very high	95.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-45.2	173.1	-76.2	161.7	0	0	0	111.7	W434 G708 E709 H714 V715 V716 W741 M745 M894 M895 I898	W434-L712 HydrophobicContact CH2-CB 4.25Å; W434-L712 HydrophobicContact CH2-CD2 4.07Å; W434-L712 HydrophobicContact CZ2-CB 4.3Å; W434-L712 HydrophobicContact CZ2-CD1 4.22Å; W434-L712 HydrophobicContact CZ2-CD2 4.17Å; W434-L712 HydrophobicContact CZ2-CG 4.45Å; G708-L712 WeakPolarHBondContact O-CG 3.36Å; G708-L712 PolarHBondContact O-N 3.17Å; E709-L712 WeakPolarHBondContact O-CB 3.11Å; E709-L712 PolarHBondContact O-N 3.48Å; L712-H714 VanDerWaalsContact C-N 3.26Å; L712-H714 PolarHBondContact O-N 2.94Å; L712-V715 PolarHBondContact O-N 3.05Å; L712-V715 VanDerWaalsContact O-N 3.13Å; L712-V716 WeakPolarHBondContact O-CG2 3.33Å; L712-V716 PolarHBondContact O-N 2.78Å; L712-W741 HydrophobicContact CD2-CB 3.61Å; L712-W741 HydrophobicContact CD2-CD2 4.17Å; L712-W741 HydrophobicContact CD2-CE3 4.18Å; L712-W741 HydrophobicContact CD2-CG 3.97Å; L712-M745 HydrophobicContact CD1-CE 4.37Å; L712-M745 HydrophobicContact CD2-CE 4.04Å; L712-M745 HydrophobicContact CG-CE 3.63Å; L712-M894 HydrophobicContact CB-SD 3.92Å; L712-M895 HydrophobicContact CD1-CB 4.4Å; L712-M895 HydrophobicContact CD1-CG 4.14Å; L712-I898 HydrophobicContact CD2-CD1 4.2Å
713	V	94.8	Very high	95.3	Very high	28 Å²	28	30.3 Å²	30.3	17%	0.17	15%	0.153	C	C	.	.	H	α-helix	trans	-56.1	-42.2	174.5	175.7	0	0	0	0	111.5	L437 E709 K717 M894	L437-V713 HydrophobicContact CD1-CG2 4.37Å; E709-V713 PolarHBondContact O-N 3.31Å; E709-V713 VanDerWaalsContact O-N 3.11Å; V713-K717 HydrophobicContact CG1-CD 4.41Å; V713-K717 WeakPolarHBondContact O-CG 3.45Å; V713-K717 PolarHBondContact O-N 3.18Å; V713-M894 HydrophobicContact CG2-CE 3.66Å; V713-M894 HydrophobicContact CG2-SD 4.14Å
714	H	94.3	Very high	95.1	Very high	64 Å²	64	30.8 Å²	30.8	30%	0.296	16%	0.161	S	C	.	.	H	α-helix	trans	-72	-35.6	177.8	-79.1	-120.6	0	0	0	112.5	P682 R710 Q711 L712 K717 W718	P682-H714 HydrophobicContact CB-CB 3.99Å; R710-H714 PolarHBondContact O-CD2 3.21Å; R710-H714 VanDerWaalsContact O-CD2 3.3Å; R710-H714 PolarHBondContact O-N 2.87Å; Q711-H714 PolarHBondContact O-N 3.43Å; L712-H714 VanDerWaalsContact C-N 3.26Å; L712-H714 PolarHBondContact O-N 2.94Å; H714-K717 PolarHBondContact O-N 3.4Å; H714-W718 VanDerWaalsContact O-CB 3.29Å; H714-W718 WeakPolarHBondContact O-CB 3.39Å; H714-W718 PolarHBondContact O-N 3.38Å
715	V	95.9	Very high	95	Very high	13 Å²	13	29.8 Å²	29.8	8%	0.079	16%	0.156	C	C	.	.	H	α-helix	trans	-64.8	-39.8	174.1	167	0	0	0	0	111.7	Q711 L712 W718 A719 I737 L744	Q711-V715 WeakPolarHBondContact O-CG2 3.3Å; Q711-V715 PolarHBondContact O-N 3.48Å; L712-V715 PolarHBondContact O-N 3.05Å; L712-V715 VanDerWaalsContact O-N 3.13Å; V715-W718 PolarHBondContact O-N 2.98Å; V715-A719 VanDerWaalsContact O-CB 3.23Å; V715-A719 WeakPolarHBondContact O-CB 3.2Å; V715-A719 PolarHBondContact O-N 3.28Å; V715-I737 HydrophobicContact CG1-CG2 4.29Å; V715-L744 HydrophobicContact CG1-CD1 4.04Å
716	V	95.4	Very high	94.9	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.024	18%	0.175	C	C	.	.	H	α-helix	trans	-63.4	-44.6	175.2	175.3	0	0	0	0	111.3	W434 L437 F438 L712 A719 K720 I737	W434-V716 HydrophobicContact CH2-CG2 3.92Å; W434-V716 HydrophobicContact CZ3-CG2 3.48Å; W434-V716 VanDerWaalsContact CZ3-CG2 3.48Å; L437-V716 HydrophobicContact CB-CG1 4.28Å; L437-V716 HydrophobicContact CD1-CG2 4.29Å; F438-V716 HydrophobicContact CE2-CG1 4.1Å; F438-V716 HydrophobicContact CE2-CG2 4.38Å; F438-V716 HydrophobicContact CZ-CG1 4.08Å; L712-V716 WeakPolarHBondContact O-CG2 3.33Å; L712-V716 PolarHBondContact O-N 2.78Å; V716-A719 PolarHBondContact O-N 3.42Å; V716-K720 HydrophobicContact CG1-CD 4.47Å; V716-K720 WeakPolarHBondContact O-CB 3.26Å; V716-K720 PolarHBondContact O-N 3.05Å; V716-I737 HydrophobicContact CG2-CG2 4.22Å
717	K	94.3	Very high	94.8	Very high	129 Å²	129	37.8 Å²	37.8	56%	0.561	19%	0.191	S	C	*	.	H	α-helix	trans	-63.2	-47	176.9	-70	172.2	-178.7	177	0	111.8	V713 H714 K720 A721	V713-K717 HydrophobicContact CG1-CD 4.41Å; V713-K717 WeakPolarHBondContact O-CG 3.45Å; V713-K717 PolarHBondContact O-N 3.18Å; H714-K717 PolarHBondContact O-N 3.4Å; K717-K720 PolarHBondContact O-N 3.21Å; K717-A721 PolarHBondContact O-N 3.35Å; K717-A721 VanDerWaalsContact O-N 3.12Å
718	W	97	Very high	94.6	Very high	7 Å²	7	37.9 Å²	37.9	3%	0.027	19%	0.192	C	C	.	.	H	α-helix	trans	-58.7	-47.4	175.2	169.9	80.5	0	0	0	112	E681 P682 H714 V715 A721 L722 L744 K808 L812	E681-W718 PolarHBondContact OE2-NE1 2.98Å; P682-W718 HydrophobicContact CG-CB 4.45Å; H714-W718 VanDerWaalsContact O-CB 3.29Å; H714-W718 WeakPolarHBondContact O-CB 3.39Å; H714-W718 PolarHBondContact O-N 3.38Å; V715-W718 PolarHBondContact O-N 2.98Å; W718-A721 WeakPolarHBondContact O-CA 3.45Å; W718-A721 WeakPolarHBondContact O-CB 3.41Å; W718-A721 PolarHBondContact O-N 3.07Å; W718-L722 HydrophobicContact CD2-CD1 4.49Å; W718-L722 HydrophobicContact CE3-CD1 4.32Å; W718-L722 HydrophobicContact CH2-CD1 3.94Å; W718-L722 HydrophobicContact CZ2-CD1 4.11Å; W718-L722 HydrophobicContact CZ2-CD2 4.26Å; W718-L722 HydrophobicContact CZ3-CD1 4.05Å; W718-L722 PolarHBondContact O-N 3.36Å; W718-L744 HydrophobicContact CH2-CD2 3.92Å; W718-L744 HydrophobicContact CZ3-CD1 4.05Å; W718-L744 HydrophobicContact CZ3-CD2 4Å; W718-K808 HydrophobicContact CH2-CD 4.29Å; W718-K808 HydrophobicContact CH2-CG 3.9Å; W718-K808 HydrophobicContact CZ2-CB 4.48Å; W718-K808 HydrophobicContact CZ2-CD 3.74Å; W718-K808 HydrophobicContact CZ2-CG 3.75Å; W718-L812 HydrophobicContact CH2-CB 4.4Å; W718-L812 HydrophobicContact CZ3-CB 4.33Å; W718-L812 HydrophobicContact CZ3-CD2 4.12Å
719	A	96.8	Very high	94.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.5	-43.6	178.8	0	0	0	0	0	112	V715 V716 A721 L722 F725 I737 L812	V715-A719 VanDerWaalsContact O-CB 3.23Å; V715-A719 WeakPolarHBondContact O-CB 3.2Å; V715-A719 PolarHBondContact O-N 3.28Å; V716-A719 PolarHBondContact O-N 3.42Å; A719-A721 PolarHBondContact O-N 3.05Å; A719-A721 VanDerWaalsContact O-N 3.15Å; A719-L722 WeakPolarHBondContact O-CB 3.38Å; A719-L722 PolarHBondContact O-N 3.21Å; A719-L722 VanDerWaalsContact O-N 3.08Å; A719-F725 HydrophobicContact CB-CD1 4.35Å; A719-F725 HydrophobicContact CB-CE1 4.04Å; A719-F725 HydrophobicContact CB-CE2 4.46Å; A719-F725 HydrophobicContact CB-CZ 4.1Å; A719-F725 VanDerWaalsContact O-CB 3.25Å; A719-F725 WeakPolarHBondContact O-CB 3.29Å; A719-F725 WeakPolarHBondContact O-CD1 3.45Å; A719-F725 WeakPolarHBondContact O-CG 3.27Å; A719-I737 HydrophobicContact CB-CD1 3.65Å; A719-I737 HydrophobicContact CB-CG1 3.96Å; A719-L812 HydrophobicContact CB-CD2 4.08Å
720	K	94.4	Very high	94.4	Very high	36 Å²	36	42.7 Å²	42.7	16%	0.157	22%	0.218	C	C	.	.	H	α-helix	trans	-58.5	-23	171.1	-82.6	-176	164.3	-173.2	0	113.1	L437 F438 V716 K717 R726	L437-K720 PolarHBondContact O-NZ 3.09Å; F438-K720 PolarHBondContact O-NZ 3.35Å; F438-K720 VanDerWaalsContact O-NZ 3.13Å; V716-K720 HydrophobicContact CG1-CD 4.47Å; V716-K720 WeakPolarHBondContact O-CB 3.26Å; V716-K720 PolarHBondContact O-N 3.05Å; K717-K720 PolarHBondContact O-N 3.21Å; K720-R726 VanDerWaalsContact O-CD 3.28Å; K720-R726 WeakPolarHBondContact O-CD 3.36Å; K720-R726 VanDerWaalsContact O-CG 3.25Å; K720-R726 WeakPolarHBondContact O-CG 3.47Å
721	A	94.1	Very high	94.3	Very high	45 Å²	45	41.8 Å²	41.8	37%	0.372	22%	0.22	S	C	.	.	H	α-helix	trans	-91.2	-10.1	177.5	0	0	0	0	0	114.4	I680 K717 W718 A719	I680-A721 HydrophobicContact CB-CB 3.93Å; I680-A721 HydrophobicContact CD1-CB 4.25Å; I680-A721 HydrophobicContact CG2-CB 3.66Å; K717-A721 PolarHBondContact O-N 3.35Å; K717-A721 VanDerWaalsContact O-N 3.12Å; W718-A721 WeakPolarHBondContact O-CA 3.45Å; W718-A721 WeakPolarHBondContact O-CB 3.41Å; W718-A721 PolarHBondContact O-N 3.07Å; A719-A721 PolarHBondContact O-N 3.05Å; A719-A721 VanDerWaalsContact O-N 3.15Å
722	L	94.8	Very high	94.3	Very high	5 Å²	5	41 Å²	41	3%	0.026	22%	0.216	C	C	.	.	S	Bend	trans	-67.4	134.8	179.9	-79	170.2	0	0	0	112.3	L677 I680 W718 A719 G724 F725 A809 L812 Y834	L677-L722 HydrophobicContact CD2-CD2 3.52Å; I680-L722 HydrophobicContact CD1-CD2 3.73Å; I680-L722 HydrophobicContact CD1-CG 4.09Å; W718-L722 HydrophobicContact CD2-CD1 4.49Å; W718-L722 HydrophobicContact CE3-CD1 4.32Å; W718-L722 HydrophobicContact CH2-CD1 3.94Å; W718-L722 HydrophobicContact CZ2-CD1 4.11Å; W718-L722 HydrophobicContact CZ2-CD2 4.26Å; W718-L722 HydrophobicContact CZ3-CD1 4.05Å; W718-L722 PolarHBondContact O-N 3.36Å; A719-L722 WeakPolarHBondContact O-CB 3.38Å; A719-L722 PolarHBondContact O-N 3.21Å; A719-L722 VanDerWaalsContact O-N 3.08Å; L722-G724 PolarHBondContact O-N 3.45Å; L722-G724 VanDerWaalsContact O-N 3.07Å; L722-F725 HydrophobicContact CB-CB 3.93Å; L722-F725 WeakPolarHBondContact O-CB 3.31Å; L722-F725 PolarHBondContact O-N 2.98Å; L722-A809 HydrophobicContact CD2-CB 4.1Å; L722-L812 HydrophobicContact CD1-CD2 3.29Å; L722-Y834 HydrophobicContact CD2-CE1 4.28Å
723	P	92.8	Very high	94.3	Very high	42 Å²	42	41.5 Å²	41.5	27%	0.273	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	114.7	174.4	-32	36.1	0	0	0	113.7	F673 V676 L830 Y834	F673-P723 HydrophobicContact CD2-CG 4.41Å; F673-P723 HydrophobicContact CE2-CB 3.9Å; F673-P723 HydrophobicContact CE2-CG 4.11Å; F673-P723 HydrophobicContact CZ-CB 4.44Å; F673-P723 HydrophobicContact CZ-CG 4.49Å; V676-P723 HydrophobicContact CG1-CG 3.82Å; P723-L830 WeakPolarHBondContact O-CD1 3.49Å; P723-Y834 WeakPolarHBondContact CD-OH 3.45Å; P723-Y834 PolarHBondContact O-OH 3.22Å
724	G	90.9	Very high	94.2	Very high	27 Å²	27	41.4 Å²	41.4	28%	0.278	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.7	-7.5	177.6	0	0	0	0	0	116.1	L722 N727 F826	L722-G724 PolarHBondContact O-N 3.45Å; L722-G724 VanDerWaalsContact O-N 3.07Å; G724-N727 WeakPolarHBondContact O-CB 3.34Å; G724-N727 PolarHBondContact O-N 3.22Å; G724-F826 WeakPolarHBondContact O-CE1 3.37Å
725	F	95.4	Very high	94.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-66.9	-42.7	-176.9	-175.9	-91.7	0	0	0	113.3	A719 L722 N727 L728 Q733 V736 I737 L812 F813	A719-F725 HydrophobicContact CB-CD1 4.35Å; A719-F725 HydrophobicContact CB-CE1 4.04Å; A719-F725 HydrophobicContact CB-CE2 4.46Å; A719-F725 HydrophobicContact CB-CZ 4.1Å; A719-F725 VanDerWaalsContact O-CB 3.25Å; A719-F725 WeakPolarHBondContact O-CB 3.29Å; A719-F725 WeakPolarHBondContact O-CD1 3.45Å; A719-F725 WeakPolarHBondContact O-CG 3.27Å; L722-F725 HydrophobicContact CB-CB 3.93Å; L722-F725 WeakPolarHBondContact O-CB 3.31Å; L722-F725 PolarHBondContact O-N 2.98Å; F725-N727 PolarHBondContact O-N 3.46Å; F725-L728 HydrophobicContact CD2-CD1 3.92Å; F725-L728 HydrophobicContact CE2-CD1 4.03Å; F725-L728 WeakPolarHBondContact O-CB 3.22Å; F725-L728 PolarHBondContact O-N 3.24Å; F725-Q733 HydrophobicContact CD1-CG 4.12Å; F725-Q733 HydrophobicContact CE1-CB 3.61Å; F725-Q733 HydrophobicContact CE1-CG 3.61Å; F725-Q733 HydrophobicContact CZ-CB 3.63Å; F725-Q733 HydrophobicContact CZ-CG 3.89Å; F725-V736 HydrophobicContact CE2-CG1 4.25Å; F725-I737 HydrophobicContact CE1-CD1 3.9Å; F725-I737 HydrophobicContact CZ-CD1 3.56Å; F725-I737 HydrophobicContact CZ-CG1 3.93Å; F725-L812 HydrophobicContact CD2-CD2 3.89Å; F725-L812 HydrophobicContact CE2-CD2 3.84Å; F725-L812 HydrophobicContact CE2-CG 4.38Å; F725-F813 AromaticContact CD2-CE1 3.84Å; F725-F813 HydrophobicContact CD2-CE1 3.84Å; F725-F813 AromaticContact CD2-CZ 3.94Å; F725-F813 HydrophobicContact CD2-CZ 3.94Å; F725-F813 HydrophobicContact CE2-CE1 4.34Å
726	R	93.6	Very high	94.2	Very high	121 Å²	121	38.6 Å²	38.6	46%	0.457	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-59.6	-10.7	176.5	-69.2	177.9	93.4	150.1	-2.3	113.6	E441 E442 K720 Q733	E441-R726 IonicContact OE1-NH2 2.69Å; E442-R726 IonicContact OE2-CZ 2.68Å; E442-R726 IonicContact OE2-NH1 2.74Å; E442-R726 PolarHBondContact OE2-NH1 3.23Å; E442-R726 IonicContact OE2-NH2 3.11Å; E442-R726 PolarHBondContact OE2-NH2 3.3Å; E442-R726 VanDerWaalsContact OE2-NH2 3.15Å; K720-R726 VanDerWaalsContact O-CD 3.28Å; K720-R726 WeakPolarHBondContact O-CD 3.36Å; K720-R726 VanDerWaalsContact O-CG 3.25Å; K720-R726 WeakPolarHBondContact O-CG 3.47Å; R726-Q733 PolarHBondContact O-NE2 3.13Å
727	N	92.2	Very high	94.3	Very high	118 Å²	118	38.4 Å²	38.4	63%	0.631	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-90.8	-9.6	179	-61.7	49.2	0	0	0	113.8	G724 F725 F826	G724-N727 WeakPolarHBondContact O-CB 3.34Å; G724-N727 PolarHBondContact O-N 3.22Å; F725-N727 PolarHBondContact O-N 3.46Å; N727-F826 HydrophobicContact CB-CE1 3.6Å; N727-F826 HydrophobicContact CB-CE2 4.48Å; N727-F826 HydrophobicContact CB-CZ 3.54Å
728	L	93.5	Very high	94.3	Very high	7 Å²	7	33.1 Å²	33.1	4%	0.037	18%	0.182	C	C	.	.	S	Bend	trans	-67.3	156.8	167.7	-75.9	162.6	0	0	0	110.2	F725 D732 Q733 F813 F826 F827 L830	F725-L728 HydrophobicContact CD2-CD1 3.92Å; F725-L728 HydrophobicContact CE2-CD1 4.03Å; F725-L728 WeakPolarHBondContact O-CB 3.22Å; F725-L728 PolarHBondContact O-N 3.24Å; L728-D732 HydrophobicContact CB-CB 4.3Å; L728-D732 HydrophobicContact CD2-CB 4.38Å; L728-Q733 HydrophobicContact CB-CG 3.65Å; L728-Q733 PolarHBondContact O-NE2 3.03Å; L728-F813 HydrophobicContact CD1-CE1 4.29Å; L728-F826 HydrophobicContact CD2-CD1 3.85Å; L728-F826 HydrophobicContact CD2-CE1 4.43Å; L728-F826 HydrophobicContact CG-CD1 4.08Å; L728-F826 HydrophobicContact CG-CE1 4.17Å; L728-F827 HydrophobicContact CD2-CB 3.95Å; L728-L830 HydrophobicContact CD1-CD2 4.03Å; L728-L830 HydrophobicContact CG-CD2 4.34Å
729	H	93.4	Very high	94.3	Very high	67 Å²	67	33.8 Å²	33.8	31%	0.31	18%	0.184	S	C	.	.			trans	-59.1	145.1	170	-172.7	-67.6	0	0	0	109.4	D731 D732 Q733 K822	H729-D731 VanDerWaalsContact C-N 3.33Å; H729-D731 VanDerWaalsContact CE1-CG 3.4Å; H729-D731 IonicContact CE1-OD1 3.73Å; H729-D731 IonicContact CE1-OD2 3.11Å; H729-D731 PolarHBondContact CE1-OD2 3.26Å; H729-D731 PolarHBondContact ND1-N 3.39Å; H729-D731 VanDerWaalsContact ND1-N 3.13Å; H729-D731 IonicContact ND1-OD1 2.88Å; H729-D731 IonicContact ND1-OD2 2.74Å; H729-D731 PolarHBondContact O-N 2.94Å; H729-D732 HydrophobicContact CB-CB 4.2Å; H729-D732 WeakPolarHBondContact CB-OD2 3.07Å; H729-D732 CarbonylContact O-C 3.59Å; H729-D732 WeakPolarHBondContact O-CA 3.39Å; H729-D732 WeakPolarHBondContact O-CB 3.43Å; H729-D732 PolarHBondContact O-N 3.39Å; H729-Q733 PolarHBondContact O-N 3.08Å; H729-K822 HydrophobicContact CB-CB 4.34Å; H729-K822 HydrophobicContact CB-CD 4.43Å; H729-K822 PolarHBondContact CE1-NZ 3.41Å; H729-K822 PolarHBondContact NE2-NZ 3.08Å
730	V	92.5	Very high	94.3	Very high	74 Å²	74	33.9 Å²	33.9	45%	0.448	19%	0.185	S	C	.	.	H	α-helix	trans	-55.4	-47	-176.7	-176.3	0	0	0	0	111.6	F438 D732 Q733 M734	F438-V730 HydrophobicContact CB-CG1 4.35Å; F438-V730 HydrophobicContact CD1-CG1 4.25Å; V730-D732 VanDerWaalsContact C-N 3.31Å; V730-D732 PolarHBondContact O-N 3.15Å; V730-Q733 WeakPolarHBondContact O-CB 3.16Å; V730-Q733 PolarHBondContact O-N 3.32Å; V730-Q733 VanDerWaalsContact O-N 3.1Å; V730-M734 HydrophobicContact CG1-CE 4.33Å; V730-M734 WeakPolarHBondContact O-CG 3.5Å; V730-M734 PolarHBondContact O-N 3.11Å
731	D	92.9	Very high	94.3	Very high	67 Å²	67	32.2 Å²	32.2	36%	0.358	18%	0.178	S	C	.	.	H	α-helix	trans	-58.2	-36.1	172.7	-47.6	-12.8	0	0	0	114.3	H729 M734 A735 K822	H729-D731 VanDerWaalsContact C-N 3.33Å; H729-D731 VanDerWaalsContact CE1-CG 3.4Å; H729-D731 IonicContact CE1-OD1 3.73Å; H729-D731 IonicContact CE1-OD2 3.11Å; H729-D731 PolarHBondContact CE1-OD2 3.26Å; H729-D731 PolarHBondContact ND1-N 3.39Å; H729-D731 VanDerWaalsContact ND1-N 3.13Å; H729-D731 IonicContact ND1-OD1 2.88Å; H729-D731 IonicContact ND1-OD2 2.74Å; H729-D731 PolarHBondContact O-N 2.94Å; D731-M734 HydrophobicContact CB-CE 4.38Å; D731-M734 PolarHBondContact O-N 2.85Å; D731-M734 WeakPolarHBondContact OD1-CE 3.29Å; D731-A735 VanDerWaalsContact O-CB 3.24Å; D731-A735 WeakPolarHBondContact O-CB 3.45Å; D731-A735 PolarHBondContact O-N 3.32Å; D731-K822 WeakPolarHBondContact OD2-CE 3.35Å; D731-K822 IonicContact OD2-NZ 2.66Å; D731-K822 PolarHBondContact OD2-NZ 3.14Å
732	D	95.3	Very high	94.5	Very high	6 Å²	6	30.6 Å²	30.6	3%	0.032	16%	0.163	C	C	.	.	H	α-helix	trans	-68.5	-40.4	174.6	-64.1	-19.3	0	0	0	110.2	L728 H729 V730 A735 V736 L821 K822 N823	L728-D732 HydrophobicContact CB-CB 4.3Å; L728-D732 HydrophobicContact CD2-CB 4.38Å; H729-D732 HydrophobicContact CB-CB 4.2Å; H729-D732 WeakPolarHBondContact CB-OD2 3.07Å; H729-D732 CarbonylContact O-C 3.59Å; H729-D732 WeakPolarHBondContact O-CA 3.39Å; H729-D732 WeakPolarHBondContact O-CB 3.43Å; H729-D732 PolarHBondContact O-N 3.39Å; V730-D732 VanDerWaalsContact C-N 3.31Å; V730-D732 PolarHBondContact O-N 3.15Å; D732-A735 PolarHBondContact O-N 3.45Å; D732-V736 VanDerWaalsContact O-CB 3.28Å; D732-V736 WeakPolarHBondContact O-CB 3.09Å; D732-V736 WeakPolarHBondContact O-CG2 3.28Å; D732-V736 PolarHBondContact O-N 2.99Å; D732-L821 HydrophobicContact CB-CD2 4.14Å; D732-K822 WeakPolarHBondContact OD1-CB 3.38Å; D732-K822 PolarHBondContact OD1-N 2.9Å; D732-K822 PolarHBondContact OD2-N 3.31Å; D732-N823 PolarHBondContact OD2-N 3.24Å
733	Q	95.1	Very high	94.6	Very high	12 Å²	12	30.5 Å²	30.5	6%	0.056	16%	0.163	C	C	.	.	H	α-helix	trans	-60.5	-47.4	174.2	-64.5	178.4	42.5	0	0	111.1	F438 F725 R726 L728 H729 V730 I737	F438-Q733 HydrophobicContact CE1-CB 3.98Å; F725-Q733 HydrophobicContact CD1-CG 4.12Å; F725-Q733 HydrophobicContact CE1-CB 3.61Å; F725-Q733 HydrophobicContact CE1-CG 3.61Å; F725-Q733 HydrophobicContact CZ-CB 3.63Å; F725-Q733 HydrophobicContact CZ-CG 3.89Å; R726-Q733 PolarHBondContact O-NE2 3.13Å; L728-Q733 HydrophobicContact CB-CG 3.65Å; L728-Q733 PolarHBondContact O-NE2 3.03Å; H729-Q733 PolarHBondContact O-N 3.08Å; V730-Q733 WeakPolarHBondContact O-CB 3.16Å; V730-Q733 PolarHBondContact O-N 3.32Å; V730-Q733 VanDerWaalsContact O-N 3.1Å; Q733-I737 WeakPolarHBondContact O-CD1 3.33Å; Q733-I737 WeakPolarHBondContact O-CG1 3.37Å; Q733-I737 PolarHBondContact O-N 3.11Å
734	M	93.5	Very high	94.8	Very high	25 Å²	25	28.6 Å²	28.6	12%	0.123	15%	0.151	C	C	.	.	H	α-helix	trans	-60.4	-51.8	176.7	-68.6	-170.1	-64.2	0	0	110.8	F438 V730 D731 V736 I737 Q738	F438-M734 HydrophobicContact CB-SD 4.46Å; F438-M734 HydrophobicContact CD1-CG 3.81Å; F438-M734 HydrophobicContact CD2-CG 3.73Å; F438-M734 HydrophobicContact CD2-SD 4.12Å; F438-M734 HydrophobicContact CE1-CG 3.82Å; F438-M734 HydrophobicContact CE2-CG 3.75Å; F438-M734 HydrophobicContact CG-CG 3.76Å; F438-M734 HydrophobicContact CG-SD 4.15Å; F438-M734 HydrophobicContact CZ-CB 4.46Å; F438-M734 HydrophobicContact CZ-CG 3.79Å; V730-M734 HydrophobicContact CG1-CE 4.33Å; V730-M734 WeakPolarHBondContact O-CG 3.5Å; V730-M734 PolarHBondContact O-N 3.11Å; D731-M734 HydrophobicContact CB-CE 4.38Å; D731-M734 PolarHBondContact O-N 2.85Å; D731-M734 WeakPolarHBondContact OD1-CE 3.29Å; M734-V736 PolarHBondContact O-N 3.25Å; M734-I737 PolarHBondContact O-N 2.84Å; M734-Q738 VanDerWaalsContact O-CB 3.24Å; M734-Q738 WeakPolarHBondContact O-CB 3.21Å; M734-Q738 WeakPolarHBondContact O-CG 3.19Å; M734-Q738 PolarHBondContact O-N 2.96Å
735	A	94.8	Very high	95.1	Very high	17 Å²	17	28.4 Å²	28.4	14%	0.14	14%	0.142	C	C	.	.	H	α-helix	trans	-59	-47.6	-179.5	0	0	0	0	0	112.6	D731 D732 I737 Q738 Y739 L821	D731-A735 VanDerWaalsContact O-CB 3.24Å; D731-A735 WeakPolarHBondContact O-CB 3.45Å; D731-A735 PolarHBondContact O-N 3.32Å; D732-A735 PolarHBondContact O-N 3.45Å; A735-I737 VanDerWaalsContact C-N 3.33Å; A735-I737 PolarHBondContact O-N 2.82Å; A735-Q738 PolarHBondContact O-N 3.33Å; A735-Y739 HydrophobicContact CB-CD2 4.31Å; A735-Y739 HydrophobicContact CB-CE2 3.94Å; A735-Y739 WeakPolarHBondContact O-CD2 3.33Å; A735-Y739 PolarHBondContact O-N 2.88Å; A735-L821 HydrophobicContact CB-CD2 4.42Å
736	V	96.3	Very high	95.2	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-40.2	-178.9	168.7	0	0	0	0	111.5	F725 D732 M734 S740 L812 F813 L821 F827	F725-V736 HydrophobicContact CE2-CG1 4.25Å; D732-V736 VanDerWaalsContact O-CB 3.28Å; D732-V736 WeakPolarHBondContact O-CB 3.09Å; D732-V736 WeakPolarHBondContact O-CG2 3.28Å; D732-V736 PolarHBondContact O-N 2.99Å; M734-V736 PolarHBondContact O-N 3.25Å; V736-S740 VanDerWaalsContact O-CB 3.3Å; V736-S740 WeakPolarHBondContact O-CB 3.37Å; V736-S740 PolarHBondContact O-N 2.99Å; V736-S740 PolarHBondContact O-OG 2.89Å; V736-L812 HydrophobicContact CG1-CD1 3.8Å; V736-L812 HydrophobicContact CG1-CG 3.83Å; V736-L812 VanDerWaalsContact CG1-O 3.28Å; V736-L812 WeakPolarHBondContact CG1-O 3.4Å; V736-F813 HydrophobicContact CG1-CD1 4.46Å; V736-L821 HydrophobicContact CG2-CD1 3.89Å; V736-L821 HydrophobicContact CG2-CD2 4.26Å; V736-F827 HydrophobicContact CG1-CE2 4.4Å; V736-F827 HydrophobicContact CG2-CD2 4.08Å; V736-F827 HydrophobicContact CG2-CE2 3.75Å
737	I	96.4	Very high	95.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-70.2	-48.4	174	-69.1	160.3	0	0	0	111.1	W434 F438 V715 V716 A719 F725 Q733 M734 A735 Y739 S740 W741 L812	W434-I737 HydrophobicContact CH2-CG2 4.47Å; W434-I737 HydrophobicContact CZ3-CG2 4.36Å; F438-I737 HydrophobicContact CE1-CD1 4.29Å; F438-I737 HydrophobicContact CZ-CD1 3.75Å; V715-I737 HydrophobicContact CG1-CG2 4.29Å; V716-I737 HydrophobicContact CG2-CG2 4.22Å; A719-I737 HydrophobicContact CB-CD1 3.65Å; A719-I737 HydrophobicContact CB-CG1 3.96Å; F725-I737 HydrophobicContact CE1-CD1 3.9Å; F725-I737 HydrophobicContact CZ-CD1 3.56Å; F725-I737 HydrophobicContact CZ-CG1 3.93Å; Q733-I737 WeakPolarHBondContact O-CD1 3.33Å; Q733-I737 WeakPolarHBondContact O-CG1 3.37Å; Q733-I737 PolarHBondContact O-N 3.11Å; M734-I737 PolarHBondContact O-N 2.84Å; A735-I737 VanDerWaalsContact C-N 3.33Å; A735-I737 PolarHBondContact O-N 2.82Å; I737-Y739 PolarHBondContact O-N 2.97Å; I737-S740 PolarHBondContact O-N 3.26Å; I737-W741 PolarHBondContact O-N 3.4Å; I737-W741 VanDerWaalsContact O-N 3.08Å; I737-L812 HydrophobicContact CG1-CD1 3.87Å
738	Q	95.5	Very high	95.6	Very high	18 Å²	18	17.8 Å²	17.8	8%	0.084	10%	0.096	C	C	.	.	H	α-helix	trans	-65.5	-20.2	-175.2	-74.9	-176.4	-17.7	0	0	114.4	M734 A735 W741 I898 Q902	M734-Q738 VanDerWaalsContact O-CB 3.24Å; M734-Q738 WeakPolarHBondContact O-CB 3.21Å; M734-Q738 WeakPolarHBondContact O-CG 3.19Å; M734-Q738 PolarHBondContact O-N 2.96Å; A735-Q738 PolarHBondContact O-N 3.33Å; Q738-W741 PolarHBondContact O-NE1 3.41Å; Q738-I898 HydrophobicContact CB-CD1 4.29Å; Q738-I898 HydrophobicContact CB-CG1 4.5Å; Q738-I898 HydrophobicContact CG-CD1 3.86Å; Q738-I898 HydrophobicContact CG-CG1 4.04Å; Q738-Q902 HydrophobicContact CB-CG 4.23Å
739	Y	95.9	Very high	95.8	Very high	21 Å²	21	17.6 Å²	17.6	8%	0.082	10%	0.096	C	C	.	.	H	α-helix	trans	-94.9	-32.8	171.9	-59.5	-47.7	0	0	0	113.9	A735 I737 P817 H874 Q902 I906 V911	A735-Y739 HydrophobicContact CB-CD2 4.31Å; A735-Y739 HydrophobicContact CB-CE2 3.94Å; A735-Y739 WeakPolarHBondContact O-CD2 3.33Å; A735-Y739 PolarHBondContact O-N 2.88Å; I737-Y739 PolarHBondContact O-N 2.97Å; Y739-P817 HydrophobicContact CE2-CG 4.05Å; Y739-H874 PolarHBondContact O-CE1 2.81Å; Y739-Q902 HydrophobicContact CD1-CB 4.4Å; Y739-Q902 HydrophobicContact CE1-CB 4.11Å; Y739-I906 HydrophobicContact CD1-CD1 4Å; Y739-I906 HydrophobicContact CD1-CG1 3.82Å; Y739-I906 HydrophobicContact CE1-CG1 4.43Å; Y739-V911 HydrophobicContact CD1-CG1 4Å; Y739-V911 HydrophobicContact CD1-CG2 3.83Å; Y739-V911 HydrophobicContact CD2-CG1 3.91Å; Y739-V911 HydrophobicContact CE1-CG1 4.43Å; Y739-V911 HydrophobicContact CE1-CG2 3.53Å; Y739-V911 HydrophobicContact CE2-CG1 4.35Å; Y739-V911 HydrophobicContact CE2-CG2 4.29Å; Y739-V911 HydrophobicContact CG-CG1 3.72Å; Y739-V911 HydrophobicContact CG-CG2 4.33Å
740	S	96.5	Very high	96	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.014	8%	0.081	C	C	.	.	H	α-helix	trans	-90.9	-16.3	-173.5	64.7	0	0	0	0	115.9	V736 I737 M742 G743 L744 L812	V736-S740 VanDerWaalsContact O-CB 3.3Å; V736-S740 WeakPolarHBondContact O-CB 3.37Å; V736-S740 PolarHBondContact O-N 2.99Å; V736-S740 PolarHBondContact O-OG 2.89Å; I737-S740 PolarHBondContact O-N 3.26Å; S740-M742 VanDerWaalsContact C-N 3.31Å; S740-M742 PolarHBondContact O-N 3.29Å; S740-M742 VanDerWaalsContact O-N 3.11Å; S740-G743 PolarHBondContact O-N 3.36Å; S740-L744 PolarHBondContact O-N 3.19Å; S740-L812 WeakPolarHBondContact OG-CD1 3.5Å
741	W	95.7	Very high	96.2	Very high	1 Å²	1	12.7 Å²	12.7	0%	0.004	7%	0.066	C	C	.	.	H	α-helix	trans	-46.8	-44.6	-172.3	69.3	-81.5	0	0	0	115.4	L712 I737 Q738 L744 M745 H874 M895 I898 I899	L712-W741 HydrophobicContact CD2-CB 3.61Å; L712-W741 HydrophobicContact CD2-CD2 4.17Å; L712-W741 HydrophobicContact CD2-CE3 4.18Å; L712-W741 HydrophobicContact CD2-CG 3.97Å; I737-W741 PolarHBondContact O-N 3.4Å; I737-W741 VanDerWaalsContact O-N 3.08Å; Q738-W741 PolarHBondContact O-NE1 3.41Å; W741-L744 PolarHBondContact O-N 3.31Å; W741-M745 HydrophobicContact CE3-CE 3.71Å; W741-M745 HydrophobicContact CE3-SD 3.66Å; W741-M745 HydrophobicContact CZ3-CE 4.12Å; W741-M745 HydrophobicContact CZ3-SD 3.84Å; W741-M745 WeakPolarHBondContact O-CG 3.15Å; W741-M745 PolarHBondContact O-N 3.33Å; W741-H874 AromaticContact CD1-NE2 3.23Å; W741-H874 AromaticContact CD2-NE2 3.62Å; W741-H874 AromaticContact CE2-NE2 2.79Å; W741-H874 AromaticContact CG-NE2 3.87Å; W741-H874 AromaticContact CZ2-CD2 3.87Å; W741-H874 AromaticContact CZ2-NE2 3.26Å; W741-H874 VanDerWaalsContact CZ2-NE2 3.26Å; W741-H874 WeakPolarHBondContact CZ2-NE2 3.37Å; W741-H874 AromaticContact NE1-NE2 2.47Å; W741-H874 PolarHBondContact NE1-NE2 3.33Å; W741-M895 HydrophobicContact CH2-CE 3.87Å; W741-M895 HydrophobicContact CZ3-CE 3.83Å; W741-I898 HydrophobicContact CD2-CG2 4.48Å; W741-I898 HydrophobicContact CZ2-CG2 3.76Å; W741-I898 VanDerWaalsContact NE1-CG2 3.27Å; W741-I899 HydrophobicContact CH2-CG1 4.46Å; W741-I899 HydrophobicContact CZ2-CG1 4.33Å
742	M	96.8	Very high	96.2	Very high	12 Å²	12	11.5 Å²	11.5	6%	0.059	6%	0.057	C	C	.	.	H	α-helix	trans	-65.5	-42.4	-178.5	-177.4	66.7	80.9	0	0	111.2	S740 L744 M745 V746 A870 L873 H874	S740-M742 VanDerWaalsContact C-N 3.31Å; S740-M742 PolarHBondContact O-N 3.29Å; S740-M742 VanDerWaalsContact O-N 3.11Å; M742-L744 VanDerWaalsContact C-N 3.34Å; M742-M745 PolarHBondContact O-N 3.41Å; M742-V746 HydrophobicContact CG-CG2 4.43Å; M742-V746 VanDerWaalsContact O-CB 3.32Å; M742-V746 WeakPolarHBondContact O-CB 3.44Å; M742-V746 WeakPolarHBondContact O-CG2 3.19Å; M742-V746 PolarHBondContact O-N 3.15Å; M742-V746 HydrophobicContact SD-CG2 4.27Å; M742-A870 HydrophobicContact CB-CB 4.3Å; M742-A870 HydrophobicContact CG-CB 3.98Å; M742-L873 HydrophobicContact CE-CB 3.84Å; M742-L873 HydrophobicContact CG-CB 3.96Å; M742-L873 HydrophobicContact SD-CB 3.65Å; M742-L873 HydrophobicContact SD-CD1 4.17Å; M742-L873 HydrophobicContact SD-CG 4.47Å; M742-H874 WeakPolarHBondContact CB-NE2 3.48Å
743	G	97.3	Very high	96.2	Very high	3 Å²	3	11.2 Å²	11.2	3%	0.031	6%	0.055	C	C	.	.	H	α-helix	trans	-63.2	-40.9	174.7	0	0	0	0	0	112.1	S740 F747	S740-G743 PolarHBondContact O-N 3.36Å; G743-F747 WeakPolarHBondContact O-CB 3.27Å; G743-F747 PolarHBondContact O-N 3.5Å
744	L	97.5	Very high	96.1	Very high	2 Å²	2	12.9 Å²	12.9	1%	0.01	6%	0.062	C	C	.	.	H	α-helix	trans	-64	-45.6	175.7	-69.5	168.8	0	0	0	112.4	V715 W718 S740 W741 M742 A748 K808 L811 L812	V715-L744 HydrophobicContact CG1-CD1 4.04Å; W718-L744 HydrophobicContact CH2-CD2 3.92Å; W718-L744 HydrophobicContact CZ3-CD1 4.05Å; W718-L744 HydrophobicContact CZ3-CD2 4Å; S740-L744 PolarHBondContact O-N 3.19Å; W741-L744 PolarHBondContact O-N 3.31Å; M742-L744 VanDerWaalsContact C-N 3.34Å; L744-A748 VanDerWaalsContact O-CB 3.28Å; L744-A748 WeakPolarHBondContact O-CB 3.36Å; L744-A748 PolarHBondContact O-N 3.42Å; L744-K808 HydrophobicContact CD2-CG 4.11Å; L744-K808 WeakPolarHBondContact CD2-O 3.47Å; L744-L811 HydrophobicContact CD2-CB 3.93Å; L744-L812 HydrophobicContact CD1-CB 4.25Å; L744-L812 HydrophobicContact CD1-CD1 3.94Å; L744-L812 HydrophobicContact CD2-CB 4.33Å
745	M	96.4	Very high	96	Very high	22 Å²	22	15.2 Å²	15.2	11%	0.108	8%	0.078	C	C	.	.	H	α-helix	trans	-61.7	-49.5	176.2	-76.5	-175	-175.6	0	0	111.7	G708 Q711 L712 W741 M742 F747 A748 M749	G708-M745 WeakPolarHBondContact O-CE 3.32Å; Q711-M745 HydrophobicContact CB-CE 3.97Å; L712-M745 HydrophobicContact CD1-CE 4.37Å; L712-M745 HydrophobicContact CD2-CE 4.04Å; L712-M745 HydrophobicContact CG-CE 3.63Å; W741-M745 HydrophobicContact CE3-CE 3.71Å; W741-M745 HydrophobicContact CE3-SD 3.66Å; W741-M745 HydrophobicContact CZ3-CE 4.12Å; W741-M745 HydrophobicContact CZ3-SD 3.84Å; W741-M745 WeakPolarHBondContact O-CG 3.15Å; W741-M745 PolarHBondContact O-N 3.33Å; M742-M745 PolarHBondContact O-N 3.41Å; M745-F747 PolarHBondContact O-N 2.69Å; M745-A748 PolarHBondContact O-N 3.34Å; M745-M749 WeakPolarHBondContact O-CB 3.26Å; M745-M749 PolarHBondContact O-N 3.07Å
746	V	97.6	Very high	95.4	Very high	5 Å²	5	18.3 Å²	18.3	3%	0.03	9%	0.093	C	C	.	.	H	α-helix	trans	-62.2	-42.8	-178.9	168.1	0	0	0	0	111.3	M742 G750 M787 L790 I869 L873	M742-V746 HydrophobicContact CG-CG2 4.43Å; M742-V746 VanDerWaalsContact O-CB 3.32Å; M742-V746 WeakPolarHBondContact O-CB 3.44Å; M742-V746 WeakPolarHBondContact O-CG2 3.19Å; M742-V746 PolarHBondContact O-N 3.15Å; M742-V746 HydrophobicContact SD-CG2 4.27Å; V746-G750 PolarHBondContact O-N 2.72Å; V746-M787 HydrophobicContact CG1-CG 4.14Å; V746-M787 HydrophobicContact CG2-SD 4.14Å; V746-L790 HydrophobicContact CG1-CD2 3.6Å; V746-I869 HydrophobicContact CG1-CG2 4Å; V746-L873 HydrophobicContact CG2-CD1 3.32Å
747	F	98.2	Very high	94.7	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-66.1	-45.2	177.2	-168.5	-104	0	0	0	112.1	G743 M745 G750 W751 F794 F804 M807 K808 L811 L863 V866	G743-F747 WeakPolarHBondContact O-CB 3.27Å; G743-F747 PolarHBondContact O-N 3.5Å; M745-F747 PolarHBondContact O-N 2.69Å; F747-G750 PolarHBondContact O-N 2.88Å; F747-W751 PolarHBondContact O-N 3.45Å; F747-F794 HydrophobicContact CD2-CE1 4.05Å; F747-F794 AromaticContact CD2-CZ 3.57Å; F747-F794 HydrophobicContact CD2-CZ 3.57Å; F747-F794 AromaticContact CE2-CE1 3.52Å; F747-F794 HydrophobicContact CE2-CE1 3.52Å; F747-F794 AromaticContact CE2-CZ 3.51Å; F747-F794 HydrophobicContact CE2-CZ 3.51Å; F747-F794 HydrophobicContact CG-CZ 4.21Å; F747-F794 HydrophobicContact CZ-CE1 4.04Å; F747-F794 HydrophobicContact CZ-CZ 4.09Å; F747-F804 AromaticContact CD1-CD2 3.92Å; F747-F804 HydrophobicContact CD1-CD2 3.92Å; F747-F804 AromaticContact CD1-CE2 3.44Å; F747-F804 HydrophobicContact CD1-CE2 3.44Å; F747-F804 VanDerWaalsContact CD1-CE2 3.44Å; F747-F804 HydrophobicContact CD1-CZ 4.37Å; F747-F804 AromaticContact CE1-CD2 3.31Å; F747-F804 HydrophobicContact CE1-CD2 3.31Å; F747-F804 AromaticContact CE1-CE2 3.37Å; F747-F804 HydrophobicContact CE1-CE2 3.37Å; F747-F804 HydrophobicContact CE1-CG 4.36Å; F747-F804 HydrophobicContact CE1-CZ 4.45Å; F747-F804 HydrophobicContact CG-CE2 4.45Å; F747-F804 AromaticContact CZ-CD2 3.96Å; F747-F804 HydrophobicContact CZ-CD2 3.96Å; F747-F804 HydrophobicContact CZ-CE2 4.33Å; F747-M807 HydrophobicContact CE1-CB 3.97Å; F747-M807 HydrophobicContact CE2-CE 4.13Å; F747-M807 HydrophobicContact CZ-CB 3.61Å; F747-M807 HydrophobicContact CZ-CE 3.93Å; F747-M807 HydrophobicContact CZ-SD 4.42Å; F747-K808 HydrophobicContact CD1-CB 4.03Å; F747-K808 HydrophobicContact CD1-CG 4.45Å; F747-K808 HydrophobicContact CE1-CB 3.99Å; F747-L811 HydrophobicContact CB-CD1 3.49Å; F747-L811 VanDerWaalsContact CB-CD1 3.49Å; F747-L811 HydrophobicContact CD1-CD1 3.7Å; F747-L811 HydrophobicContact CD2-CD1 3.56Å; F747-L811 HydrophobicContact CE1-CD1 4.28Å; F747-L811 HydrophobicContact CE2-CD1 4.16Å; F747-L811 HydrophobicContact CG-CD1 3.3Å; F747-L863 HydrophobicContact CE2-CD2 4.04Å; F747-L863 HydrophobicContact CZ-CD2 4.23Å; F747-V866 HydrophobicContact CD2-CG2 3.84Å
748	A	97.3	Very high	93.8	Very high	11 Å²	11	25.3 Å²	25.3	9%	0.091	13%	0.131	C	C	.	.	H	α-helix	trans	-69.1	-35.6	177.6	0	0	0	0	0	113.2	L744 M745 W751 R752	L744-A748 VanDerWaalsContact O-CB 3.28Å; L744-A748 WeakPolarHBondContact O-CB 3.36Å; L744-A748 PolarHBondContact O-N 3.42Å; M745-A748 PolarHBondContact O-N 3.34Å; A748-W751 PolarHBondContact O-N 3.33Å; A748-R752 WeakPolarHBondContact O-CG 3.45Å; A748-R752 PolarHBondContact O-N 3.34Å; A748-R752 PolarHBondContact O-NH1 3.11Å
749	M	96.4	Very high	93.3	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.02	13%	0.129	C	C	.	.	H	α-helix	trans	-66.7	-42.8	173.6	178.5	-69	-51.5	0	0	110.9	M745 W751 R752 S753 L762 F764 M787	M745-M749 WeakPolarHBondContact O-CB 3.26Å; M745-M749 PolarHBondContact O-N 3.07Å; M749-W751 VanDerWaalsContact C-N 3.27Å; M749-W751 PolarHBondContact O-N 2.89Å; M749-R752 PolarHBondContact O-N 2.47Å; M749-S753 WeakPolarHBondContact O-CB 3.49Å; M749-S753 PolarHBondContact O-N 3.48Å; M749-S753 PolarHBondContact O-OG 3.27Å; M749-S753 PolarHBondContact SD-OG 3.41Å; M749-L762 HydrophobicContact CE-CD2 4.13Å; M749-L762 HydrophobicContact SD-CB 4.04Å; M749-L762 HydrophobicContact SD-CD2 3.94Å; M749-L762 HydrophobicContact SD-CG 4.48Å; M749-F764 HydrophobicContact CG-CD1 3.61Å; M749-F764 HydrophobicContact CG-CE1 3.92Å; M749-F764 HydrophobicContact CG-CG 4.08Å; M749-F764 HydrophobicContact SD-CD1 4.48Å; M749-F764 HydrophobicContact SD-CE1 4.37Å; M749-M787 HydrophobicContact CE-CB 3.76Å; M749-M787 HydrophobicContact CE-CG 4.07Å; M749-M787 HydrophobicContact CE-SD 3.85Å
750	G	97.3	Very high	92.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.4	-38.2	173.7	0	0	0	0	0	111.8	V746 F747 S753 F754 S791	V746-G750 PolarHBondContact O-N 2.72Å; F747-G750 PolarHBondContact O-N 2.88Å; G750-S753 WeakPolarHBondContact O-CB 3.23Å; G750-S753 PolarHBondContact O-N 3.34Å; G750-F754 WeakPolarHBondContact O-CB 3.46Å; G750-F754 PolarHBondContact O-N 3.02Å; G750-S791 PolarHBondContact O-OG 3.31Å; G750-S791 VanDerWaalsContact O-OG 3.08Å
751	W	96.7	Very high	92	Very high	37 Å²	37	36.6 Å²	36.6	14%	0.14	18%	0.178	C	C	.	.	H	α-helix	trans	-66	-47.3	177.4	179.5	-103.2	0	0	0	111.6	F747 A748 M749 S753 F754 T755 F794 I799 P801 F804	F747-W751 PolarHBondContact O-N 3.45Å; A748-W751 PolarHBondContact O-N 3.33Å; M749-W751 VanDerWaalsContact C-N 3.27Å; M749-W751 PolarHBondContact O-N 2.89Å; W751-S753 PolarHBondContact O-N 3.13Å; W751-F754 HydrophobicContact CE3-CD1 4.05Å; W751-F754 HydrophobicContact CH2-CE1 4.45Å; W751-F754 AromaticContact CZ3-CD1 3.95Å; W751-F754 HydrophobicContact CZ3-CD1 3.95Å; W751-F754 HydrophobicContact CZ3-CE1 4.06Å; W751-F754 PolarHBondContact O-N 2.64Å; W751-T755 HydrophobicContact CD2-CG2 4.33Å; W751-T755 HydrophobicContact CZ2-CG2 4.12Å; W751-T755 PolarHBondContact O-N 3.22Å; W751-T755 PolarHBondContact O-OG1 3.19Å; W751-F794 HydrophobicContact CB-CE2 4.27Å; W751-F794 VanDerWaalsContact N-CE2 3.33Å; W751-I799 WeakPolarHBondContact CH2-O 3.48Å; W751-I799 HydrophobicContact CZ3-CB 4.13Å; W751-I799 HydrophobicContact CZ3-CG2 3.93Å; W751-I799 WeakPolarHBondContact CZ3-O 3.48Å; W751-P801 HydrophobicContact CH2-CG 4.28Å; W751-P801 HydrophobicContact CZ2-CB 4.14Å; W751-P801 HydrophobicContact CZ2-CG 4.03Å; W751-F804 HydrophobicContact CB-CD2 3.76Å; W751-F804 HydrophobicContact CB-CE1 4.42Å; W751-F804 HydrophobicContact CB-CE2 3.3Å; W751-F804 HydrophobicContact CB-CG 4.5Å; W751-F804 HydrophobicContact CB-CZ 3.69Å; W751-F804 AromaticContact CD1-CD1 3.98Å; W751-F804 AromaticContact CD1-CE1 3.71Å; W751-F804 AromaticContact CD1-CZ 3.79Å; W751-F804 HydrophobicContact CD2-CB 4.07Å; W751-F804 AromaticContact CD2-CD1 3.94Å; W751-F804 HydrophobicContact CD2-CD1 3.94Å; W751-F804 AromaticContact CD2-CD2 3.6Å; W751-F804 HydrophobicContact CD2-CD2 3.6Å; W751-F804 HydrophobicContact CD2-CE1 4.33Å; W751-F804 HydrophobicContact CD2-CE2 4.03Å; W751-F804 AromaticContact CD2-CG 3.56Å; W751-F804 HydrophobicContact CD2-CG 3.56Å; W751-F804 HydrophobicContact CD2-CZ 4.37Å; W751-F804 AromaticContact CE2-CD1 3.89Å; W751-F804 AromaticContact CE2-CG 3.88Å; W751-F804 HydrophobicContact CE3-CB 3.85Å; W751-F804 AromaticContact CE3-CD2 3.7Å; W751-F804 HydrophobicContact CE3-CD2 3.7Å; W751-F804 HydrophobicContact CE3-CE2 4.46Å; W751-F804 AromaticContact CE3-CG 3.76Å; W751-F804 HydrophobicContact CE3-CG 3.76Å; W751-F804 HydrophobicContact CG-CD1 4.02Å; W751-F804 AromaticContact CG-CD2 3.64Å; W751-F804 HydrophobicContact CG-CD2 3.64Å; W751-F804 AromaticContact CG-CE1 3.91Å; W751-F804 HydrophobicContact CG-CE1 3.91Å; W751-F804 AromaticContact CG-CE2 3.53Å; W751-F804 HydrophobicContact CG-CE2 3.53Å; W751-F804 AromaticContact CG-CG 3.9Å; W751-F804 HydrophobicContact CG-CG 3.9Å; W751-F804 AromaticContact CG-CZ 3.66Å; W751-F804 HydrophobicContact CG-CZ 3.66Å; W751-F804 HydrophobicContact CH2-CB 4.04Å; W751-F804 HydrophobicContact CZ2-CB 4.23Å; W751-F804 HydrophobicContact CZ2-CD1 4.48Å; W751-F804 HydrophobicContact CZ2-CG 4.37Å; W751-F804 HydrophobicContact CZ3-CB 3.85Å; W751-F804 HydrophobicContact CZ3-CG 4.26Å; W751-F804 AromaticContact NE1-CD1 3.89Å
752	R	94.3	Very high	92	Very high	42 Å²	42	36.5 Å²	36.5	16%	0.158	18%	0.178	C	C	.	.	H	α-helix	trans	-58.5	-36.8	171.9	-66.2	-173.1	-61.6	-91.9	16.6	112.5	A748 M749 T755 N756 Y763 F764	A748-R752 WeakPolarHBondContact O-CG 3.45Å; A748-R752 PolarHBondContact O-N 3.34Å; A748-R752 PolarHBondContact O-NH1 3.11Å; M749-R752 PolarHBondContact O-N 2.47Å; R752-T755 PolarHBondContact O-OG1 3.46Å; R752-N756 WeakPolarHBondContact O-CB 3.49Å; R752-N756 PolarHBondContact O-N 3.07Å; R752-Y763 HydrophobicContact CB-CD1 3.77Å; R752-Y763 HydrophobicContact CB-CG 4.39Å; R752-Y763 PolarHBondContact NE-O 3Å; R752-F764 PolarHBondContact NE-O 3.33Å; R752-F764 PolarHBondContact NH2-O 3.23Å
753	S	94.3	Very high	91.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-68.6	-38.2	178.9	-59.1	0	0	0	0	112	M749 G750 W751 V757 N758 S759 Y763 S791	M749-S753 WeakPolarHBondContact O-CB 3.49Å; M749-S753 PolarHBondContact O-N 3.48Å; M749-S753 PolarHBondContact O-OG 3.27Å; M749-S753 PolarHBondContact SD-OG 3.41Å; G750-S753 WeakPolarHBondContact O-CB 3.23Å; G750-S753 PolarHBondContact O-N 3.34Å; W751-S753 PolarHBondContact O-N 3.13Å; S753-V757 CarbonylContact O-C 3.38Å; S753-V757 WeakPolarHBondContact O-CG2 3.37Å; S753-V757 PolarHBondContact O-N 2.94Å; S753-N758 PolarHBondContact O-N 3.34Å; S753-S759 PolarHBondContact O-N 3.42Å; S753-Y763 PolarHBondContact OG-N 3.39Å; S753-S791 WeakPolarHBondContact CB-OG 3.32Å
754	F	94.3	Very high	91.6	Very high	47 Å²	47	38.7 Å²	38.7	21%	0.206	19%	0.185	C	C	.	.	H	α-helix	trans	-65.9	-52.8	171.9	169.1	-125.1	0	0	0	111.6	G750 W751 N758 S759 S791 F794	G750-F754 WeakPolarHBondContact O-CB 3.46Å; G750-F754 PolarHBondContact O-N 3.02Å; W751-F754 HydrophobicContact CE3-CD1 4.05Å; W751-F754 HydrophobicContact CH2-CE1 4.45Å; W751-F754 AromaticContact CZ3-CD1 3.95Å; W751-F754 HydrophobicContact CZ3-CD1 3.95Å; W751-F754 HydrophobicContact CZ3-CE1 4.06Å; W751-F754 PolarHBondContact O-N 2.64Å; F754-N758 WeakPolarHBondContact O-CA 3.45Å; F754-N758 PolarHBondContact O-N 2.86Å; F754-S759 WeakPolarHBondContact CA-OG 3.44Å; F754-S791 PolarHBondContact N-OG 3Å; F754-S791 VanDerWaalsContact N-OG 3.11Å; F754-F794 HydrophobicContact CB-CB 4.09Å; F754-F794 HydrophobicContact CB-CD2 4.27Å; F754-F794 HydrophobicContact CD1-CB 3.85Å; F754-F794 HydrophobicContact CD2-CB 4.47Å; F754-F794 HydrophobicContact CE1-CB 4.42Å; F754-F794 HydrophobicContact CG-CB 3.88Å
755	T	89.6	Confident	91.4	Very high	74 Å²	74	38.6 Å²	38.6	45%	0.454	19%	0.185	S	C	.	.	H	α-helix	trans	-69.9	-38.7	-175	57.6	0	0	0	0	113.6	W751 R752	W751-T755 HydrophobicContact CD2-CG2 4.33Å; W751-T755 HydrophobicContact CZ2-CG2 4.12Å; W751-T755 PolarHBondContact O-N 3.22Å; W751-T755 PolarHBondContact O-OG1 3.19Å; R752-T755 PolarHBondContact O-OG1 3.46Å
756	N	83.8	Confident	90.9	Very high	83 Å²	83	40.5 Å²	40.5	44%	0.444	20%	0.198	S	C	.	.	H	α-helix	trans	-100.5	-27.2	-167.5	-58.3	7.1	0	0	0	113.6	R752 Y763	R752-N756 WeakPolarHBondContact O-CB 3.49Å; R752-N756 PolarHBondContact O-N 3.07Å; N756-Y763 HydrophobicContact CB-CD2 3.87Å; N756-Y763 HydrophobicContact CB-CE2 3.93Å; N756-Y763 HydrophobicContact CB-CG 4.22Å; N756-Y763 VanDerWaalsContact ND2-CE1 3.32Å; N756-Y763 WeakPolarHBondContact ND2-CE1 3.34Å; N756-Y763 VanDerWaalsContact ND2-CZ 3.29Å
757	V	81.3	Confident	90.3	Very high	39 Å²	39	41.8 Å²	41.8	24%	0.236	21%	0.205	C	C	.	.	H	α-helix	trans	-134.3	18.9	-176.4	-63.7	0	0	0	0	113.3	S753 S759 R760 M761 Y763	S753-V757 CarbonylContact O-C 3.38Å; S753-V757 WeakPolarHBondContact O-CG2 3.37Å; S753-V757 PolarHBondContact O-N 2.94Å; V757-S759 PolarHBondContact O-N 3.16Å; V757-S759 VanDerWaalsContact O-N 3.1Å; V757-R760 PolarHBondContact O-N 3.03Å; V757-R760 VanDerWaalsContact O-N 3.11Å; V757-M761 HydrophobicContact CB-CB 4.34Å; V757-M761 HydrophobicContact CG2-CB 4.04Å; V757-M761 VanDerWaalsContact CG2-O 3.28Å; V757-M761 WeakPolarHBondContact CG2-O 3.46Å; V757-Y763 HydrophobicContact CG1-CD2 4.02Å
758	N	77.3	Confident	90	Very high	109 Å²	109	41.8 Å²	41.8	58%	0.583	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.3	41.2	175.6	-164.8	9.2	0	0	0	113.2	S753 F754 R760	S753-N758 PolarHBondContact O-N 3.34Å; F754-N758 WeakPolarHBondContact O-CA 3.45Å; F754-N758 PolarHBondContact O-N 2.86Å; N758-R760 PolarHBondContact O-N 3.12Å
759	S	84.4	Confident	89.7	Confident	6 Å²	6	42.8 Å²	42.8	4%	0.042	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	19.4	177.7	-50.3	0	0	0	0	115.7	S753 F754 V757 R788 S791 Q792	S753-S759 PolarHBondContact O-N 3.42Å; F754-S759 WeakPolarHBondContact CA-OG 3.44Å; V757-S759 PolarHBondContact O-N 3.16Å; V757-S759 VanDerWaalsContact O-N 3.1Å; S759-R788 VanDerWaalsContact O-CG 3.31Å; S759-R788 WeakPolarHBondContact O-CG 3.47Å; S759-S791 VanDerWaalsContact CB-OG 3.29Å; S759-S791 WeakPolarHBondContact CB-OG 3.29Å; S759-S791 PolarHBondContact OG-O 3.04Å; S759-S791 PolarHBondContact OG-OG 3.42Å; S759-Q792 PolarHBondContact O-NE2 3.49Å
760	R	77.6	Confident	89.5	Confident	191 Å²	191	42.6 Å²	42.6	72%	0.721	21%	0.209	S	C	*	.	S	Bend	trans	-85.3	-32.4	174.4	-64.3	-176.1	177.3	-169.9	-1.9	112.7	V757 N758 R788	V757-R760 PolarHBondContact O-N 3.03Å; V757-R760 VanDerWaalsContact O-N 3.11Å; N758-R760 PolarHBondContact O-N 3.12Å; R760-R788 PolarHBondContact O-NE 2.92Å
761	M	88.7	Confident	89.1	Confident	80 Å²	80	45.3 Å²	45.3	39%	0.394	22%	0.224	S	C	.	.	S	Bend	trans	-127.6	168.7	178.3	-63.2	-172.5	-173.1	0	0	109.5	V757 V769 F770 N771	V757-M761 HydrophobicContact CB-CB 4.34Å; V757-M761 HydrophobicContact CG2-CB 4.04Å; V757-M761 VanDerWaalsContact CG2-O 3.28Å; V757-M761 WeakPolarHBondContact CG2-O 3.46Å; M761-V769 HydrophobicContact CB-CG1 4.05Å; M761-V769 HydrophobicContact SD-CG1 4.23Å; M761-F770 WeakPolarHBondContact CB-O 3.23Å; M761-N771 HydrophobicContact CE-CB 4.01Å; M761-N771 HydrophobicContact CG-CB 4.37Å; M761-N771 HydrophobicContact SD-CB 3.85Å
762	L	93.9	Very high	88.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	118.7	173	-60.9	178.5	0	0	0	110.2	M749 F764 V769 F770 M775 C784 M787 R788	M749-L762 HydrophobicContact CE-CD2 4.13Å; M749-L762 HydrophobicContact SD-CB 4.04Å; M749-L762 HydrophobicContact SD-CD2 3.94Å; M749-L762 HydrophobicContact SD-CG 4.48Å; L762-F764 HydrophobicContact CB-CD2 4.08Å; L762-F764 HydrophobicContact CB-CE2 3.61Å; L762-F764 HydrophobicContact CB-CZ 4.26Å; L762-F764 HydrophobicContact CD1-CE2 3.91Å; L762-F764 HydrophobicContact CD1-CZ 3.94Å; L762-F764 HydrophobicContact CG-CE2 4.44Å; L762-F764 PolarHBondContact O-N 2.89Å; L762-V769 WeakPolarHBondContact O-CA 3.38Å; L762-F770 HydrophobicContact CB-CB 4.08Å; L762-F770 PolarHBondContact N-O 3.1Å; L762-F770 PolarHBondContact O-N 2.89Å; L762-M775 HydrophobicContact CD1-SD 4.19Å; L762-M775 HydrophobicContact CG-SD 4.39Å; L762-C784 HydrophobicContact CD1-CB 3.61Å; L762-M787 HydrophobicContact CD1-CB 4.16Å; L762-M787 HydrophobicContact CD1-CE 4.26Å; L762-M787 HydrophobicContact CD2-CB 4.13Å; L762-R788 HydrophobicContact CD2-CB 3.97Å; L762-R788 HydrophobicContact CD2-CG 4.47Å
763	Y	93.2	Very high	88.7	Confident	39 Å²	39	51.2 Å²	51.2	15%	0.153	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	82.9	179.4	-164.5	-81.1	0	0	0	109.7	R752 S753 N756 V757 P766 V769	R752-Y763 HydrophobicContact CB-CD1 3.77Å; R752-Y763 HydrophobicContact CB-CG 4.39Å; R752-Y763 PolarHBondContact NE-O 3Å; S753-Y763 PolarHBondContact OG-N 3.39Å; N756-Y763 HydrophobicContact CB-CD2 3.87Å; N756-Y763 HydrophobicContact CB-CE2 3.93Å; N756-Y763 HydrophobicContact CB-CG 4.22Å; N756-Y763 VanDerWaalsContact ND2-CE1 3.32Å; N756-Y763 WeakPolarHBondContact ND2-CE1 3.34Å; N756-Y763 VanDerWaalsContact ND2-CZ 3.29Å; V757-Y763 HydrophobicContact CG1-CD2 4.02Å; Y763-P766 HydrophobicContact CE1-CG 4.34Å; Y763-P766 WeakPolarHBondContact OH-CA 3.3Å; Y763-P766 WeakPolarHBondContact OH-CB 3.41Å; Y763-V769 HydrophobicContact CD2-CG2 3.62Å; Y763-V769 HydrophobicContact CE2-CG2 3.94Å; Y763-V769 HydrophobicContact CG-CG2 4.31Å
764	F	94.2	Very high	88.6	Confident	22 Å²	22	52.6 Å²	52.6	10%	0.096	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	-48.4	175.7	-67	-87.8	0	0	0	110.4	L704 L707 M749 R752 L762 L768 F770 M787	L704-F764 HydrophobicContact CD2-CB 4.03Å; L704-F764 HydrophobicContact CD2-CD1 3.51Å; L704-F764 HydrophobicContact CD2-CD2 3.99Å; L704-F764 HydrophobicContact CD2-CE1 3.87Å; L704-F764 HydrophobicContact CD2-CE2 4.3Å; L704-F764 HydrophobicContact CD2-CG 3.58Å; L704-F764 HydrophobicContact CD2-CZ 4.25Å; L707-F764 HydrophobicContact CD2-CB 3.76Å; M749-F764 HydrophobicContact CG-CD1 3.61Å; M749-F764 HydrophobicContact CG-CE1 3.92Å; M749-F764 HydrophobicContact CG-CG 4.08Å; M749-F764 HydrophobicContact SD-CD1 4.48Å; M749-F764 HydrophobicContact SD-CE1 4.37Å; R752-F764 PolarHBondContact NE-O 3.33Å; R752-F764 PolarHBondContact NH2-O 3.23Å; L762-F764 HydrophobicContact CB-CD2 4.08Å; L762-F764 HydrophobicContact CB-CE2 3.61Å; L762-F764 HydrophobicContact CB-CZ 4.26Å; L762-F764 HydrophobicContact CD1-CE2 3.91Å; L762-F764 HydrophobicContact CD1-CZ 3.94Å; L762-F764 HydrophobicContact CG-CE2 4.44Å; L762-F764 PolarHBondContact O-N 2.89Å; F764-L768 HydrophobicContact CB-CD2 4.44Å; F764-L768 HydrophobicContact CB-CG 4.47Å; F764-L768 WeakPolarHBondContact CB-O 3.23Å; F764-L768 PolarHBondContact N-O 2.98Å; F764-F770 HydrophobicContact CD2-CB 4.2Å; F764-F770 HydrophobicContact CD2-CD1 4.09Å; F764-F770 HydrophobicContact CD2-CG 4.05Å; F764-F770 HydrophobicContact CE2-CB 3.89Å; F764-F770 HydrophobicContact CE2-CD1 4.18Å; F764-F770 AromaticContact CE2-CD2 3.82Å; F764-F770 HydrophobicContact CE2-CD2 3.82Å; F764-F770 HydrophobicContact CE2-CE2 4.35Å; F764-F770 AromaticContact CE2-CG 3.73Å; F764-F770 HydrophobicContact CE2-CG 3.73Å; F764-M787 HydrophobicContact CE1-CE 4.32Å; F764-M787 HydrophobicContact CE1-SD 4.32Å; F764-M787 HydrophobicContact CZ-CE 3.89Å; F764-M787 HydrophobicContact CZ-SD 4.36Å
765	A	92.2	Very high	88.6	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	168.4	174.6	0	0	0	0	0	110.6	V685 A687 L707 D767 L768	V685-A765 WeakPolarHBondContact O-CB 3.46Å; A687-A765 HydrophobicContact CB-CB 4.35Å; L707-A765 HydrophobicContact CD1-CB 3.9Å; L707-A765 HydrophobicContact CD2-CB 3.78Å; A765-D767 VanDerWaalsContact CB-OD1 3.23Å; A765-D767 WeakPolarHBondContact CB-OD1 3.11Å; A765-D767 PolarHBondContact O-N 2.86Å; A765-L768 HydrophobicContact CB-CB 4.12Å; A765-L768 PolarHBondContact N-O 3.49Å; A765-L768 CarbonylContact O-C 3.28Å; A765-L768 VanDerWaalsContact O-C 3.28Å; A765-L768 PolarHBondContact O-N 2.78Å
766	P	85.5	Confident	88.8	Confident	61 Å²	61	51.8 Å²	51.8	40%	0.396	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-33.5	179.3	-23.5	34.6	0	0	0	114	V684 Y763	V684-P766 HydrophobicContact CG1-CG 3.53Å; Y763-P766 HydrophobicContact CE1-CG 4.34Å; Y763-P766 WeakPolarHBondContact OH-CA 3.3Å; Y763-P766 WeakPolarHBondContact OH-CB 3.41Å
767	D	85.8	Confident	89.3	Confident	32 Å²	32	51.5 Å²	51.5	17%	0.171	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-7.3	177.5	60.3	-33.9	0	0	0	113.3	C686 A687 G688 H689 N691 A765	C686-D767 WeakPolarHBondContact CA-OD1 3.45Å; A687-D767 WeakPolarHBondContact CA-OD2 3.29Å; A687-D767 VanDerWaalsContact N-CG 3.34Å; A687-D767 PolarHBondContact N-OD1 3.2Å; A687-D767 PolarHBondContact N-OD2 3.15Å; G688-D767 WeakPolarHBondContact CA-OD2 3.42Å; G688-D767 PolarHBondContact N-OD2 3.03Å; H689-D767 PolarHBondContact N-OD2 3.12Å; N691-D767 PolarHBondContact ND2-O 2.96Å; A765-D767 VanDerWaalsContact CB-OD1 3.23Å; A765-D767 WeakPolarHBondContact CB-OD1 3.11Å; A765-D767 PolarHBondContact O-N 2.86Å
768	L	91.3	Very high	89.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	77.9	-178.2	-165.4	64.8	0	0	0	110.7	A687 H689 L700 L704 L707 F764 A765 F770	A687-L768 HydrophobicContact CB-CB 3.76Å; A687-L768 HydrophobicContact CB-CD2 3.73Å; A687-L768 HydrophobicContact CB-CG 4.33Å; H689-L768 HydrophobicContact CB-CB 4.49Å; H689-L768 HydrophobicContact CB-CD1 4.02Å; L700-L768 HydrophobicContact CD2-CD1 4.42Å; L704-L768 HydrophobicContact CD2-CD2 3.65Å; L704-L768 HydrophobicContact CG-CD2 3.96Å; L707-L768 HydrophobicContact CD2-CD2 4.14Å; F764-L768 HydrophobicContact CB-CD2 4.44Å; F764-L768 HydrophobicContact CB-CG 4.47Å; F764-L768 WeakPolarHBondContact CB-O 3.23Å; F764-L768 PolarHBondContact N-O 2.98Å; A765-L768 HydrophobicContact CB-CB 4.12Å; A765-L768 PolarHBondContact N-O 3.49Å; A765-L768 CarbonylContact O-C 3.28Å; A765-L768 VanDerWaalsContact O-C 3.28Å; A765-L768 PolarHBondContact O-N 2.78Å; L768-F770 HydrophobicContact CD1-CD1 4.45Å; L768-F770 HydrophobicContact CD1-CE1 3.88Å; L768-F770 HydrophobicContact CG-CD1 4.48Å; L768-F770 HydrophobicContact CG-CE1 4.12Å
769	V	91.4	Very high	90.7	Very high	32 Å²	32	52.8 Å²	52.8	19%	0.194	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	129.2	173.4	-174.8	0	0	0	0	109.6	M761 L762 Y763 R774	M761-V769 HydrophobicContact CB-CG1 4.05Å; M761-V769 HydrophobicContact SD-CG1 4.23Å; L762-V769 WeakPolarHBondContact O-CA 3.38Å; Y763-V769 HydrophobicContact CD2-CG2 3.62Å; Y763-V769 HydrophobicContact CE2-CG2 3.94Å; Y763-V769 HydrophobicContact CG-CG2 4.31Å; V769-R774 WeakPolarHBondContact O-CD 3.34Å; V769-R774 PolarHBondContact O-NH1 3.42Å
770	F	93	Very high	91.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	111.2	-179.2	-91.4	38.6	0	0	0	110.6	L700 L704 M761 L762 F764 L768 R774 M775 S778	L700-F770 HydrophobicContact CB-CZ 4.16Å; L700-F770 HydrophobicContact CD2-CE1 3.87Å; L700-F770 HydrophobicContact CD2-CZ 4.21Å; L704-F770 HydrophobicContact CD1-CE1 4.42Å; L704-F770 HydrophobicContact CD1-CE2 3.95Å; L704-F770 HydrophobicContact CD1-CZ 3.59Å; L704-F770 HydrophobicContact CG-CZ 4.12Å; M761-F770 WeakPolarHBondContact CB-O 3.23Å; L762-F770 HydrophobicContact CB-CB 4.08Å; L762-F770 PolarHBondContact N-O 3.1Å; L762-F770 PolarHBondContact O-N 2.89Å; F764-F770 HydrophobicContact CD2-CB 4.2Å; F764-F770 HydrophobicContact CD2-CD1 4.09Å; F764-F770 HydrophobicContact CD2-CG 4.05Å; F764-F770 HydrophobicContact CE2-CB 3.89Å; F764-F770 HydrophobicContact CE2-CD1 4.18Å; F764-F770 AromaticContact CE2-CD2 3.82Å; F764-F770 HydrophobicContact CE2-CD2 3.82Å; F764-F770 HydrophobicContact CE2-CE2 4.35Å; F764-F770 AromaticContact CE2-CG 3.73Å; F764-F770 HydrophobicContact CE2-CG 3.73Å; L768-F770 HydrophobicContact CD1-CD1 4.45Å; L768-F770 HydrophobicContact CD1-CE1 3.88Å; L768-F770 HydrophobicContact CG-CD1 4.48Å; L768-F770 HydrophobicContact CG-CE1 4.12Å; F770-R774 HydrophobicContact CB-CB 4.23Å; F770-R774 HydrophobicContact CD1-CB 3.96Å; F770-R774 HydrophobicContact CD2-CB 4.23Å; F770-R774 HydrophobicContact CE1-CB 4.42Å; F770-R774 HydrophobicContact CG-CB 3.85Å; F770-M775 HydrophobicContact CB-CG 4.16Å; F770-M775 HydrophobicContact CD2-CG 4.11Å; F770-S778 WeakPolarHBondContact CE2-OG 3.34Å
771	N	89.3	Confident	92	Very high	58 Å²	58	48.4 Å²	48.4	31%	0.31	22%	0.218	S	C	.	.			trans	-88.2	-179	165.5	61.3	17	0	0	0	110.8	M761 Y773 R774 M775	M761-N771 HydrophobicContact CE-CB 4.01Å; M761-N771 HydrophobicContact CG-CB 4.37Å; M761-N771 HydrophobicContact SD-CB 3.85Å; N771-Y773 VanDerWaalsContact C-N 3.26Å; N771-Y773 PolarHBondContact O-N 2.66Å; N771-Y773 WeakPolarHBondContact OD1-CB 3.31Å; N771-Y773 PolarHBondContact OD1-N 3.23Å; N771-R774 PolarHBondContact O-N 2.75Å; N771-R774 PolarHBondContact OD1-N 3.37Å; N771-M775 WeakPolarHBondContact O-CG 3.48Å; N771-M775 PolarHBondContact O-N 3.44Å
772	E	89.8	Confident	92.3	Very high	79 Å²	79	48.2 Å²	48.2	37%	0.369	23%	0.225	S	C	.	.	H	α-helix	trans	-49.8	-44.7	175.7	-78.6	-58.5	148.4	0	0	113.6	M775 H776 Y781 R788	E772-M775 PolarHBondContact O-N 2.98Å; E772-H776 PolarHBondContact O-N 3.28Å; E772-H776 VanDerWaalsContact O-N 3.13Å; E772-H776 PolarHBondContact O-ND1 2.93Å; E772-H776 IonicContact OE2-CE1 3.52Å; E772-H776 IonicContact OE2-ND1 2.74Å; E772-Y781 WeakPolarHBondContact OE2-CE2 3.38Å; E772-R788 IonicContact OE1-CZ 3.8Å; E772-R788 IonicContact OE1-NH1 3.76Å; E772-R788 PolarHBondContact OE1-NH1 3.23Å; E772-R788 IonicContact OE1-NH2 2.62Å; E772-R788 PolarHBondContact OE1-NH2 3.3Å
773	Y	91.8	Very high	92.4	Very high	124 Å²	124	49.6 Å²	49.6	49%	0.486	23%	0.231	S	C	.	.	H	α-helix	trans	-61.1	-52	179.2	175.2	-92.9	0	0	0	111.5	D695 N771 M775 H776 K777	D695-Y773 HydrophobicContact CB-CE1 4Å; N771-Y773 VanDerWaalsContact C-N 3.26Å; N771-Y773 PolarHBondContact O-N 2.66Å; N771-Y773 WeakPolarHBondContact OD1-CB 3.31Å; N771-Y773 PolarHBondContact OD1-N 3.23Å; Y773-M775 VanDerWaalsContact C-N 3.31Å; Y773-M775 PolarHBondContact O-N 3.35Å; Y773-H776 PolarHBondContact O-N 2.92Å; Y773-K777 HydrophobicContact CE1-CB 4.3Å; Y773-K777 HydrophobicContact CE1-CD 4.29Å; Y773-K777 HydrophobicContact CE1-CG 4.22Å; Y773-K777 VanDerWaalsContact O-CB 3.22Å; Y773-K777 WeakPolarHBondContact O-CB 3.35Å; Y773-K777 PolarHBondContact O-N 2.81Å; Y773-K777 PolarHBondContact OH-NZ 2.65Å
774	R	91.7	Very high	92.6	Very high	28 Å²	28	47.7 Å²	47.7	11%	0.106	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-34.8	179.6	-78	178.5	166.3	179.8	-10.5	112.6	H689 N691 D695 L700 V769 F770 N771 K777 S778	H689-R774 PolarHBondContact NE2-NH2 3.4Å; N691-R774 PolarHBondContact OD1-NH1 3.05Å; N691-R774 PolarHBondContact OD1-NH2 2.94Å; D695-R774 VanDerWaalsContact CG-NE 3.34Å; D695-R774 IonicContact OD1-CZ 3.25Å; D695-R774 IonicContact OD1-NE 2.66Å; D695-R774 PolarHBondContact OD1-NE 2.67Å; D695-R774 VanDerWaalsContact OD1-NE 3.1Å; D695-R774 IonicContact OD1-NH2 3.1Å; D695-R774 PolarHBondContact OD1-NH2 3.25Å; D695-R774 WeakPolarHBondContact OD2-CG 3.4Å; D695-R774 IonicContact OD2-CZ 2.69Å; D695-R774 IonicContact OD2-NE 2.65Å; D695-R774 PolarHBondContact OD2-NE 3.37Å; D695-R774 IonicContact OD2-NH2 2.82Å; L700-R774 HydrophobicContact CD1-CB 4.46Å; L700-R774 HydrophobicContact CD1-CG 4.31Å; L700-R774 HydrophobicContact CD2-CG 4.21Å; V769-R774 WeakPolarHBondContact O-CD 3.34Å; V769-R774 PolarHBondContact O-NH1 3.42Å; F770-R774 HydrophobicContact CB-CB 4.23Å; F770-R774 HydrophobicContact CD1-CB 3.96Å; F770-R774 HydrophobicContact CD2-CB 4.23Å; F770-R774 HydrophobicContact CE1-CB 4.42Å; F770-R774 HydrophobicContact CG-CB 3.85Å; N771-R774 PolarHBondContact O-N 2.75Å; N771-R774 PolarHBondContact OD1-N 3.37Å; R774-K777 PolarHBondContact O-N 3.13Å; R774-S778 VanDerWaalsContact O-CB 3.3Å; R774-S778 WeakPolarHBondContact O-CB 3.32Å; R774-S778 PolarHBondContact O-N 3.42Å; R774-S778 PolarHBondContact O-OG 2.82Å
775	M	94.6	Very high	92.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.2	-39.7	174.6	-70.5	175.5	29.3	0	0	113	L762 F770 N771 E772 Y773 S778 M780 Y781 C784 V785 R788	L762-M775 HydrophobicContact CD1-SD 4.19Å; L762-M775 HydrophobicContact CG-SD 4.39Å; F770-M775 HydrophobicContact CB-CG 4.16Å; F770-M775 HydrophobicContact CD2-CG 4.11Å; N771-M775 WeakPolarHBondContact O-CG 3.48Å; N771-M775 PolarHBondContact O-N 3.44Å; E772-M775 PolarHBondContact O-N 2.98Å; Y773-M775 VanDerWaalsContact C-N 3.31Å; Y773-M775 PolarHBondContact O-N 3.35Å; M775-S778 PolarHBondContact O-OG 3.17Å; M775-M780 PolarHBondContact O-N 3.43Å; M775-Y781 HydrophobicContact CB-CD2 4Å; M775-Y781 HydrophobicContact CE-CD2 3.77Å; M775-Y781 HydrophobicContact CE-CE2 3.74Å; M775-Y781 PolarHBondContact O-N 3.02Å; M775-C784 HydrophobicContact CB-CB 4.08Å; M775-C784 HydrophobicContact CE-CB 3.62Å; M775-C784 HydrophobicContact CG-CB 3.57Å; M775-C784 HydrophobicContact SD-CB 3.73Å; M775-V785 HydrophobicContact CE-CG2 4Å; M775-R788 VanDerWaalsContact CE-NH2 3.29Å; M775-R788 PolarHBondContact SD-NH2 2.91Å
776	H	94.9	Very high	92.8	Very high	105 Å²	105	52.1 Å²	52.1	49%	0.486	24%	0.243	S	C	.	.	H	α-helix	trans	-72.3	-43.5	172.5	-72.6	86.6	0	0	0	111.9	E772 Y773 S778 R779 Y781	E772-H776 PolarHBondContact O-N 3.28Å; E772-H776 VanDerWaalsContact O-N 3.13Å; E772-H776 PolarHBondContact O-ND1 2.93Å; E772-H776 IonicContact OE2-CE1 3.52Å; E772-H776 IonicContact OE2-ND1 2.74Å; Y773-H776 PolarHBondContact O-N 2.92Å; H776-S778 PolarHBondContact O-N 2.66Å; H776-R779 WeakPolarHBondContact O-CA 3.38Å; H776-R779 PolarHBondContact O-N 2.99Å; H776-Y781 AromaticContact CE1-CD2 3.36Å; H776-Y781 WeakPolarHBondContact CE1-CD2 3.12Å; H776-Y781 AromaticContact CE1-CE2 3.18Å; H776-Y781 WeakPolarHBondContact CE1-CE2 3.38Å; H776-Y781 AromaticContact CE1-CZ 3.75Å; H776-Y781 AromaticContact ND1-CD2 3.61Å; H776-Y781 AromaticContact ND1-CE2 3.81Å; H776-Y781 AromaticContact NE2-CD2 3.68Å; H776-Y781 AromaticContact NE2-CE2 3.7Å; H776-Y781 AromaticContact NE2-CG 3.93Å; H776-Y781 AromaticContact NE2-CZ 3.92Å
777	K	94.7	Very high	93.4	Very high	77 Å²	77	49.4 Å²	49.4	34%	0.335	23%	0.225	S	C	.	.	H	α-helix	trans	-63.5	-38.4	-176.1	-169.3	74.4	171.2	-147.7	0	113.4	D695 L700 Y773 R774 R779	D695-K777 HydrophobicContact CB-CG 4.38Å; D695-K777 WeakPolarHBondContact O-CE 3.14Å; D695-K777 PolarHBondContact O-NZ 3.2Å; L700-K777 HydrophobicContact CD1-CB 3.96Å; L700-K777 HydrophobicContact CD1-CG 3.85Å; Y773-K777 HydrophobicContact CE1-CB 4.3Å; Y773-K777 HydrophobicContact CE1-CD 4.29Å; Y773-K777 HydrophobicContact CE1-CG 4.22Å; Y773-K777 VanDerWaalsContact O-CB 3.22Å; Y773-K777 WeakPolarHBondContact O-CB 3.35Å; Y773-K777 PolarHBondContact O-N 2.81Å; Y773-K777 PolarHBondContact OH-NZ 2.65Å; R774-K777 PolarHBondContact O-N 3.13Å; K777-R779 PolarHBondContact O-N 3.4Å
778	S	93.8	Very high	93.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-6.5	173	57.3	0	0	0	0	113.9	F697 F770 R774 M775 H776 M780	F697-S778 WeakPolarHBondContact CD2-O 3.4Å; F697-S778 VanDerWaalsContact CE2-O 3.25Å; F697-S778 WeakPolarHBondContact CE2-O 3.2Å; F770-S778 WeakPolarHBondContact CE2-OG 3.34Å; R774-S778 VanDerWaalsContact O-CB 3.3Å; R774-S778 WeakPolarHBondContact O-CB 3.32Å; R774-S778 PolarHBondContact O-N 3.42Å; R774-S778 PolarHBondContact O-OG 2.82Å; M775-S778 PolarHBondContact O-OG 3.17Å; H776-S778 PolarHBondContact O-N 2.66Å; S778-M780 PolarHBondContact O-N 2.75Å; S778-M780 VanDerWaalsContact O-N 3.08Å
779	R	92.4	Very high	94.1	Very high	174 Å²	174	54.4 Å²	54.4	66%	0.657	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	14.3	-171.8	-52.8	175.6	175.6	149.3	-8.8	114.8	F697 H776 K777 Y781	F697-R779 HydrophobicContact CD2-CB 4.11Å; F697-R779 HydrophobicContact CD2-CG 3.7Å; F697-R779 HydrophobicContact CE2-CB 3.86Å; F697-R779 HydrophobicContact CE2-CG 3.85Å; H776-R779 WeakPolarHBondContact O-CA 3.38Å; H776-R779 PolarHBondContact O-N 2.99Å; K777-R779 PolarHBondContact O-N 3.4Å; R779-Y781 VanDerWaalsContact C-N 3.28Å; R779-Y781 PolarHBondContact O-N 2.86Å
780	M	94.1	Very high	94.3	Very high	13 Å²	13	53.1 Å²	53.1	6%	0.064	24%	0.238	C	C	.	.			trans	-89.1	16.8	175.2	-69.4	-173.1	75	0	0	113	L701 L704 M775 S778 S782 Q783 C784 L873 F876	L701-M780 HydrophobicContact CD2-CG 3.97Å; L701-M780 HydrophobicContact CD2-SD 3.45Å; L701-M780 WeakPolarHBondContact CD2-SD 3.48Å; L704-M780 HydrophobicContact CD1-SD 3.85Å; M775-M780 PolarHBondContact O-N 3.43Å; S778-M780 PolarHBondContact O-N 2.75Å; S778-M780 VanDerWaalsContact O-N 3.08Å; M780-S782 PolarHBondContact O-N 2.98Å; M780-Q783 PolarHBondContact O-N 2.97Å; M780-Q783 VanDerWaalsContact O-N 3.13Å; M780-Q783 PolarHBondContact O-OE1 3.36Å; M780-Q783 VanDerWaalsContact O-OE1 3.1Å; M780-C784 WeakPolarHBondContact O-CB 3.42Å; M780-C784 PolarHBondContact O-N 2.98Å; M780-C784 PolarHBondContact O-SG 3.23Å; M780-C784 VanDerWaalsContact O-SG 3.35Å; M780-L873 HydrophobicContact CE-CD2 3.54Å; M780-F876 HydrophobicContact CE-CD1 3.87Å; M780-F876 HydrophobicContact CE-CE1 3.8Å; M780-F876 HydrophobicContact CG-CD1 4.27Å; M780-F876 HydrophobicContact CG-CE1 3.47Å; M780-F876 VanDerWaalsContact CG-CE1 3.47Å; M780-F876 HydrophobicContact CG-CE2 4.04Å; M780-F876 HydrophobicContact CG-CZ 3.35Å; M780-F876 HydrophobicContact SD-CD1 4.35Å; M780-F876 HydrophobicContact SD-CE1 3.66Å; M780-F876 HydrophobicContact SD-CZ 4.15Å
781	Y	95.3	Very high	94.5	Very high	93 Å²	93	53.1 Å²	53.1	37%	0.365	24%	0.238	S	C	.	.	H	α-helix	trans	-53.9	-47.3	-164.9	-179.7	-107	0	0	0	114	E772 M775 H776 R779 C784 V785	E772-Y781 WeakPolarHBondContact OE2-CE2 3.38Å; M775-Y781 HydrophobicContact CB-CD2 4Å; M775-Y781 HydrophobicContact CE-CD2 3.77Å; M775-Y781 HydrophobicContact CE-CE2 3.74Å; M775-Y781 PolarHBondContact O-N 3.02Å; H776-Y781 AromaticContact CE1-CD2 3.36Å; H776-Y781 WeakPolarHBondContact CE1-CD2 3.12Å; H776-Y781 AromaticContact CE1-CE2 3.18Å; H776-Y781 WeakPolarHBondContact CE1-CE2 3.38Å; H776-Y781 AromaticContact CE1-CZ 3.75Å; H776-Y781 AromaticContact ND1-CD2 3.61Å; H776-Y781 AromaticContact ND1-CE2 3.81Å; H776-Y781 AromaticContact NE2-CD2 3.68Å; H776-Y781 AromaticContact NE2-CE2 3.7Å; H776-Y781 AromaticContact NE2-CG 3.93Å; H776-Y781 AromaticContact NE2-CZ 3.92Å; R779-Y781 VanDerWaalsContact C-N 3.28Å; R779-Y781 PolarHBondContact O-N 2.86Å; Y781-C784 PolarHBondContact O-N 2.95Å; Y781-V785 HydrophobicContact CD1-CG2 4.38Å; Y781-V785 HydrophobicContact CD2-CG2 4.28Å; Y781-V785 HydrophobicContact CE1-CG2 3.9Å; Y781-V785 HydrophobicContact CE2-CG2 3.76Å; Y781-V785 WeakPolarHBondContact O-CG2 3.28Å; Y781-V785 PolarHBondContact O-N 3.36Å
782	S	95.2	Very high	94.8	Very high	76 Å²	76	52.7 Å²	52.7	53%	0.531	24%	0.235	S	C	.	.	H	α-helix	trans	-66.3	-41.9	-180	51.9	0	0	0	0	112.5	M780 C784 V785 R786	M780-S782 PolarHBondContact O-N 2.98Å; S782-C784 VanDerWaalsContact C-N 3.34Å; S782-V785 PolarHBondContact O-N 3.39Å; S782-R786 PolarHBondContact O-N 3.45Å; S782-R786 VanDerWaalsContact O-N 3.17Å
783	Q	96.1	Very high	95.1	Very high	28 Å²	28	52 Å²	52	13%	0.131	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-41.2	174.6	-59.6	81.7	1.8	0	0	110.9	M780 R786 M787 L873	M780-Q783 PolarHBondContact O-N 2.97Å; M780-Q783 VanDerWaalsContact O-N 3.13Å; M780-Q783 PolarHBondContact O-OE1 3.36Å; M780-Q783 VanDerWaalsContact O-OE1 3.1Å; Q783-R786 PolarHBondContact O-N 2.81Å; Q783-M787 HydrophobicContact CB-CE 4.47Å; Q783-M787 WeakPolarHBondContact O-CB 3.32Å; Q783-M787 WeakPolarHBondContact O-CG 3.46Å; Q783-M787 PolarHBondContact O-N 3.29Å; Q783-L873 HydrophobicContact CB-CD2 3.76Å; Q783-L873 HydrophobicContact CB-CG 4.33Å; Q783-L873 HydrophobicContact CG-CD2 4.08Å
784	C	96.9	Very high	95.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.7	-37.9	177.5	-73	0	0	0	0	113.1	L762 M775 M780 Y781 S782 M787 R788	L762-C784 HydrophobicContact CD1-CB 3.61Å; M775-C784 HydrophobicContact CB-CB 4.08Å; M775-C784 HydrophobicContact CE-CB 3.62Å; M775-C784 HydrophobicContact CG-CB 3.57Å; M775-C784 HydrophobicContact SD-CB 3.73Å; M780-C784 WeakPolarHBondContact O-CB 3.42Å; M780-C784 PolarHBondContact O-N 2.98Å; M780-C784 PolarHBondContact O-SG 3.23Å; M780-C784 VanDerWaalsContact O-SG 3.35Å; Y781-C784 PolarHBondContact O-N 2.95Å; S782-C784 VanDerWaalsContact C-N 3.34Å; C784-M787 HydrophobicContact CB-CE 4.41Å; C784-M787 PolarHBondContact O-N 3.11Å; C784-R788 WeakPolarHBondContact O-CB 3.3Å; C784-R788 PolarHBondContact O-N 3.27Å
785	V	95.7	Very high	95.3	Very high	35 Å²	35	46 Å²	46	21%	0.212	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-44.9	172.2	168.2	0	0	0	0	110.6	M775 Y781 S782 M787 R788 H789	M775-V785 HydrophobicContact CE-CG2 4Å; Y781-V785 HydrophobicContact CD1-CG2 4.38Å; Y781-V785 HydrophobicContact CD2-CG2 4.28Å; Y781-V785 HydrophobicContact CE1-CG2 3.9Å; Y781-V785 HydrophobicContact CE2-CG2 3.76Å; Y781-V785 WeakPolarHBondContact O-CG2 3.28Å; Y781-V785 PolarHBondContact O-N 3.36Å; S782-V785 PolarHBondContact O-N 3.39Å; V785-M787 PolarHBondContact O-N 2.9Å; V785-R788 PolarHBondContact O-N 2.97Å; V785-R788 VanDerWaalsContact O-N 3.14Å; V785-H789 PolarHBondContact O-CD2 2.67Å; V785-H789 PolarHBondContact O-N 3.41Å
786	R	96.4	Very high	95.2	Very high	79 Å²	79	54.4 Å²	54.4	30%	0.298	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-42.9	175.1	-68.5	-172.2	68.2	144.8	2.6	112.9	S782 Q783 R788 H789 L790 I869 E872	S782-R786 PolarHBondContact O-N 3.45Å; S782-R786 VanDerWaalsContact O-N 3.17Å; Q783-R786 PolarHBondContact O-N 2.81Å; R786-R788 VanDerWaalsContact C-N 3.28Å; R786-R788 PolarHBondContact O-N 2.95Å; R786-H789 PolarHBondContact O-N 3.34Å; R786-L790 PolarHBondContact O-N 3.3Å; R786-L790 VanDerWaalsContact O-N 3.15Å; R786-I869 HydrophobicContact CB-CG1 4.33Å; R786-I869 HydrophobicContact CB-CG2 4.35Å; R786-E872 WeakPolarHBondContact CD-OE2 3.36Å; R786-E872 IonicContact CZ-OE1 3.79Å; R786-E872 IonicContact CZ-OE2 3.17Å; R786-E872 IonicContact NE-OE2 2.71Å; R786-E872 IonicContact NH1-OE1 3.51Å; R786-E872 PolarHBondContact NH1-OE1 3.43Å; R786-E872 IonicContact NH1-OE2 2.7Å; R786-E872 PolarHBondContact NH1-OE2 3Å
787	M	96.9	Very high	95.2	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.02	23%	0.232	C	C	.	.	H	α-helix	trans	-62.2	-34.8	173.9	-77.2	-168.9	-71.6	0	0	112.3	V746 M749 L762 F764 Q783 C784 V785 S791 I869 L873	V746-M787 HydrophobicContact CG1-CG 4.14Å; V746-M787 HydrophobicContact CG2-SD 4.14Å; M749-M787 HydrophobicContact CE-CB 3.76Å; M749-M787 HydrophobicContact CE-CG 4.07Å; M749-M787 HydrophobicContact CE-SD 3.85Å; L762-M787 HydrophobicContact CD1-CB 4.16Å; L762-M787 HydrophobicContact CD1-CE 4.26Å; L762-M787 HydrophobicContact CD2-CB 4.13Å; F764-M787 HydrophobicContact CE1-CE 4.32Å; F764-M787 HydrophobicContact CE1-SD 4.32Å; F764-M787 HydrophobicContact CZ-CE 3.89Å; F764-M787 HydrophobicContact CZ-SD 4.36Å; Q783-M787 HydrophobicContact CB-CE 4.47Å; Q783-M787 WeakPolarHBondContact O-CB 3.32Å; Q783-M787 WeakPolarHBondContact O-CG 3.46Å; Q783-M787 PolarHBondContact O-N 3.29Å; C784-M787 HydrophobicContact CB-CE 4.41Å; C784-M787 PolarHBondContact O-N 3.11Å; V785-M787 PolarHBondContact O-N 2.9Å; M787-S791 PolarHBondContact O-N 3.49Å; M787-I869 HydrophobicContact CG-CG2 4.07Å; M787-L873 HydrophobicContact CE-CD1 4.4Å; M787-L873 HydrophobicContact CE-CD2 4.03Å; M787-L873 HydrophobicContact CG-CD1 4.09Å; M787-L873 HydrophobicContact SD-CD1 3.7Å; M787-L873 HydrophobicContact SD-CD2 4.35Å
788	R	95.7	Very high	95.1	Very high	33 Å²	33	54.3 Å²	54.3	13%	0.125	25%	0.249	C	C	.	.	H	α-helix	trans	-71.2	-39.7	175.5	-164.9	-168	-66.8	163.1	-6.4	111.6	S759 R760 L762 E772 M775 C784 V785 R786 L790 S791 Q792	S759-R788 VanDerWaalsContact O-CG 3.31Å; S759-R788 WeakPolarHBondContact O-CG 3.47Å; R760-R788 PolarHBondContact O-NE 2.92Å; L762-R788 HydrophobicContact CD2-CB 3.97Å; L762-R788 HydrophobicContact CD2-CG 4.47Å; E772-R788 IonicContact OE1-CZ 3.8Å; E772-R788 IonicContact OE1-NH1 3.76Å; E772-R788 PolarHBondContact OE1-NH1 3.23Å; E772-R788 IonicContact OE1-NH2 2.62Å; E772-R788 PolarHBondContact OE1-NH2 3.3Å; M775-R788 VanDerWaalsContact CE-NH2 3.29Å; M775-R788 PolarHBondContact SD-NH2 2.91Å; C784-R788 WeakPolarHBondContact O-CB 3.3Å; C784-R788 PolarHBondContact O-N 3.27Å; V785-R788 PolarHBondContact O-N 2.97Å; V785-R788 VanDerWaalsContact O-N 3.14Å; R786-R788 VanDerWaalsContact C-N 3.28Å; R786-R788 PolarHBondContact O-N 2.95Å; R788-L790 VanDerWaalsContact C-N 3.32Å; R788-L790 PolarHBondContact O-N 2.89Å; R788-S791 CarbonylContact O-C 3.59Å; R788-S791 WeakPolarHBondContact O-CA 3.2Å; R788-S791 VanDerWaalsContact O-CB 3.26Å; R788-S791 WeakPolarHBondContact O-CB 3.16Å; R788-S791 PolarHBondContact O-N 3.34Å; R788-S791 VanDerWaalsContact O-N 3.08Å; R788-Q792 WeakPolarHBondContact O-CG 3.26Å; R788-Q792 PolarHBondContact O-N 3.49Å
789	H	96	Very high	95.1	Very high	105 Å²	105	54.7 Å²	54.7	49%	0.486	25%	0.251	S	S	.	.	H	α-helix	trans	-59.2	-42.3	174	-73.2	-167.8	0	0	0	111.5	V785 R786 S791 Q792 E793	V785-H789 PolarHBondContact O-CD2 2.67Å; V785-H789 PolarHBondContact O-N 3.41Å; R786-H789 PolarHBondContact O-N 3.34Å; H789-S791 VanDerWaalsContact C-N 3.29Å; H789-S791 PolarHBondContact O-N 3.46Å; H789-Q792 PolarHBondContact CD2-OE1 2.82Å; H789-Q792 WeakPolarHBondContact O-CB 3.17Å; H789-Q792 PolarHBondContact O-N 3Å; H789-E793 WeakPolarHBondContact O-CG 3.35Å; H789-E793 PolarHBondContact O-N 3.15Å
790	L	96.9	Very high	95.1	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-57.8	-40.8	172.7	177.2	64.8	0	0	0	112.5	V746 R786 R788 Q792 F794 L862 V866 I869	V746-L790 HydrophobicContact CG1-CD2 3.6Å; R786-L790 PolarHBondContact O-N 3.3Å; R786-L790 VanDerWaalsContact O-N 3.15Å; R788-L790 VanDerWaalsContact C-N 3.32Å; R788-L790 PolarHBondContact O-N 2.89Å; L790-Q792 VanDerWaalsContact C-N 3.32Å; L790-Q792 PolarHBondContact O-N 3.43Å; L790-F794 HydrophobicContact CD1-CE1 4.14Å; L790-F794 HydrophobicContact CD1-CZ 4.03Å; L790-F794 HydrophobicContact CG-CE2 4.33Å; L790-F794 HydrophobicContact CG-CZ 4.05Å; L790-F794 PolarHBondContact O-N 3.09Å; L790-L862 HydrophobicContact CD1-CD1 3.89Å; L790-L862 HydrophobicContact CD1-CD2 4.48Å; L790-L862 HydrophobicContact CD1-CG 4.08Å; L790-V866 HydrophobicContact CD1-CG2 3.89Å; L790-V866 HydrophobicContact CD2-CG2 4Å; L790-I869 HydrophobicContact CB-CD1 4.15Å
791	S	96.2	Very high	95.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.4	-36.5	173.1	-166.9	0	0	0	0	112.3	G750 S753 F754 S759 M787 R788 H789 F794	G750-S791 PolarHBondContact O-OG 3.31Å; G750-S791 VanDerWaalsContact O-OG 3.08Å; S753-S791 WeakPolarHBondContact CB-OG 3.32Å; F754-S791 PolarHBondContact N-OG 3Å; F754-S791 VanDerWaalsContact N-OG 3.11Å; S759-S791 VanDerWaalsContact CB-OG 3.29Å; S759-S791 WeakPolarHBondContact CB-OG 3.29Å; S759-S791 PolarHBondContact OG-O 3.04Å; S759-S791 PolarHBondContact OG-OG 3.42Å; M787-S791 PolarHBondContact O-N 3.49Å; R788-S791 CarbonylContact O-C 3.59Å; R788-S791 WeakPolarHBondContact O-CA 3.2Å; R788-S791 VanDerWaalsContact O-CB 3.26Å; R788-S791 WeakPolarHBondContact O-CB 3.16Å; R788-S791 PolarHBondContact O-N 3.34Å; R788-S791 VanDerWaalsContact O-N 3.08Å; H789-S791 VanDerWaalsContact C-N 3.29Å; H789-S791 PolarHBondContact O-N 3.46Å; S791-F794 PolarHBondContact O-N 3.46Å
792	Q	95.1	Very high	95	Very high	50 Å²	50	48.3 Å²	48.3	23%	0.234	24%	0.241	C	C	.	.	H	α-helix	trans	-72	-39.4	-179.8	-69.5	167.3	-10.6	0	0	111.8	S759 R788 H789 L790 F794 G795 W796	S759-Q792 PolarHBondContact O-NE2 3.49Å; R788-Q792 WeakPolarHBondContact O-CG 3.26Å; R788-Q792 PolarHBondContact O-N 3.49Å; H789-Q792 PolarHBondContact CD2-OE1 2.82Å; H789-Q792 WeakPolarHBondContact O-CB 3.17Å; H789-Q792 PolarHBondContact O-N 3Å; L790-Q792 VanDerWaalsContact C-N 3.32Å; L790-Q792 PolarHBondContact O-N 3.43Å; Q792-F794 PolarHBondContact O-N 2.96Å; Q792-G795 PolarHBondContact O-N 3.34Å; Q792-W796 HydrophobicContact CB-CH2 4.41Å; Q792-W796 HydrophobicContact CB-CZ2 4.26Å; Q792-W796 PolarHBondContact O-N 3.48Å
793	E	96.6	Very high	95	Very high	64 Å²	64	44.8 Å²	44.8	30%	0.299	22%	0.216	S	C	.	.	H	α-helix	trans	-55.2	-37.3	171.8	-71.9	-66.9	142.8	0	0	112.5	H789 G795 W796 L797 L862	H789-E793 WeakPolarHBondContact O-CG 3.35Å; H789-E793 PolarHBondContact O-N 3.15Å; E793-G795 VanDerWaalsContact C-N 3.28Å; E793-G795 PolarHBondContact O-N 3.5Å; E793-W796 PolarHBondContact O-N 3.4Å; E793-W796 WeakPolarHBondContact OE1-CZ3 3.47Å; E793-L797 VanDerWaalsContact O-CB 3.22Å; E793-L797 WeakPolarHBondContact O-CB 3.46Å; E793-L797 WeakPolarHBondContact O-CG 3.3Å; E793-L797 PolarHBondContact O-N 3.47Å; E793-L862 HydrophobicContact CB-CD1 3.55Å; E793-L862 HydrophobicContact CB-CD2 4.37Å; E793-L862 HydrophobicContact CG-CD1 3.81Å
794	F	95.9	Very high	95	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-35.9	175.4	-63.1	-29.5	0	0	0	113.3	F747 W751 F754 L790 S791 Q792 Q798 I799 L862	F747-F794 HydrophobicContact CD2-CE1 4.05Å; F747-F794 AromaticContact CD2-CZ 3.57Å; F747-F794 HydrophobicContact CD2-CZ 3.57Å; F747-F794 AromaticContact CE2-CE1 3.52Å; F747-F794 HydrophobicContact CE2-CE1 3.52Å; F747-F794 AromaticContact CE2-CZ 3.51Å; F747-F794 HydrophobicContact CE2-CZ 3.51Å; F747-F794 HydrophobicContact CG-CZ 4.21Å; F747-F794 HydrophobicContact CZ-CE1 4.04Å; F747-F794 HydrophobicContact CZ-CZ 4.09Å; W751-F794 HydrophobicContact CB-CE2 4.27Å; W751-F794 VanDerWaalsContact N-CE2 3.33Å; F754-F794 HydrophobicContact CB-CB 4.09Å; F754-F794 HydrophobicContact CB-CD2 4.27Å; F754-F794 HydrophobicContact CD1-CB 3.85Å; F754-F794 HydrophobicContact CD2-CB 4.47Å; F754-F794 HydrophobicContact CE1-CB 4.42Å; F754-F794 HydrophobicContact CG-CB 3.88Å; L790-F794 HydrophobicContact CD1-CE1 4.14Å; L790-F794 HydrophobicContact CD1-CZ 4.03Å; L790-F794 HydrophobicContact CG-CE2 4.33Å; L790-F794 HydrophobicContact CG-CZ 4.05Å; L790-F794 PolarHBondContact O-N 3.09Å; S791-F794 PolarHBondContact O-N 3.46Å; Q792-F794 PolarHBondContact O-N 2.96Å; F794-Q798 WeakPolarHBondContact O-CA 3.41Å; F794-Q798 PolarHBondContact O-N 2.9Å; F794-Q798 VanDerWaalsContact O-N 3.11Å; F794-I799 HydrophobicContact CD1-CD1 3.67Å; F794-I799 HydrophobicContact CD1-CG1 4.3Å; F794-I799 HydrophobicContact CE1-CD1 4.1Å; F794-I799 PolarHBondContact O-N 3.09Å; F794-L862 HydrophobicContact CD1-CD2 3.6Å; F794-L862 HydrophobicContact CE1-CD2 3.47Å; F794-L862 VanDerWaalsContact CE1-CD2 3.47Å; F794-L862 HydrophobicContact CE1-CG 4.47Å
795	G	91.4	Very high	95	Very high	26 Å²	26	44.5 Å²	44.5	27%	0.268	22%	0.215	S	C	.	.	H	α-helix	trans	-75.9	-45.7	174.7	0	0	0	0	0	112.9	Q792 E793 L797 Q798	Q792-G795 PolarHBondContact O-N 3.34Å; E793-G795 VanDerWaalsContact C-N 3.28Å; E793-G795 PolarHBondContact O-N 3.5Å; G795-L797 PolarHBondContact O-N 3.38Å; G795-Q798 WeakPolarHBondContact O-CG 3.48Å; G795-Q798 PolarHBondContact O-N 3.15Å; G795-Q798 VanDerWaalsContact O-N 3.11Å
796	W	93.8	Very high	95	Very high	177 Å²	177	42.9 Å²	42.9	67%	0.67	21%	0.205	S	C	*	.	H	α-helix	trans	-65.2	-38.3	179.3	-63.7	-19.3	0	0	0	112.9	Q792 E793 Q798	Q792-W796 HydrophobicContact CB-CH2 4.41Å; Q792-W796 HydrophobicContact CB-CZ2 4.26Å; Q792-W796 PolarHBondContact O-N 3.48Å; E793-W796 PolarHBondContact O-N 3.4Å; E793-W796 WeakPolarHBondContact OE1-CZ3 3.47Å; W796-Q798 VanDerWaalsContact C-N 3.32Å
797	L	93.8	Very high	95.1	Very high	29 Å²	29	39.1 Å²	39.1	15%	0.152	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-6	174.1	-63.2	172.7	0	0	0	112.6	E793 G795 I799 R855 Q858 L862	E793-L797 VanDerWaalsContact O-CB 3.22Å; E793-L797 WeakPolarHBondContact O-CB 3.46Å; E793-L797 WeakPolarHBondContact O-CG 3.3Å; E793-L797 PolarHBondContact O-N 3.47Å; G795-L797 PolarHBondContact O-N 3.38Å; L797-I799 HydrophobicContact CB-CG1 4.11Å; L797-I799 PolarHBondContact O-N 3.15Å; L797-R855 PolarHBondContact O-NH1 2.91Å; L797-R855 PolarHBondContact O-NH2 2.95Å; L797-Q858 HydrophobicContact CD2-CB 4.17Å; L797-Q858 HydrophobicContact CD2-CG 4.3Å; L797-L862 HydrophobicContact CD1-CB 4.48Å; L797-L862 HydrophobicContact CD1-CD2 4.05Å
798	Q	92.3	Very high	95.1	Very high	151 Å²	151	39.2 Å²	39.2	71%	0.706	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.4	60.7	-176.3	-57.5	-180	14.6	0	0	111.5	F794 G795 W796 T800 R855	F794-Q798 WeakPolarHBondContact O-CA 3.41Å; F794-Q798 PolarHBondContact O-N 2.9Å; F794-Q798 VanDerWaalsContact O-N 3.11Å; G795-Q798 WeakPolarHBondContact O-CG 3.48Å; G795-Q798 PolarHBondContact O-N 3.15Å; G795-Q798 VanDerWaalsContact O-N 3.11Å; W796-Q798 VanDerWaalsContact C-N 3.32Å; Q798-T800 PolarHBondContact O-N 3.17Å; Q798-R855 PolarHBondContact O-NH2 3.4Å
799	I	94.5	Very high	95.2	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.036	19%	0.185	C	C	.	.			trans	-70.7	126.5	179.4	-62.5	-160.2	0	0	0	109.5	W751 F794 L797 E803 F804 M807 L859 L862	W751-I799 WeakPolarHBondContact CH2-O 3.48Å; W751-I799 HydrophobicContact CZ3-CB 4.13Å; W751-I799 HydrophobicContact CZ3-CG2 3.93Å; W751-I799 WeakPolarHBondContact CZ3-O 3.48Å; F794-I799 HydrophobicContact CD1-CD1 3.67Å; F794-I799 HydrophobicContact CD1-CG1 4.3Å; F794-I799 HydrophobicContact CE1-CD1 4.1Å; F794-I799 PolarHBondContact O-N 3.09Å; L797-I799 HydrophobicContact CB-CG1 4.11Å; L797-I799 PolarHBondContact O-N 3.15Å; I799-E803 HydrophobicContact CG2-CB 4.05Å; I799-F804 HydrophobicContact CG2-CB 4.03Å; I799-M807 HydrophobicContact CD1-CE 3.88Å; I799-M807 HydrophobicContact CD1-SD 3.93Å; I799-M807 HydrophobicContact CG2-SD 4.41Å; I799-L859 HydrophobicContact CD1-CD2 3.61Å; I799-L859 HydrophobicContact CG1-CD2 3.91Å; I799-L862 HydrophobicContact CD1-CD2 3.59Å
800	T	92.8	Very high	95.3	Very high	37 Å²	37	32.7 Å²	32.7	23%	0.227	16%	0.162	C	C	.	.			trans	-86.9	153.5	177.8	63.6	0	0	0	0	111.1	Q798 Q802 E803 F804 K845	Q798-T800 PolarHBondContact O-N 3.17Å; T800-Q802 PolarHBondContact O-N 3.46Å; T800-Q802 VanDerWaalsContact O-N 3.11Å; T800-E803 WeakPolarHBondContact CB-OE2 3.4Å; T800-E803 PolarHBondContact N-OE2 3.5Å; T800-E803 WeakPolarHBondContact O-CB 3.37Å; T800-E803 PolarHBondContact O-N 3.27Å; T800-E803 VanDerWaalsContact OG1-CD 3.29Å; T800-E803 WeakPolarHBondContact OG1-CG 3.5Å; T800-E803 PolarHBondContact OG1-OE2 2.92Å; T800-F804 PolarHBondContact O-N 3.45Å; T800-K845 VanDerWaalsContact CB-NZ 3.28Å; T800-K845 PolarHBondContact OG1-NZ 3.32Å
801	P	93.1	Very high	95.3	Very high	67 Å²	67	32.6 Å²	32.6	44%	0.435	16%	0.162	S	C	.	.	H	α-helix	trans	-54.5	-36.7	-175.8	-26.4	33.9	0	0	0	113.5	W751 F804 L805	W751-P801 HydrophobicContact CH2-CG 4.28Å; W751-P801 HydrophobicContact CZ2-CB 4.14Å; W751-P801 HydrophobicContact CZ2-CG 4.03Å; P801-F804 PolarHBondContact O-N 2.84Å; P801-L805 WeakPolarHBondContact O-CG 3.31Å; P801-L805 PolarHBondContact O-N 3.13Å
802	Q	92.9	Very high	95.3	Very high	43 Å²	43	32.6 Å²	32.6	20%	0.201	16%	0.162	C	C	.	.	H	α-helix	trans	-63.8	-41	176.9	-63.7	82.3	20.8	0	0	112.8	L674 T800 C806 I841	L674-Q802 HydrophobicContact CD1-CB 3.64Å; L674-Q802 HydrophobicContact CD1-CG 3.56Å; L674-Q802 HydrophobicContact CD2-CB 3.99Å; L674-Q802 HydrophobicContact CD2-CG 4.39Å; L674-Q802 HydrophobicContact CG-CB 4.5Å; T800-Q802 PolarHBondContact O-N 3.46Å; T800-Q802 VanDerWaalsContact O-N 3.11Å; Q802-C806 PolarHBondContact O-N 3.43Å; Q802-I841 HydrophobicContact CB-CG2 4.06Å
803	E	95.2	Very high	95.4	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.009	15%	0.15	C	C	.	.	H	α-helix	trans	-68.6	-44.8	175.5	-68.4	165	131.6	0	0	110.1	I799 T800 L805 C806 M807 I841 R855 L859	I799-E803 HydrophobicContact CG2-CB 4.05Å; T800-E803 WeakPolarHBondContact CB-OE2 3.4Å; T800-E803 PolarHBondContact N-OE2 3.5Å; T800-E803 WeakPolarHBondContact O-CB 3.37Å; T800-E803 PolarHBondContact O-N 3.27Å; T800-E803 VanDerWaalsContact OG1-CD 3.29Å; T800-E803 WeakPolarHBondContact OG1-CG 3.5Å; T800-E803 PolarHBondContact OG1-OE2 2.92Å; E803-L805 PolarHBondContact O-N 3.39Å; E803-C806 PolarHBondContact O-N 3.05Å; E803-M807 VanDerWaalsContact O-CB 3.26Å; E803-M807 WeakPolarHBondContact O-CB 3.48Å; E803-M807 WeakPolarHBondContact O-CG 3.3Å; E803-M807 PolarHBondContact O-N 3.28Å; E803-I841 HydrophobicContact CG-CG2 3.97Å; E803-R855 VanDerWaalsContact CD-NH2 3.29Å; E803-R855 IonicContact OE1-CZ 2.69Å; E803-R855 IonicContact OE1-NE 2.85Å; E803-R855 PolarHBondContact OE1-NE 2.65Å; E803-R855 IonicContact OE1-NH2 3.99Å; E803-R855 PolarHBondContact OE1-NH2 3Å; E803-R855 VanDerWaalsContact OE1-NH2 3.15Å; E803-R855 IonicContact OE2-CZ 2.8Å; E803-R855 IonicContact OE2-NE 3.85Å; E803-R855 IonicContact OE2-NH2 3.71Å; E803-R855 PolarHBondContact OE2-NH2 3.31Å; E803-L859 HydrophobicContact CB-CD1 3.97Å; E803-L859 HydrophobicContact CG-CD1 3.94Å
804	F	97.2	Very high	95.3	Very high	5 Å²	5	27.3 Å²	27.3	2%	0.022	14%	0.137	C	C	.	.	H	α-helix	trans	-55.7	-49.2	176.5	166.5	-98.7	0	0	0	112.7	F747 W751 I799 T800 P801 C806 M807 K808	F747-F804 AromaticContact CD1-CD2 3.92Å; F747-F804 HydrophobicContact CD1-CD2 3.92Å; F747-F804 AromaticContact CD1-CE2 3.44Å; F747-F804 HydrophobicContact CD1-CE2 3.44Å; F747-F804 VanDerWaalsContact CD1-CE2 3.44Å; F747-F804 HydrophobicContact CD1-CZ 4.37Å; F747-F804 AromaticContact CE1-CD2 3.31Å; F747-F804 HydrophobicContact CE1-CD2 3.31Å; F747-F804 AromaticContact CE1-CE2 3.37Å; F747-F804 HydrophobicContact CE1-CE2 3.37Å; F747-F804 HydrophobicContact CE1-CG 4.36Å; F747-F804 HydrophobicContact CE1-CZ 4.45Å; F747-F804 HydrophobicContact CG-CE2 4.45Å; F747-F804 AromaticContact CZ-CD2 3.96Å; F747-F804 HydrophobicContact CZ-CD2 3.96Å; F747-F804 HydrophobicContact CZ-CE2 4.33Å; W751-F804 HydrophobicContact CB-CD2 3.76Å; W751-F804 HydrophobicContact CB-CE1 4.42Å; W751-F804 HydrophobicContact CB-CE2 3.3Å; W751-F804 HydrophobicContact CB-CG 4.5Å; W751-F804 HydrophobicContact CB-CZ 3.69Å; W751-F804 AromaticContact CD1-CD1 3.98Å; W751-F804 AromaticContact CD1-CE1 3.71Å; W751-F804 AromaticContact CD1-CZ 3.79Å; W751-F804 HydrophobicContact CD2-CB 4.07Å; W751-F804 AromaticContact CD2-CD1 3.94Å; W751-F804 HydrophobicContact CD2-CD1 3.94Å; W751-F804 AromaticContact CD2-CD2 3.6Å; W751-F804 HydrophobicContact CD2-CD2 3.6Å; W751-F804 HydrophobicContact CD2-CE1 4.33Å; W751-F804 HydrophobicContact CD2-CE2 4.03Å; W751-F804 AromaticContact CD2-CG 3.56Å; W751-F804 HydrophobicContact CD2-CG 3.56Å; W751-F804 HydrophobicContact CD2-CZ 4.37Å; W751-F804 AromaticContact CE2-CD1 3.89Å; W751-F804 AromaticContact CE2-CG 3.88Å; W751-F804 HydrophobicContact CE3-CB 3.85Å; W751-F804 AromaticContact CE3-CD2 3.7Å; W751-F804 HydrophobicContact CE3-CD2 3.7Å; W751-F804 HydrophobicContact CE3-CE2 4.46Å; W751-F804 AromaticContact CE3-CG 3.76Å; W751-F804 HydrophobicContact CE3-CG 3.76Å; W751-F804 HydrophobicContact CG-CD1 4.02Å; W751-F804 AromaticContact CG-CD2 3.64Å; W751-F804 HydrophobicContact CG-CD2 3.64Å; W751-F804 AromaticContact CG-CE1 3.91Å; W751-F804 HydrophobicContact CG-CE1 3.91Å; W751-F804 AromaticContact CG-CE2 3.53Å; W751-F804 HydrophobicContact CG-CE2 3.53Å; W751-F804 AromaticContact CG-CG 3.9Å; W751-F804 HydrophobicContact CG-CG 3.9Å; W751-F804 AromaticContact CG-CZ 3.66Å; W751-F804 HydrophobicContact CG-CZ 3.66Å; W751-F804 HydrophobicContact CH2-CB 4.04Å; W751-F804 HydrophobicContact CZ2-CB 4.23Å; W751-F804 HydrophobicContact CZ2-CD1 4.48Å; W751-F804 HydrophobicContact CZ2-CG 4.37Å; W751-F804 HydrophobicContact CZ3-CB 3.85Å; W751-F804 HydrophobicContact CZ3-CG 4.26Å; W751-F804 AromaticContact NE1-CD1 3.89Å; I799-F804 HydrophobicContact CG2-CB 4.03Å; T800-F804 PolarHBondContact O-N 3.45Å; P801-F804 PolarHBondContact O-N 2.84Å; F804-C806 VanDerWaalsContact C-N 3.35Å; F804-C806 PolarHBondContact O-N 3.25Å; F804-M807 PolarHBondContact O-N 2.88Å; F804-K808 HydrophobicContact CE1-CD 4.26Å; F804-K808 HydrophobicContact CZ-CB 4.47Å; F804-K808 HydrophobicContact CZ-CD 4.06Å; F804-K808 VanDerWaalsContact O-CB 3.32Å; F804-K808 WeakPolarHBondContact O-CB 3.44Å; F804-K808 PolarHBondContact O-N 3.36Å
805	L	96.3	Very high	95.1	Very high	17 Å²	17	27.8 Å²	27.8	9%	0.089	14%	0.139	C	C	.	.	H	α-helix	trans	-59.7	-44.1	-179.3	-73.6	170.6	0	0	0	112	L677 E678 E681 P801 E803 A809	L677-L805 HydrophobicContact CB-CB 4.09Å; L677-L805 HydrophobicContact CB-CD1 4.35Å; L677-L805 HydrophobicContact CD1-CB 4.17Å; E678-L805 HydrophobicContact CB-CD1 3.97Å; E681-L805 HydrophobicContact CB-CD2 4.19Å; E681-L805 HydrophobicContact CG-CD2 4.11Å; P801-L805 WeakPolarHBondContact O-CG 3.31Å; P801-L805 PolarHBondContact O-N 3.13Å; E803-L805 PolarHBondContact O-N 3.39Å; L805-A809 PolarHBondContact O-N 3.43Å; L805-A809 VanDerWaalsContact O-N 3.15Å
806	C	96.1	Very high	95.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-69.9	-39.9	178.6	-163.4	0	0	0	0	112	L677 Q802 E803 F804 A809 L810 Y834 L838 I841	L677-C806 HydrophobicContact CD1-CB 4.44Å; Q802-C806 PolarHBondContact O-N 3.43Å; E803-C806 PolarHBondContact O-N 3.05Å; F804-C806 VanDerWaalsContact C-N 3.35Å; F804-C806 PolarHBondContact O-N 3.25Å; C806-A809 PolarHBondContact O-N 2.74Å; C806-L810 WeakPolarHBondContact O-CG 3.44Å; C806-L810 PolarHBondContact O-N 3.01Å; C806-Y834 PolarHBondContact SG-O 3.35Å; C806-L838 HydrophobicContact CB-CD1 4.28Å; C806-I841 HydrophobicContact CB-CD1 3.74Å
807	M	97.9	Very high	95.3	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.6	-41.8	174.2	-76.7	174.4	76.3	0	0	112.8	F747 I799 E803 F804 A809 L810 L811 L838 L859 L862 L863	F747-M807 HydrophobicContact CE1-CB 3.97Å; F747-M807 HydrophobicContact CE2-CE 4.13Å; F747-M807 HydrophobicContact CZ-CB 3.61Å; F747-M807 HydrophobicContact CZ-CE 3.93Å; F747-M807 HydrophobicContact CZ-SD 4.42Å; I799-M807 HydrophobicContact CD1-CE 3.88Å; I799-M807 HydrophobicContact CD1-SD 3.93Å; I799-M807 HydrophobicContact CG2-SD 4.41Å; E803-M807 VanDerWaalsContact O-CB 3.26Å; E803-M807 WeakPolarHBondContact O-CB 3.48Å; E803-M807 WeakPolarHBondContact O-CG 3.3Å; E803-M807 PolarHBondContact O-N 3.28Å; F804-M807 PolarHBondContact O-N 2.88Å; M807-A809 VanDerWaalsContact C-N 3.35Å; M807-A809 PolarHBondContact O-N 3.29Å; M807-L810 WeakPolarHBondContact O-CB 3.12Å; M807-L810 PolarHBondContact O-N 3.48Å; M807-L811 PolarHBondContact O-N 3.18Å; M807-L838 HydrophobicContact CG-CD1 4.24Å; M807-L838 HydrophobicContact CG-CD2 4.36Å; M807-L859 HydrophobicContact CE-CB 3.94Å; M807-L859 HydrophobicContact CE-CD2 4.13Å; M807-L859 VanDerWaalsContact CE-O 3.29Å; M807-L859 WeakPolarHBondContact CE-O 3.3Å; M807-L859 HydrophobicContact SD-CB 3.85Å; M807-L859 HydrophobicContact SD-CD1 3.88Å; M807-L859 HydrophobicContact SD-CD2 3.74Å; M807-L859 HydrophobicContact SD-CG 4.02Å; M807-L862 HydrophobicContact CE-CB 4.37Å; M807-L862 HydrophobicContact CE-CD2 4.27Å; M807-L863 HydrophobicContact CB-CD2 3.88Å; M807-L863 HydrophobicContact CE-CD2 3.7Å; M807-L863 HydrophobicContact CE-CG 4.03Å; M807-L863 HydrophobicContact CG-CD1 4.45Å; M807-L863 HydrophobicContact CG-CD2 4.26Å
808	K	97.6	Very high	95.2	Very high	7 Å²	7	22.8 Å²	22.8	3%	0.03	12%	0.123	C	C	.	.	H	α-helix	trans	-60.3	-44.4	174.4	-176.3	-170.4	171.5	-171.5	0	110.9	E681 W718 L744 F747 F804 L811 L812	E681-K808 IonicContact OE1-NZ 3.16Å; E681-K808 PolarHBondContact OE1-NZ 3.07Å; E681-K808 IonicContact OE2-NZ 2.74Å; E681-K808 PolarHBondContact OE2-NZ 2.76Å; W718-K808 HydrophobicContact CH2-CD 4.29Å; W718-K808 HydrophobicContact CH2-CG 3.9Å; W718-K808 HydrophobicContact CZ2-CB 4.48Å; W718-K808 HydrophobicContact CZ2-CD 3.74Å; W718-K808 HydrophobicContact CZ2-CG 3.75Å; L744-K808 HydrophobicContact CD2-CG 4.11Å; L744-K808 WeakPolarHBondContact CD2-O 3.47Å; F747-K808 HydrophobicContact CD1-CB 4.03Å; F747-K808 HydrophobicContact CD1-CG 4.45Å; F747-K808 HydrophobicContact CE1-CB 3.99Å; F804-K808 HydrophobicContact CE1-CD 4.26Å; F804-K808 HydrophobicContact CZ-CB 4.47Å; F804-K808 HydrophobicContact CZ-CD 4.06Å; F804-K808 VanDerWaalsContact O-CB 3.32Å; F804-K808 WeakPolarHBondContact O-CB 3.44Å; F804-K808 PolarHBondContact O-N 3.36Å; K808-L811 PolarHBondContact O-N 3.48Å; K808-L812 PolarHBondContact O-N 3.44Å
809	A	97.4	Very high	95.1	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.5	-38	174.5	0	0	0	0	0	112.4	L722 L805 C806 M807 L811 L812 F813 Y834	L722-A809 HydrophobicContact CD2-CB 4.1Å; L805-A809 PolarHBondContact O-N 3.43Å; L805-A809 VanDerWaalsContact O-N 3.15Å; C806-A809 PolarHBondContact O-N 2.74Å; M807-A809 VanDerWaalsContact C-N 3.35Å; M807-A809 PolarHBondContact O-N 3.29Å; A809-L811 VanDerWaalsContact C-N 3.32Å; A809-L811 PolarHBondContact O-N 3.09Å; A809-L812 WeakPolarHBondContact O-CB 3.38Å; A809-L812 PolarHBondContact O-N 3.04Å; A809-F813 WeakPolarHBondContact O-CD2 3.27Å; A809-Y834 HydrophobicContact CB-CD1 3.51Å; A809-Y834 HydrophobicContact CB-CE1 3.38Å; A809-Y834 HydrophobicContact CB-CG 4.48Å
810	L	97.6	Very high	94.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-32.6	173.8	-76	168.8	0	0	0	113.3	C806 M807 F813 S814 I835 L838 L863 F916	C806-L810 WeakPolarHBondContact O-CG 3.44Å; C806-L810 PolarHBondContact O-N 3.01Å; M807-L810 WeakPolarHBondContact O-CB 3.12Å; M807-L810 PolarHBondContact O-N 3.48Å; L810-F813 CarbonylContact O-C 3.58Å; L810-F813 PolarHBondContact O-N 3.19Å; L810-S814 WeakPolarHBondContact O-CB 3.19Å; L810-S814 PolarHBondContact O-N 3.44Å; L810-S814 PolarHBondContact O-OG 2.86Å; L810-I835 HydrophobicContact CD2-CG1 3.68Å; L810-L838 HydrophobicContact CD1-CB 4.2Å; L810-L838 HydrophobicContact CD1-CD2 3.72Å; L810-L863 HydrophobicContact CB-CD1 3.81Å; L810-L863 HydrophobicContact CD1-CD1 4.13Å; L810-F916 HydrophobicContact CD1-CZ 4.31Å; L810-F916 HydrophobicContact CD2-CZ 4.34Å
811	L	97.4	Very high	94.9	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.016	13%	0.133	C	C	.	.	H	α-helix	trans	-65.6	-36.7	176.5	-77.2	171.7	0	0	0	113.1	L744 F747 M807 K808 A809 F813 S814 L863 V866	L744-L811 HydrophobicContact CD2-CB 3.93Å; F747-L811 HydrophobicContact CB-CD1 3.49Å; F747-L811 VanDerWaalsContact CB-CD1 3.49Å; F747-L811 HydrophobicContact CD1-CD1 3.7Å; F747-L811 HydrophobicContact CD2-CD1 3.56Å; F747-L811 HydrophobicContact CE1-CD1 4.28Å; F747-L811 HydrophobicContact CE2-CD1 4.16Å; F747-L811 HydrophobicContact CG-CD1 3.3Å; M807-L811 PolarHBondContact O-N 3.18Å; K808-L811 PolarHBondContact O-N 3.48Å; A809-L811 VanDerWaalsContact C-N 3.32Å; A809-L811 PolarHBondContact O-N 3.09Å; L811-F813 VanDerWaalsContact C-N 3.29Å; L811-F813 PolarHBondContact O-N 2.88Å; L811-S814 WeakPolarHBondContact O-CB 3.39Å; L811-S814 PolarHBondContact O-N 3.16Å; L811-S814 VanDerWaalsContact O-N 3.13Å; L811-L863 HydrophobicContact CD1-CD2 4.06Å; L811-L863 HydrophobicContact CD2-CB 4.32Å; L811-L863 HydrophobicContact CD2-CD2 3.96Å; L811-L863 HydrophobicContact CG-CD2 3.75Å; L811-V866 HydrophobicContact CD1-CG1 4.36Å; L811-V866 HydrophobicContact CD1-CG2 4.46Å; L811-V866 HydrophobicContact CD2-CB 4.23Å; L811-V866 HydrophobicContact CD2-CG1 4.22Å
812	L	97.4	Very high	94.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-54.9	-49.5	171.5	178	68.6	0	0	0	109.8	W718 A719 L722 F725 V736 I737 S740 L744 K808 A809 S814	W718-L812 HydrophobicContact CH2-CB 4.4Å; W718-L812 HydrophobicContact CZ3-CB 4.33Å; W718-L812 HydrophobicContact CZ3-CD2 4.12Å; A719-L812 HydrophobicContact CB-CD2 4.08Å; L722-L812 HydrophobicContact CD1-CD2 3.29Å; F725-L812 HydrophobicContact CD2-CD2 3.89Å; F725-L812 HydrophobicContact CE2-CD2 3.84Å; F725-L812 HydrophobicContact CE2-CG 4.38Å; V736-L812 HydrophobicContact CG1-CD1 3.8Å; V736-L812 HydrophobicContact CG1-CG 3.83Å; V736-L812 VanDerWaalsContact CG1-O 3.28Å; V736-L812 WeakPolarHBondContact CG1-O 3.4Å; I737-L812 HydrophobicContact CG1-CD1 3.87Å; S740-L812 WeakPolarHBondContact OG-CD1 3.5Å; L744-L812 HydrophobicContact CD1-CB 4.25Å; L744-L812 HydrophobicContact CD1-CD1 3.94Å; L744-L812 HydrophobicContact CD2-CB 4.33Å; K808-L812 PolarHBondContact O-N 3.44Å; A809-L812 WeakPolarHBondContact O-CB 3.38Å; A809-L812 PolarHBondContact O-N 3.04Å; L812-S814 PolarHBondContact O-N 3.33Å
813	F	96.3	Very high	94.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	21.5	179.1	-52.6	-67.1	0	0	0	114.4	F725 L728 V736 A809 L810 L811 F827 L830 R831 Y834	F725-F813 AromaticContact CD2-CE1 3.84Å; F725-F813 HydrophobicContact CD2-CE1 3.84Å; F725-F813 AromaticContact CD2-CZ 3.94Å; F725-F813 HydrophobicContact CD2-CZ 3.94Å; F725-F813 HydrophobicContact CE2-CE1 4.34Å; L728-F813 HydrophobicContact CD1-CE1 4.29Å; V736-F813 HydrophobicContact CG1-CD1 4.46Å; A809-F813 WeakPolarHBondContact O-CD2 3.27Å; L810-F813 CarbonylContact O-C 3.58Å; L810-F813 PolarHBondContact O-N 3.19Å; L811-F813 VanDerWaalsContact C-N 3.29Å; L811-F813 PolarHBondContact O-N 2.88Å; F813-F827 HydrophobicContact CB-CE2 4.11Å; F813-F827 HydrophobicContact CB-CZ 4.07Å; F813-F827 HydrophobicContact CD1-CD2 4.1Å; F813-F827 AromaticContact CD1-CE2 3.8Å; F813-F827 HydrophobicContact CD1-CE2 3.8Å; F813-F827 HydrophobicContact CG-CE2 4.47Å; F813-F827 WeakPolarHBondContact O-CZ 3.46Å; F813-L830 HydrophobicContact CD1-CD2 4.35Å; F813-L830 HydrophobicContact CE1-CD2 3.49Å; F813-L830 VanDerWaalsContact CE1-CD2 3.49Å; F813-L830 HydrophobicContact CE1-CG 4.04Å; F813-L830 HydrophobicContact CE2-CG 4.49Å; F813-L830 HydrophobicContact CZ-CD2 3.66Å; F813-L830 HydrophobicContact CZ-CG 3.97Å; F813-R831 HydrophobicContact CB-CB 4.08Å; F813-R831 HydrophobicContact CB-CG 4.19Å; F813-R831 WeakPolarHBondContact O-CD 3.27Å; F813-R831 PolarHBondContact O-NH1 2.99Å; F813-Y834 AromaticContact CD2-CD2 3.91Å; F813-Y834 HydrophobicContact CD2-CD2 3.91Å; F813-Y834 HydrophobicContact CD2-CE2 4.18Å; F813-Y834 HydrophobicContact CD2-CG 4.41Å; F813-Y834 AromaticContact CE2-CD2 3.59Å; F813-Y834 HydrophobicContact CE2-CD2 3.59Å; F813-Y834 AromaticContact CE2-CE2 3.38Å; F813-Y834 HydrophobicContact CE2-CE2 3.38Å; F813-Y834 HydrophobicContact CE2-CG 4.31Å; F813-Y834 AromaticContact CE2-CZ 3.92Å; F813-Y834 HydrophobicContact CZ-CD2 4.49Å; F813-Y834 HydrophobicContact CZ-CE2 4Å
814	S	93.6	Very high	94.8	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.014	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	6	-177.3	-68.6	0	0	0	0	115.3	L810 L811 L812 R831 P913 I914	L810-S814 WeakPolarHBondContact O-CB 3.19Å; L810-S814 PolarHBondContact O-N 3.44Å; L810-S814 PolarHBondContact O-OG 2.86Å; L811-S814 WeakPolarHBondContact O-CB 3.39Å; L811-S814 PolarHBondContact O-N 3.16Å; L811-S814 VanDerWaalsContact O-N 3.13Å; L812-S814 PolarHBondContact O-N 3.33Å; S814-R831 PolarHBondContact OG-NH1 3.4Å; S814-P913 CarbonylContact O-C 3.6Å; S814-P913 WeakPolarHBondContact O-CA 3.43Å; S814-I914 PolarHBondContact O-N 2.7Å
815	I	93.2	Very high	94.6	Very high	10 Å²	10	37.2 Å²	37.2	5%	0.051	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	133.2	178.6	-50.5	-175.9	0	0	0	110.3	Q867 V911	I815-Q867 VanDerWaalsContact CD1-OE1 3.31Å; I815-V911 HydrophobicContact CG2-CG1 3.3Å
816	I	94	Very high	94.5	Very high	22 Å²	22	39.4 Å²	39.4	11%	0.113	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	159.9	-179.5	57.8	168.5	0	0	0	112.4	L821 F827 V911 K912 I914	I816-L821 HydrophobicContact CG2-CD1 3.86Å; I816-L821 HydrophobicContact CG2-CG 4.17Å; I816-F827 HydrophobicContact CG2-CD1 4.3Å; I816-F827 HydrophobicContact CG2-CE1 3.58Å; I816-F827 HydrophobicContact CG2-CE2 4.01Å; I816-F827 HydrophobicContact CG2-CZ 3.39Å; I816-V911 CarbonylContact O-C 3.58Å; I816-V911 WeakPolarHBondContact O-CA 3.36Å; I816-V911 VanDerWaalsContact O-CG1 3.26Å; I816-V911 WeakPolarHBondContact O-CG1 3.41Å; I816-K912 PolarHBondContact N-O 2.98Å; I816-K912 PolarHBondContact O-N 2.71Å; I816-I914 HydrophobicContact CD1-CD1 3.97Å; I816-I914 HydrophobicContact CD1-CG1 4.32Å; I816-I914 HydrophobicContact CG1-CD1 3.99Å; I816-I914 HydrophobicContact CG1-CG1 4.08Å; I816-I914 HydrophobicContact CG2-CD1 3.91Å
817	P	93.9	Very high	94.5	Very high	18 Å²	18	39.4 Å²	39.4	12%	0.117	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	151.3	165.7	-17.6	29.4	0	0	0	111.9	Y739 D819 G820 L821	Y739-P817 HydrophobicContact CE2-CG 4.05Å; P817-D819 VanDerWaalsContact C-N 3.26Å; P817-D819 PolarHBondContact O-N 2.73Å; P817-G820 WeakPolarHBondContact CG-O 3.37Å; P817-G820 PolarHBondContact O-N 3.37Å; P817-G820 VanDerWaalsContact O-N 3.15Å; P817-L821 HydrophobicContact CG-CD2 4.04Å
818	V	91.9	Very high	94.4	Very high	87 Å²	87	42.9 Å²	42.9	53%	0.527	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-33.2	169.5	167.6	0	0	0	0	111.5	G820 G909 K910 K912	V818-G820 PolarHBondContact O-N 2.96Å; V818-G909 WeakPolarHBondContact CG2-O 3.18Å; V818-K910 PolarHBondContact N-O 2.88Å; V818-K912 HydrophobicContact CG2-CB 4.16Å
819	D	89.9	Confident	94.3	Very high	156 Å²	156	48.5 Å²	48.5	83%	0.834	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-4.9	174.1	-48.4	-65.1	0	0	0	113.3	P817	P817-D819 VanDerWaalsContact C-N 3.26Å; P817-D819 PolarHBondContact O-N 2.73Å
820	G	91.8	Very high	94.1	Very high	26 Å²	26	48.9 Å²	48.9	27%	0.268	25%	0.248	S	C	.	.			trans	82.1	178.3	-175.6	0	0	0	0	0	114.5	P817 V818	P817-G820 WeakPolarHBondContact CG-O 3.37Å; P817-G820 PolarHBondContact O-N 3.37Å; P817-G820 VanDerWaalsContact O-N 3.15Å; V818-G820 PolarHBondContact O-N 2.96Å
821	L	92.9	Very high	94.1	Very high	14 Å²	14	49.8 Å²	49.8	7%	0.073	25%	0.252	C	S	.	.			trans	-98.3	151.5	171.7	-65.6	175.5	0	0	0	111.1	D732 A735 V736 I816 P817 N823 Q824 F827	D732-L821 HydrophobicContact CB-CD2 4.14Å; A735-L821 HydrophobicContact CB-CD2 4.42Å; V736-L821 HydrophobicContact CG2-CD1 3.89Å; V736-L821 HydrophobicContact CG2-CD2 4.26Å; I816-L821 HydrophobicContact CG2-CD1 3.86Å; I816-L821 HydrophobicContact CG2-CG 4.17Å; P817-L821 HydrophobicContact CG-CD2 4.04Å; L821-N823 VanDerWaalsContact C-N 3.27Å; L821-N823 PolarHBondContact O-N 3.16Å; L821-Q824 WeakPolarHBondContact O-CB 3.5Å; L821-Q824 PolarHBondContact O-N 3.26Å; L821-Q824 VanDerWaalsContact O-N 3.13Å; L821-F827 HydrophobicContact CD1-CB 3.79Å; L821-F827 HydrophobicContact CD1-CD1 4.1Å; L821-F827 HydrophobicContact CD1-CD2 3.29Å; L821-F827 HydrophobicContact CD1-CE2 3.78Å; L821-F827 HydrophobicContact CD1-CG 3.46Å; L821-F827 VanDerWaalsContact CD1-CG 3.46Å; L821-F827 HydrophobicContact CD1-CZ 4.38Å
822	K	92	Very high	93.9	Very high	128 Å²	128	53.8 Å²	53.8	56%	0.557	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-44.7	179.4	-71.8	-179.6	163.2	-174.8	0	111.5	H729 D731 D732	H729-K822 HydrophobicContact CB-CB 4.34Å; H729-K822 HydrophobicContact CB-CD 4.43Å; H729-K822 PolarHBondContact CE1-NZ 3.41Å; H729-K822 PolarHBondContact NE2-NZ 3.08Å; D731-K822 WeakPolarHBondContact OD2-CE 3.35Å; D731-K822 IonicContact OD2-NZ 2.66Å; D731-K822 PolarHBondContact OD2-NZ 3.14Å; D732-K822 WeakPolarHBondContact OD1-CB 3.38Å; D732-K822 PolarHBondContact OD1-N 2.9Å; D732-K822 PolarHBondContact OD2-N 3.31Å
823	N	91.7	Very high	93.8	Very high	73 Å²	73	57.6 Å²	57.6	39%	0.39	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	40.8	178.1	-69.8	-6	0	0	0	112.4	D732 L821 K825 F826 F827	D732-N823 PolarHBondContact OD2-N 3.24Å; L821-N823 VanDerWaalsContact C-N 3.27Å; L821-N823 PolarHBondContact O-N 3.16Å; N823-K825 VanDerWaalsContact C-N 3.28Å; N823-K825 PolarHBondContact O-N 3.4Å; N823-F826 HydrophobicContact CB-CB 4.4Å; N823-F826 PolarHBondContact O-N 2.79Å; N823-F827 PolarHBondContact O-N 2.92Å
824	Q	94.4	Very high	93.7	Very high	45 Å²	45	57.7 Å²	57.7	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-41.8	-47.5	-175.3	-170.8	63.5	51.2	0	0	114.4	L821 F826 F827 D828	L821-Q824 WeakPolarHBondContact O-CB 3.5Å; L821-Q824 PolarHBondContact O-N 3.26Å; L821-Q824 VanDerWaalsContact O-N 3.13Å; Q824-F826 VanDerWaalsContact C-N 3.28Å; Q824-F826 PolarHBondContact O-N 3.31Å; Q824-F827 CarbonylContact O-C 3.58Å; Q824-F827 WeakPolarHBondContact O-CA 3.26Å; Q824-F827 WeakPolarHBondContact O-CB 3.13Å; Q824-F827 PolarHBondContact O-N 2.79Å; Q824-D828 PolarHBondContact NE2-OD1 3.38Å; Q824-D828 PolarHBondContact O-N 3.34Å
825	K	94	Very high	93.8	Very high	173 Å²	173	58.8 Å²	58.8	75%	0.752	30%	0.298	S	S	*	.	H	α-helix	trans	-57.4	-38.1	179.3	-66	176.2	-178	169.8	0	113.4	N823 E829	N823-K825 VanDerWaalsContact C-N 3.28Å; N823-K825 PolarHBondContact O-N 3.4Å; K825-E829 WeakPolarHBondContact O-CG 3.37Å; K825-E829 PolarHBondContact O-N 3.42Å
826	F	94.2	Very high	93.8	Very high	63 Å²	63	63.7 Å²	63.7	28%	0.276	32%	0.319	S	S	.	.	H	α-helix	trans	-74.9	-35.4	177.5	-178.2	-102.9	0	0	0	111.5	G724 N727 L728 N823 Q824 L830	G724-F826 WeakPolarHBondContact O-CE1 3.37Å; N727-F826 HydrophobicContact CB-CE1 3.6Å; N727-F826 HydrophobicContact CB-CE2 4.48Å; N727-F826 HydrophobicContact CB-CZ 3.54Å; L728-F826 HydrophobicContact CD2-CD1 3.85Å; L728-F826 HydrophobicContact CD2-CE1 4.43Å; L728-F826 HydrophobicContact CG-CD1 4.08Å; L728-F826 HydrophobicContact CG-CE1 4.17Å; N823-F826 HydrophobicContact CB-CB 4.4Å; N823-F826 PolarHBondContact O-N 2.79Å; Q824-F826 VanDerWaalsContact C-N 3.28Å; Q824-F826 PolarHBondContact O-N 3.31Å; F826-L830 HydrophobicContact CE1-CD2 4.26Å; F826-L830 WeakPolarHBondContact O-CB 3.35Å; F826-L830 PolarHBondContact O-N 2.81Å
827	F	95.9	Very high	93.7	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.4	-43.3	170	173.6	-85	0	0	0	111.7	L728 V736 F813 I816 L821 N823 Q824 L830 R831 I914	L728-F827 HydrophobicContact CD2-CB 3.95Å; V736-F827 HydrophobicContact CG1-CE2 4.4Å; V736-F827 HydrophobicContact CG2-CD2 4.08Å; V736-F827 HydrophobicContact CG2-CE2 3.75Å; F813-F827 HydrophobicContact CB-CE2 4.11Å; F813-F827 HydrophobicContact CB-CZ 4.07Å; F813-F827 HydrophobicContact CD1-CD2 4.1Å; F813-F827 AromaticContact CD1-CE2 3.8Å; F813-F827 HydrophobicContact CD1-CE2 3.8Å; F813-F827 HydrophobicContact CG-CE2 4.47Å; F813-F827 WeakPolarHBondContact O-CZ 3.46Å; I816-F827 HydrophobicContact CG2-CD1 4.3Å; I816-F827 HydrophobicContact CG2-CE1 3.58Å; I816-F827 HydrophobicContact CG2-CE2 4.01Å; I816-F827 HydrophobicContact CG2-CZ 3.39Å; L821-F827 HydrophobicContact CD1-CB 3.79Å; L821-F827 HydrophobicContact CD1-CD1 4.1Å; L821-F827 HydrophobicContact CD1-CD2 3.29Å; L821-F827 HydrophobicContact CD1-CE2 3.78Å; L821-F827 HydrophobicContact CD1-CG 3.46Å; L821-F827 VanDerWaalsContact CD1-CG 3.46Å; L821-F827 HydrophobicContact CD1-CZ 4.38Å; N823-F827 PolarHBondContact O-N 2.92Å; Q824-F827 CarbonylContact O-C 3.58Å; Q824-F827 WeakPolarHBondContact O-CA 3.26Å; Q824-F827 WeakPolarHBondContact O-CB 3.13Å; Q824-F827 PolarHBondContact O-N 2.79Å; F827-L830 PolarHBondContact O-N 3.38Å; F827-R831 WeakPolarHBondContact O-CB 3.47Å; F827-R831 PolarHBondContact O-N 3.07Å; F827-I914 HydrophobicContact CE1-CD1 3.67Å; F827-I914 HydrophobicContact CZ-CD1 4.08Å
828	D	95.4	Very high	93.7	Very high	74 Å²	74	62.9 Å²	62.9	40%	0.396	31%	0.313	S	S	.	.	H	α-helix	trans	-64.7	-45.1	178.6	-58.9	-29.7	0	0	0	111.2	Q824 L830 M832	Q824-D828 PolarHBondContact NE2-OD1 3.38Å; Q824-D828 PolarHBondContact O-N 3.34Å; D828-L830 VanDerWaalsContact C-N 3.34Å; D828-L830 PolarHBondContact O-N 3.03Å; D828-M832 WeakPolarHBondContact O-CB 3.43Å; D828-M832 PolarHBondContact O-N 3.47Å
829	E	95.4	Very high	93.6	Very high	125 Å²	125	62.1 Å²	62.1	58%	0.584	31%	0.306	S	S	*	.	H	α-helix	trans	-59.5	-42.3	172.1	-77.1	-179.3	-170.9	0	0	111.9	K825 M832 N833	K825-E829 WeakPolarHBondContact O-CG 3.37Å; K825-E829 PolarHBondContact O-N 3.42Å; E829-M832 PolarHBondContact O-N 3.36Å; E829-N833 PolarHBondContact O-N 2.95Å; E829-N833 PolarHBondContact O-ND2 3.1Å; E829-N833 VanDerWaalsContact O-ND2 3.08Å
830	L	93.9	Very high	93.6	Very high	7 Å²	7	58.1 Å²	58.1	4%	0.037	28%	0.279	C	S	.	.	H	α-helix	trans	-65.4	-52.8	179.6	-173.6	59.2	0	0	0	111.4	P723 L728 F813 F826 F827 D828 M832 N833 Y834	P723-L830 WeakPolarHBondContact O-CD1 3.49Å; L728-L830 HydrophobicContact CD1-CD2 4.03Å; L728-L830 HydrophobicContact CG-CD2 4.34Å; F813-L830 HydrophobicContact CD1-CD2 4.35Å; F813-L830 HydrophobicContact CE1-CD2 3.49Å; F813-L830 VanDerWaalsContact CE1-CD2 3.49Å; F813-L830 HydrophobicContact CE1-CG 4.04Å; F813-L830 HydrophobicContact CE2-CG 4.49Å; F813-L830 HydrophobicContact CZ-CD2 3.66Å; F813-L830 HydrophobicContact CZ-CG 3.97Å; F826-L830 HydrophobicContact CE1-CD2 4.26Å; F826-L830 WeakPolarHBondContact O-CB 3.35Å; F826-L830 PolarHBondContact O-N 2.81Å; F827-L830 PolarHBondContact O-N 3.38Å; D828-L830 VanDerWaalsContact C-N 3.34Å; D828-L830 PolarHBondContact O-N 3.03Å; L830-M832 VanDerWaalsContact C-N 3.27Å; L830-M832 PolarHBondContact O-N 3.38Å; L830-N833 WeakPolarHBondContact O-CB 3.34Å; L830-N833 PolarHBondContact O-N 3.41Å; L830-Y834 HydrophobicContact CD1-CD2 4.41Å; L830-Y834 HydrophobicContact CD1-CE2 3.88Å; L830-Y834 HydrophobicContact CG-CE2 4.23Å; L830-Y834 WeakPolarHBondContact O-CD2 3.41Å; L830-Y834 PolarHBondContact O-N 2.9Å
831	R	96.1	Very high	93.4	Very high	19 Å²	19	57.1 Å²	57.1	7%	0.072	27%	0.267	C	S	.	.	H	α-helix	trans	-53.9	-45.6	174	-179.6	-177.6	168.1	89.1	-4.9	110.8	F813 S814 F827 N833 Y834 I835 I914	F813-R831 HydrophobicContact CB-CB 4.08Å; F813-R831 HydrophobicContact CB-CG 4.19Å; F813-R831 WeakPolarHBondContact O-CD 3.27Å; F813-R831 PolarHBondContact O-NH1 2.99Å; S814-R831 PolarHBondContact OG-NH1 3.4Å; F827-R831 WeakPolarHBondContact O-CB 3.47Å; F827-R831 PolarHBondContact O-N 3.07Å; R831-N833 VanDerWaalsContact C-N 3.26Å; R831-N833 PolarHBondContact O-N 2.89Å; R831-Y834 PolarHBondContact O-N 2.82Å; R831-I835 HydrophobicContact CG-CD1 4.11Å; R831-I835 WeakPolarHBondContact O-CG1 3.23Å; R831-I835 PolarHBondContact O-N 3.28Å; R831-I914 PolarHBondContact NH2-O 3.47Å
832	M	95.2	Very high	93.3	Very high	87 Å²	87	56.4 Å²	56.4	43%	0.429	26%	0.264	S	S	.	.	H	α-helix	trans	-62	-30.1	178.6	-179.7	55.9	61.1	0	0	113.2	D828 E829 L830 K836	D828-M832 WeakPolarHBondContact O-CB 3.43Å; D828-M832 PolarHBondContact O-N 3.47Å; E829-M832 PolarHBondContact O-N 3.36Å; L830-M832 VanDerWaalsContact C-N 3.27Å; L830-M832 PolarHBondContact O-N 3.38Å; M832-K836 HydrophobicContact CG-CD 4.47Å; M832-K836 WeakPolarHBondContact O-CD 3.27Å; M832-K836 VanDerWaalsContact O-CG 3.29Å; M832-K836 WeakPolarHBondContact O-CG 3.46Å; M832-K836 PolarHBondContact O-N 2.79Å; M832-K836 VanDerWaalsContact O-N 3.14Å; M832-K836 HydrophobicContact SD-CG 4.48Å
833	N	93.6	Very high	93	Very high	81 Å²	81	53 Å²	53	43%	0.433	26%	0.259	S	S	.	.	H	α-helix	trans	-72.3	-39.8	174.5	-65.7	-31.3	0	0	0	112.2	E829 L830 R831 I835 K836 E837	E829-N833 PolarHBondContact O-N 2.95Å; E829-N833 PolarHBondContact O-ND2 3.1Å; E829-N833 VanDerWaalsContact O-ND2 3.08Å; L830-N833 WeakPolarHBondContact O-CB 3.34Å; L830-N833 PolarHBondContact O-N 3.41Å; R831-N833 VanDerWaalsContact C-N 3.26Å; R831-N833 PolarHBondContact O-N 2.89Å; N833-I835 VanDerWaalsContact C-N 3.33Å; N833-K836 PolarHBondContact O-N 2.67Å; N833-E837 PolarHBondContact O-N 2.62Å; N833-E837 VanDerWaalsContact O-N 3.07Å
834	Y	95.1	Very high	92.2	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-65.6	-34.8	172.3	-77	-88.1	0	0	0	112.5	F673 L677 L722 P723 C806 A809 F813 L830 R831 E837 L838	F673-Y834 AromaticContact CE1-CD1 3.7Å; F673-Y834 HydrophobicContact CE1-CD1 3.7Å; F673-Y834 AromaticContact CE1-CE1 3.46Å; F673-Y834 HydrophobicContact CE1-CE1 3.46Å; F673-Y834 VanDerWaalsContact CE1-CE1 3.46Å; F673-Y834 AromaticContact CZ-CD1 3.68Å; F673-Y834 HydrophobicContact CZ-CD1 3.68Å; F673-Y834 HydrophobicContact CZ-CD2 4.47Å; F673-Y834 AromaticContact CZ-CE1 3.33Å; F673-Y834 HydrophobicContact CZ-CE1 3.33Å; F673-Y834 HydrophobicContact CZ-CE2 4.16Å; F673-Y834 HydrophobicContact CZ-CG 4.23Å; F673-Y834 AromaticContact CZ-CZ 3.59Å; L677-Y834 HydrophobicContact CD2-CE1 4.22Å; L722-Y834 HydrophobicContact CD2-CE1 4.28Å; P723-Y834 WeakPolarHBondContact CD-OH 3.45Å; P723-Y834 PolarHBondContact O-OH 3.22Å; C806-Y834 PolarHBondContact SG-O 3.35Å; A809-Y834 HydrophobicContact CB-CD1 3.51Å; A809-Y834 HydrophobicContact CB-CE1 3.38Å; A809-Y834 HydrophobicContact CB-CG 4.48Å; F813-Y834 AromaticContact CD2-CD2 3.91Å; F813-Y834 HydrophobicContact CD2-CD2 3.91Å; F813-Y834 HydrophobicContact CD2-CE2 4.18Å; F813-Y834 HydrophobicContact CD2-CG 4.41Å; F813-Y834 AromaticContact CE2-CD2 3.59Å; F813-Y834 HydrophobicContact CE2-CD2 3.59Å; F813-Y834 AromaticContact CE2-CE2 3.38Å; F813-Y834 HydrophobicContact CE2-CE2 3.38Å; F813-Y834 HydrophobicContact CE2-CG 4.31Å; F813-Y834 AromaticContact CE2-CZ 3.92Å; F813-Y834 HydrophobicContact CZ-CD2 4.49Å; F813-Y834 HydrophobicContact CZ-CE2 4Å; L830-Y834 HydrophobicContact CD1-CD2 4.41Å; L830-Y834 HydrophobicContact CD1-CE2 3.88Å; L830-Y834 HydrophobicContact CG-CE2 4.23Å; L830-Y834 WeakPolarHBondContact O-CD2 3.41Å; L830-Y834 PolarHBondContact O-N 2.9Å; R831-Y834 PolarHBondContact O-N 2.82Å; Y834-E837 PolarHBondContact O-N 3.24Å; Y834-L838 PolarHBondContact O-N 2.99Å
835	I	95.7	Very high	91.1	Very high	25 Å²	25	55.1 Å²	55.1	13%	0.128	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-50.6	174.4	-70	174.7	0	0	0	110.6	L810 R831 N833 E837 L838 D839 F856 F916	L810-I835 HydrophobicContact CD2-CG1 3.68Å; R831-I835 HydrophobicContact CG-CD1 4.11Å; R831-I835 WeakPolarHBondContact O-CG1 3.23Å; R831-I835 PolarHBondContact O-N 3.28Å; N833-I835 VanDerWaalsContact C-N 3.33Å; I835-E837 VanDerWaalsContact C-N 3.26Å; I835-E837 PolarHBondContact O-N 3.46Å; I835-L838 WeakPolarHBondContact O-CB 3.42Å; I835-L838 PolarHBondContact O-N 3Å; I835-L838 VanDerWaalsContact O-N 3.12Å; I835-D839 PolarHBondContact O-N 3.15Å; I835-F856 HydrophobicContact CG2-CE2 4.12Å; I835-F856 HydrophobicContact CG2-CZ 3.92Å; I835-F916 HydrophobicContact CD1-CE1 3.83Å; I835-F916 HydrophobicContact CG1-CE1 3.95Å; I835-F916 HydrophobicContact CG1-CZ 4.5Å
836	K	92.8	Very high	90.1	Very high	114 Å²	114	50.4 Å²	50.4	50%	0.496	25%	0.251	S	S	.	.	H	α-helix	trans	-60.5	-34.6	177.9	-70.3	164.1	-173.6	163.9	0	112.8	M832 N833 R840	M832-K836 HydrophobicContact CG-CD 4.47Å; M832-K836 WeakPolarHBondContact O-CD 3.27Å; M832-K836 VanDerWaalsContact O-CG 3.29Å; M832-K836 WeakPolarHBondContact O-CG 3.46Å; M832-K836 PolarHBondContact O-N 2.79Å; M832-K836 VanDerWaalsContact O-N 3.14Å; M832-K836 HydrophobicContact SD-CG 4.48Å; N833-K836 PolarHBondContact O-N 2.67Å; K836-R840 WeakPolarHBondContact O-CB 3.21Å; K836-R840 PolarHBondContact O-N 3.13Å
837	E	91.6	Very high	88.4	Confident	22 Å²	22	55.1 Å²	55.1	10%	0.103	27%	0.271	C	S	.	.	H	α-helix	trans	-71.5	-37.1	176.2	-173.6	55.2	-150.8	0	0	111.8	P671 F673 N833 Y834 I835 D839 R840 I841	P671-E837 WeakPolarHBondContact CG-OE1 3.49Å; F673-E837 HydrophobicContact CB-CG 4.34Å; F673-E837 HydrophobicContact CD1-CB 4.38Å; F673-E837 HydrophobicContact CD1-CG 3.65Å; F673-E837 HydrophobicContact CE1-CB 4.36Å; F673-E837 HydrophobicContact CE1-CG 4.07Å; F673-E837 HydrophobicContact CG-CG 4.1Å; N833-E837 PolarHBondContact O-N 2.62Å; N833-E837 VanDerWaalsContact O-N 3.07Å; Y834-E837 PolarHBondContact O-N 3.24Å; I835-E837 VanDerWaalsContact C-N 3.26Å; I835-E837 PolarHBondContact O-N 3.46Å; E837-D839 PolarHBondContact O-N 2.95Å; E837-R840 VanDerWaalsContact CD-NE 3.31Å; E837-R840 WeakPolarHBondContact O-CB 3.43Å; E837-R840 PolarHBondContact O-N 2.74Å; E837-R840 VanDerWaalsContact O-N 3.16Å; E837-R840 IonicContact OE1-CZ 3.71Å; E837-R840 VanDerWaalsContact OE1-CZ 3.25Å; E837-R840 IonicContact OE1-NE 3.6Å; E837-R840 PolarHBondContact OE1-NE 3.37Å; E837-R840 IonicContact OE1-NH2 3.59Å; E837-R840 PolarHBondContact OE1-NH2 2.92Å; E837-R840 WeakPolarHBondContact OE2-CD 3.3Å; E837-R840 IonicContact OE2-CZ 3.7Å; E837-R840 IonicContact OE2-NE 3.35Å; E837-R840 PolarHBondContact OE2-NE 3.23Å; E837-I841 HydrophobicContact CG-CD1 4.03Å; E837-I841 HydrophobicContact CG-CG1 4.41Å; E837-I841 WeakPolarHBondContact O-CD1 3.47Å; E837-I841 WeakPolarHBondContact O-CG1 3.49Å; E837-I841 PolarHBondContact O-N 3.45Å
838	L	93.6	Very high	87.1	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.9	-46	171.5	-175.9	62	0	0	0	111.4	C806 M807 L810 Y834 I835 R840 I841 I842 F856 L859 T860	C806-L838 HydrophobicContact CB-CD1 4.28Å; M807-L838 HydrophobicContact CG-CD1 4.24Å; M807-L838 HydrophobicContact CG-CD2 4.36Å; L810-L838 HydrophobicContact CD1-CB 4.2Å; L810-L838 HydrophobicContact CD1-CD2 3.72Å; Y834-L838 PolarHBondContact O-N 2.99Å; I835-L838 WeakPolarHBondContact O-CB 3.42Å; I835-L838 PolarHBondContact O-N 3Å; I835-L838 VanDerWaalsContact O-N 3.12Å; L838-R840 VanDerWaalsContact C-N 3.31Å; L838-R840 PolarHBondContact O-N 3.41Å; L838-I841 PolarHBondContact O-N 2.83Å; L838-I842 HydrophobicContact CD1-CD1 4.31Å; L838-I842 HydrophobicContact CG-CD1 4Å; L838-I842 WeakPolarHBondContact O-CD1 3.5Å; L838-I842 VanDerWaalsContact O-CG1 3.23Å; L838-I842 WeakPolarHBondContact O-CG1 3.46Å; L838-I842 PolarHBondContact O-N 2.81Å; L838-F856 HydrophobicContact CB-CE2 4.5Å; L838-F856 HydrophobicContact CD2-CD2 4.23Å; L838-F856 HydrophobicContact CD2-CE2 4.05Å; L838-F856 HydrophobicContact CG-CD2 4.34Å; L838-F856 HydrophobicContact CG-CE2 4.37Å; L838-L859 HydrophobicContact CD1-CD1 3.93Å; L838-T860 HydrophobicContact CD2-CG2 4.18Å
839	D	91.3	Very high	85.8	Confident	72 Å²	72	61.4 Å²	61.4	39%	0.385	31%	0.309	S	S	.	.	H	α-helix	trans	-56.2	-44.6	172	-81.9	-49.1	0	0	0	111.9	I835 E837 I842 A843 F856	I835-D839 PolarHBondContact O-N 3.15Å; E837-D839 PolarHBondContact O-N 2.95Å; D839-I842 PolarHBondContact O-N 3.26Å; D839-A843 WeakPolarHBondContact O-CB 3.49Å; D839-A843 PolarHBondContact O-N 2.68Å; D839-F856 WeakPolarHBondContact OD1-CD2 3.35Å
840	R	88.6	Confident	84.4	Confident	72 Å²	72	60.8 Å²	60.8	27%	0.272	31%	0.314	S	S	.	.	H	α-helix	trans	-64.6	-41.4	-179.9	-155.8	-162.6	65.5	59.4	39.6	112	K836 E837 L838 A843 C844	K836-R840 WeakPolarHBondContact O-CB 3.21Å; K836-R840 PolarHBondContact O-N 3.13Å; E837-R840 VanDerWaalsContact CD-NE 3.31Å; E837-R840 WeakPolarHBondContact O-CB 3.43Å; E837-R840 PolarHBondContact O-N 2.74Å; E837-R840 VanDerWaalsContact O-N 3.16Å; E837-R840 IonicContact OE1-CZ 3.71Å; E837-R840 VanDerWaalsContact OE1-CZ 3.25Å; E837-R840 IonicContact OE1-NE 3.6Å; E837-R840 PolarHBondContact OE1-NE 3.37Å; E837-R840 IonicContact OE1-NH2 3.59Å; E837-R840 PolarHBondContact OE1-NH2 2.92Å; E837-R840 WeakPolarHBondContact OE2-CD 3.3Å; E837-R840 IonicContact OE2-CZ 3.7Å; E837-R840 IonicContact OE2-NE 3.35Å; E837-R840 PolarHBondContact OE2-NE 3.23Å; L838-R840 VanDerWaalsContact C-N 3.31Å; L838-R840 PolarHBondContact O-N 3.41Å; R840-A843 PolarHBondContact O-N 3.5Å; R840-C844 PolarHBondContact NH1-SG 2.96Å; R840-C844 WeakPolarHBondContact O-CB 3.45Å; R840-C844 PolarHBondContact O-N 2.88Å; R840-C844 PolarHBondContact O-SG 3.25Å; R840-C844 VanDerWaalsContact O-SG 3.34Å
841	I	89.1	Confident	83.8	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-61.8	-45	175.4	-67.5	162.2	0	0	0	110.7	L674 Q802 E803 C806 E837 L838 K845	L674-I841 HydrophobicContact CD1-CD1 4.11Å; L674-I841 HydrophobicContact CD1-CG1 3.96Å; L674-I841 HydrophobicContact CD2-CD1 3.74Å; L674-I841 HydrophobicContact CD2-CG1 4.5Å; L674-I841 HydrophobicContact CG-CD1 4.04Å; L674-I841 HydrophobicContact CG-CG1 4.34Å; Q802-I841 HydrophobicContact CB-CG2 4.06Å; E803-I841 HydrophobicContact CG-CG2 3.97Å; C806-I841 HydrophobicContact CB-CD1 3.74Å; E837-I841 HydrophobicContact CG-CD1 4.03Å; E837-I841 HydrophobicContact CG-CG1 4.41Å; E837-I841 WeakPolarHBondContact O-CD1 3.47Å; E837-I841 WeakPolarHBondContact O-CG1 3.49Å; E837-I841 PolarHBondContact O-N 3.45Å; L838-I841 PolarHBondContact O-N 2.83Å; I841-K845 PolarHBondContact O-N 3.07Å
842	I	89.9	Confident	83.3	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.1	-44.6	177.9	-69.9	166.6	0	0	0	111	L838 D839 K845 R846 C852 R855 F856 L859	L838-I842 HydrophobicContact CD1-CD1 4.31Å; L838-I842 HydrophobicContact CG-CD1 4Å; L838-I842 WeakPolarHBondContact O-CD1 3.5Å; L838-I842 VanDerWaalsContact O-CG1 3.23Å; L838-I842 WeakPolarHBondContact O-CG1 3.46Å; L838-I842 PolarHBondContact O-N 2.81Å; D839-I842 PolarHBondContact O-N 3.26Å; I842-K845 PolarHBondContact O-N 3.36Å; I842-R846 PolarHBondContact O-N 3.05Å; I842-C852 HydrophobicContact CG2-CB 3.71Å; I842-R855 HydrophobicContact CD1-CG 3.99Å; I842-R855 HydrophobicContact CG1-CG 3.88Å; I842-R855 HydrophobicContact CG2-CB 3.9Å; I842-R855 HydrophobicContact CG2-CG 3.97Å; I842-F856 HydrophobicContact CD1-CB 3.84Å; I842-F856 HydrophobicContact CD1-CD2 4Å; I842-F856 HydrophobicContact CD1-CG 4.41Å; I842-L859 HydrophobicContact CD1-CD1 4.11Å; I842-L859 HydrophobicContact CG1-CD1 4.37Å
843	A	85.9	Confident	82.9	Confident	55 Å²	55	62.7 Å²	62.7	46%	0.455	34%	0.339	S	S	.	.	H	α-helix	trans	-67	-41.2	179.6	0	0	0	0	0	112.6	D839 R840 K845 R846	D839-A843 WeakPolarHBondContact O-CB 3.49Å; D839-A843 PolarHBondContact O-N 2.68Å; R840-A843 PolarHBondContact O-N 3.5Å; A843-K845 PolarHBondContact O-N 3.34Å; A843-R846 PolarHBondContact O-N 3.26Å
844	C	75.3	Confident	82.8	Confident	77 Å²	77	67.3 Å²	67.3	52%	0.52	35%	0.351	S	S	.	.	H	α-helix	trans	-58.9	-31.6	175.5	-76.9	0	0	0	0	113	R840	R840-C844 PolarHBondContact NH1-SG 2.96Å; R840-C844 WeakPolarHBondContact O-CB 3.45Å; R840-C844 PolarHBondContact O-N 2.88Å; R840-C844 PolarHBondContact O-SG 3.25Å; R840-C844 VanDerWaalsContact O-SG 3.34Å
845	K	71.5	Confident	82.7	Confident	87 Å²	87	67.8 Å²	67.8	38%	0.378	35%	0.352	S	S	.	.	H	α-helix	trans	-90.7	-8.9	179.6	-68	-169.3	179.9	-175.3	0	115	T800 I841 I842 A843	T800-K845 VanDerWaalsContact CB-NZ 3.28Å; T800-K845 PolarHBondContact OG1-NZ 3.32Å; I841-K845 PolarHBondContact O-N 3.07Å; I842-K845 PolarHBondContact O-N 3.36Å; A843-K845 PolarHBondContact O-N 3.34Å
846	R	72.5	Confident	82.7	Confident	73 Å²	73	68.4 Å²	68.4	28%	0.275	35%	0.354	S	S	.	.			trans	-141.1	122.2	-179.4	-66.4	-170.5	-158	71.9	-0.2	113.5	I842 A843 I848 S851 C852	I842-R846 PolarHBondContact O-N 3.05Å; A843-R846 PolarHBondContact O-N 3.26Å; R846-I848 PolarHBondContact O-N 3.48Å; R846-I848 VanDerWaalsContact O-N 3.15Å; R846-S851 WeakPolarHBondContact CD-OG 3.34Å; R846-C852 PolarHBondContact O-SG 3.45Å
847	K	59	Low	82.8	Confident	163 Å²	163	68.5 Å²	68.5	71%	0.709	35%	0.352	S	S	*	.	S	Bend	trans	-70.9	-1.2	178.6	-60.1	179.9	178.7	178.5	0	115.2	E665	E665-K847 IonicContact OE1-NZ 3Å; E665-K847 PolarHBondContact OE1-NZ 3.26Å
848	I	68.4	Low	83	Confident	104 Å²	104	70.4 Å²	70.4	53%	0.533	36%	0.361	S	S	.	.			trans	-122.4	112.5	-170.6	-56.5	177.4	0	0	0	110.6	R846 T850 S851 C852	R846-I848 PolarHBondContact O-N 3.48Å; R846-I848 VanDerWaalsContact O-N 3.15Å; I848-T850 PolarHBondContact O-N 3.42Å; I848-S851 VanDerWaalsContact O-CB 3.3Å; I848-S851 WeakPolarHBondContact O-CB 3.41Å; I848-S851 PolarHBondContact O-N 2.95Å; I848-C852 PolarHBondContact O-N 3.12Å; I848-C852 PolarHBondContact O-SG 2.68Å
849	P	66.4	Low	83.2	Confident	101 Å²	101	70.4 Å²	70.4	66%	0.656	36%	0.361	S	S	*	.	H	α-helix	trans	-56.8	-41	-173.1	-29.2	35.8	0	0	0	115.8	S851 C852 S853	P849-S851 VanDerWaalsContact C-N 3.26Å; P849-S851 PolarHBondContact O-N 3.4Å; P849-C852 WeakPolarHBondContact O-CA 3.33Å; P849-C852 VanDerWaalsContact O-CB 3.31Å; P849-C852 WeakPolarHBondContact O-CB 3.49Å; P849-C852 PolarHBondContact O-N 3.48Å; P849-S853 PolarHBondContact O-N 3.1Å; P849-S853 PolarHBondContact O-OG 3.19Å
850	T	68	Low	83.4	Confident	113 Å²	113	67 Å²	67	69%	0.693	34%	0.343	S	S	*	.	H	α-helix	trans	-64.5	-31.3	179	52.4	0	0	0	0	112.6	I848 R854	I848-T850 PolarHBondContact O-N 3.42Å; T850-R854 WeakPolarHBondContact O-CB 3.23Å; T850-R854 PolarHBondContact O-N 3.07Å; T850-R854 VanDerWaalsContact O-N 3.16Å
851	S	81.2	Confident	83.8	Confident	49 Å²	49	67 Å²	67	34%	0.343	35%	0.345	S	S	.	.	H	α-helix	trans	-70	-35.3	173.1	-160.2	0	0	0	0	111.5	R846 I848 P849 R855	R846-S851 WeakPolarHBondContact CD-OG 3.34Å; I848-S851 VanDerWaalsContact O-CB 3.3Å; I848-S851 WeakPolarHBondContact O-CB 3.41Å; I848-S851 PolarHBondContact O-N 2.95Å; P849-S851 VanDerWaalsContact C-N 3.26Å; P849-S851 PolarHBondContact O-N 3.4Å; S851-R855 WeakPolarHBondContact O-CB 3.49Å; S851-R855 PolarHBondContact O-N 3.48Å
852	C	83.9	Confident	84.2	Confident	19 Å²	19	67.1 Å²	67.1	13%	0.128	35%	0.345	C	S	.	.	H	α-helix	trans	-65.1	-50.7	174.8	-58.5	0	0	0	0	111.7	I842 R846 I848 P849 R854 R855 F856	I842-C852 HydrophobicContact CG2-CB 3.71Å; R846-C852 PolarHBondContact O-SG 3.45Å; I848-C852 PolarHBondContact O-N 3.12Å; I848-C852 PolarHBondContact O-SG 2.68Å; P849-C852 WeakPolarHBondContact O-CA 3.33Å; P849-C852 VanDerWaalsContact O-CB 3.31Å; P849-C852 WeakPolarHBondContact O-CB 3.49Å; P849-C852 PolarHBondContact O-N 3.48Å; C852-R854 VanDerWaalsContact C-N 3.34Å; C852-R854 PolarHBondContact O-N 3.01Å; C852-R855 WeakPolarHBondContact O-CB 3.46Å; C852-R855 PolarHBondContact O-N 2.88Å; C852-R855 VanDerWaalsContact O-N 3.13Å; C852-F856 PolarHBondContact O-N 3.48Å
853	S	88.1	Confident	84.6	Confident	84 Å²	84	67.2 Å²	67.2	59%	0.587	35%	0.346	S	S	*	.	H	α-helix	trans	-59.8	-42.4	177.9	-56	0	0	0	0	112.5	P849 R855 F856 Y857	P849-S853 PolarHBondContact O-N 3.1Å; P849-S853 PolarHBondContact O-OG 3.19Å; S853-R855 PolarHBondContact O-N 2.94Å; S853-F856 PolarHBondContact O-N 3.41Å; S853-Y857 PolarHBondContact O-N 3.46Å; S853-Y857 VanDerWaalsContact O-N 3.09Å
854	R	90.8	Very high	85.1	Confident	179 Å²	179	65.1 Å²	65.1	68%	0.675	33%	0.327	S	S	*	.	H	α-helix	trans	-62.3	-41.1	175	-174.9	177.5	178.8	-174.8	0.4	112	T850 C852 Q858	T850-R854 WeakPolarHBondContact O-CB 3.23Å; T850-R854 PolarHBondContact O-N 3.07Å; T850-R854 VanDerWaalsContact O-N 3.16Å; C852-R854 VanDerWaalsContact C-N 3.34Å; C852-R854 PolarHBondContact O-N 3.01Å; R854-Q858 WeakPolarHBondContact O-CG 3.38Å; R854-Q858 PolarHBondContact O-N 2.91Å
855	R	93.9	Very high	86.1	Confident	10 Å²	10	63.7 Å²	63.7	4%	0.038	32%	0.318	C	S	.	.	H	α-helix	trans	-64.1	-46.7	175.5	176.7	58.8	160.1	-170.4	-11.4	111.7	L797 Q798 E803 I842 S851 C852 S853 Y857 Q858 L859	L797-R855 PolarHBondContact O-NH1 2.91Å; L797-R855 PolarHBondContact O-NH2 2.95Å; Q798-R855 PolarHBondContact O-NH2 3.4Å; E803-R855 VanDerWaalsContact CD-NH2 3.29Å; E803-R855 IonicContact OE1-CZ 2.69Å; E803-R855 IonicContact OE1-NE 2.85Å; E803-R855 PolarHBondContact OE1-NE 2.65Å; E803-R855 IonicContact OE1-NH2 3.99Å; E803-R855 PolarHBondContact OE1-NH2 3Å; E803-R855 VanDerWaalsContact OE1-NH2 3.15Å; E803-R855 IonicContact OE2-CZ 2.8Å; E803-R855 IonicContact OE2-NE 3.85Å; E803-R855 IonicContact OE2-NH2 3.71Å; E803-R855 PolarHBondContact OE2-NH2 3.31Å; I842-R855 HydrophobicContact CD1-CG 3.99Å; I842-R855 HydrophobicContact CG1-CG 3.88Å; I842-R855 HydrophobicContact CG2-CB 3.9Å; I842-R855 HydrophobicContact CG2-CG 3.97Å; S851-R855 WeakPolarHBondContact O-CB 3.49Å; S851-R855 PolarHBondContact O-N 3.48Å; C852-R855 WeakPolarHBondContact O-CB 3.46Å; C852-R855 PolarHBondContact O-N 2.88Å; C852-R855 VanDerWaalsContact O-N 3.13Å; S853-R855 PolarHBondContact O-N 2.94Å; R855-Y857 VanDerWaalsContact C-N 3.31Å; R855-Y857 PolarHBondContact O-N 3.04Å; R855-Q858 WeakPolarHBondContact O-CB 3.23Å; R855-Q858 PolarHBondContact O-N 3.25Å; R855-Q858 VanDerWaalsContact O-N 3.12Å; R855-L859 HydrophobicContact CG-CD1 4.21Å; R855-L859 HydrophobicContact CG-CG 4.24Å; R855-L859 WeakPolarHBondContact O-CG 3.24Å; R855-L859 PolarHBondContact O-N 3.37Å
856	F	95	Very high	87.3	Confident	38 Å²	38	59.6 Å²	59.6	17%	0.167	30%	0.3	C	S	.	.	H	α-helix	trans	-56.9	-48.5	-179.3	-178.5	-87.6	0	0	0	110.5	I835 L838 D839 I842 C852 S853 Q858 L859 T860	I835-F856 HydrophobicContact CG2-CE2 4.12Å; I835-F856 HydrophobicContact CG2-CZ 3.92Å; L838-F856 HydrophobicContact CB-CE2 4.5Å; L838-F856 HydrophobicContact CD2-CD2 4.23Å; L838-F856 HydrophobicContact CD2-CE2 4.05Å; L838-F856 HydrophobicContact CG-CD2 4.34Å; L838-F856 HydrophobicContact CG-CE2 4.37Å; D839-F856 WeakPolarHBondContact OD1-CD2 3.35Å; I842-F856 HydrophobicContact CD1-CB 3.84Å; I842-F856 HydrophobicContact CD1-CD2 4Å; I842-F856 HydrophobicContact CD1-CG 4.41Å; C852-F856 PolarHBondContact O-N 3.48Å; S853-F856 PolarHBondContact O-N 3.41Å; F856-Q858 PolarHBondContact O-N 3.05Å; F856-L859 PolarHBondContact O-N 3.18Å; F856-T860 HydrophobicContact CD1-CG2 4.2Å; F856-T860 HydrophobicContact CE1-CG2 3.71Å; F856-T860 HydrophobicContact CE2-CG2 4.09Å; F856-T860 HydrophobicContact CZ-CG2 3.65Å; F856-T860 PolarHBondContact O-N 2.88Å; F856-T860 PolarHBondContact O-OG1 3.19Å
857	Y	95.3	Very high	88.4	Confident	117 Å²	117	56.9 Å²	56.9	46%	0.459	29%	0.29	S	S	.	.	H	α-helix	trans	-54.9	-48.2	173.2	175.9	-91.6	0	0	0	112.6	S853 R855 L859 T860 K861 H917	S853-Y857 PolarHBondContact O-N 3.46Å; S853-Y857 VanDerWaalsContact O-N 3.09Å; R855-Y857 VanDerWaalsContact C-N 3.31Å; R855-Y857 PolarHBondContact O-N 3.04Å; Y857-L859 PolarHBondContact O-N 3.19Å; Y857-T860 PolarHBondContact O-N 3.12Å; Y857-T860 PolarHBondContact O-OG1 3.3Å; Y857-K861 HydrophobicContact CE1-CB 4.5Å; Y857-K861 WeakPolarHBondContact O-CB 3.32Å; Y857-K861 PolarHBondContact O-N 2.85Å; Y857-H917 AromaticContact CD2-CD2 3.65Å; Y857-H917 AromaticContact CD2-CE1 3.84Å; Y857-H917 AromaticContact CD2-NE2 3.12Å; Y857-H917 WeakPolarHBondContact CD2-NE2 3.39Å; Y857-H917 AromaticContact CE2-CD2 3.53Å; Y857-H917 AromaticContact CE2-CE1 3.99Å; Y857-H917 AromaticContact CE2-NE2 3.44Å; Y857-H917 WeakPolarHBondContact CE2-NE2 3.23Å
858	Q	95.9	Very high	90.1	Very high	62 Å²	62	51.1 Å²	51.1	29%	0.29	27%	0.27	S	S	.	.	H	α-helix	trans	-59.7	-43.5	178.7	-75.1	174.2	-51.6	0	0	112.5	L797 R854 R855 F856 L862	L797-Q858 HydrophobicContact CD2-CB 4.17Å; L797-Q858 HydrophobicContact CD2-CG 4.3Å; R854-Q858 WeakPolarHBondContact O-CG 3.38Å; R854-Q858 PolarHBondContact O-N 2.91Å; R855-Q858 WeakPolarHBondContact O-CB 3.23Å; R855-Q858 PolarHBondContact O-N 3.25Å; R855-Q858 VanDerWaalsContact O-N 3.12Å; F856-Q858 PolarHBondContact O-N 3.05Å; Q858-L862 PolarHBondContact O-N 2.73Å
859	L	97	Very high	91.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-69.4	-46.4	179.7	-65.8	-170.1	0	0	0	111.7	I799 E803 M807 L838 I842 R855 F856 Y857 K861 L862 L863	I799-L859 HydrophobicContact CD1-CD2 3.61Å; I799-L859 HydrophobicContact CG1-CD2 3.91Å; E803-L859 HydrophobicContact CB-CD1 3.97Å; E803-L859 HydrophobicContact CG-CD1 3.94Å; M807-L859 HydrophobicContact CE-CB 3.94Å; M807-L859 HydrophobicContact CE-CD2 4.13Å; M807-L859 VanDerWaalsContact CE-O 3.29Å; M807-L859 WeakPolarHBondContact CE-O 3.3Å; M807-L859 HydrophobicContact SD-CB 3.85Å; M807-L859 HydrophobicContact SD-CD1 3.88Å; M807-L859 HydrophobicContact SD-CD2 3.74Å; M807-L859 HydrophobicContact SD-CG 4.02Å; L838-L859 HydrophobicContact CD1-CD1 3.93Å; I842-L859 HydrophobicContact CD1-CD1 4.11Å; I842-L859 HydrophobicContact CG1-CD1 4.37Å; R855-L859 HydrophobicContact CG-CD1 4.21Å; R855-L859 HydrophobicContact CG-CG 4.24Å; R855-L859 WeakPolarHBondContact O-CG 3.24Å; R855-L859 PolarHBondContact O-N 3.37Å; F856-L859 PolarHBondContact O-N 3.18Å; Y857-L859 PolarHBondContact O-N 3.19Å; L859-K861 PolarHBondContact O-N 2.91Å; L859-L862 WeakPolarHBondContact O-CB 3.2Å; L859-L862 PolarHBondContact O-N 2.97Å; L859-L863 PolarHBondContact O-N 3.21Å; L859-L863 VanDerWaalsContact O-N 3.09Å
860	T	96.6	Very high	93	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-72.6	-28.3	-178.7	52	0	0	0	0	112.8	L838 F856 Y857 L862 L863 D864 F916 H917	L838-T860 HydrophobicContact CD2-CG2 4.18Å; F856-T860 HydrophobicContact CD1-CG2 4.2Å; F856-T860 HydrophobicContact CE1-CG2 3.71Å; F856-T860 HydrophobicContact CE2-CG2 4.09Å; F856-T860 HydrophobicContact CZ-CG2 3.65Å; F856-T860 PolarHBondContact O-N 2.88Å; F856-T860 PolarHBondContact O-OG1 3.19Å; Y857-T860 PolarHBondContact O-N 3.12Å; Y857-T860 PolarHBondContact O-OG1 3.3Å; T860-L862 VanDerWaalsContact C-N 3.28Å; T860-L862 PolarHBondContact O-N 3.11Å; T860-L863 WeakPolarHBondContact O-CB 3.34Å; T860-L863 PolarHBondContact O-N 2.88Å; T860-L863 VanDerWaalsContact O-N 3.15Å; T860-D864 PolarHBondContact O-N 3.32Å; T860-F916 VanDerWaalsContact CB-CG 3.49Å; T860-F916 HydrophobicContact CG2-CB 4.42Å; T860-F916 HydrophobicContact CG2-CD1 3.58Å; T860-F916 HydrophobicContact CG2-CD2 4.14Å; T860-F916 HydrophobicContact CG2-CE1 3.73Å; T860-F916 HydrophobicContact CG2-CE2 4.28Å; T860-F916 HydrophobicContact CG2-CG 3.79Å; T860-F916 HydrophobicContact CG2-CZ 4.09Å; T860-H917 PolarHBondContact OG1-CE1 2.67Å
861	K	96.6	Very high	94.3	Very high	73 Å²	73	43.1 Å²	43.1	32%	0.317	21%	0.208	S	C	.	.	H	α-helix	trans	-68.5	-28.2	170.4	-164	69	176.7	-178.8	0	112	Y857 L859 D864 S865 H917	Y857-K861 HydrophobicContact CE1-CB 4.5Å; Y857-K861 WeakPolarHBondContact O-CB 3.32Å; Y857-K861 PolarHBondContact O-N 2.85Å; L859-K861 PolarHBondContact O-N 2.91Å; K861-D864 PolarHBondContact O-N 3.25Å; K861-S865 PolarHBondContact O-N 3.34Å; K861-H917 HydrophobicContact CD-CB 4.33Å; K861-H917 PolarHBondContact N-CE1 3.24Å
862	L	97.2	Very high	95	Very high	6 Å²	6	44.9 Å²	44.9	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-71.7	-35	169.4	-166	68.6	0	0	0	112.1	L790 E793 F794 L797 I799 M807 Q858 L859 T860 D864 S865 V866	L790-L862 HydrophobicContact CD1-CD1 3.89Å; L790-L862 HydrophobicContact CD1-CD2 4.48Å; L790-L862 HydrophobicContact CD1-CG 4.08Å; E793-L862 HydrophobicContact CB-CD1 3.55Å; E793-L862 HydrophobicContact CB-CD2 4.37Å; E793-L862 HydrophobicContact CG-CD1 3.81Å; F794-L862 HydrophobicContact CD1-CD2 3.6Å; F794-L862 HydrophobicContact CE1-CD2 3.47Å; F794-L862 VanDerWaalsContact CE1-CD2 3.47Å; F794-L862 HydrophobicContact CE1-CG 4.47Å; L797-L862 HydrophobicContact CD1-CB 4.48Å; L797-L862 HydrophobicContact CD1-CD2 4.05Å; I799-L862 HydrophobicContact CD1-CD2 3.59Å; M807-L862 HydrophobicContact CE-CB 4.37Å; M807-L862 HydrophobicContact CE-CD2 4.27Å; Q858-L862 PolarHBondContact O-N 2.73Å; L859-L862 WeakPolarHBondContact O-CB 3.2Å; L859-L862 PolarHBondContact O-N 2.97Å; T860-L862 VanDerWaalsContact C-N 3.28Å; T860-L862 PolarHBondContact O-N 3.11Å; L862-D864 VanDerWaalsContact C-N 3.3Å; L862-D864 PolarHBondContact O-N 3.08Å; L862-S865 PolarHBondContact O-N 2.76Å; L862-S865 PolarHBondContact O-OG 2.86Å; L862-S865 VanDerWaalsContact O-OG 3.05Å; L862-V866 WeakPolarHBondContact O-CG2 3.15Å; L862-V866 PolarHBondContact O-N 3.14Å
863	L	97.4	Very high	95.6	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-38	171.4	-62.5	-172.6	0	0	0	112.1	F747 M807 L810 L811 L859 T860 S865 F916	F747-L863 HydrophobicContact CE2-CD2 4.04Å; F747-L863 HydrophobicContact CZ-CD2 4.23Å; M807-L863 HydrophobicContact CB-CD2 3.88Å; M807-L863 HydrophobicContact CE-CD2 3.7Å; M807-L863 HydrophobicContact CE-CG 4.03Å; M807-L863 HydrophobicContact CG-CD1 4.45Å; M807-L863 HydrophobicContact CG-CD2 4.26Å; L810-L863 HydrophobicContact CB-CD1 3.81Å; L810-L863 HydrophobicContact CD1-CD1 4.13Å; L811-L863 HydrophobicContact CD1-CD2 4.06Å; L811-L863 HydrophobicContact CD2-CB 4.32Å; L811-L863 HydrophobicContact CD2-CD2 3.96Å; L811-L863 HydrophobicContact CG-CD2 3.75Å; L859-L863 PolarHBondContact O-N 3.21Å; L859-L863 VanDerWaalsContact O-N 3.09Å; T860-L863 WeakPolarHBondContact O-CB 3.34Å; T860-L863 PolarHBondContact O-N 2.88Å; T860-L863 VanDerWaalsContact O-N 3.15Å; L863-S865 VanDerWaalsContact C-N 3.34Å; L863-F916 HydrophobicContact CB-CD2 4.24Å; L863-F916 HydrophobicContact CB-CE2 4.04Å; L863-F916 HydrophobicContact CD1-CD2 4.44Å; L863-F916 HydrophobicContact CD1-CE2 3.61Å; L863-F916 HydrophobicContact CD1-CZ 4Å; L863-F916 HydrophobicContact CG-CE2 4.45Å
864	D	96.8	Very high	96	Very high	12 Å²	12	40.4 Å²	40.4	6%	0.064	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-36.4	174.8	-64.3	-28.3	0	0	0	112.2	T860 K861 L862 Q867 P868 Y915 F916 H917	T860-D864 PolarHBondContact O-N 3.32Å; K861-D864 PolarHBondContact O-N 3.25Å; L862-D864 VanDerWaalsContact C-N 3.3Å; L862-D864 PolarHBondContact O-N 3.08Å; D864-Q867 PolarHBondContact O-N 3.08Å; D864-P868 VanDerWaalsContact O-CD 3.3Å; D864-P868 WeakPolarHBondContact O-CD 3.44Å; D864-Y915 HydrophobicContact CB-CD1 3.92Å; D864-Y915 VanDerWaalsContact OD1-CA 3.23Å; D864-Y915 WeakPolarHBondContact OD1-CA 3.35Å; D864-F916 PolarHBondContact OD1-N 2.67Å; D864-H917 IonicContact OD2-CE1 3.1Å; D864-H917 IonicContact OD2-CG 2.83Å; D864-H917 PolarHBondContact OD2-N 2.86Å; D864-H917 IonicContact OD2-ND1 2.72Å; D864-H917 PolarHBondContact OD2-ND1 2.8Å
865	S	96.1	Very high	96.3	Very high	47 Å²	47	35.7 Å²	35.7	33%	0.329	17%	0.165	S	C	.	.	H	α-helix	trans	-76.6	-18.5	-177.6	78.2	0	0	0	0	114.3	K861 L862 L863 Q867 P868 I869	K861-S865 PolarHBondContact O-N 3.34Å; L862-S865 PolarHBondContact O-N 2.76Å; L862-S865 PolarHBondContact O-OG 2.86Å; L862-S865 VanDerWaalsContact O-OG 3.05Å; L863-S865 VanDerWaalsContact C-N 3.34Å; S865-Q867 VanDerWaalsContact C-N 3.33Å; S865-P868 WeakPolarHBondContact O-CD 3.45Å; S865-P868 WeakPolarHBondContact O-CG 3.29Å; S865-I869 WeakPolarHBondContact O-CD1 3.48Å; S865-I869 WeakPolarHBondContact O-CG1 3.33Å
866	V	97.3	Very high	96.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.2	-36.8	170.1	174.7	0	0	0	0	111.6	F747 L790 L811 L862 I869 A870	F747-V866 HydrophobicContact CD2-CG2 3.84Å; L790-V866 HydrophobicContact CD1-CG2 3.89Å; L790-V866 HydrophobicContact CD2-CG2 4Å; L811-V866 HydrophobicContact CD1-CG1 4.36Å; L811-V866 HydrophobicContact CD1-CG2 4.46Å; L811-V866 HydrophobicContact CD2-CB 4.23Å; L811-V866 HydrophobicContact CD2-CG1 4.22Å; L862-V866 WeakPolarHBondContact O-CG2 3.15Å; L862-V866 PolarHBondContact O-N 3.14Å; V866-I869 WeakPolarHBondContact O-CB 3.45Å; V866-I869 PolarHBondContact O-N 3.44Å; V866-I869 VanDerWaalsContact O-N 3.15Å; V866-A870 PolarHBondContact O-N 3.25Å
867	Q	95.4	Very high	96.5	Very high	16 Å²	16	35.6 Å²	35.6	8%	0.075	17%	0.165	C	C	.	.	H	α-helix	trans	-57.6	-50.4	-174	-56.4	-62.2	-28.5	0	0	114	I815 D864 S865 I869 A870 R871 P913 Y915	I815-Q867 VanDerWaalsContact CD1-OE1 3.31Å; D864-Q867 PolarHBondContact O-N 3.08Å; S865-Q867 VanDerWaalsContact C-N 3.33Å; Q867-I869 VanDerWaalsContact C-N 3.32Å; Q867-I869 PolarHBondContact O-N 3.35Å; Q867-A870 PolarHBondContact O-N 3.43Å; Q867-R871 PolarHBondContact O-N 3.46Å; Q867-P913 HydrophobicContact CG-CB 4.25Å; Q867-Y915 HydrophobicContact CB-CE1 3.73Å; Q867-Y915 HydrophobicContact CG-CD1 4.27Å; Q867-Y915 HydrophobicContact CG-CE1 3.71Å
868	P	95.6	Very high	96.5	Very high	42 Å²	42	31.9 Å²	31.9	27%	0.273	15%	0.152	S	C	.	.	H	α-helix	trans	-67.5	-29	176.5	26.4	-35.7	0	0	0	113.4	D864 S865 R871 E872	D864-P868 VanDerWaalsContact O-CD 3.3Å; D864-P868 WeakPolarHBondContact O-CD 3.44Å; S865-P868 WeakPolarHBondContact O-CD 3.45Å; S865-P868 WeakPolarHBondContact O-CG 3.29Å; P868-R871 PolarHBondContact O-N 3.28Å; P868-E872 PolarHBondContact O-N 2.83Å; P868-E872 VanDerWaalsContact O-N 3.1Å
869	I	97.2	Very high	96.5	Very high	12 Å²	12	31.5 Å²	31.5	6%	0.062	15%	0.152	C	C	.	.	H	α-helix	trans	-66.6	-46.2	174.2	-56.1	171	0	0	0	109.6	V746 R786 M787 L790 S865 V866 Q867 R871 E872 L873	V746-I869 HydrophobicContact CG1-CG2 4Å; R786-I869 HydrophobicContact CB-CG1 4.33Å; R786-I869 HydrophobicContact CB-CG2 4.35Å; M787-I869 HydrophobicContact CG-CG2 4.07Å; L790-I869 HydrophobicContact CB-CD1 4.15Å; S865-I869 WeakPolarHBondContact O-CD1 3.48Å; S865-I869 WeakPolarHBondContact O-CG1 3.33Å; V866-I869 WeakPolarHBondContact O-CB 3.45Å; V866-I869 PolarHBondContact O-N 3.44Å; V866-I869 VanDerWaalsContact O-N 3.15Å; Q867-I869 VanDerWaalsContact C-N 3.32Å; Q867-I869 PolarHBondContact O-N 3.35Å; I869-R871 VanDerWaalsContact C-N 3.35Å; I869-R871 PolarHBondContact O-N 3.36Å; I869-E872 PolarHBondContact O-N 3.49Å; I869-L873 HydrophobicContact CG2-CD1 4.04Å; I869-L873 PolarHBondContact O-N 3.11Å
870	A	97.1	Very high	96.4	Very high	2 Å²	2	32.1 Å²	32.1	2%	0.017	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-40.9	175.6	0	0	0	0	0	111.9	M742 V866 Q867 E872 L873 H874	M742-A870 HydrophobicContact CB-CB 4.3Å; M742-A870 HydrophobicContact CG-CB 3.98Å; V866-A870 PolarHBondContact O-N 3.25Å; Q867-A870 PolarHBondContact O-N 3.43Å; A870-E872 PolarHBondContact O-N 3.34Å; A870-L873 PolarHBondContact O-N 3.02Å; A870-H874 WeakPolarHBondContact O-CB 3.25Å; A870-H874 PolarHBondContact O-N 3.11Å; A870-H874 PolarHBondContact O-ND1 3.3Å
871	R	95.9	Very high	96.4	Very high	137 Å²	137	33.6 Å²	33.6	52%	0.517	16%	0.163	S	C	.	.	H	α-helix	trans	-64	-39.2	177.4	-170.4	174.5	-175.7	-96.7	-2.4	113.1	Q867 P868 I869 H874 Q875 L907	Q867-R871 PolarHBondContact O-N 3.46Å; P868-R871 PolarHBondContact O-N 3.28Å; I869-R871 VanDerWaalsContact C-N 3.35Å; I869-R871 PolarHBondContact O-N 3.36Å; R871-H874 PolarHBondContact O-N 3.1Å; R871-Q875 PolarHBondContact O-N 2.91Å; R871-L907 HydrophobicContact CG-CD2 4.24Å; R871-L907 PolarHBondContact NH2-O 3.39Å; R871-L907 VanDerWaalsContact NH2-O 3.13Å
872	E	96.5	Very high	96.2	Very high	86 Å²	86	34.1 Å²	34.1	40%	0.402	17%	0.168	S	C	.	.	H	α-helix	trans	-71.3	-34.3	176.3	-79.6	173.1	-162.7	0	0	112.8	R786 P868 I869 A870 Q875 F876	R786-E872 WeakPolarHBondContact CD-OE2 3.36Å; R786-E872 IonicContact CZ-OE1 3.79Å; R786-E872 IonicContact CZ-OE2 3.17Å; R786-E872 IonicContact NE-OE2 2.71Å; R786-E872 IonicContact NH1-OE1 3.51Å; R786-E872 PolarHBondContact NH1-OE1 3.43Å; R786-E872 IonicContact NH1-OE2 2.7Å; R786-E872 PolarHBondContact NH1-OE2 3Å; P868-E872 PolarHBondContact O-N 2.83Å; P868-E872 VanDerWaalsContact O-N 3.1Å; I869-E872 PolarHBondContact O-N 3.49Å; A870-E872 PolarHBondContact O-N 3.34Å; E872-Q875 PolarHBondContact O-N 3.13Å; E872-F876 WeakPolarHBondContact O-CB 3.26Å; E872-F876 PolarHBondContact O-N 2.93Å
873	L	96.9	Very high	96	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-69.3	-41.4	171.3	-75.5	160.7	0	0	0	111.7	M742 V746 M780 Q783 M787 I869 A870 Q875 F876 T877	M742-L873 HydrophobicContact CE-CB 3.84Å; M742-L873 HydrophobicContact CG-CB 3.96Å; M742-L873 HydrophobicContact SD-CB 3.65Å; M742-L873 HydrophobicContact SD-CD1 4.17Å; M742-L873 HydrophobicContact SD-CG 4.47Å; V746-L873 HydrophobicContact CG2-CD1 3.32Å; M780-L873 HydrophobicContact CE-CD2 3.54Å; Q783-L873 HydrophobicContact CB-CD2 3.76Å; Q783-L873 HydrophobicContact CB-CG 4.33Å; Q783-L873 HydrophobicContact CG-CD2 4.08Å; M787-L873 HydrophobicContact CE-CD1 4.4Å; M787-L873 HydrophobicContact CE-CD2 4.03Å; M787-L873 HydrophobicContact CG-CD1 4.09Å; M787-L873 HydrophobicContact SD-CD1 3.7Å; M787-L873 HydrophobicContact SD-CD2 4.35Å; I869-L873 HydrophobicContact CG2-CD1 4.04Å; I869-L873 PolarHBondContact O-N 3.11Å; A870-L873 PolarHBondContact O-N 3.02Å; L873-Q875 VanDerWaalsContact C-N 3.33Å; L873-Q875 PolarHBondContact O-N 3.48Å; L873-F876 PolarHBondContact O-N 2.74Å; L873-T877 WeakPolarHBondContact O-CB 3.46Å; L873-T877 PolarHBondContact O-N 3.06Å; L873-T877 PolarHBondContact O-OG1 3.19Å
874	H	96.3	Very high	95.6	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.019	20%	0.195	C	C	.	.	H	α-helix	trans	-55.2	-47.1	171.1	-80.1	150.1	0	0	0	111.6	Y739 W741 M742 A870 R871 F878 V903 I906 L907	Y739-H874 PolarHBondContact O-CE1 2.81Å; W741-H874 AromaticContact CD1-NE2 3.23Å; W741-H874 AromaticContact CD2-NE2 3.62Å; W741-H874 AromaticContact CE2-NE2 2.79Å; W741-H874 AromaticContact CG-NE2 3.87Å; W741-H874 AromaticContact CZ2-CD2 3.87Å; W741-H874 AromaticContact CZ2-NE2 3.26Å; W741-H874 VanDerWaalsContact CZ2-NE2 3.26Å; W741-H874 WeakPolarHBondContact CZ2-NE2 3.37Å; W741-H874 AromaticContact NE1-NE2 2.47Å; W741-H874 PolarHBondContact NE1-NE2 3.33Å; M742-H874 WeakPolarHBondContact CB-NE2 3.48Å; A870-H874 WeakPolarHBondContact O-CB 3.25Å; A870-H874 PolarHBondContact O-N 3.11Å; A870-H874 PolarHBondContact O-ND1 3.3Å; R871-H874 PolarHBondContact O-N 3.1Å; H874-F878 VanDerWaalsContact O-CB 3.3Å; H874-F878 WeakPolarHBondContact O-CB 3.4Å; H874-F878 PolarHBondContact O-N 2.89Å; H874-V903 HydrophobicContact CB-CG1 3.84Å; H874-V903 HydrophobicContact CB-CG2 4.42Å; H874-V903 WeakPolarHBondContact O-CG1 2.88Å; H874-I906 WeakPolarHBondContact CE1-CD1 3.33Å; H874-L907 HydrophobicContact CB-CD2 4.5Å
875	Q	96.7	Very high	94.9	Very high	79 Å²	79	45.7 Å²	45.7	37%	0.369	22%	0.223	S	C	.	.	H	α-helix	trans	-58.7	-51.9	174.6	-178	64.7	55.4	0	0	111.5	R871 E872 L873 T877 F878 D879 L907	R871-Q875 PolarHBondContact O-N 2.91Å; E872-Q875 PolarHBondContact O-N 3.13Å; L873-Q875 VanDerWaalsContact C-N 3.33Å; L873-Q875 PolarHBondContact O-N 3.48Å; Q875-T877 PolarHBondContact O-N 3.31Å; Q875-F878 PolarHBondContact O-N 2.97Å; Q875-D879 PolarHBondContact NE2-OD2 3.15Å; Q875-D879 WeakPolarHBondContact O-CB 3.22Å; Q875-D879 PolarHBondContact O-N 2.79Å; Q875-L907 HydrophobicContact CB-CD2 4.01Å
876	F	96.4	Very high	94.4	Very high	35 Å²	35	50.3 Å²	50.3	15%	0.154	24%	0.241	C	C	.	.	H	α-helix	trans	-57.9	-48.2	179.8	175.7	-91.1	0	0	0	112.4	L701 M780 E872 L873 F878 D879 L880	L701-F876 HydrophobicContact CD1-CZ 4.34Å; M780-F876 HydrophobicContact CE-CD1 3.87Å; M780-F876 HydrophobicContact CE-CE1 3.8Å; M780-F876 HydrophobicContact CG-CD1 4.27Å; M780-F876 HydrophobicContact CG-CE1 3.47Å; M780-F876 VanDerWaalsContact CG-CE1 3.47Å; M780-F876 HydrophobicContact CG-CE2 4.04Å; M780-F876 HydrophobicContact CG-CZ 3.35Å; M780-F876 HydrophobicContact SD-CD1 4.35Å; M780-F876 HydrophobicContact SD-CE1 3.66Å; M780-F876 HydrophobicContact SD-CZ 4.15Å; E872-F876 WeakPolarHBondContact O-CB 3.26Å; E872-F876 PolarHBondContact O-N 2.93Å; L873-F876 PolarHBondContact O-N 2.74Å; F876-F878 VanDerWaalsContact C-N 3.34Å; F876-F878 PolarHBondContact O-N 3.45Å; F876-D879 PolarHBondContact O-N 3.06Å; F876-L880 HydrophobicContact CE1-CD2 3.88Å; F876-L880 HydrophobicContact CZ-CD2 4.4Å; F876-L880 VanDerWaalsContact O-CB 3.23Å; F876-L880 WeakPolarHBondContact O-CB 3.41Å; F876-L880 PolarHBondContact O-N 3.37Å
877	T	95.6	Very high	93.9	Very high	11 Å²	11	52.4 Å²	52.4	7%	0.067	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-34.4	-178.4	-58	0	0	0	0	111.8	L873 Q875 L880 L881 F891 I899	L873-T877 WeakPolarHBondContact O-CB 3.46Å; L873-T877 PolarHBondContact O-N 3.06Å; L873-T877 PolarHBondContact O-OG1 3.19Å; Q875-T877 PolarHBondContact O-N 3.31Å; T877-L880 PolarHBondContact O-N 2.97Å; T877-L881 WeakPolarHBondContact O-CB 3.39Å; T877-L881 PolarHBondContact O-N 2.74Å; T877-F891 HydrophobicContact CG2-CE1 3.91Å; T877-I899 HydrophobicContact CG2-CD1 3.4Å; T877-I899 HydrophobicContact CG2-CG1 3.86Å; T877-I899 HydrophobicContact CG2-CG2 4.33Å
878	F	96.6	Very high	93.6	Very high	39 Å²	39	55.9 Å²	55.9	17%	0.171	28%	0.28	C	S	.	.	H	α-helix	trans	-69.3	-45.6	173.4	-179.1	-109.7	0	0	0	112.3	H874 Q875 F876 L880 L881 I882 I899 V903 P904 L907	H874-F878 VanDerWaalsContact O-CB 3.3Å; H874-F878 WeakPolarHBondContact O-CB 3.4Å; H874-F878 PolarHBondContact O-N 2.89Å; Q875-F878 PolarHBondContact O-N 2.97Å; F876-F878 VanDerWaalsContact C-N 3.34Å; F876-F878 PolarHBondContact O-N 3.45Å; F878-L880 PolarHBondContact O-N 2.94Å; F878-L881 PolarHBondContact O-N 3.26Å; F878-I882 HydrophobicContact CD1-CD1 3.98Å; F878-I882 HydrophobicContact CE1-CD1 3.56Å; F878-I882 HydrophobicContact CE2-CD1 4.31Å; F878-I882 HydrophobicContact CZ-CD1 3.74Å; F878-I882 WeakPolarHBondContact O-CG1 3.42Å; F878-I882 PolarHBondContact O-N 2.99Å; F878-I882 VanDerWaalsContact O-N 3.09Å; F878-I899 HydrophobicContact CB-CG2 4.23Å; F878-I899 HydrophobicContact CD2-CG2 4.19Å; F878-V903 HydrophobicContact CB-CG1 3.82Å; F878-V903 HydrophobicContact CG-CG1 4.28Å; F878-P904 HydrophobicContact CD2-CG 4.19Å; F878-P904 HydrophobicContact CE2-CG 3.51Å; F878-P904 HydrophobicContact CZ-CG 3.81Å; F878-L907 HydrophobicContact CB-CD1 4.37Å; F878-L907 HydrophobicContact CD1-CD1 4.11Å; F878-L907 HydrophobicContact CG-CD1 4.39Å
879	D	95.6	Very high	93.6	Very high	55 Å²	55	54.1 Å²	54.1	29%	0.294	27%	0.269	S	S	.	.	H	α-helix	trans	-59.1	-35.6	173.1	-93.4	-56.1	0	0	0	112.7	Q875 F876 K883	Q875-D879 PolarHBondContact NE2-OD2 3.15Å; Q875-D879 WeakPolarHBondContact O-CB 3.22Å; Q875-D879 PolarHBondContact O-N 2.79Å; F876-D879 PolarHBondContact O-N 3.06Å; D879-K883 VanDerWaalsContact O-CD 3.27Å; D879-K883 WeakPolarHBondContact O-CD 3.35Å; D879-K883 VanDerWaalsContact O-CG 3.3Å; D879-K883 WeakPolarHBondContact O-CG 3.14Å; D879-K883 PolarHBondContact O-N 3.42Å; D879-K883 PolarHBondContact O-NZ 3.23Å; D879-K883 IonicContact OD1-NZ 3.01Å; D879-K883 PolarHBondContact OD1-NZ 2.7Å
880	L	95	Very high	93.3	Very high	13 Å²	13	58.8 Å²	58.8	7%	0.068	29%	0.294	C	S	.	.	H	α-helix	trans	-72.5	-42.1	176.2	-176.4	66.7	0	0	0	111.6	F697 L701 F876 T877 F878 I882 K883 S884 V887 V889 F891	F697-L880 HydrophobicContact CZ-CD1 4.11Å; L701-L880 HydrophobicContact CB-CD2 4.41Å; L701-L880 HydrophobicContact CD1-CD1 3.89Å; L701-L880 HydrophobicContact CD1-CD2 3.82Å; F876-L880 HydrophobicContact CE1-CD2 3.88Å; F876-L880 HydrophobicContact CZ-CD2 4.4Å; F876-L880 VanDerWaalsContact O-CB 3.23Å; F876-L880 WeakPolarHBondContact O-CB 3.41Å; F876-L880 PolarHBondContact O-N 3.37Å; T877-L880 PolarHBondContact O-N 2.97Å; F878-L880 PolarHBondContact O-N 2.94Å; L880-I882 PolarHBondContact O-N 2.78Å; L880-K883 CarbonylContact O-C 3.28Å; L880-K883 PolarHBondContact O-N 3.22Å; L880-K883 VanDerWaalsContact O-N 3.13Å; L880-S884 WeakPolarHBondContact O-CA 3.25Å; L880-S884 PolarHBondContact O-N 2.97Å; L880-V887 HydrophobicContact CD1-CG2 4.18Å; L880-V889 HydrophobicContact CD1-CB 4.43Å; L880-V889 HydrophobicContact CD1-CG1 4.44Å; L880-V889 HydrophobicContact CD1-CG2 4.32Å; L880-V889 HydrophobicContact CD2-CG1 4.18Å; L880-V889 HydrophobicContact CG-CG1 4.31Å; L880-F891 HydrophobicContact CB-CZ 4.07Å; L880-F891 HydrophobicContact CD2-CE2 4.35Å; L880-F891 HydrophobicContact CD2-CZ 3.8Å; L880-F891 HydrophobicContact CG-CE2 3.97Å; L880-F891 HydrophobicContact CG-CZ 3.71Å
881	L	95.7	Very high	93.2	Very high	31 Å²	31	60.4 Å²	60.4	16%	0.162	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-44.1	176.3	-179.4	67.6	0	0	0	111.5	T877 F878 K883 S884 F891 A896 I899	T877-L881 WeakPolarHBondContact O-CB 3.39Å; T877-L881 PolarHBondContact O-N 2.74Å; F878-L881 PolarHBondContact O-N 3.26Å; L881-K883 PolarHBondContact O-N 3.37Å; L881-S884 VanDerWaalsContact O-CB 3.3Å; L881-S884 WeakPolarHBondContact O-CB 3.48Å; L881-S884 PolarHBondContact O-N 3.38Å; L881-S884 PolarHBondContact O-OG 2.84Å; L881-F891 HydrophobicContact CB-CE1 4.27Å; L881-F891 HydrophobicContact CB-CE2 4.22Å; L881-F891 HydrophobicContact CB-CZ 4Å; L881-F891 HydrophobicContact CD1-CB 3.91Å; L881-F891 HydrophobicContact CD1-CD1 3.93Å; L881-F891 HydrophobicContact CD1-CD2 3.69Å; L881-F891 HydrophobicContact CD1-CE1 4.33Å; L881-F891 HydrophobicContact CD1-CE2 4.12Å; L881-F891 HydrophobicContact CD1-CG 3.57Å; L881-F891 HydrophobicContact CD1-CZ 4.4Å; L881-A896 HydrophobicContact CD1-CB 4.33Å; L881-I899 HydrophobicContact CB-CG2 3.97Å; L881-I899 HydrophobicContact CD2-CB 3.85Å; L881-I899 HydrophobicContact CD2-CG2 3.57Å; L881-I899 HydrophobicContact CG-CG2 4.39Å
882	I	94.1	Very high	93.2	Very high	84 Å²	84	54.7 Å²	54.7	43%	0.431	28%	0.281	S	S	.	.	H	α-helix	trans	-58.7	-37.3	176.1	-69.4	167	0	0	0	111.4	F878 L880 H885	F878-I882 HydrophobicContact CD1-CD1 3.98Å; F878-I882 HydrophobicContact CE1-CD1 3.56Å; F878-I882 HydrophobicContact CE2-CD1 4.31Å; F878-I882 HydrophobicContact CZ-CD1 3.74Å; F878-I882 WeakPolarHBondContact O-CG1 3.42Å; F878-I882 PolarHBondContact O-N 2.99Å; F878-I882 VanDerWaalsContact O-N 3.09Å; L880-I882 PolarHBondContact O-N 2.78Å; I882-H885 PolarHBondContact O-CE1 3.1Å; I882-H885 PolarHBondContact O-ND1 2.95Å
883	K	92.3	Very high	93	Very high	94 Å²	94	56.5 Å²	56.5	41%	0.409	29%	0.289	S	S	.	.	H	α-helix	trans	-95.3	-5.1	-174.9	-64.3	165.7	-165.6	131.7	0	113.7	D879 L880 L881 H885 M886 V887	D879-K883 VanDerWaalsContact O-CD 3.27Å; D879-K883 WeakPolarHBondContact O-CD 3.35Å; D879-K883 VanDerWaalsContact O-CG 3.3Å; D879-K883 WeakPolarHBondContact O-CG 3.14Å; D879-K883 PolarHBondContact O-N 3.42Å; D879-K883 PolarHBondContact O-NZ 3.23Å; D879-K883 IonicContact OD1-NZ 3.01Å; D879-K883 PolarHBondContact OD1-NZ 2.7Å; L880-K883 CarbonylContact O-C 3.28Å; L880-K883 PolarHBondContact O-N 3.22Å; L880-K883 VanDerWaalsContact O-N 3.13Å; L881-K883 PolarHBondContact O-N 3.37Å; K883-H885 PolarHBondContact O-N 2.67Å; K883-M886 WeakPolarHBondContact O-CA 3.25Å; K883-M886 WeakPolarHBondContact O-CB 3.21Å; K883-M886 PolarHBondContact O-N 3.19Å; K883-V887 PolarHBondContact O-N 3.43Å
884	S	88.8	Confident	92.7	Very high	28 Å²	28	56.3 Å²	56.3	20%	0.196	29%	0.288	C	S	.	.	H	α-helix	trans	-39.2	-59.3	-176.1	50.5	0	0	0	0	113.6	L880 L881 M886 V887 S888 V889	L880-S884 WeakPolarHBondContact O-CA 3.25Å; L880-S884 PolarHBondContact O-N 2.97Å; L881-S884 VanDerWaalsContact O-CB 3.3Å; L881-S884 WeakPolarHBondContact O-CB 3.48Å; L881-S884 PolarHBondContact O-N 3.38Å; L881-S884 PolarHBondContact O-OG 2.84Å; S884-M886 PolarHBondContact O-N 3.26Å; S884-M886 VanDerWaalsContact O-N 3.1Å; S884-V887 CarbonylContact O-C 3.59Å; S884-V887 PolarHBondContact O-N 2.96Å; S884-S888 PolarHBondContact O-N 3.41Å; S884-V889 WeakPolarHBondContact CB-O 3.16Å; S884-V889 PolarHBondContact O-N 2.99Å
885	H	81.8	Confident	92.5	Very high	140 Å²	140	56.5 Å²	56.5	65%	0.648	29%	0.289	S	S	*	.	H	α-helix	trans	-61.7	-14.4	179.1	71.9	-80.3	0	0	0	115.5	I882 K883	I882-H885 PolarHBondContact O-CE1 3.1Å; I882-H885 PolarHBondContact O-ND1 2.95Å; K883-H885 PolarHBondContact O-N 2.67Å
886	M	85.1	Confident	92.5	Very high	144 Å²	144	53.9 Å²	53.9	71%	0.709	28%	0.281	S	S	*	.	H	α-helix	trans	-97.9	-14.7	174.8	-56.3	-176.1	66.3	0	0	113	K883 S884	K883-M886 WeakPolarHBondContact O-CA 3.25Å; K883-M886 WeakPolarHBondContact O-CB 3.21Å; K883-M886 PolarHBondContact O-N 3.19Å; S884-M886 PolarHBondContact O-N 3.26Å; S884-M886 VanDerWaalsContact O-N 3.1Å
887	V	87.1	Confident	92.4	Very high	43 Å²	43	55.2 Å²	55.2	26%	0.261	29%	0.288	S	S	.	.	H	α-helix	trans	-124.4	4.2	-172.8	-54.8	0	0	0	0	113.8	F697 L880 K883 S884 V889	F697-V887 HydrophobicContact CE1-CB 3.9Å; F697-V887 HydrophobicContact CE1-CG2 3.99Å; L880-V887 HydrophobicContact CD1-CG2 4.18Å; K883-V887 PolarHBondContact O-N 3.43Å; S884-V887 CarbonylContact O-C 3.59Å; S884-V887 PolarHBondContact O-N 2.96Å; V887-V889 VanDerWaalsContact C-N 3.32Å; V887-V889 HydrophobicContact CG2-CB 4.03Å; V887-V889 HydrophobicContact CG2-CG2 3.84Å; V887-V889 PolarHBondContact O-N 3.08Å
888	S	90.3	Very high	92.3	Very high	89 Å²	89	54.7 Å²	54.7	62%	0.622	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	45.8	-177.9	-54.1	0	0	0	0	113.2	A698 S884	A698-S888 VanDerWaalsContact CB-O 3.24Å; A698-S888 WeakPolarHBondContact CB-O 3.44Å; S884-S888 PolarHBondContact O-N 3.41Å
889	V	93.8	Very high	92.3	Very high	6 Å²	6	52.9 Å²	52.9	4%	0.036	28%	0.277	C	S	.	.			trans	-108.1	123.5	171.7	171.4	0	0	0	0	109	F697 L701 N705 L880 S884 V887 F891	F697-V889 HydrophobicContact CD1-CG2 4.39Å; F697-V889 HydrophobicContact CE1-CG2 3.95Å; L701-V889 HydrophobicContact CB-CG1 3.83Å; L701-V889 HydrophobicContact CB-CG2 3.88Å; L701-V889 HydrophobicContact CD1-CG2 4.23Å; N705-V889 WeakPolarHBondContact ND2-CG1 3.28Å; L880-V889 HydrophobicContact CD1-CB 4.43Å; L880-V889 HydrophobicContact CD1-CG1 4.44Å; L880-V889 HydrophobicContact CD1-CG2 4.32Å; L880-V889 HydrophobicContact CD2-CG1 4.18Å; L880-V889 HydrophobicContact CG-CG1 4.31Å; S884-V889 WeakPolarHBondContact CB-O 3.16Å; S884-V889 PolarHBondContact O-N 2.99Å; V887-V889 VanDerWaalsContact C-N 3.32Å; V887-V889 HydrophobicContact CG2-CB 4.03Å; V887-V889 HydrophobicContact CG2-CG2 3.84Å; V887-V889 PolarHBondContact O-N 3.08Å; V889-F891 HydrophobicContact CG1-CD2 4.33Å; V889-F891 HydrophobicContact CG1-CE2 3.87Å
890	D	92.9	Very high	92.3	Very high	110 Å²	110	53.2 Å²	53.2	59%	0.588	28%	0.283	S	S	*	.			trans	-85	147.4	-177.6	-48.6	-71.7	0	0	0	110.7	S702 N705	S702-D890 WeakPolarHBondContact CB-OD2 3.31Å; S702-D890 PolarHBondContact OG-N 3.38Å; S702-D890 PolarHBondContact OG-OD2 3.19Å; N705-D890 PolarHBondContact ND2-O 3.49Å
891	F	94.8	Very high	92.3	Very high	35 Å²	35	55.8 Å²	55.8	15%	0.154	30%	0.3	C	S	.	.			trans	-132	117.6	176.2	-80.2	-92.8	0	0	0	108.9	N705 T877 L880 L881 V889 A896 I899	N705-F891 HydrophobicContact CB-CD1 4.46Å; N705-F891 WeakPolarHBondContact ND2-CD1 3.37Å; N705-F891 VanDerWaalsContact ND2-CE1 3.26Å; N705-F891 WeakPolarHBondContact ND2-CE1 3.43Å; N705-F891 WeakPolarHBondContact ND2-CZ 3.44Å; T877-F891 HydrophobicContact CG2-CE1 3.91Å; L880-F891 HydrophobicContact CB-CZ 4.07Å; L880-F891 HydrophobicContact CD2-CE2 4.35Å; L880-F891 HydrophobicContact CD2-CZ 3.8Å; L880-F891 HydrophobicContact CG-CE2 3.97Å; L880-F891 HydrophobicContact CG-CZ 3.71Å; L881-F891 HydrophobicContact CB-CE1 4.27Å; L881-F891 HydrophobicContact CB-CE2 4.22Å; L881-F891 HydrophobicContact CB-CZ 4Å; L881-F891 HydrophobicContact CD1-CB 3.91Å; L881-F891 HydrophobicContact CD1-CD1 3.93Å; L881-F891 HydrophobicContact CD1-CD2 3.69Å; L881-F891 HydrophobicContact CD1-CE1 4.33Å; L881-F891 HydrophobicContact CD1-CE2 4.12Å; L881-F891 HydrophobicContact CD1-CG 3.57Å; L881-F891 HydrophobicContact CD1-CZ 4.4Å; V889-F891 HydrophobicContact CG1-CD2 4.33Å; V889-F891 HydrophobicContact CG1-CE2 3.87Å; F891-A896 HydrophobicContact CB-CB 4.21Å; F891-I899 HydrophobicContact CD1-CD1 3.73Å; F891-I899 HydrophobicContact CE1-CD1 3.66Å
892	P	95.1	Very high	92.2	Very high	17 Å²	17	55.3 Å²	55.3	11%	0.11	30%	0.296	C	S	.	.			trans	-61.7	152.6	173.3	-23.4	34.5	0	0	0	112.5	E706 E709 M894 M895 A896	E706-P892 WeakPolarHBondContact OE2-CG 3.44Å; E709-P892 HydrophobicContact CB-CB 3.8Å; E709-P892 HydrophobicContact CB-CG 4.06Å; E709-P892 HydrophobicContact CG-CB 4.11Å; E709-P892 WeakPolarHBondContact OE1-CB 3.22Å; E709-P892 WeakPolarHBondContact OE2-CB 3.04Å; P892-M894 PolarHBondContact O-N 3.36Å; P892-M895 PolarHBondContact O-N 3.44Å; P892-A896 WeakPolarHBondContact O-CB 3.43Å; P892-A896 PolarHBondContact O-N 3.44Å
893	E	91.8	Very high	92.3	Very high	124 Å²	124	51.3 Å²	51.3	58%	0.579	28%	0.276	S	S	*	.	H	α-helix	trans	-56.5	-49.7	-168.7	-176.6	176.8	-153.6	0	0	112.8	S431 E709 M895 A896 E897	S431-E893 WeakPolarHBondContact CB-OE2 3.19Å; E709-E893 PolarHBondContact OE1-N 3.26Å; E893-M895 VanDerWaalsContact C-N 3.29Å; E893-M895 PolarHBondContact O-N 3.35Å; E893-A896 PolarHBondContact O-N 2.97Å; E893-E897 PolarHBondContact O-N 3.46Å
894	M	91.3	Very high	92.5	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-64.5	-36.3	-177.7	-175.9	-166.9	-58.3	0	0	111.6	S432 W434 L437 E709 L712 V713 P892 I898	S432-M894 WeakPolarHBondContact O-CE 3.45Å; S432-M894 WeakPolarHBondContact OG-CE 3.43Å; W434-M894 HydrophobicContact CD2-CG 4.05Å; W434-M894 HydrophobicContact CG-CG 4.28Å; W434-M894 HydrophobicContact CH2-CG 4.41Å; W434-M894 HydrophobicContact CH2-SD 4.25Å; W434-M894 HydrophobicContact CZ2-CG 3.4Å; W434-M894 VanDerWaalsContact CZ2-CG 3.4Å; W434-M894 HydrophobicContact CZ2-SD 3.74Å; W434-M894 PolarHBondContact NE1-O 3.37Å; L437-M894 HydrophobicContact CD1-CE 3.63Å; L437-M894 HydrophobicContact CD1-SD 4Å; L437-M894 HydrophobicContact CG-CE 4.47Å; E709-M894 HydrophobicContact CG-CB 3.95Å; E709-M894 HydrophobicContact CG-CE 4.24Å; E709-M894 HydrophobicContact CG-SD 4.12Å; E709-M894 WeakPolarHBondContact OE1-CB 3.24Å; E709-M894 PolarHBondContact OE1-N 3.12Å; L712-M894 HydrophobicContact CB-SD 3.92Å; V713-M894 HydrophobicContact CG2-CE 3.66Å; V713-M894 HydrophobicContact CG2-SD 4.14Å; P892-M894 PolarHBondContact O-N 3.36Å; M894-I898 PolarHBondContact O-N 2.92Å
895	M	93.1	Very high	92.8	Very high	8 Å²	8	50.9 Å²	50.9	4%	0.039	28%	0.275	C	S	.	.	H	α-helix	trans	-74.2	-44.8	179.2	-155.9	-168.2	-173.4	0	0	110.6	N705 L712 W741 P892 E893 E897 I898 I899	N705-M895 HydrophobicContact CB-SD 3.83Å; N705-M895 VanDerWaalsContact O-SD 3.35Å; L712-M895 HydrophobicContact CD1-CB 4.4Å; L712-M895 HydrophobicContact CD1-CG 4.14Å; W741-M895 HydrophobicContact CH2-CE 3.87Å; W741-M895 HydrophobicContact CZ3-CE 3.83Å; P892-M895 PolarHBondContact O-N 3.44Å; E893-M895 VanDerWaalsContact C-N 3.29Å; E893-M895 PolarHBondContact O-N 3.35Å; M895-E897 VanDerWaalsContact C-N 3.3Å; M895-E897 PolarHBondContact O-N 3.42Å; M895-I898 PolarHBondContact O-N 3Å; M895-I899 HydrophobicContact CB-CD1 4.47Å; M895-I899 HydrophobicContact CE-CD1 4.37Å; M895-I899 HydrophobicContact CG-CD1 3.75Å; M895-I899 VanDerWaalsContact O-CD1 3.28Å; M895-I899 WeakPolarHBondContact O-CD1 3.38Å; M895-I899 WeakPolarHBondContact O-CG1 3.3Å; M895-I899 PolarHBondContact O-N 3.43Å; M895-I899 HydrophobicContact SD-CD1 4.21Å
896	A	94.8	Very high	93.3	Very high	24 Å²	24	45.1 Å²	45.1	20%	0.198	25%	0.249	C	C	.	.	H	α-helix	trans	-59.5	-38.6	176.3	0	0	0	0	0	112.2	L881 F891 P892 E893 I899 S900	L881-A896 HydrophobicContact CD1-CB 4.33Å; F891-A896 HydrophobicContact CB-CB 4.21Å; P892-A896 WeakPolarHBondContact O-CB 3.43Å; P892-A896 PolarHBondContact O-N 3.44Å; E893-A896 PolarHBondContact O-N 2.97Å; A896-I899 PolarHBondContact O-N 3.48Å; A896-S900 VanDerWaalsContact O-CB 3.27Å; A896-S900 WeakPolarHBondContact O-CB 3.34Å; A896-S900 PolarHBondContact O-N 3.41Å; A896-S900 PolarHBondContact O-OG 3.21Å
897	E	94.5	Very high	93.8	Very high	62 Å²	62	39.4 Å²	39.4	29%	0.29	22%	0.221	S	C	.	.	H	α-helix	trans	-60.5	-51.6	174.8	-162.8	-165.5	129.8	0	0	111.5	E893 M895 I899 S900 V901	E893-E897 PolarHBondContact O-N 3.46Å; M895-E897 VanDerWaalsContact C-N 3.3Å; M895-E897 PolarHBondContact O-N 3.42Å; E897-I899 PolarHBondContact O-N 2.86Å; E897-S900 PolarHBondContact O-N 3.17Å; E897-S900 PolarHBondContact O-OG 3.22Å; E897-V901 HydrophobicContact CG-CG2 4.46Å; E897-V901 VanDerWaalsContact O-CB 3.32Å; E897-V901 WeakPolarHBondContact O-CB 3.31Å; E897-V901 WeakPolarHBondContact O-CG2 3.34Å; E897-V901 PolarHBondContact O-N 3.27Å
898	I	94.6	Very high	94.1	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-59.1	-46.3	176.3	-86.4	-173.8	0	0	0	111.8	W434 L712 Q738 W741 M894 M895 Q902 V903	W434-I898 HydrophobicContact CH2-CD1 3.75Å; W434-I898 HydrophobicContact CZ2-CD1 3.17Å; W434-I898 HydrophobicContact CZ2-CG1 3.88Å; L712-I898 HydrophobicContact CD2-CD1 4.2Å; Q738-I898 HydrophobicContact CB-CD1 4.29Å; Q738-I898 HydrophobicContact CB-CG1 4.5Å; Q738-I898 HydrophobicContact CG-CD1 3.86Å; Q738-I898 HydrophobicContact CG-CG1 4.04Å; W741-I898 HydrophobicContact CD2-CG2 4.48Å; W741-I898 HydrophobicContact CZ2-CG2 3.76Å; W741-I898 VanDerWaalsContact NE1-CG2 3.27Å; M894-I898 PolarHBondContact O-N 2.92Å; M895-I898 PolarHBondContact O-N 3Å; I898-Q902 WeakPolarHBondContact O-CA 3.34Å; I898-Q902 WeakPolarHBondContact O-CB 3.48Å; I898-Q902 PolarHBondContact O-N 3.46Å; I898-V903 PolarHBondContact O-N 2.93Å
899	I	96.1	Very high	94.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68.5	-39.2	-175.2	-62.1	155.6	0	0	0	110.6	W741 T877 F878 L881 F891 M895 A896 E897 V903 P904	W741-I899 HydrophobicContact CH2-CG1 4.46Å; W741-I899 HydrophobicContact CZ2-CG1 4.33Å; T877-I899 HydrophobicContact CG2-CD1 3.4Å; T877-I899 HydrophobicContact CG2-CG1 3.86Å; T877-I899 HydrophobicContact CG2-CG2 4.33Å; F878-I899 HydrophobicContact CB-CG2 4.23Å; F878-I899 HydrophobicContact CD2-CG2 4.19Å; L881-I899 HydrophobicContact CB-CG2 3.97Å; L881-I899 HydrophobicContact CD2-CB 3.85Å; L881-I899 HydrophobicContact CD2-CG2 3.57Å; L881-I899 HydrophobicContact CG-CG2 4.39Å; F891-I899 HydrophobicContact CD1-CD1 3.73Å; F891-I899 HydrophobicContact CE1-CD1 3.66Å; M895-I899 HydrophobicContact CB-CD1 4.47Å; M895-I899 HydrophobicContact CE-CD1 4.37Å; M895-I899 HydrophobicContact CG-CD1 3.75Å; M895-I899 VanDerWaalsContact O-CD1 3.28Å; M895-I899 WeakPolarHBondContact O-CD1 3.38Å; M895-I899 WeakPolarHBondContact O-CG1 3.3Å; M895-I899 PolarHBondContact O-N 3.43Å; M895-I899 HydrophobicContact SD-CD1 4.21Å; A896-I899 PolarHBondContact O-N 3.48Å; E897-I899 PolarHBondContact O-N 2.86Å; I899-V903 WeakPolarHBondContact O-CB 3.4Å; I899-P904 WeakPolarHBondContact O-CD 3.47Å
900	S	95.4	Very high	94	Very high	62 Å²	62	45.3 Å²	45.3	43%	0.434	26%	0.255	S	S	.	.	H	α-helix	trans	-75.1	-38.5	179.3	58.5	0	0	0	0	113.1	A896 E897 P904	A896-S900 VanDerWaalsContact O-CB 3.27Å; A896-S900 WeakPolarHBondContact O-CB 3.34Å; A896-S900 PolarHBondContact O-N 3.41Å; A896-S900 PolarHBondContact O-OG 3.21Å; E897-S900 PolarHBondContact O-N 3.17Å; E897-S900 PolarHBondContact O-OG 3.22Å; S900-P904 WeakPolarHBondContact O-CG 3.22Å
901	V	94.3	Very high	94.1	Very high	68 Å²	68	40.5 Å²	40.5	41%	0.412	23%	0.229	S	C	.	.	H	α-helix	trans	-90.8	-42.2	-173.8	179.1	0	0	0	0	113.1	E897 K905	E897-V901 HydrophobicContact CG-CG2 4.46Å; E897-V901 VanDerWaalsContact O-CB 3.32Å; E897-V901 WeakPolarHBondContact O-CB 3.31Å; E897-V901 WeakPolarHBondContact O-CG2 3.34Å; E897-V901 PolarHBondContact O-N 3.27Å; V901-K905 WeakPolarHBondContact O-CE 3.44Å
902	Q	95	Very high	93.9	Very high	20 Å²	20	45.2 Å²	45.2	9%	0.093	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-38.2	-165.8	-52.8	-65.6	20.3	0	0	113.3	Q738 Y739 I898 K905 I906	Q738-Q902 HydrophobicContact CB-CG 4.23Å; Y739-Q902 HydrophobicContact CD1-CB 4.4Å; Y739-Q902 HydrophobicContact CE1-CB 4.11Å; I898-Q902 WeakPolarHBondContact O-CA 3.34Å; I898-Q902 WeakPolarHBondContact O-CB 3.48Å; I898-Q902 PolarHBondContact O-N 3.46Å; Q902-K905 WeakPolarHBondContact O-CB 3.47Å; Q902-K905 PolarHBondContact O-N 3.18Å; Q902-I906 PolarHBondContact O-N 2.83Å
903	V	95.9	Very high	93.8	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-39.8	-179.7	172.6	0	0	0	0	113.4	H874 F878 I898 I899 K905 I906 L907	H874-V903 HydrophobicContact CB-CG1 3.84Å; H874-V903 HydrophobicContact CB-CG2 4.42Å; H874-V903 WeakPolarHBondContact O-CG1 2.88Å; F878-V903 HydrophobicContact CB-CG1 3.82Å; F878-V903 HydrophobicContact CG-CG1 4.28Å; I898-V903 PolarHBondContact O-N 2.93Å; I899-V903 WeakPolarHBondContact O-CB 3.4Å; V903-K905 PolarHBondContact O-N 3.02Å; V903-I906 PolarHBondContact O-N 3.21Å; V903-I906 VanDerWaalsContact O-N 3.1Å; V903-L907 HydrophobicContact CG1-CD1 3.58Å; V903-L907 HydrophobicContact CG1-CG 3.9Å; V903-L907 WeakPolarHBondContact O-CG 3.37Å; V903-L907 PolarHBondContact O-N 3.26Å
904	P	95.8	Very high	93.9	Very high	44 Å²	44	42.1 Å²	42.1	29%	0.286	24%	0.237	S	C	.	.	H	α-helix	trans	-55.6	-34.3	171.5	-30.6	37.8	0	0	0	114.2	F878 I899 S900 S908	F878-P904 HydrophobicContact CD2-CG 4.19Å; F878-P904 HydrophobicContact CE2-CG 3.51Å; F878-P904 HydrophobicContact CZ-CG 3.81Å; I899-P904 WeakPolarHBondContact O-CD 3.47Å; S900-P904 WeakPolarHBondContact O-CG 3.22Å; P904-S908 VanDerWaalsContact O-CB 3.23Å; P904-S908 WeakPolarHBondContact O-CB 3.15Å; P904-S908 PolarHBondContact O-N 3.11Å; P904-S908 PolarHBondContact O-OG 3.1Å
905	K	94.6	Very high	94	Very high	69 Å²	69	45.4 Å²	45.4	30%	0.3	25%	0.25	S	S	.	.	H	α-helix	trans	-70.9	-38.9	177.4	-55.7	176.3	-169.5	162.4	0	111.4	V901 Q902 V903 S908 G909 K910 V911	V901-K905 WeakPolarHBondContact O-CE 3.44Å; Q902-K905 WeakPolarHBondContact O-CB 3.47Å; Q902-K905 PolarHBondContact O-N 3.18Å; V903-K905 PolarHBondContact O-N 3.02Å; K905-S908 PolarHBondContact O-OG 2.89Å; K905-G909 PolarHBondContact O-N 3.22Å; K905-K910 HydrophobicContact CB-CB 4.23Å; K905-K910 PolarHBondContact O-N 2.83Å; K905-V911 HydrophobicContact CB-CG2 3.96Å
906	I	94	Very high	94	Very high	19 Å²	19	47.2 Å²	47.2	10%	0.097	26%	0.258	C	S	.	.	H	α-helix	trans	-65.1	-48.8	174.6	-57	172.2	0	0	0	110.4	Y739 H874 Q902 V903 S908 G909 V911	Y739-I906 HydrophobicContact CD1-CD1 4Å; Y739-I906 HydrophobicContact CD1-CG1 3.82Å; Y739-I906 HydrophobicContact CE1-CG1 4.43Å; H874-I906 WeakPolarHBondContact CE1-CD1 3.33Å; Q902-I906 PolarHBondContact O-N 2.83Å; V903-I906 PolarHBondContact O-N 3.21Å; V903-I906 VanDerWaalsContact O-N 3.1Å; I906-S908 PolarHBondContact O-N 2.99Å; I906-G909 PolarHBondContact O-N 3.25Å; I906-V911 HydrophobicContact CG1-CB 4.25Å; I906-V911 HydrophobicContact CG1-CG1 4.46Å; I906-V911 HydrophobicContact CG1-CG2 4.03Å
907	L	94.1	Very high	93.9	Very high	25 Å²	25	48.1 Å²	48.1	13%	0.131	26%	0.258	C	S	.	.	H	α-helix	trans	-66.4	-39.3	-177.5	-65.7	173.3	0	0	0	112.3	R871 H874 Q875 F878 V903 G909	R871-L907 HydrophobicContact CG-CD2 4.24Å; R871-L907 PolarHBondContact NH2-O 3.39Å; R871-L907 VanDerWaalsContact NH2-O 3.13Å; H874-L907 HydrophobicContact CB-CD2 4.5Å; Q875-L907 HydrophobicContact CB-CD2 4.01Å; F878-L907 HydrophobicContact CB-CD1 4.37Å; F878-L907 HydrophobicContact CD1-CD1 4.11Å; F878-L907 HydrophobicContact CG-CD1 4.39Å; V903-L907 HydrophobicContact CG1-CD1 3.58Å; V903-L907 HydrophobicContact CG1-CG 3.9Å; V903-L907 WeakPolarHBondContact O-CG 3.37Å; V903-L907 PolarHBondContact O-N 3.26Å; L907-G909 VanDerWaalsContact C-N 3.25Å; L907-G909 PolarHBondContact O-N 3.13Å
908	S	94.4	Very high	93.1	Very high	79 Å²	79	51.5 Å²	51.5	55%	0.552	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	6.1	175.8	63.9	0	0	0	0	114.9	P904 K905 I906 K910	P904-S908 VanDerWaalsContact O-CB 3.23Å; P904-S908 WeakPolarHBondContact O-CB 3.15Å; P904-S908 PolarHBondContact O-N 3.11Å; P904-S908 PolarHBondContact O-OG 3.1Å; K905-S908 PolarHBondContact O-OG 2.89Å; I906-S908 PolarHBondContact O-N 2.99Å; S908-K910 VanDerWaalsContact C-N 3.32Å; S908-K910 PolarHBondContact O-N 2.84Å
909	G	91.2	Very high	91.2	Very high	46 Å²	46	60.6 Å²	60.6	47%	0.474	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	14.2	173.7	0	0	0	0	0	115.7	V818 K905 I906 L907 V911	V818-G909 WeakPolarHBondContact CG2-O 3.18Å; K905-G909 PolarHBondContact O-N 3.22Å; I906-G909 PolarHBondContact O-N 3.25Å; L907-G909 VanDerWaalsContact C-N 3.25Å; L907-G909 PolarHBondContact O-N 3.13Å; G909-V911 PolarHBondContact O-N 2.7Å
910	K	91.5	Very high	90.9	Very high	136 Å²	136	63.6 Å²	63.6	59%	0.591	34%	0.342	S	S	*	.	S	Bend	trans	-73.5	-2.8	170.5	-64.3	-176.1	177.6	-174.7	0	113.1	V818 K905 S908	V818-K910 PolarHBondContact N-O 2.88Å; K905-K910 HydrophobicContact CB-CB 4.23Å; K905-K910 PolarHBondContact O-N 2.83Å; S908-K910 VanDerWaalsContact C-N 3.32Å; S908-K910 PolarHBondContact O-N 2.84Å
911	V	93	Very high	90.7	Very high	9 Å²	9	63.7 Å²	63.7	6%	0.055	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.6	-179.6	-171.5	0	0	0	0	107.4	Y739 I815 I816 K905 I906 G909	Y739-V911 HydrophobicContact CD1-CG1 4Å; Y739-V911 HydrophobicContact CD1-CG2 3.83Å; Y739-V911 HydrophobicContact CD2-CG1 3.91Å; Y739-V911 HydrophobicContact CE1-CG1 4.43Å; Y739-V911 HydrophobicContact CE1-CG2 3.53Å; Y739-V911 HydrophobicContact CE2-CG1 4.35Å; Y739-V911 HydrophobicContact CE2-CG2 4.29Å; Y739-V911 HydrophobicContact CG-CG1 3.72Å; Y739-V911 HydrophobicContact CG-CG2 4.33Å; I815-V911 HydrophobicContact CG2-CG1 3.3Å; I816-V911 CarbonylContact O-C 3.58Å; I816-V911 WeakPolarHBondContact O-CA 3.36Å; I816-V911 VanDerWaalsContact O-CG1 3.26Å; I816-V911 WeakPolarHBondContact O-CG1 3.41Å; K905-V911 HydrophobicContact CB-CG2 3.96Å; I906-V911 HydrophobicContact CG1-CB 4.25Å; I906-V911 HydrophobicContact CG1-CG1 4.46Å; I906-V911 HydrophobicContact CG1-CG2 4.03Å; G909-V911 PolarHBondContact O-N 2.7Å
912	K	91.2	Very high	90.5	Very high	134 Å²	134	63.4 Å²	63.4	58%	0.583	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	121.2	-174.4	-176.7	174.3	178.7	179.4	0	111	I816 V818	I816-K912 PolarHBondContact N-O 2.98Å; I816-K912 PolarHBondContact O-N 2.71Å; V818-K912 HydrophobicContact CG2-CB 4.16Å
913	P	93.5	Very high	90.2	Very high	34 Å²	34	66 Å²	66	22%	0.221	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	140.6	166.1	28.8	-33	0	0	0	110.9	S814 Q867 Y915	S814-P913 CarbonylContact O-C 3.6Å; S814-P913 WeakPolarHBondContact O-CA 3.43Å; Q867-P913 HydrophobicContact CG-CB 4.25Å; P913-Y915 HydrophobicContact CB-CE1 4.43Å; P913-Y915 HydrophobicContact CB-CE2 4.19Å; P913-Y915 HydrophobicContact CG-CD2 4.44Å; P913-Y915 HydrophobicContact CG-CE1 4.48Å; P913-Y915 HydrophobicContact CG-CE2 3.61Å
914	I	94.1	Very high	89.9	Confident	42 Å²	42	70.1 Å²	70.1	22%	0.215	37%	0.368	C	S	.	.			trans	-99.3	84.8	177.5	-48.8	177.4	0	0	0	108.4	S814 I816 F827 R831	S814-I914 PolarHBondContact O-N 2.7Å; I816-I914 HydrophobicContact CD1-CD1 3.97Å; I816-I914 HydrophobicContact CD1-CG1 4.32Å; I816-I914 HydrophobicContact CG1-CD1 3.99Å; I816-I914 HydrophobicContact CG1-CG1 4.08Å; I816-I914 HydrophobicContact CG2-CD1 3.91Å; F827-I914 HydrophobicContact CE1-CD1 3.67Å; F827-I914 HydrophobicContact CZ-CD1 4.08Å; R831-I914 PolarHBondContact NH2-O 3.47Å
915	Y	93.8	Very high	89.5	Confident	72 Å²	72	71.9 Å²	71.9	28%	0.282	37%	0.374	S	S	.	.			trans	-63.3	153.5	173	-60.2	-68.6	0	0	0	112	D864 Q867 P913 H917 Q919	D864-Y915 HydrophobicContact CB-CD1 3.92Å; D864-Y915 VanDerWaalsContact OD1-CA 3.23Å; D864-Y915 WeakPolarHBondContact OD1-CA 3.35Å; Q867-Y915 HydrophobicContact CB-CE1 3.73Å; Q867-Y915 HydrophobicContact CG-CD1 4.27Å; Q867-Y915 HydrophobicContact CG-CE1 3.71Å; P913-Y915 HydrophobicContact CB-CE1 4.43Å; P913-Y915 HydrophobicContact CB-CE2 4.19Å; P913-Y915 HydrophobicContact CG-CD2 4.44Å; P913-Y915 HydrophobicContact CG-CE1 4.48Å; P913-Y915 HydrophobicContact CG-CE2 3.61Å; Y915-H917 WeakPolarHBondContact CB-O 3.36Å; Y915-Q919 HydrophobicContact CD2-CG 4.36Å; Y915-Q919 VanDerWaalsContact CE1-NE2 3.3Å; Y915-Q919 HydrophobicContact CE2-CG 4.36Å; Y915-Q919 PolarHBondContact OH-NE2 2.66Å
916	F	93.2	Very high	89.1	Confident	46 Å²	46	72.1 Å²	72.1	20%	0.202	38%	0.379	C	S	.	.	S	Bend	trans	-84.6	-29.2	170.4	-71.3	-91.3	0	0	0	112.2	L810 I835 T860 L863 D864	L810-F916 HydrophobicContact CD1-CZ 4.31Å; L810-F916 HydrophobicContact CD2-CZ 4.34Å; I835-F916 HydrophobicContact CD1-CE1 3.83Å; I835-F916 HydrophobicContact CG1-CE1 3.95Å; I835-F916 HydrophobicContact CG1-CZ 4.5Å; T860-F916 VanDerWaalsContact CB-CG 3.49Å; T860-F916 HydrophobicContact CG2-CB 4.42Å; T860-F916 HydrophobicContact CG2-CD1 3.58Å; T860-F916 HydrophobicContact CG2-CD2 4.14Å; T860-F916 HydrophobicContact CG2-CE1 3.73Å; T860-F916 HydrophobicContact CG2-CE2 4.28Å; T860-F916 HydrophobicContact CG2-CG 3.79Å; T860-F916 HydrophobicContact CG2-CZ 4.09Å; L863-F916 HydrophobicContact CB-CD2 4.24Å; L863-F916 HydrophobicContact CB-CE2 4.04Å; L863-F916 HydrophobicContact CD1-CD2 4.44Å; L863-F916 HydrophobicContact CD1-CE2 3.61Å; L863-F916 HydrophobicContact CD1-CZ 4Å; L863-F916 HydrophobicContact CG-CE2 4.45Å; D864-F916 PolarHBondContact OD1-N 2.67Å
917	H	91.7	Very high	88.7	Confident	43 Å²	43	76.2 Å²	76.2	20%	0.199	40%	0.401	C	S	.	.	S	Bend	trans	-120.4	154.9	179.7	-49.8	97.3	0	0	0	111.2	Y857 T860 K861 D864 Y915	Y857-H917 AromaticContact CD2-CD2 3.65Å; Y857-H917 AromaticContact CD2-CE1 3.84Å; Y857-H917 AromaticContact CD2-NE2 3.12Å; Y857-H917 WeakPolarHBondContact CD2-NE2 3.39Å; Y857-H917 AromaticContact CE2-CD2 3.53Å; Y857-H917 AromaticContact CE2-CE1 3.99Å; Y857-H917 AromaticContact CE2-NE2 3.44Å; Y857-H917 WeakPolarHBondContact CE2-NE2 3.23Å; T860-H917 PolarHBondContact OG1-CE1 2.67Å; K861-H917 HydrophobicContact CD-CB 4.33Å; K861-H917 PolarHBondContact N-CE1 3.24Å; D864-H917 IonicContact OD2-CE1 3.1Å; D864-H917 IonicContact OD2-CG 2.83Å; D864-H917 PolarHBondContact OD2-N 2.86Å; D864-H917 IonicContact OD2-ND1 2.72Å; D864-H917 PolarHBondContact OD2-ND1 2.8Å; Y915-H917 WeakPolarHBondContact CB-O 3.36Å
918	T	77.3	Confident	88.3	Confident	132 Å²	132	80.4 Å²	80.4	81%	0.81	42%	0.423	S	S	*	.			trans	-58.5	142.9	158.6	47.3	0	0	0	0	109.5
919	Q	54.6	Low	87.7	Confident	192 Å²	192	80.5 Å²	80.5	90%	0.897	41%	0.412	S	S	*	.			trans	-80.2	0	176.4	-65	-162.7	-45.8	0	0	110.7	Y915	Y915-Q919 HydrophobicContact CD2-CG 4.36Å; Y915-Q919 VanDerWaalsContact CE1-NE2 3.3Å; Y915-Q919 HydrophobicContact CE2-CG 4.36Å; Y915-Q919 PolarHBondContact OH-NE2 2.66Å

Retrieved 919 of 919 residues in 170.8 ms (Link to these results)

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