A0A077ZH05_TRITR Loading...

Conjugal transfer protein TraO

AlphaFold DB , UniProt , Accession A0A077ZH05, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 934 aa.

						>A0A077ZH05_TRITR|A0A077ZH05
MGGVIIIGGGYLLLTWLSPENAASLSSVNINSTTSGGGRNVMETQHYRDLLRADNERGAAEALRNNETFIASLPRGLDTDTGNDQKRDNPPDDQSGTSGQNASPPQEDQTAREKRREALQKLLARINTQHQDARPPVVAAAMWSTTGTPGTAPHASPSGTVTSQHPRLQETSLATPATRQGIQLIPALTRVPAYIDTEVDSDNAVSRVVASVPAGPWAGAVLYSQDARLAGQGMDIHFDRMMWRGMFLKVNAYALNERTGMSTVASDVNHRWFKHIVLPSVLGGVGNVGSLYKDANTQILQGNYGSITGRVGMPDGEALAGVIAGGMAERGSQLLTRQAESEPYRQVTVSRGEVVSILFVEPVMSNDISTPSSGTAPSESPSSGRPLTQAEAEHQASDRIRAAVLRKLSMKNEHEDPGSFGETTAPASGKSFLKRQYMGYSLPVWAGCALIILVAIWYKFLRTPSEPPADAGFAVTPPAAESWAEPMTMTESGIGNNMPAPPVTPQADMQQLARDLKAELDRRDEEIRRTLTMLKDSITTLSNAIQKDEAWAQETRQLLEETRKQVHTLQMQGALPAPTGNNRQPAKTLPSPLQGMKIMSVEKGMAWIRWQGSAWAPGSHHLCRYITMMSIDALTAIENFASGIFSAGMEFLFTWGELLGIIGLIGHLMRARAEGRHSMGPGKFIAGIFICGMLVSLPSMINAGGTQMGFRADSFAPIAYVQPGSFGAAAGAVNAILSLAKLAGVGFVMNGISIWRKSLLDGHTALSASESISKGNVKFVAGVLLVFNDRVIDATLASLGDTMSRLRAMAARLRAASVYVQLCLMACRDRLVRLLLLLPVMLLPHTAMANTLFDMIKTVGDGARGSSSSFVAIGQVIGLVLFIGGLLGLKQIGKKPGAGLACLLSILVGVCLAVVPELMGSGQKTLGLSPVSIS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.6	Very low	48.3	Very low	152 Å²	152	88.2 Å²	88.2	75%	0.749	53%	0.53	S	S	*	.				0	-61.4	0	-59.9	-44.9	165.4	0	0	112.3	G3 V4 L799	M1-G3 VanDerWaalsContact C-N 3.27Å; M1-G3 PolarHBondContact O-N 3.04Å; M1-V4 PolarHBondContact O-N 3.26Å; M1-L799 HydrophobicContact CE-CD1 3.68Å; M1-L799 HydrophobicContact SD-CD1 4.03Å
2	G	38.1	Very low	49	Very low	45 Å²	45	86.2 Å²	86.2	46%	0.464	51%	0.514	S	S	.	.	H	α-helix	trans	-45.9	-41.8	-177.6	0	0	0	0	0	116	V4 I5 I6	G2-V4 VanDerWaalsContact C-N 3.26Å; G2-V4 PolarHBondContact O-N 3.46Å; G2-V4 VanDerWaalsContact O-N 3.17Å; G2-I5 PolarHBondContact O-N 3.16Å; G2-I6 WeakPolarHBondContact O-CG1 3.21Å; G2-I6 PolarHBondContact O-N 3.48Å
3	G	33.2	Very low	49.8	Very low	44 Å²	44	87.8 Å²	87.8	45%	0.454	52%	0.517	S	S	.	.	H	α-helix	trans	-56	-30.5	176.5	0	0	0	0	0	115.6	M1 I6 I7	M1-G3 VanDerWaalsContact C-N 3.27Å; M1-G3 PolarHBondContact O-N 3.04Å; G3-I6 PolarHBondContact O-N 3.01Å; G3-I7 WeakPolarHBondContact O-CB 3.33Å; G3-I7 WeakPolarHBondContact O-CD1 3.42Å; G3-I7 VanDerWaalsContact O-CG1 3.24Å; G3-I7 WeakPolarHBondContact O-CG1 3.34Å; G3-I7 PolarHBondContact O-N 2.82Å
4	V	45.4	Very low	49.8	Very low	112 Å²	112	89.9 Å²	89.9	68%	0.679	52%	0.524	S	S	*	.	H	α-helix	trans	-72.1	-36	176.5	-176.8	0	0	0	0	111	M1 G2 G8	M1-V4 PolarHBondContact O-N 3.26Å; G2-V4 VanDerWaalsContact C-N 3.26Å; G2-V4 PolarHBondContact O-N 3.46Å; G2-V4 VanDerWaalsContact O-N 3.17Å; V4-G8 PolarHBondContact O-N 2.83Å
5	I	54	Low	50.4	Low	103 Å²	103	89.4 Å²	89.4	53%	0.528	52%	0.523	S	S	.	.	H	α-helix	trans	-71.8	-38.2	175.6	-56.8	177.6	0	0	0	110.1	G2 G9 I792	G2-I5 PolarHBondContact O-N 3.16Å; I5-G9 WeakPolarHBondContact O-CA 3.36Å; I5-G9 PolarHBondContact O-N 3.23Å; I5-I792 HydrophobicContact CD1-CD1 4.27Å; I5-I792 HydrophobicContact CD1-CG1 4.28Å
6	I	54.4	Low	50.4	Low	127 Å²	127	94.1 Å²	94.1	65%	0.651	53%	0.529	S	S	*	.	H	α-helix	trans	-66.5	-42.3	175.4	-65.1	168.6	0	0	0	111.2	G2 G3 G10	G2-I6 WeakPolarHBondContact O-CG1 3.21Å; G2-I6 PolarHBondContact O-N 3.48Å; G3-I6 PolarHBondContact O-N 3.01Å; I6-G10 WeakPolarHBondContact O-CA 3.26Å; I6-G10 PolarHBondContact O-N 2.84Å
7	I	54.9	Low	50.6	Low	117 Å²	117	95.4 Å²	95.4	60%	0.6	53%	0.534	S	S	*	.	H	α-helix	trans	-70.6	-45.7	177.7	-68.1	165.8	0	0	0	111.1	G3 Y11	G3-I7 WeakPolarHBondContact O-CB 3.33Å; G3-I7 WeakPolarHBondContact O-CD1 3.42Å; G3-I7 VanDerWaalsContact O-CG1 3.24Å; G3-I7 WeakPolarHBondContact O-CG1 3.34Å; G3-I7 PolarHBondContact O-N 2.82Å; I7-Y11 VanDerWaalsContact O-CB 3.29Å; I7-Y11 WeakPolarHBondContact O-CB 3.37Å; I7-Y11 PolarHBondContact O-N 2.96Å
8	G	48	Very low	50.2	Low	35 Å²	35	94.1 Å²	94.1	36%	0.361	53%	0.532	S	S	.	.	H	α-helix	trans	-66.6	-46.4	178.7	0	0	0	0	0	112.9	V4 Y11 L12	V4-G8 PolarHBondContact O-N 2.83Å; G8-Y11 PolarHBondContact O-N 3.01Å; G8-L12 WeakPolarHBondContact O-CB 3.2Å; G8-L12 WeakPolarHBondContact O-CG 3.43Å; G8-L12 PolarHBondContact O-N 2.78Å
9	G	58.8	Low	49.7	Very low	38 Å²	38	94.6 Å²	94.6	39%	0.392	54%	0.539	S	S	.	.	H	α-helix	trans	-65.6	-40.9	174.9	0	0	0	0	0	112.3	I5 L12 L13	I5-G9 WeakPolarHBondContact O-CA 3.36Å; I5-G9 PolarHBondContact O-N 3.23Å; G9-L12 PolarHBondContact O-N 3.45Å; G9-L13 WeakPolarHBondContact O-CB 3.16Å; G9-L13 PolarHBondContact O-N 3.25Å
10	G	57.1	Low	49.2	Very low	28 Å²	28	98.5 Å²	98.5	29%	0.289	55%	0.553	S	S	.	*	H	α-helix	trans	-63.1	-42.7	174.7	0	0	0	0	0	112.7	I6 L13 L14	I6-G10 WeakPolarHBondContact O-CA 3.26Å; I6-G10 PolarHBondContact O-N 2.84Å; G10-L13 PolarHBondContact O-N 3.08Å; G10-L14 WeakPolarHBondContact O-CD1 3.47Å; G10-L14 PolarHBondContact O-N 2.68Å
11	Y	46.7	Very low	48.6	Very low	169 Å²	169	100.7 Å²	100.7	66%	0.663	56%	0.563	S	S	*	*	H	α-helix	trans	-65.4	-39.2	175.4	-169	-93.4	0	0	0	112.3	I7 G8 T15	I7-Y11 VanDerWaalsContact O-CB 3.29Å; I7-Y11 WeakPolarHBondContact O-CB 3.37Å; I7-Y11 PolarHBondContact O-N 2.96Å; G8-Y11 PolarHBondContact O-N 3.01Å; Y11-T15 HydrophobicContact CE1-CG2 4.21Å; Y11-T15 PolarHBondContact O-N 3.09Å; Y11-T15 PolarHBondContact O-OG1 3.23Å
12	L	56.9	Low	48.3	Very low	64 Å²	64	97.9 Å²	97.9	34%	0.335	57%	0.565	S	S	.	*	H	α-helix	trans	-66.7	-34.9	172.2	-76.4	168.8	0	0	0	112.7	G8 G9 T15 W16 F747	G8-L12 WeakPolarHBondContact O-CB 3.2Å; G8-L12 WeakPolarHBondContact O-CG 3.43Å; G8-L12 PolarHBondContact O-N 2.78Å; G9-L12 PolarHBondContact O-N 3.45Å; L12-T15 WeakPolarHBondContact CA-OG1 3.36Å; L12-T15 PolarHBondContact O-OG1 3.1Å; L12-W16 WeakPolarHBondContact O-CB 3.42Å; L12-W16 PolarHBondContact O-N 3.32Å; L12-W16 VanDerWaalsContact O-N 3.16Å; L12-F747 HydrophobicContact CB-CZ 4.48Å
13	L	59.2	Low	48.2	Very low	107 Å²	107	99.5 Å²	99.5	56%	0.56	57%	0.573	S	S	*	*	H	α-helix	trans	-73	-41.4	176.7	-158.2	105.4	0	0	0	111.3	G9 G10 W16 L17	G9-L13 WeakPolarHBondContact O-CB 3.16Å; G9-L13 PolarHBondContact O-N 3.25Å; G10-L13 PolarHBondContact O-N 3.08Å; L13-W16 CarbonylContact O-C 3.29Å; L13-W16 PolarHBondContact O-N 3.44Å; L13-W16 VanDerWaalsContact O-N 3.11Å; L13-L17 HydrophobicContact CD2-CD1 3.94Å; L13-L17 HydrophobicContact CG-CD1 3.83Å; L13-L17 VanDerWaalsContact O-CD1 3.3Å; L13-L17 WeakPolarHBondContact O-CD1 3.47Å; L13-L17 PolarHBondContact O-N 2.88Å
14	L	50.5	Low	48.2	Very low	118 Å²	118	102.7 Å²	102.7	62%	0.618	59%	0.589	S	S	*	*	H	α-helix	trans	-63	-42.7	172.6	-92.6	84.7	0	0	0	111.4	G10 W16 L17 S18	G10-L14 WeakPolarHBondContact O-CD1 3.47Å; G10-L14 PolarHBondContact O-N 2.68Å; L14-W16 PolarHBondContact O-N 3.08Å; L14-L17 PolarHBondContact O-N 3.44Å; L14-S18 WeakPolarHBondContact O-CB 3.41Å; L14-S18 PolarHBondContact O-N 3.09Å; L14-S18 PolarHBondContact O-OG 3.15Å
15	T	58.4	Low	47.8	Very low	82 Å²	82	105.2 Å²	105.2	50%	0.503	60%	0.597	S	S	.	*	H	α-helix	trans	-71.1	-4.4	174.3	45.6	0	0	0	0	114.4	Y11 L12	Y11-T15 HydrophobicContact CE1-CG2 4.21Å; Y11-T15 PolarHBondContact O-N 3.09Å; Y11-T15 PolarHBondContact O-OG1 3.23Å; L12-T15 WeakPolarHBondContact CA-OG1 3.36Å; L12-T15 PolarHBondContact O-OG1 3.1Å
16	W	50.8	Low	46.9	Very low	164 Å²	164	105.2 Å²	105.2	62%	0.621	61%	0.607	S	S	*	*	H	α-helix	trans	-102.4	-29.3	169.7	-162.2	88.7	0	0	0	113.1	L12 L13 L14	L12-W16 WeakPolarHBondContact O-CB 3.42Å; L12-W16 PolarHBondContact O-N 3.32Å; L12-W16 VanDerWaalsContact O-N 3.16Å; L13-W16 CarbonylContact O-C 3.29Å; L13-W16 PolarHBondContact O-N 3.44Å; L13-W16 VanDerWaalsContact O-N 3.11Å; L14-W16 PolarHBondContact O-N 3.08Å
17	L	54.2	Low	46.3	Very low	117 Å²	117	103.2 Å²	103.2	61%	0.613	60%	0.604	S	S	*	*	H	α-helix	trans	-84.6	-21.8	173.1	-91.7	83.8	0	0	0	113.5	L13 L14 P19	L13-L17 HydrophobicContact CD2-CD1 3.94Å; L13-L17 HydrophobicContact CG-CD1 3.83Å; L13-L17 VanDerWaalsContact O-CD1 3.3Å; L13-L17 WeakPolarHBondContact O-CD1 3.47Å; L13-L17 PolarHBondContact O-N 2.88Å; L14-L17 PolarHBondContact O-N 3.44Å; L17-P19 WeakPolarHBondContact O-CD 3.39Å
18	S	41.9	Very low	45.5	Very low	71 Å²	71	103.1 Å²	103.1	50%	0.497	61%	0.608	S	S	.	*	S	Bend	trans	-63.4	118.4	170.9	-69.5	0	0	0	0	109.3	L14 E20	L14-S18 WeakPolarHBondContact O-CB 3.41Å; L14-S18 PolarHBondContact O-N 3.09Å; L14-S18 PolarHBondContact O-OG 3.15Å; S18-E20 PolarHBondContact O-N 3.38Å
19	P	41.5	Very low	45	Very low	104 Å²	104	107.4 Å²	107.4	68%	0.675	62%	0.623	S	S	*	*			trans	-61	132.6	170.3	26.6	-33	0	0	0	108.8	L17 N21	L17-P19 WeakPolarHBondContact O-CD 3.39Å; P19-N21 VanDerWaalsContact C-N 3.33Å; P19-N21 PolarHBondContact O-N 2.74Å
20	E	40.4	Very low	44.3	Very low	173 Å²	173	111.6 Å²	111.6	81%	0.808	64%	0.636	S	S	*	*			trans	-66.7	94.6	172	-67.1	-173.9	-142.2	0	0	108.1	S18 A22	S18-E20 PolarHBondContact O-N 3.38Å; E20-A22 PolarHBondContact O-N 3.3Å
21	N	34.8	Very low	43.5	Very low	144 Å²	144	117.4 Å²	117.4	77%	0.77	66%	0.66	S	S	*	*			trans	-50.2	114.9	175	-79.2	-7.1	0	0	0	108.8	P19 A23	P19-N21 VanDerWaalsContact C-N 3.33Å; P19-N21 PolarHBondContact O-N 2.74Å; N21-A23 PolarHBondContact O-N 2.96Å
22	A	35.6	Very low	43.4	Very low	94 Å²	94	113.6 Å²	113.6	78%	0.777	66%	0.658	S	S	*	*			trans	-75.9	36.5	-167.9	0	0	0	0	0	114	E20 S24	E20-A22 PolarHBondContact O-N 3.3Å; A22-S24 PolarHBondContact O-N 2.93Å
23	A	36.6	Very low	42.7	Very low	78 Å²	78	116 Å²	116	65%	0.645	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	125.6	-178.9	0	0	0	0	0	111.4	N21	N21-A23 PolarHBondContact O-N 2.96Å
24	S	33.1	Very low	42	Very low	111 Å²	111	117.4 Å²	117.4	78%	0.776	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.1	56.6	164.8	57.8	0	0	0	0	117.5	A22 S26	A22-S24 PolarHBondContact O-N 2.93Å; S24-S26 VanDerWaalsContact C-N 3.35Å; S24-S26 PolarHBondContact O-N 3.48Å
25	L	35.9	Very low	41.7	Very low	165 Å²	165	116.7 Å²	116.7	86%	0.864	69%	0.693	S	S	*	*			trans	-64.9	94	152.8	-87.5	167.5	0	0	0	109.8	S27	L25-S27 PolarHBondContact O-N 2.88Å
26	S	36.3	Very low	40.8	Very low	103 Å²	103	116.4 Å²	116.4	72%	0.72	71%	0.707	S	S	*	*			trans	-79.3	84.2	-175.2	47.4	0	0	0	0	113.1	S24 V28	S24-S26 VanDerWaalsContact C-N 3.35Å; S24-S26 PolarHBondContact O-N 3.48Å; S26-V28 PolarHBondContact O-N 3.28Å
27	S	41.3	Very low	40	Very low	86 Å²	86	111.9 Å²	111.9	60%	0.601	71%	0.711	S	S	*	*			trans	-77.1	47.4	178.1	51	0	0	0	0	114.5	L25 N29	L25-S27 PolarHBondContact O-N 2.88Å; S27-N29 PolarHBondContact O-N 3.05Å
28	V	37	Very low	39.3	Very low	114 Å²	114	110.9 Å²	110.9	69%	0.691	73%	0.729	S	S	*	*			trans	-83.5	97.1	175.3	-172.6	0	0	0	0	110.3	S26 I30	S26-V28 PolarHBondContact O-N 3.28Å; V28-I30 HydrophobicContact CG1-CG1 3.85Å; V28-I30 PolarHBondContact O-N 3.16Å; V28-I30 VanDerWaalsContact O-N 3.16Å
29	N	38.7	Very low	39.3	Very low	126 Å²	126	118 Å²	118	67%	0.674	75%	0.745	S	S	*	*			trans	-78.8	94.1	170.1	-172.5	-7.1	0	0	0	110.3	S27 N31	S27-N29 PolarHBondContact O-N 3.05Å; N29-N31 PolarHBondContact O-N 2.9Å; N29-N31 VanDerWaalsContact O-N 3.16Å; N29-N31 VanDerWaalsContact OD1-CB 3.25Å; N29-N31 WeakPolarHBondContact OD1-CB 3.4Å; N29-N31 PolarHBondContact OD1-N 2.82Å
30	I	43	Very low	39.7	Very low	126 Å²	126	121.2 Å²	121.2	65%	0.646	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-68.1	-9.7	-177.1	-57.9	174.6	0	0	0	112.5	V28 S32 T33	V28-I30 HydrophobicContact CG1-CG1 3.85Å; V28-I30 PolarHBondContact O-N 3.16Å; V28-I30 VanDerWaalsContact O-N 3.16Å; I30-S32 PolarHBondContact O-N 2.82Å; I30-T33 PolarHBondContact O-OG1 2.98Å
31	N	41.4	Very low	40.1	Very low	149 Å²	149	119 Å²	119	80%	0.797	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-77	13.3	-169.8	-143.8	45.7	0	0	0	115.2	N29	N29-N31 PolarHBondContact O-N 2.9Å; N29-N31 VanDerWaalsContact O-N 3.16Å; N29-N31 VanDerWaalsContact OD1-CB 3.25Å; N29-N31 WeakPolarHBondContact OD1-CB 3.4Å; N29-N31 PolarHBondContact OD1-N 2.82Å
32	S	43.9	Very low	41.1	Very low	89 Å²	89	119.5 Å²	119.5	62%	0.622	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-111.8	-8.4	-179.4	55.7	0	0	0	0	114.6	I30	I30-S32 PolarHBondContact O-N 2.82Å
33	T	41.8	Very low	42.2	Very low	114 Å²	114	116.1 Å²	116.1	70%	0.699	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-0.9	-166.8	-29.1	0	0	0	0	114.9	I30	I30-T33 PolarHBondContact O-OG1 2.98Å
34	T	44.9	Very low	44	Very low	137 Å²	137	116.3 Å²	116.3	84%	0.84	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-4.9	-170.5	-42.2	0	0	0	0	114
35	S	44.1	Very low	46	Very low	103 Å²	103	118.5 Å²	118.5	72%	0.72	71%	0.714	S	S	*	*	S	Bend	trans	-113.7	100.1	-176.7	63.1	0	0	0	0	114.3
36	G	39	Very low	47.7	Very low	77 Å²	77	116.8 Å²	116.8	79%	0.794	70%	0.701	S	S	*	*			trans	66.3	91.3	138.9	0	0	0	0	0	119.8
37	G	35.5	Very low	49.4	Very low	69 Å²	69	118 Å²	118	71%	0.711	69%	0.691	S	S	*	*			trans	69.9	95.3	131.9	0	0	0	0	0	120	R39	G37-R39 VanDerWaalsContact C-N 3.3Å; G37-R39 PolarHBondContact O-N 2.84Å
38	G	38.3	Very low	51.4	Low	96 Å²	96	118.6 Å²	118.6	99%	0.99	68%	0.68	S	S	*	*				66.1	3.4	127.9	0	0	0	0	0	120.6
39	R	42.1	Very low	53.5	Low	219 Å²	219	116.7 Å²	116.7	83%	0.826	67%	0.666	S	S	*	*			trans	-82.5	143.9	175.5	-64.1	178.8	74.1	105.9	-3	110.9	G37 V41	G37-R39 VanDerWaalsContact C-N 3.3Å; G37-R39 PolarHBondContact O-N 2.84Å; R39-V41 PolarHBondContact O-N 2.82Å
40	N	50.9	Low	55.5	Low	172 Å²	172	113.7 Å²	113.7	92%	0.92	65%	0.65	S	S	*	*			trans	-57.5	112.8	166.3	-95.5	-49.2	0	0	0	109.1	M42	N40-M42 PolarHBondContact O-N 3Å
41	V	48.4	Very low	57.4	Low	128 Å²	128	108.8 Å²	108.8	78%	0.776	62%	0.624	S	S	*	*			trans	-80.2	109.4	-179.7	-179.8	0	0	0	0	108.3	R39	R39-V41 PolarHBondContact O-N 2.82Å
42	M	54.6	Low	59.5	Low	154 Å²	154	107.9 Å²	107.9	76%	0.759	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-62.3	141.7	171.2	-160.3	-165.1	82.3	0	0	109.5	N40 T44	N40-M42 PolarHBondContact O-N 3Å; M42-T44 PolarHBondContact O-N 2.8Å
43	E	59.1	Low	61.5	Low	23 Å²	23	105.6 Å²	105.6	11%	0.107	60%	0.596	C	S	.	*	P	Polyproline II helix	trans	-54.7	119.4	-179.8	-164.5	-171.7	176.9	0	0	111.4	Y47 R48 L51 P74 R75	E43-Y47 HydrophobicContact CG-CD1 3.72Å; E43-Y47 HydrophobicContact CG-CE1 4.43Å; E43-R48 VanDerWaalsContact CD-CG 3.4Å; E43-R48 VanDerWaalsContact CD-NE 3.28Å; E43-R48 HydrophobicContact CG-CG 3.97Å; E43-R48 WeakPolarHBondContact OE1-CG 3.15Å; E43-R48 IonicContact OE1-NE 3.79Å; E43-R48 IonicContact OE2-CZ 3.28Å; E43-R48 VanDerWaalsContact OE2-CZ 3.28Å; E43-R48 IonicContact OE2-NE 2.76Å; E43-R48 PolarHBondContact OE2-NE 3.47Å; E43-R48 IonicContact OE2-NH2 2.91Å; E43-R48 PolarHBondContact OE2-NH2 3.29Å; E43-L51 VanDerWaalsContact OE1-CD1 3.25Å; E43-L51 WeakPolarHBondContact OE1-CD1 3.41Å; E43-P74 WeakPolarHBondContact OE1-CB 3.41Å; E43-P74 WeakPolarHBondContact OE2-CB 3.35Å; E43-R75 PolarHBondContact OE2-N 2.9Å
44	T	73.9	Confident	63.5	Low	82 Å²	82	104.3 Å²	104.3	50%	0.503	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-73.2	145	-176.5	53.9	0	0	0	0	111.1	M42 H46 Y47 R48	M42-T44 PolarHBondContact O-N 2.8Å; T44-H46 PolarHBondContact O-N 2.9Å; T44-Y47 WeakPolarHBondContact O-CA 3.14Å; T44-Y47 WeakPolarHBondContact O-CB 3.41Å; T44-Y47 PolarHBondContact O-N 2.98Å; T44-Y47 WeakPolarHBondContact OG1-CB 3.32Å; T44-R48 PolarHBondContact O-N 3.43Å; T44-R48 VanDerWaalsContact O-N 3.07Å
45	Q	75.2	Confident	65.6	Low	157 Å²	157	99 Å²	99	73%	0.734	55%	0.552	S	S	*	*	H	α-helix	trans	-56.6	-38.4	-178.6	-165.3	169.1	1.2	0	0	112.1	Y47 R48 D49	Q45-Y47 PolarHBondContact O-N 3.33Å; Q45-R48 WeakPolarHBondContact O-CB 3.4Å; Q45-R48 PolarHBondContact O-N 2.81Å; Q45-D49 PolarHBondContact O-N 3.26Å
46	H	72.3	Confident	67.8	Low	129 Å²	129	100 Å²	100	60%	0.597	55%	0.545	S	S	*	.	H	α-helix	trans	-61.5	-37.1	173.1	-176	46.9	0	0	0	113.5	T44 D49 L50	T44-H46 PolarHBondContact O-N 2.9Å; H46-D49 PolarHBondContact O-N 3.06Å; H46-L50 WeakPolarHBondContact O-CG 3.43Å; H46-L50 PolarHBondContact O-N 2.9Å
47	Y	72.7	Confident	70	Confident	128 Å²	128	103.2 Å²	103.2	50%	0.502	53%	0.533	S	S	.	.	H	α-helix	trans	-70.3	-36.4	175.4	-174.3	-103.9	0	0	0	111.7	E43 T44 Q45 D49 L50 L51	E43-Y47 HydrophobicContact CG-CD1 3.72Å; E43-Y47 HydrophobicContact CG-CE1 4.43Å; T44-Y47 WeakPolarHBondContact O-CA 3.14Å; T44-Y47 WeakPolarHBondContact O-CB 3.41Å; T44-Y47 PolarHBondContact O-N 2.98Å; T44-Y47 WeakPolarHBondContact OG1-CB 3.32Å; Q45-Y47 PolarHBondContact O-N 3.33Å; Y47-D49 VanDerWaalsContact C-N 3.34Å; Y47-D49 PolarHBondContact O-N 2.87Å; Y47-L50 PolarHBondContact O-N 3.19Å; Y47-L51 HydrophobicContact CD1-CD1 3.74Å; Y47-L51 HydrophobicContact CD1-CG 4.18Å; Y47-L51 HydrophobicContact CE1-CD1 3.49Å; Y47-L51 VanDerWaalsContact CE1-CD1 3.49Å; Y47-L51 HydrophobicContact CE1-CD2 4.34Å; Y47-L51 HydrophobicContact CE1-CG 3.92Å; Y47-L51 WeakPolarHBondContact O-CB 3.35Å; Y47-L51 WeakPolarHBondContact O-CG 3.29Å; Y47-L51 PolarHBondContact O-N 3.27Å
48	R	82	Confident	72.3	Confident	98 Å²	98	100.7 Å²	100.7	37%	0.37	51%	0.507	S	S	.	.	H	α-helix	trans	-62.3	-39.1	171.5	-74.8	-177.9	169.4	-175.4	-2.4	112.8	E43 T44 Q45 R52 P74 R75	E43-R48 VanDerWaalsContact CD-CG 3.4Å; E43-R48 VanDerWaalsContact CD-NE 3.28Å; E43-R48 HydrophobicContact CG-CG 3.97Å; E43-R48 WeakPolarHBondContact OE1-CG 3.15Å; E43-R48 IonicContact OE1-NE 3.79Å; E43-R48 IonicContact OE2-CZ 3.28Å; E43-R48 VanDerWaalsContact OE2-CZ 3.28Å; E43-R48 IonicContact OE2-NE 2.76Å; E43-R48 PolarHBondContact OE2-NE 3.47Å; E43-R48 IonicContact OE2-NH2 2.91Å; E43-R48 PolarHBondContact OE2-NH2 3.29Å; T44-R48 PolarHBondContact O-N 3.43Å; T44-R48 VanDerWaalsContact O-N 3.07Å; Q45-R48 WeakPolarHBondContact O-CB 3.4Å; Q45-R48 PolarHBondContact O-N 2.81Å; R48-R52 WeakPolarHBondContact O-CB 3.18Å; R48-R52 PolarHBondContact O-N 2.94Å; R48-P74 HydrophobicContact CG-CB 4.46Å; R48-R75 PolarHBondContact NH2-O 3.08Å
49	D	81.6	Confident	74.6	Confident	75 Å²	75	98.1 Å²	98.1	40%	0.401	48%	0.476	S	S	.	.	H	α-helix	trans	-73.8	-34.1	177.4	-64.3	-31.2	0	0	0	112	Q45 H46 Y47 R52 A53	Q45-D49 PolarHBondContact O-N 3.26Å; H46-D49 PolarHBondContact O-N 3.06Å; Y47-D49 VanDerWaalsContact C-N 3.34Å; Y47-D49 PolarHBondContact O-N 2.87Å; D49-R52 PolarHBondContact O-N 3.37Å; D49-R52 IonicContact OD1-CZ 3.73Å; D49-R52 IonicContact OD1-NH1 3.23Å; D49-R52 PolarHBondContact OD1-NH1 3.42Å; D49-A53 WeakPolarHBondContact O-CB 3.45Å; D49-A53 PolarHBondContact O-N 2.8Å
50	L	81	Confident	76.7	Confident	62 Å²	62	90 Å²	90	33%	0.325	46%	0.456	S	S	.	.	H	α-helix	trans	-63.3	-48.4	169.2	-74.9	168.3	0	0	0	111.7	H46 Y47 R52 A53 D54	H46-L50 WeakPolarHBondContact O-CG 3.43Å; H46-L50 PolarHBondContact O-N 2.9Å; Y47-L50 PolarHBondContact O-N 3.19Å; L50-R52 VanDerWaalsContact C-N 3.33Å; L50-R52 PolarHBondContact O-N 2.85Å; L50-A53 PolarHBondContact O-N 3.38Å; L50-D54 WeakPolarHBondContact O-CB 3.27Å; L50-D54 PolarHBondContact O-N 2.85Å
51	L	83.7	Confident	78.2	Confident	23 Å²	23	87.4 Å²	87.4	12%	0.12	44%	0.439	C	S	.	.	H	α-helix	trans	-57.9	-43.5	174.8	-77.8	172.6	0	0	0	111.8	E43 Y47 D54 N55 S72	E43-L51 VanDerWaalsContact OE1-CD1 3.25Å; E43-L51 WeakPolarHBondContact OE1-CD1 3.41Å; Y47-L51 HydrophobicContact CD1-CD1 3.74Å; Y47-L51 HydrophobicContact CD1-CG 4.18Å; Y47-L51 HydrophobicContact CE1-CD1 3.49Å; Y47-L51 VanDerWaalsContact CE1-CD1 3.49Å; Y47-L51 HydrophobicContact CE1-CD2 4.34Å; Y47-L51 HydrophobicContact CE1-CG 3.92Å; Y47-L51 WeakPolarHBondContact O-CB 3.35Å; Y47-L51 WeakPolarHBondContact O-CG 3.29Å; Y47-L51 PolarHBondContact O-N 3.27Å; L51-D54 PolarHBondContact O-N 2.82Å; L51-N55 VanDerWaalsContact O-CB 3.3Å; L51-N55 WeakPolarHBondContact O-CB 3.46Å; L51-N55 PolarHBondContact O-N 2.88Å; L51-N55 PolarHBondContact O-ND2 2.96Å; L51-S72 VanDerWaalsContact CD2-OG 3.31Å; L51-S72 WeakPolarHBondContact CD2-OG 3.29Å
52	R	85.2	Confident	80	Confident	131 Å²	131	81.7 Å²	81.7	49%	0.494	41%	0.405	S	S	.	.	H	α-helix	trans	-62	-49.2	176.5	-171.6	-179.7	-60.6	104.4	2.1	111.2	R48 D49 L50 D54 N55 E56	R48-R52 WeakPolarHBondContact O-CB 3.18Å; R48-R52 PolarHBondContact O-N 2.94Å; D49-R52 PolarHBondContact O-N 3.37Å; D49-R52 IonicContact OD1-CZ 3.73Å; D49-R52 IonicContact OD1-NH1 3.23Å; D49-R52 PolarHBondContact OD1-NH1 3.42Å; L50-R52 VanDerWaalsContact C-N 3.33Å; L50-R52 PolarHBondContact O-N 2.85Å; R52-D54 PolarHBondContact O-N 3.03Å; R52-N55 PolarHBondContact O-N 2.88Å; R52-E56 HydrophobicContact CG-CG 4.47Å; R52-E56 VanDerWaalsContact CG-OE1 3.29Å; R52-E56 WeakPolarHBondContact CG-OE1 3.42Å; R52-E56 WeakPolarHBondContact O-CB 3.45Å; R52-E56 WeakPolarHBondContact O-CG 3.43Å; R52-E56 PolarHBondContact O-N 2.78Å
53	A	85.5	Confident	81.5	Confident	40 Å²	40	81.5 Å²	81.5	33%	0.331	41%	0.406	S	S	.	.	H	α-helix	trans	-67.6	-21.9	179.2	0	0	0	0	0	113.5	D49 L50 R57	D49-A53 WeakPolarHBondContact O-CB 3.45Å; D49-A53 PolarHBondContact O-N 2.8Å; L50-A53 PolarHBondContact O-N 3.38Å; A53-R57 PolarHBondContact O-NE 2.81Å; A53-R57 PolarHBondContact O-NH2 2.82Å; A53-R57 VanDerWaalsContact O-NH2 3.14Å
54	D	84.4	Confident	82.6	Confident	87 Å²	87	90.2 Å²	90.2	47%	0.465	44%	0.438	S	S	.	.	H	α-helix	trans	-80.6	-47.4	172.8	-154.5	63.2	0	0	0	111.3	L50 L51 R52 E56 R57 G58	L50-D54 WeakPolarHBondContact O-CB 3.27Å; L50-D54 PolarHBondContact O-N 2.85Å; L51-D54 PolarHBondContact O-N 2.82Å; R52-D54 PolarHBondContact O-N 3.03Å; D54-E56 VanDerWaalsContact C-N 3.33Å; D54-E56 PolarHBondContact O-N 2.93Å; D54-R57 PolarHBondContact O-N 3.03Å; D54-R57 VanDerWaalsContact O-N 3.09Å; D54-R57 IonicContact OD1-NH2 3.87Å; D54-G58 PolarHBondContact O-N 3.02Å
55	N	88.8	Confident	83	Confident	27 Å²	27	90.5 Å²	90.5	14%	0.144	44%	0.437	C	S	.	.	H	α-helix	trans	-60.5	-39	175.4	-72.4	-31.2	0	0	0	112.7	L51 R52 R57 A59 F69 A71 S72	L51-N55 VanDerWaalsContact O-CB 3.3Å; L51-N55 WeakPolarHBondContact O-CB 3.46Å; L51-N55 PolarHBondContact O-N 2.88Å; L51-N55 PolarHBondContact O-ND2 2.96Å; R52-N55 PolarHBondContact O-N 2.88Å; N55-R57 VanDerWaalsContact C-N 3.35Å; N55-A59 VanDerWaalsContact O-CB 3.23Å; N55-A59 WeakPolarHBondContact O-CB 3.29Å; N55-A59 PolarHBondContact O-N 2.61Å; N55-F69 HydrophobicContact CB-CE1 4.13Å; N55-F69 WeakPolarHBondContact O-CE1 3.16Å; N55-A71 HydrophobicContact CB-CB 4.22Å; N55-A71 WeakPolarHBondContact OD1-CA 3.31Å; N55-S72 PolarHBondContact ND2-O 3.42Å; N55-S72 PolarHBondContact ND2-OG 3.38Å; N55-S72 PolarHBondContact OD1-N 3.4Å; N55-S72 PolarHBondContact OD1-OG 2.68Å
56	E	88.9	Confident	83.2	Confident	124 Å²	124	90.7 Å²	90.7	58%	0.579	44%	0.442	S	S	*	.	H	α-helix	trans	-65	-36.9	174.3	-76.4	173.3	-167.5	0	0	112.2	R52 D54 A60	R52-E56 HydrophobicContact CG-CG 4.47Å; R52-E56 VanDerWaalsContact CG-OE1 3.29Å; R52-E56 WeakPolarHBondContact CG-OE1 3.42Å; R52-E56 WeakPolarHBondContact O-CB 3.45Å; R52-E56 WeakPolarHBondContact O-CG 3.43Å; R52-E56 PolarHBondContact O-N 2.78Å; D54-E56 VanDerWaalsContact C-N 3.33Å; D54-E56 PolarHBondContact O-N 2.93Å; E56-A60 WeakPolarHBondContact O-CB 3.35Å; E56-A60 PolarHBondContact O-N 2.94Å; E56-A60 VanDerWaalsContact O-N 3.11Å
57	R	86.8	Confident	83.8	Confident	143 Å²	143	90.9 Å²	90.9	54%	0.54	44%	0.444	S	S	.	.	H	α-helix	trans	-70.8	-48.8	175	-86.4	176.5	-72.6	149.7	11	111.7	A53 D54 N55 A59 A60 E61	A53-R57 PolarHBondContact O-NE 2.81Å; A53-R57 PolarHBondContact O-NH2 2.82Å; A53-R57 VanDerWaalsContact O-NH2 3.14Å; D54-R57 PolarHBondContact O-N 3.03Å; D54-R57 VanDerWaalsContact O-N 3.09Å; D54-R57 IonicContact OD1-NH2 3.87Å; N55-R57 VanDerWaalsContact C-N 3.35Å; R57-A59 VanDerWaalsContact C-N 3.31Å; R57-A59 PolarHBondContact O-N 2.94Å; R57-A60 PolarHBondContact O-N 2.64Å; R57-A60 VanDerWaalsContact O-N 3.09Å; R57-E61 WeakPolarHBondContact O-CB 3.41Å; R57-E61 PolarHBondContact O-N 3.25Å
58	G	82.8	Confident	84.4	Confident	16 Å²	16	91.5 Å²	91.5	17%	0.165	46%	0.461	C	S	.	.	H	α-helix	trans	-59.6	-39.9	177.4	0	0	0	0	0	113	D54 E61 A62 F69	D54-G58 PolarHBondContact O-N 3.02Å; G58-E61 PolarHBondContact O-N 3.14Å; G58-A62 WeakPolarHBondContact O-CB 3.35Å; G58-A62 PolarHBondContact O-N 3.38Å; G58-F69 VanDerWaalsContact C-CG 3.45Å
59	A	87.2	Confident	84.4	Confident	42 Å²	42	90.9 Å²	90.9	35%	0.347	46%	0.461	S	S	.	.	H	α-helix	trans	-64.3	-40.4	173	0	0	0	0	0	112.5	N55 R57 L63 F69	N55-A59 VanDerWaalsContact O-CB 3.23Å; N55-A59 WeakPolarHBondContact O-CB 3.29Å; N55-A59 PolarHBondContact O-N 2.61Å; R57-A59 VanDerWaalsContact C-N 3.31Å; R57-A59 PolarHBondContact O-N 2.94Å; A59-L63 WeakPolarHBondContact O-CB 3.37Å; A59-L63 PolarHBondContact O-N 2.98Å; A59-F69 HydrophobicContact CB-CD1 4.08Å
60	A	85.8	Confident	84.5	Confident	49 Å²	49	94.7 Å²	94.7	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-72.2	-32.7	178	0	0	0	0	0	113.6	E56 R57 R64	E56-A60 WeakPolarHBondContact O-CB 3.35Å; E56-A60 PolarHBondContact O-N 2.94Å; E56-A60 VanDerWaalsContact O-N 3.11Å; R57-A60 PolarHBondContact O-N 2.64Å; R57-A60 VanDerWaalsContact O-N 3.09Å; A60-R64 WeakPolarHBondContact O-CG 3.35Å; A60-R64 PolarHBondContact O-N 2.87Å
61	E	83	Confident	84.6	Confident	118 Å²	118	94.1 Å²	94.1	55%	0.551	48%	0.484	S	S	*	.	H	α-helix	trans	-64.9	-51	172.8	-159.1	75.7	-125.7	0	0	110	R57 G58 L63 R64 N65	R57-E61 WeakPolarHBondContact O-CB 3.41Å; R57-E61 PolarHBondContact O-N 3.25Å; G58-E61 PolarHBondContact O-N 3.14Å; E61-L63 VanDerWaalsContact C-N 3.33Å; E61-L63 PolarHBondContact O-N 3.07Å; E61-R64 WeakPolarHBondContact O-CB 3.48Å; E61-R64 PolarHBondContact O-N 3.03Å; E61-N65 PolarHBondContact O-N 3.48Å; E61-N65 VanDerWaalsContact O-N 3.09Å
62	A	85.9	Confident	84.5	Confident	8 Å²	8	95.5 Å²	95.5	7%	0.066	50%	0.496	C	S	.	.	H	α-helix	trans	-61.5	-38.3	177.2	0	0	0	0	0	112.8	G58 R64 N65 N66 E67 F69	G58-A62 WeakPolarHBondContact O-CB 3.35Å; G58-A62 PolarHBondContact O-N 3.38Å; A62-R64 VanDerWaalsContact C-N 3.25Å; A62-R64 PolarHBondContact O-N 2.85Å; A62-N65 PolarHBondContact O-N 2.96Å; A62-N66 PolarHBondContact O-N 3.26Å; A62-E67 HydrophobicContact CB-CB 4.31Å; A62-E67 PolarHBondContact O-N 3.11Å; A62-F69 HydrophobicContact CB-CB 3.7Å
63	L	84.7	Confident	84	Confident	149 Å²	149	95.6 Å²	95.6	78%	0.78	51%	0.505	S	S	*	.	H	α-helix	trans	-63.7	-27	174	-127	78.5	0	0	0	113.7	A59 E61	A59-L63 WeakPolarHBondContact O-CB 3.37Å; A59-L63 PolarHBondContact O-N 2.98Å; E61-L63 VanDerWaalsContact C-N 3.33Å; E61-L63 PolarHBondContact O-N 3.07Å
64	R	82.9	Confident	83.1	Confident	207 Å²	207	96.4 Å²	96.4	78%	0.781	51%	0.507	S	S	*	.	H	α-helix	trans	-80.7	-31.9	175.1	-73.7	167.8	173.4	-108.5	-2	112.2	A60 E61 A62	A60-R64 WeakPolarHBondContact O-CG 3.35Å; A60-R64 PolarHBondContact O-N 2.87Å; E61-R64 WeakPolarHBondContact O-CB 3.48Å; E61-R64 PolarHBondContact O-N 3.03Å; A62-R64 VanDerWaalsContact C-N 3.25Å; A62-R64 PolarHBondContact O-N 2.85Å
65	N	83.5	Confident	82	Confident	88 Å²	88	102.2 Å²	102.2	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-97.9	-3.1	-172.3	-60.1	-14.4	0	0	0	113.7	E61 A62 E67	E61-N65 PolarHBondContact O-N 3.48Å; E61-N65 VanDerWaalsContact O-N 3.09Å; A62-N65 PolarHBondContact O-N 2.96Å; N65-E67 VanDerWaalsContact C-N 3.26Å; N65-E67 HydrophobicContact CB-CG 4.02Å; N65-E67 PolarHBondContact O-N 2.81Å
66	N	78.7	Confident	80.3	Confident	160 Å²	160	103.9 Å²	103.9	86%	0.856	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	34	-168.9	-75.4	-30	0	0	0	113.6	A62	A62-N66 PolarHBondContact O-N 3.26Å
67	E	84.7	Confident	78.3	Confident	134 Å²	134	104.6 Å²	104.6	63%	0.626	55%	0.554	S	S	*	*			trans	-101.8	172.8	176.3	-64.7	-173.1	139.3	0	0	111.7	A62 N65	A62-E67 HydrophobicContact CB-CB 4.31Å; A62-E67 PolarHBondContact O-N 3.11Å; N65-E67 VanDerWaalsContact C-N 3.26Å; N65-E67 HydrophobicContact CB-CG 4.02Å; N65-E67 PolarHBondContact O-N 2.81Å
68	T	84.5	Confident	76.1	Confident	141 Å²	141	104.3 Å²	104.3	87%	0.865	56%	0.563	S	S	*	*			trans	-108.7	117.7	177	49.6	0	0	0	0	111.2
69	F	83.8	Confident	73.7	Confident	84 Å²	84	109.3 Å²	109.3	37%	0.368	59%	0.59	S	S	.	*			trans	-93.6	134	176.5	-179.7	-108	0	0	0	111.9	N55 G58 A59 A62 A71	N55-F69 HydrophobicContact CB-CE1 4.13Å; N55-F69 WeakPolarHBondContact O-CE1 3.16Å; G58-F69 VanDerWaalsContact C-CG 3.45Å; A59-F69 HydrophobicContact CB-CD1 4.08Å; A62-F69 HydrophobicContact CB-CB 3.7Å; F69-A71 HydrophobicContact CD1-CB 4.48Å; F69-A71 HydrophobicContact CE1-CB 3.98Å
70	I	83	Confident	71.2	Confident	155 Å²	155	116 Å²	116	80%	0.795	62%	0.62	S	S	*	*			trans	-102.9	112.9	171.4	-59.6	178.7	0	0	0	108.3
71	A	83.4	Confident	69	Low	50 Å²	50	119 Å²	119	41%	0.413	63%	0.633	S	S	.	*	P	Polyproline II helix	trans	-70.1	139.5	178.4	0	0	0	0	0	112.2	N55 F69	N55-A71 HydrophobicContact CB-CB 4.22Å; N55-A71 WeakPolarHBondContact OD1-CA 3.31Å; F69-A71 HydrophobicContact CD1-CB 4.48Å; F69-A71 HydrophobicContact CE1-CB 3.98Å
72	S	80.4	Confident	66.4	Low	52 Å²	52	116.9 Å²	116.9	36%	0.364	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-76.5	122.9	172.3	55.9	0	0	0	0	110.5	L51 N55	L51-S72 VanDerWaalsContact CD2-OG 3.31Å; L51-S72 WeakPolarHBondContact CD2-OG 3.29Å; N55-S72 PolarHBondContact ND2-O 3.42Å; N55-S72 PolarHBondContact ND2-OG 3.38Å; N55-S72 PolarHBondContact OD1-N 3.4Å; N55-S72 PolarHBondContact OD1-OG 2.68Å
73	L	74.9	Confident	64	Low	133 Å²	133	124.3 Å²	124.3	70%	0.696	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-82.5	141.2	-177.8	-68.7	109.9	0	0	0	112	L77	L73-L77 HydrophobicContact CD2-CD2 4.4Å
74	P	68	Low	61.5	Low	57 Å²	57	124.6 Å²	124.6	37%	0.37	68%	0.684	S	S	.	*	P	Polyproline II helix	trans	-65.8	149.8	168.3	30.2	-34.9	0	0	0	110.3	E43 R48	E43-P74 WeakPolarHBondContact OE1-CB 3.41Å; E43-P74 WeakPolarHBondContact OE2-CB 3.35Å; R48-P74 HydrophobicContact CG-CB 4.46Å
75	R	59.6	Low	59.5	Low	209 Å²	209	123.9 Å²	123.9	79%	0.789	69%	0.69	S	S	*	*	S	Bend	trans	-76.7	141.9	178.9	-73.1	-171.9	-180	178.6	1	110.7	E43 R48	E43-R75 PolarHBondContact OE2-N 2.9Å; R48-R75 PolarHBondContact NH2-O 3.08Å
76	G	54.7	Low	57.1	Low	63 Å²	63	128.2 Å²	128.2	65%	0.649	70%	0.704	S	S	*	*			trans	97.4	26.1	-173.6	0	0	0	0	0	114.4
77	L	46.3	Very low	55.1	Low	139 Å²	139	132.3 Å²	132.3	73%	0.728	71%	0.708	S	S	*	*			trans	-105.2	11.9	156.5	-138.6	79.9	0	0	0	112.1	L73	L73-L77 HydrophobicContact CD2-CD2 4.4Å
78	D	39.4	Very low	52.9	Low	137 Å²	137	131.9 Å²	131.9	73%	0.733	71%	0.71	S	S	*	*	S	Bend	trans	-70.9	139.8	172	-56.1	-77	0	0	0	110
79	T	34.3	Very low	50.7	Low	120 Å²	120	132.9 Å²	132.9	74%	0.736	71%	0.71	S	S	*	*			trans	-72.4	130.6	-167.4	45	0	0	0	0	113.6	T81	T79-T81 PolarHBondContact O-N 2.9Å; T79-T81 PolarHBondContact O-OG1 3.3Å; T79-T81 PolarHBondContact OG1-OG1 2.81Å
80	D	34.1	Very low	48.5	Very low	182 Å²	182	134.4 Å²	134.4	97%	0.973	73%	0.729	S	S	*	*			trans	-53.8	104.9	163.1	-105.8	-38.6	0	0	0	109.4
81	T	38.3	Very low	46.4	Very low	112 Å²	112	132.9 Å²	132.9	69%	0.687	73%	0.728	S	S	*	*			trans	-127.9	107.8	-177.8	-44.3	0	0	0	0	105.7	T79	T79-T81 PolarHBondContact O-N 2.9Å; T79-T81 PolarHBondContact O-OG1 3.3Å; T79-T81 PolarHBondContact OG1-OG1 2.81Å
82	G	29.1	Very low	44.3	Very low	74 Å²	74	138.8 Å²	138.8	76%	0.763	75%	0.753	S	S	*	*			trans	-60.8	148.7	-155.6	0	0	0	0	0	115.4
83	N	36.3	Very low	42.1	Very low	164 Å²	164	143.5 Å²	143.5	88%	0.877	78%	0.775	S	S	*	*			trans	-146.6	97.7	164.9	-139.7	-12.1	0	0	0	109.4	Q85	N83-Q85 PolarHBondContact O-N 3.11Å
84	D	32.3	Very low	40.4	Very low	156 Å²	156	146.3 Å²	146.3	83%	0.834	78%	0.784	S	S	*	*			trans	-68.5	115.4	-177.5	-68.9	-76.7	0	0	0	112.2
85	Q	39.5	Very low	38.7	Very low	191 Å²	191	148.9 Å²	148.9	89%	0.893	80%	0.803	S	S	*	*			trans	-150.1	64.9	162.8	-125.7	165.5	52.8	0	0	116	N83	N83-Q85 PolarHBondContact O-N 3.11Å
86	K	33.6	Very low	37.5	Very low	179 Å²	179	142.3 Å²	142.3	78%	0.778	80%	0.8	S	S	*	*			trans	14.7	112.4	138.5	-175.1	-174	-176.7	176.8	0	117.4
87	R	36.5	Very low	36.5	Very low	246 Å²	246	145.5 Å²	145.5	93%	0.928	81%	0.808	S	S	*	*			trans	-156.8	131.3	132.9	-119.6	173.1	-171.5	150.3	4.3	112.5
88	D	38.4	Very low	36	Very low	125 Å²	125	144.7 Å²	144.7	67%	0.668	81%	0.814	S	S	*	*			trans	-87.6	147.7	-172.3	-41.7	-96.6	0	0	0	112.2
89	N	38.7	Very low	35.7	Very low	162 Å²	162	141.7 Å²	141.7	87%	0.866	82%	0.815	S	S	*	*			trans	-165.9	133.2	140.5	-108.9	1.5	0	0	0	110.8
90	P	36.8	Very low	35.7	Very low	117 Å²	117	145.5 Å²	145.5	76%	0.76	83%	0.825	S	S	*	*			trans	-82.1	173	179.1	-11.7	30.2	0	0	0	114.4
91	P	39.4	Very low	35.6	Very low	122 Å²	122	145 Å²	145	79%	0.792	82%	0.822	S	S	*	*			trans	-97.8	166.3	-175.7	39	-35.3	0	0	0	114.7
92	D	39.4	Very low	35.5	Very low	174 Å²	174	144.5 Å²	144.5	93%	0.93	83%	0.829	S	S	*	*			trans	-111.7	149	165.8	-86.4	-52.6	0	0	0	111.4
93	D	34.7	Very low	35.9	Very low	152 Å²	152	146.6 Å²	146.6	81%	0.813	83%	0.832	S	S	*	*			trans	-85.5	148.9	-175.4	-89.2	-56	0	0	0	114.9
94	Q	38.8	Very low	35.9	Very low	191 Å²	191	144.4 Å²	144.4	89%	0.893	83%	0.827	S	S	*	*			trans	-158.8	88.7	136	-117.2	161.7	66.4	0	0	115
95	S	32.1	Very low	36.4	Very low	111 Å²	111	142.3 Å²	142.3	78%	0.776	82%	0.822	S	S	*	*			trans	12	127.9	145.1	58.8	0	0	0	0	120.9
96	G	35.3	Very low	36.9	Very low	71 Å²	71	140.7 Å²	140.7	73%	0.732	81%	0.814	S	S	*	*			trans	-159.1	55.9	175.8	0	0	0	0	0	117.7
97	T	33.4	Very low	37.7	Very low	130 Å²	130	140 Å²	140	80%	0.798	81%	0.814	S	S	*	*			trans	52.7	114.1	161.1	45.8	0	0	0	0	121.8
98	S	35	Very low	38.5	Very low	123 Å²	123	132 Å²	132	86%	0.86	79%	0.79	S	S	*	*				62.8	125.1	125.7	-51.3	0	0	0	0	122.6
99	G	33.3	Very low	39.4	Very low	74 Å²	74	132.1 Å²	132.1	76%	0.763	79%	0.786	S	S	*	*			trans	150.8	83.4	142.3	0	0	0	0	0	120.6
100	Q	34.5	Very low	40.8	Very low	200 Å²	200	128 Å²	128	94%	0.935	77%	0.767	S	S	*	*			trans	56.4	135.4	144.6	-67.6	174.5	-21.6	0	0	122.5
101	N	31.6	Very low	42.3	Very low	171 Å²	171	124.7 Å²	124.7	91%	0.914	75%	0.749	S	S	*	*			trans	-79.9	148.1	167.8	-65.9	-41	0	0	0	112.3
102	A	36.7	Very low	43.7	Very low	102 Å²	102	125.8 Å²	125.8	84%	0.843	74%	0.738	S	S	*	*			trans	-146.6	141.4	159	0	0	0	0	0	111.4
103	S	38.1	Very low	45.5	Very low	118 Å²	118	123.4 Å²	123.4	83%	0.825	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-80.5	159.9	-178.7	-60.9	0	0	0	0	112.6
104	P	35.4	Very low	47.6	Very low	117 Å²	117	123 Å²	123	76%	0.76	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-78.1	157.2	-163.3	30.7	-36.8	0	0	0	114.9
105	P	43.1	Very low	49.1	Very low	113 Å²	113	122.6 Å²	122.6	73%	0.734	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-63.5	138.9	176.8	-21.7	33.9	0	0	0	113.7	E107	P105-E107 PolarHBondContact O-N 2.86Å
106	Q	50.8	Low	51.3	Low	156 Å²	156	126.3 Å²	126.3	73%	0.729	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-13.8	-167.4	-162.6	168.1	-15.1	0	0	114.7	D108 Q109	Q106-D108 PolarHBondContact O-N 2.77Å; Q106-Q109 PolarHBondContact O-N 2.9Å
107	E	50.1	Low	53.5	Low	165 Å²	165	128.9 Å²	128.9	77%	0.771	69%	0.692	S	S	*	*	H	α-helix	trans	-68.2	-28.2	-174.4	-66.5	-173.7	106.9	0	0	114.8	P105 Q109 T110 A111	P105-E107 PolarHBondContact O-N 2.86Å; E107-Q109 PolarHBondContact O-N 3.14Å; E107-T110 PolarHBondContact O-N 2.8Å; E107-A111 PolarHBondContact O-N 3.47Å; E107-A111 VanDerWaalsContact O-N 3.14Å
108	D	53	Low	55.3	Low	79 Å²	79	125.6 Å²	125.6	42%	0.422	68%	0.678	S	S	.	*	H	α-helix	trans	-69.2	-18.8	-178.8	-171	32.4	0	0	0	112.3	Q106 R112	Q106-D108 PolarHBondContact O-N 2.77Å; D108-R112 WeakPolarHBondContact O-CB 3.47Å; D108-R112 VanDerWaalsContact O-CG 3.23Å; D108-R112 WeakPolarHBondContact O-CG 3.48Å; D108-R112 PolarHBondContact O-N 3.21Å; D108-R112 VanDerWaalsContact O-N 3.12Å; D108-R112 IonicContact OD1-CZ 3.7Å; D108-R112 IonicContact OD1-NE 3.93Å; D108-R112 IonicContact OD1-NH2 3.65Å; D108-R112 IonicContact OD2-CZ 2.89Å; D108-R112 IonicContact OD2-NE 3.82Å; D108-R112 IonicContact OD2-NH1 2.81Å; D108-R112 PolarHBondContact OD2-NH1 2.98Å; D108-R112 IonicContact OD2-NH2 2.68Å; D108-R112 PolarHBondContact OD2-NH2 3.03Å
109	Q	56.9	Low	56.6	Low	126 Å²	126	125.3 Å²	125.3	59%	0.589	67%	0.666	S	S	*	*	H	α-helix	trans	-69.9	-52.6	170.5	-71.2	-175.9	-21.1	0	0	111.2	Q106 E107 A111 R112 E113	Q106-Q109 PolarHBondContact O-N 2.9Å; E107-Q109 PolarHBondContact O-N 3.14Å; Q109-A111 PolarHBondContact O-N 2.95Å; Q109-R112 CarbonylContact O-C 3.56Å; Q109-R112 WeakPolarHBondContact O-CA 3.13Å; Q109-R112 WeakPolarHBondContact O-CB 3.13Å; Q109-R112 PolarHBondContact O-N 2.84Å; Q109-E113 PolarHBondContact O-N 2.88Å
110	T	67.6	Low	58.6	Low	77 Å²	77	128.4 Å²	128.4	47%	0.472	66%	0.661	S	S	.	*	H	α-helix	trans	-62.4	-33.7	-179.8	-25.1	0	0	0	0	112	E107 K114	E107-T110 PolarHBondContact O-N 2.8Å; T110-K114 PolarHBondContact O-N 3.43Å; T110-K114 VanDerWaalsContact O-N 3.07Å
111	A	69.5	Low	60.6	Low	46 Å²	46	126.3 Å²	126.3	38%	0.38	65%	0.649	S	S	.	*	H	α-helix	trans	-67.3	-40.7	172.6	0	0	0	0	0	112.4	E107 Q109 R115	E107-A111 PolarHBondContact O-N 3.47Å; E107-A111 VanDerWaalsContact O-N 3.14Å; Q109-A111 PolarHBondContact O-N 2.95Å; A111-R115 VanDerWaalsContact O-CB 3.27Å; A111-R115 WeakPolarHBondContact O-CB 3.22Å; A111-R115 PolarHBondContact O-N 3.31Å
112	R	67.4	Low	62	Low	146 Å²	146	122.8 Å²	122.8	55%	0.551	63%	0.629	S	S	*	*	H	α-helix	trans	-69.4	-36.1	174.9	-78.5	176.3	177.4	129.7	17.1	113	D108 Q109 R115 R116	D108-R112 WeakPolarHBondContact O-CB 3.47Å; D108-R112 VanDerWaalsContact O-CG 3.23Å; D108-R112 WeakPolarHBondContact O-CG 3.48Å; D108-R112 PolarHBondContact O-N 3.21Å; D108-R112 VanDerWaalsContact O-N 3.12Å; D108-R112 IonicContact OD1-CZ 3.7Å; D108-R112 IonicContact OD1-NE 3.93Å; D108-R112 IonicContact OD1-NH2 3.65Å; D108-R112 IonicContact OD2-CZ 2.89Å; D108-R112 IonicContact OD2-NE 3.82Å; D108-R112 IonicContact OD2-NH1 2.81Å; D108-R112 PolarHBondContact OD2-NH1 2.98Å; D108-R112 IonicContact OD2-NH2 2.68Å; D108-R112 PolarHBondContact OD2-NH2 3.03Å; Q109-R112 CarbonylContact O-C 3.56Å; Q109-R112 WeakPolarHBondContact O-CA 3.13Å; Q109-R112 WeakPolarHBondContact O-CB 3.13Å; Q109-R112 PolarHBondContact O-N 2.84Å; R112-R115 PolarHBondContact O-N 2.57Å; R112-R116 WeakPolarHBondContact O-CB 3.44Å; R112-R116 PolarHBondContact O-N 3.09Å
113	E	78.7	Confident	63.4	Low	124 Å²	124	123.6 Å²	123.6	58%	0.579	62%	0.619	S	S	*	*	H	α-helix	trans	-67.6	-50.8	175.7	-76.8	-178.4	139.9	0	0	111.5	Q109 R115 R116 E117	Q109-E113 PolarHBondContact O-N 2.88Å; E113-R115 PolarHBondContact O-N 3.28Å; E113-R116 CarbonylContact O-C 3.58Å; E113-R116 WeakPolarHBondContact O-CA 3.44Å; E113-R116 WeakPolarHBondContact O-CB 3.48Å; E113-R116 PolarHBondContact O-N 3.11Å; E113-E117 PolarHBondContact O-N 2.85Å
114	K	78.7	Confident	65.1	Low	143 Å²	143	120.7 Å²	120.7	62%	0.622	60%	0.602	S	S	*	*	H	α-helix	trans	-57.1	-36	172.7	-77.1	-178.6	175.3	176.6	0	112.6	T110 A118	T110-K114 PolarHBondContact O-N 3.43Å; T110-K114 VanDerWaalsContact O-N 3.07Å; K114-A118 VanDerWaalsContact O-CB 3.22Å; K114-A118 WeakPolarHBondContact O-CB 3.38Å; K114-A118 PolarHBondContact O-N 3.04Å
115	R	69.8	Low	66.5	Low	183 Å²	183	122.3 Å²	122.3	69%	0.691	59%	0.593	S	S	*	*	H	α-helix	trans	-69	-36.2	174.7	-165.2	176.8	-64.2	179.3	1.6	112.2	A111 R112 E113 L119	A111-R115 VanDerWaalsContact O-CB 3.27Å; A111-R115 WeakPolarHBondContact O-CB 3.22Å; A111-R115 PolarHBondContact O-N 3.31Å; R112-R115 PolarHBondContact O-N 2.57Å; E113-R115 PolarHBondContact O-N 3.28Å; R115-L119 WeakPolarHBondContact O-CB 3.42Å; R115-L119 PolarHBondContact O-N 3.35Å
116	R	78.1	Confident	67.2	Low	188 Å²	188	121.2 Å²	121.2	71%	0.709	58%	0.58	S	S	*	*	H	α-helix	trans	-68.3	-45.9	173.1	-87	-179.7	157.6	163.2	-5.2	112.5	R112 E113 L119 Q120	R112-R116 WeakPolarHBondContact O-CB 3.44Å; R112-R116 PolarHBondContact O-N 3.09Å; E113-R116 CarbonylContact O-C 3.58Å; E113-R116 WeakPolarHBondContact O-CA 3.44Å; E113-R116 WeakPolarHBondContact O-CB 3.48Å; E113-R116 PolarHBondContact O-N 3.11Å; R116-L119 WeakPolarHBondContact O-CB 3.24Å; R116-L119 PolarHBondContact O-N 2.85Å; R116-Q120 WeakPolarHBondContact O-CG 3.44Å; R116-Q120 PolarHBondContact O-N 3.45Å
117	E	81.2	Confident	67.2	Low	126 Å²	126	119 Å²	119	59%	0.589	57%	0.573	S	S	*	*	H	α-helix	trans	-59.9	-46.3	174.7	-70	-172.7	136.4	0	0	111.2	E113 L119 Q120 K121	E113-E117 PolarHBondContact O-N 2.85Å; E117-L119 VanDerWaalsContact C-N 3.3Å; E117-L119 PolarHBondContact O-N 3.17Å; E117-Q120 PolarHBondContact O-N 3.41Å; E117-K121 WeakPolarHBondContact O-CB 3.33Å; E117-K121 PolarHBondContact O-N 3.42Å
118	A	71.7	Confident	67.5	Low	61 Å²	61	115.4 Å²	115.4	50%	0.504	56%	0.563	S	S	.	*	H	α-helix	trans	-59.6	-41.1	175.3	0	0	0	0	0	111.7	K114 L122	K114-A118 VanDerWaalsContact O-CB 3.22Å; K114-A118 WeakPolarHBondContact O-CB 3.38Å; K114-A118 PolarHBondContact O-N 3.04Å; A118-L122 WeakPolarHBondContact O-CB 3.38Å; A118-L122 PolarHBondContact O-N 3.4Å
119	L	61.9	Low	67.1	Low	116 Å²	116	119.5 Å²	119.5	61%	0.607	58%	0.579	S	S	*	*	H	α-helix	trans	-63.1	-50.2	175.3	-134.4	94	0	0	0	111.6	R115 R116 E117 K121 L122 L123	R115-L119 WeakPolarHBondContact O-CB 3.42Å; R115-L119 PolarHBondContact O-N 3.35Å; R116-L119 WeakPolarHBondContact O-CB 3.24Å; R116-L119 PolarHBondContact O-N 2.85Å; E117-L119 VanDerWaalsContact C-N 3.3Å; E117-L119 PolarHBondContact O-N 3.17Å; L119-K121 VanDerWaalsContact C-N 3.33Å; L119-K121 PolarHBondContact O-N 3.06Å; L119-L122 WeakPolarHBondContact O-CB 3.45Å; L119-L122 PolarHBondContact O-N 2.92Å; L119-L123 WeakPolarHBondContact O-CB 3.29Å; L119-L123 PolarHBondContact O-N 2.9Å
120	Q	75	Confident	66.6	Low	140 Å²	140	120.6 Å²	120.6	65%	0.654	58%	0.584	S	S	*	*	H	α-helix	trans	-61.5	-40.2	179.1	-73.8	-178.9	-7.4	0	0	111.9	R116 E117 L122 L123 A124	R116-Q120 WeakPolarHBondContact O-CG 3.44Å; R116-Q120 PolarHBondContact O-N 3.45Å; E117-Q120 PolarHBondContact O-N 3.41Å; Q120-L122 VanDerWaalsContact C-N 3.29Å; Q120-L122 PolarHBondContact O-N 3Å; Q120-L123 PolarHBondContact O-N 3.34Å; Q120-A124 VanDerWaalsContact O-CB 3.31Å; Q120-A124 WeakPolarHBondContact O-CB 3.2Å; Q120-A124 PolarHBondContact O-N 3.43Å
121	K	76.6	Confident	65.2	Low	156 Å²	156	123.7 Å²	123.7	68%	0.678	59%	0.593	S	S	*	*	H	α-helix	trans	-76.4	-14.3	178.8	-157.2	169.3	-169.7	171.2	0	113.5	E117 L119	E117-K121 WeakPolarHBondContact O-CB 3.33Å; E117-K121 PolarHBondContact O-N 3.42Å; L119-K121 VanDerWaalsContact C-N 3.33Å; L119-K121 PolarHBondContact O-N 3.06Å
122	L	60.7	Low	63.7	Low	97 Å²	97	129.8 Å²	129.8	51%	0.508	62%	0.62	S	S	.	*	H	α-helix	trans	-82.4	-48.2	164.7	-162.6	82.9	0	0	0	110.4	A118 L119 Q120 A124 R125 I126	A118-L122 WeakPolarHBondContact O-CB 3.38Å; A118-L122 PolarHBondContact O-N 3.4Å; L119-L122 WeakPolarHBondContact O-CB 3.45Å; L119-L122 PolarHBondContact O-N 2.92Å; Q120-L122 VanDerWaalsContact C-N 3.29Å; Q120-L122 PolarHBondContact O-N 3Å; L122-A124 PolarHBondContact O-N 2.95Å; L122-R125 WeakPolarHBondContact O-CA 3.43Å; L122-R125 WeakPolarHBondContact O-CB 3.49Å; L122-R125 PolarHBondContact O-N 2.83Å; L122-I126 HydrophobicContact CD2-CD1 4.21Å; L122-I126 HydrophobicContact CG-CD1 4.1Å; L122-I126 WeakPolarHBondContact O-CG1 3.47Å; L122-I126 PolarHBondContact O-N 2.84Å
123	L	67.5	Low	62	Low	119 Å²	119	126.7 Å²	126.7	62%	0.623	63%	0.625	S	S	*	*	H	α-helix	trans	-60	-44.3	-178.8	-146.5	75.9	0	0	0	111.9	L119 Q120 R125 I126 N127	L119-L123 WeakPolarHBondContact O-CB 3.29Å; L119-L123 PolarHBondContact O-N 2.9Å; Q120-L123 PolarHBondContact O-N 3.34Å; L123-R125 VanDerWaalsContact C-N 3.31Å; L123-R125 PolarHBondContact O-N 2.99Å; L123-I126 PolarHBondContact O-N 3.37Å; L123-N127 WeakPolarHBondContact O-CB 3.1Å; L123-N127 PolarHBondContact O-N 3.43Å
124	A	73.8	Confident	59.7	Low	57 Å²	57	132.8 Å²	132.8	47%	0.471	64%	0.643	S	S	.	*	H	α-helix	trans	-58.4	-42.7	173.3	0	0	0	0	0	111.7	Q120 L122 N127 T128	Q120-A124 VanDerWaalsContact O-CB 3.31Å; Q120-A124 WeakPolarHBondContact O-CB 3.2Å; Q120-A124 PolarHBondContact O-N 3.43Å; L122-A124 PolarHBondContact O-N 2.95Å; A124-N127 PolarHBondContact O-N 3Å; A124-T128 WeakPolarHBondContact O-CG2 3.33Å; A124-T128 PolarHBondContact O-N 2.83Å; A124-T128 PolarHBondContact O-OG1 2.92Å; A124-T128 VanDerWaalsContact O-OG1 3.06Å
125	R	63.7	Low	57.3	Low	150 Å²	150	131.3 Å²	131.3	57%	0.566	65%	0.648	S	S	*	*	H	α-helix	trans	-65	-46.3	179.8	-133.3	-174.4	-57.3	-173.4	4.5	111.8	L122 L123 N127 T128 Q129	L122-R125 WeakPolarHBondContact O-CA 3.43Å; L122-R125 WeakPolarHBondContact O-CB 3.49Å; L122-R125 PolarHBondContact O-N 2.83Å; L123-R125 VanDerWaalsContact C-N 3.31Å; L123-R125 PolarHBondContact O-N 2.99Å; R125-N127 VanDerWaalsContact C-N 3.29Å; R125-N127 PolarHBondContact O-N 3.04Å; R125-T128 WeakPolarHBondContact CA-OG1 3.4Å; R125-T128 PolarHBondContact O-N 3.35Å; R125-T128 PolarHBondContact O-OG1 3.12Å; R125-Q129 WeakPolarHBondContact O-CB 3.46Å; R125-Q129 PolarHBondContact O-N 2.91Å
126	I	59	Low	55.5	Low	91 Å²	91	128 Å²	128	47%	0.467	65%	0.65	S	S	.	*	H	α-helix	trans	-58.3	-43.9	176.1	-67.9	165.4	0	0	0	110.4	L122 L123 Q129	L122-I126 HydrophobicContact CD2-CD1 4.21Å; L122-I126 HydrophobicContact CG-CD1 4.1Å; L122-I126 WeakPolarHBondContact O-CG1 3.47Å; L122-I126 PolarHBondContact O-N 2.84Å; L123-I126 PolarHBondContact O-N 3.37Å; I126-Q129 PolarHBondContact O-N 3.49Å
127	N	51	Low	53.2	Low	108 Å²	108	125.1 Å²	125.1	58%	0.578	65%	0.653	S	S	*	*	H	α-helix	trans	-68.9	-42.7	-179.6	-157.8	41	0	0	0	112.2	L123 A124 R125 Q129 H130	L123-N127 WeakPolarHBondContact O-CB 3.1Å; L123-N127 PolarHBondContact O-N 3.43Å; A124-N127 PolarHBondContact O-N 3Å; R125-N127 VanDerWaalsContact C-N 3.29Å; R125-N127 PolarHBondContact O-N 3.04Å; N127-Q129 VanDerWaalsContact C-N 3.3Å; N127-Q129 PolarHBondContact O-N 3.31Å; N127-H130 PolarHBondContact O-N 3.42Å
128	T	55.4	Low	50.6	Low	91 Å²	91	126.3 Å²	126.3	56%	0.558	67%	0.669	S	S	*	*	H	α-helix	trans	-66.3	-30	175.7	49.2	0	0	0	0	113.4	A124 R125 H130	A124-T128 WeakPolarHBondContact O-CG2 3.33Å; A124-T128 PolarHBondContact O-N 2.83Å; A124-T128 PolarHBondContact O-OG1 2.92Å; A124-T128 VanDerWaalsContact O-OG1 3.06Å; R125-T128 WeakPolarHBondContact CA-OG1 3.4Å; R125-T128 PolarHBondContact O-N 3.35Å; R125-T128 PolarHBondContact O-OG1 3.12Å; T128-H130 PolarHBondContact O-N 2.92Å
129	Q	45.9	Very low	48.6	Very low	165 Å²	165	127.6 Å²	127.6	77%	0.771	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-1.8	-177.6	-163	168.1	-0	0	0	113.3	R125 I126 N127	R125-Q129 WeakPolarHBondContact O-CB 3.46Å; R125-Q129 PolarHBondContact O-N 2.91Å; I126-Q129 PolarHBondContact O-N 3.49Å; N127-Q129 VanDerWaalsContact C-N 3.3Å; N127-Q129 PolarHBondContact O-N 3.31Å
130	H	45.8	Very low	47	Very low	148 Å²	148	127.2 Å²	127.2	69%	0.685	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	-0.9	-176.8	-101.7	87	0	0	0	115.3	N127 T128	N127-H130 PolarHBondContact O-N 3.42Å; T128-H130 PolarHBondContact O-N 2.92Å
131	Q	38.1	Very low	44.9	Very low	142 Å²	142	124.8 Å²	124.8	66%	0.664	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-16.3	-167.1	-74.8	-172.5	-55.4	0	0	116.5
132	D	36.8	Very low	42.7	Very low	175 Å²	175	125.6 Å²	125.6	94%	0.936	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	15.4	-175.2	-74.2	-48.1	0	0	0	115.3
133	A	32.6	Very low	41.1	Very low	81 Å²	81	132.2 Å²	132.2	67%	0.669	72%	0.723	S	S	*	*	S	Bend	trans	-130.2	120.5	170.3	0	0	0	0	0	111.1
134	R	30.2	Very low	39.3	Very low	251 Å²	251	132 Å²	132	95%	0.947	73%	0.732	S	S	*	*			trans	-71.1	140.2	-176.3	-96.8	177.4	166.6	164.9	-5	112.3
135	P	29.5	Very low	37.4	Very low	112 Å²	112	135.2 Å²	135.2	73%	0.727	75%	0.746	S	S	*	*			trans	-84.4	178.7	179.8	38.5	-38.9	0	0	0	112
136	P	31.5	Very low	35.9	Very low	115 Å²	115	135 Å²	135	75%	0.747	76%	0.761	S	S	*	*				-142.6	138.7	98.7	35.9	-21.4	0	0	0	116.7
137	V	29.4	Very low	34.7	Very low	126 Å²	126	133.8 Å²	133.8	76%	0.764	77%	0.771	S	S	*	*			trans	50.5	106.7	138.7	-171.7	0	0	0	0	119.1
138	V	26.6	Very low	33.9	Very low	152 Å²	152	135.7 Å²	135.7	92%	0.921	79%	0.787	S	S	*	*			trans	-126.1	118.3	139.2	178.7	0	0	0	0	107.9
139	A	30.2	Very low	32.9	Very low	88 Å²	88	137.5 Å²	137.5	73%	0.727	80%	0.8	S	S	*	*			trans	-150.4	100.2	173.9	0	0	0	0	0	109.6
140	A	26.7	Very low	32.4	Very low	108 Å²	108	132.8 Å²	132.8	89%	0.893	80%	0.796	S	S	*	*			trans	-83	124	169.6	0	0	0	0	0	109
141	A	31.9	Very low	31.9	Very low	88 Å²	88	133 Å²	133	73%	0.727	81%	0.808	S	S	*	*			trans	-141.6	119.3	175.4	0	0	0	0	0	111.5
142	M	29.6	Very low	31.8	Very low	173 Å²	173	130.3 Å²	130.3	85%	0.852	81%	0.81	S	S	*	*			trans	60.6	114.6	150.8	-64.9	169.2	68.1	0	0	119.5
143	W	28.3	Very low	32	Very low	237 Å²	237	126.7 Å²	126.7	90%	0.898	80%	0.796	S	S	*	*			trans	-45.3	159.9	158.8	-52.3	-86.8	0	0	0	115.2
144	S	30.1	Very low	32.1	Very low	115 Å²	115	131.5 Å²	131.5	80%	0.804	80%	0.804	S	S	*	*			trans	71	148.1	166	76.3	0	0	0	0	117.3
145	T	33.3	Very low	32.5	Very low	124 Å²	124	124.4 Å²	124.4	76%	0.761	80%	0.799	S	S	*	*			cis	-160	148.8	-19	-94.8	0	0	0	0	108.9
146	T	32.7	Very low	32.7	Very low	145 Å²	145	124.7 Å²	124.7	89%	0.89	80%	0.804	S	S	*	*			trans	5.1	128.5	160.6	-50.2	0	0	0	0	119.7
147	G	33.4	Very low	33.3	Very low	65 Å²	65	124.6 Å²	124.6	67%	0.67	80%	0.803	S	S	*	*			trans	-166.4	-0.5	176.1	0	0	0	0	0	125.1
148	T	34.6	Very low	33.6	Very low	149 Å²	149	124.2 Å²	124.2	91%	0.914	81%	0.806	S	S	*	*			trans	60.6	163.9	170.2	34.5	0	0	0	0	120
149	P	33.7	Very low	34.3	Very low	128 Å²	128	120.2 Å²	120.2	83%	0.831	80%	0.796	S	S	*	*			trans	-117.5	166.2	-168.9	41.9	-32.1	0	0	0	116.3
150	G	34.5	Very low	34.6	Very low	66 Å²	66	122.2 Å²	122.2	68%	0.68	80%	0.799	S	S	*	*			trans	176	129.5	163.4	0	0	0	0	0	118.8
151	T	36.6	Very low	35.1	Very low	153 Å²	153	123.1 Å²	123.1	94%	0.939	79%	0.793	S	S	*	*			trans	77.6	149.6	148.6	-32.3	0	0	0	0	120.1
152	A	35.7	Very low	35.2	Very low	86 Å²	86	124.4 Å²	124.4	71%	0.711	79%	0.792	S	S	*	*			trans	-134.2	-154.6	179.9	0	0	0	0	0	108.6
153	P	41.4	Very low	35.5	Very low	99 Å²	99	120.8 Å²	120.8	64%	0.643	78%	0.784	S	S	*	*			cis	-137.5	-164.5	-14.7	33.3	-8.9	0	0	0	114.5
154	H	34.9	Very low	35.8	Very low	182 Å²	182	118.8 Å²	118.8	84%	0.843	78%	0.784	S	S	*	*			trans	73.3	123.3	156.5	-57.6	-36.1	0	0	0	122.1
155	A	38.4	Very low	35.9	Very low	101 Å²	101	122.1 Å²	122.1	84%	0.835	79%	0.787	S	S	*	*				179.2	156	109.9	0	0	0	0	0	113.1
156	S	32.4	Very low	36.1	Very low	118 Å²	118	121.8 Å²	121.8	83%	0.825	79%	0.787	S	S	*	*			trans	-131.3	-166	174.4	-50.5	0	0	0	0	108.3
157	P	44.8	Very low	35.9	Very low	113 Å²	113	125.4 Å²	125.4	73%	0.734	78%	0.784	S	S	*	*			cis	-146.8	-169.1	-1	43.3	-22.3	0	0	0	117.5
158	S	35.1	Very low	35.9	Very low	119 Å²	119	129 Å²	129	83%	0.832	79%	0.787	S	S	*	*			trans	90.1	140.7	139.3	-69.6	0	0	0	0	124.9
159	G	42.3	Very low	35.7	Very low	68 Å²	68	129.5 Å²	129.5	70%	0.701	78%	0.779	S	S	*	*			trans	141.8	85.6	173.3	0	0	0	0	0	111.7
160	T	36.6	Very low	35.6	Very low	130 Å²	130	130.5 Å²	130.5	80%	0.798	77%	0.773	S	S	*	*				60.8	127.6	65	-26.5	0	0	0	0	112
161	V	35.9	Very low	35.5	Very low	126 Å²	126	133.9 Å²	133.9	76%	0.764	78%	0.781	S	S	*	*			cis	-131.4	-162.2	18.4	-144.7	0	0	0	0	109
162	T	34.7	Very low	35.3	Very low	115 Å²	115	131.9 Å²	131.9	71%	0.706	77%	0.773	S	S	*	*			cis	-158.9	137.6	2.2	-80.8	0	0	0	0	104.1
163	S	37	Very low	35.3	Very low	98 Å²	98	136.2 Å²	136.2	69%	0.685	78%	0.783	S	S	*	*			cis	100.9	102.1	21.9	80.1	0	0	0	0	117.1
164	Q	34.6	Very low	34.8	Very low	194 Å²	194	136 Å²	136	91%	0.907	79%	0.789	S	S	*	*			trans	-143.5	132.7	151.7	-86.3	-166.8	-7.7	0	0	111.2
165	H	32	Very low	34.7	Very low	185 Å²	185	133.6 Å²	133.6	86%	0.856	79%	0.788	S	S	*	*			trans	-171	143.5	176.9	-112	65.2	0	0	0	108.1
166	P	36.6	Very low	34.4	Very low	117 Å²	117	134.5 Å²	134.5	76%	0.76	79%	0.785	S	S	*	*				-145.3	160.2	103.5	38.1	-21.5	0	0	0	113
167	R	28.3	Very low	34.4	Very low	221 Å²	221	133.6 Å²	133.6	83%	0.834	79%	0.785	S	S	*	*				63.7	132.3	56	-120.5	-170.8	179.2	-175.7	-0.4	112.3
168	L	32.9	Very low	34	Very low	140 Å²	140	134.8 Å²	134.8	73%	0.733	79%	0.79	S	S	*	*			cis	-124.5	-168.4	14	-67.9	146.3	0	0	0	109.8
169	Q	32.3	Very low	34.1	Very low	160 Å²	160	140.4 Å²	140.4	75%	0.748	79%	0.793	S	S	*	*			cis	-161.2	176.6	25.6	-167.9	156.9	-6.8	0	0	113.4
170	E	30.7	Very low	34.1	Very low	150 Å²	150	146.1 Å²	146.1	70%	0.701	80%	0.802	S	S	*	*			trans	-48.8	150.8	-175.3	-59.7	135.2	129.9	0	0	116
171	T	33.4	Very low	35.1	Very low	137 Å²	137	141.5 Å²	141.5	84%	0.84	78%	0.779	S	S	*	*				-170.8	152.6	72.3	-61.2	0	0	0	0	112.1
172	S	30.7	Very low	36.2	Very low	111 Å²	111	141.6 Å²	141.6	78%	0.776	78%	0.775	S	S	*	*			trans	-74.9	141.6	-176.8	-47.7	0	0	0	0	115.6
173	L	36.5	Very low	38.1	Very low	176 Å²	176	141 Å²	141	92%	0.921	76%	0.763	S	S	*	*			trans	-161.5	156.2	148.6	-108.1	154	0	0	0	111.4
174	A	30.6	Very low	39.9	Very low	94 Å²	94	137.9 Å²	137.9	78%	0.777	74%	0.739	S	S	*	*			trans	-62.2	148.4	-159.3	0	0	0	0	0	117.2
175	T	32.2	Very low	42.2	Very low	132 Å²	132	128.7 Å²	128.7	81%	0.81	70%	0.696	S	S	*	*			trans	-147.7	136.7	161.3	-63.1	0	0	0	0	107.9
176	P	33.6	Very low	44.6	Very low	120 Å²	120	122.8 Å²	122.8	78%	0.779	67%	0.674	S	S	*	*			trans	-80.7	162.7	-162.2	31.3	-36.9	0	0	0	115	T178	P176-T178 PolarHBondContact O-N 3.43Å
177	A	31.8	Very low	46.9	Very low	99 Å²	99	119.3 Å²	119.3	82%	0.818	66%	0.656	S	S	*	*			trans	-58.9	131.1	-177.7	0	0	0	0	0	113.3	R179	A177-R179 PolarHBondContact O-N 3.39Å
178	T	37	Very low	49.5	Very low	138 Å²	138	114.9 Å²	114.9	85%	0.847	65%	0.648	S	S	*	*			trans	-63.7	104.9	174.4	-44	0	0	0	0	110.2	P176 Q180	P176-T178 PolarHBondContact O-N 3.43Å; T178-Q180 PolarHBondContact O-N 3.24Å; T178-Q180 VanDerWaalsContact O-N 3.16Å
179	R	36.7	Very low	52	Low	237 Å²	237	109.5 Å²	109.5	89%	0.894	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-56.4	119.9	168.1	-96.7	-177.2	170.3	175.6	-2.7	108.7	A177 G181	A177-R179 PolarHBondContact O-N 3.39Å; R179-G181 PolarHBondContact O-N 2.9Å
180	Q	42.1	Very low	54.7	Low	189 Å²	189	107.8 Å²	107.8	88%	0.883	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-62.1	122.6	171.8	-69.7	179.2	-18.8	0	0	109	T178	T178-Q180 PolarHBondContact O-N 3.24Å; T178-Q180 VanDerWaalsContact O-N 3.16Å
181	G	56.4	Low	57.5	Low	32 Å²	32	100.9 Å²	100.9	33%	0.33	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-65.2	133.4	173.1	0	0	0	0	0	110.1	R179 Q183	R179-G181 PolarHBondContact O-N 2.9Å; G181-Q183 PolarHBondContact O-N 3.2Å
182	I	60.5	Low	60.1	Low	129 Å²	129	97.3 Å²	97.3	66%	0.662	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-66	133.6	171.7	-58.6	174.4	0	0	0	107.9	L184 S365	I182-L184 VanDerWaalsContact O-CD1 3.26Å; I182-L184 WeakPolarHBondContact O-CD1 3.42Å; I182-L184 PolarHBondContact O-N 3.03Å; I182-S365 WeakPolarHBondContact O-CB 3.44Å; I182-S365 PolarHBondContact O-N 2.9Å
183	Q	73.2	Confident	62.9	Low	101 Å²	101	92.1 Å²	92.1	47%	0.472	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	120.4	173.2	-173.4	171.8	41.6	0	0	109.8	G181 P362 M364	G181-Q183 PolarHBondContact O-N 3.2Å; Q183-P362 VanDerWaalsContact NE2-CB 3.32Å; Q183-M364 HydrophobicContact CB-SD 3.67Å; Q183-M364 HydrophobicContact CG-CE 4.35Å; Q183-M364 HydrophobicContact CG-SD 3.8Å
184	L	76.4	Confident	65.5	Low	33 Å²	33	87.9 Å²	87.9	17%	0.173	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-36.3	179.6	-89	68	0	0	0	112.1	I182 W217 W243 M246 L248 V363	I182-L184 VanDerWaalsContact O-CD1 3.26Å; I182-L184 WeakPolarHBondContact O-CD1 3.42Å; I182-L184 PolarHBondContact O-N 3.03Å; L184-W217 PolarHBondContact O-NE1 2.86Å; L184-W243 HydrophobicContact CD2-CE3 4.41Å; L184-W243 HydrophobicContact CD2-CZ3 4.26Å; L184-M246 HydrophobicContact CD2-CE 3.73Å; L184-L248 HydrophobicContact CD2-CD1 3.71Å; L184-L248 HydrophobicContact CD2-CD2 4.22Å; L184-V363 PolarHBondContact N-O 2.92Å
185	I	82.1	Confident	68.3	Low	1 Å²	1	83.4 Å²	83.4	1%	0.005	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	125.5	176.9	-50.3	-172.4	0	0	0	108.7	T189 W217 M241 F359 P362 V363	I185-T189 HydrophobicContact CG2-CG2 4.39Å; I185-W217 HydrophobicContact CD1-CD2 4.48Å; I185-W217 HydrophobicContact CD1-CG 4.4Å; I185-W217 HydrophobicContact CG1-CD2 4.47Å; I185-W217 HydrophobicContact CG1-CZ2 4.32Å; I185-W217 HydrophobicContact CG2-CH2 4.5Å; I185-W217 HydrophobicContact CG2-CZ2 4.21Å; I185-M241 HydrophobicContact CD1-CE 3.84Å; I185-M241 HydrophobicContact CD1-SD 4.14Å; I185-F359 HydrophobicContact CD1-CD1 4Å; I185-F359 HydrophobicContact CD1-CD2 4.43Å; I185-F359 HydrophobicContact CD1-CE1 3.57Å; I185-F359 HydrophobicContact CD1-CE2 4.05Å; I185-F359 HydrophobicContact CD1-CG 4.42Å; I185-F359 HydrophobicContact CD1-CZ 3.59Å; I185-F359 HydrophobicContact CG2-CB 4.21Å; I185-F359 HydrophobicContact CG2-CD1 4.35Å; I185-F359 HydrophobicContact CG2-CD2 3.99Å; I185-F359 HydrophobicContact CG2-CE2 4.49Å; I185-F359 HydrophobicContact CG2-CG 3.91Å; I185-P362 CarbonylContact O-C 3.56Å; I185-P362 WeakPolarHBondContact O-CA 3.48Å; I185-V363 HydrophobicContact CB-CB 4Å; I185-V363 HydrophobicContact CB-CG2 4.07Å; I185-V363 HydrophobicContact CD1-CB 4.49Å; I185-V363 HydrophobicContact CD1-CG2 4.22Å; I185-V363 HydrophobicContact CG1-CB 4.15Å; I185-V363 HydrophobicContact CG1-CG2 4.31Å; I185-V363 PolarHBondContact N-O 3.28Å; I185-V363 PolarHBondContact O-N 2.98Å
186	P	82.8	Confident	70.9	Confident	61 Å²	61	79.4 Å²	79.4	40%	0.396	43%	0.428	S	S	.	.			trans	-65.7	147.1	170.9	-19.5	32.5	0	0	0	112.3	T189	P186-T189 WeakPolarHBondContact O-CB 3.41Å; P186-T189 PolarHBondContact O-N 2.81Å; P186-T189 PolarHBondContact O-OG1 3.06Å
187	A	84	Confident	73.3	Confident	45 Å²	45	75.6 Å²	75.6	37%	0.372	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	149.6	171	0	0	0	0	0	111.4	T189 P362	A187-T189 PolarHBondContact O-N 3.01Å; A187-P362 HydrophobicContact CB-CB 4.16Å; A187-P362 HydrophobicContact CB-CG 4.38Å
188	L	83.8	Confident	75.8	Confident	127 Å²	127	78 Å²	78	67%	0.665	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	16.6	-178.2	-52.5	176.1	0	0	0	115.4	L358 F359	L188-L358 HydrophobicContact CB-CD1 4.47Å; L188-L358 WeakPolarHBondContact O-CD1 3.31Å; L188-F359 WeakPolarHBondContact CA-O 3.44Å; L188-F359 PolarHBondContact N-O 2.88Å
189	T	86	Confident	77.8	Confident	27 Å²	27	71.6 Å²	71.6	17%	0.166	36%	0.357	C	S	.	.			trans	-71.8	130	173.4	-57.8	0	0	0	0	110.7	I185 P186 A187 V191 W217 L358 F359	I185-T189 HydrophobicContact CG2-CG2 4.39Å; P186-T189 WeakPolarHBondContact O-CB 3.41Å; P186-T189 PolarHBondContact O-N 2.81Å; P186-T189 PolarHBondContact O-OG1 3.06Å; A187-T189 PolarHBondContact O-N 3.01Å; T189-V191 HydrophobicContact CG2-CG2 3.93Å; T189-W217 HydrophobicContact CG2-CH2 3.7Å; T189-W217 HydrophobicContact CG2-CZ3 3.74Å; T189-L358 WeakPolarHBondContact O-CA 3.45Å; T189-F359 PolarHBondContact O-N 3.02Å
190	R	88	Confident	79.9	Confident	124 Å²	124	62.6 Å²	62.6	47%	0.468	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.4	168.6	-68.5	-178.3	65.7	177.6	-3.1	110.6	S356 I357 L358	R190-S356 PolarHBondContact NH2-OG 3.28Å; R190-I357 CarbonylContact C-O 3.5Å; R190-I357 VanDerWaalsContact CA-O 3.32Å; R190-I357 WeakPolarHBondContact CA-O 3.34Å; R190-L358 HydrophobicContact CG-CB 4.23Å; R190-L358 HydrophobicContact CG-CD1 3.75Å
191	V	89.4	Confident	81.6	Confident	5 Å²	5	54.6 Å²	54.6	3%	0.03	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	129.5	-178.1	-175.6	0	0	0	0	109.5	T189 V212 W217 I357 F359	T189-V191 HydrophobicContact CG2-CG2 3.93Å; V191-V212 HydrophobicContact CG1-CB 4.44Å; V191-V212 HydrophobicContact CG1-CG1 3.58Å; V191-V212 HydrophobicContact CG1-CG2 3.92Å; V191-W217 HydrophobicContact CG1-CE3 4.26Å; V191-W217 HydrophobicContact CG2-CE3 3.58Å; V191-W217 HydrophobicContact CG2-CZ3 3.65Å; V191-I357 PolarHBondContact N-O 3.06Å; V191-I357 PolarHBondContact O-N 2.93Å; V191-F359 HydrophobicContact CB-CE2 4.22Å; V191-F359 HydrophobicContact CG2-CD2 4.1Å; V191-F359 HydrophobicContact CG2-CE2 3.7Å
192	P	88.7	Confident	82.5	Confident	63 Å²	63	56.9 Å²	56.9	41%	0.409	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	136.9	175.2	30.2	-34.1	0	0	0	110.7
193	A	89.5	Confident	83.1	Confident	2 Å²	2	55.2 Å²	55.2	2%	0.017	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	167.2	178.2	0	0	0	0	0	110.3	S211 V212 V355 I357	A193-S211 VanDerWaalsContact CA-O 3.29Å; A193-S211 WeakPolarHBondContact CA-O 3.49Å; A193-S211 WeakPolarHBondContact CB-O 3.43Å; A193-V212 HydrophobicContact CB-CG2 4.24Å; A193-V355 HydrophobicContact CB-CG2 4.3Å; A193-V355 PolarHBondContact N-O 3.16Å; A193-V355 PolarHBondContact O-N 2.85Å; A193-V355 VanDerWaalsContact O-O 3.11Å; A193-I357 HydrophobicContact CB-CD1 3.43Å; A193-I357 VanDerWaalsContact CB-CD1 3.43Å; A193-I357 HydrophobicContact CB-CG1 3.86Å
194	Y	90.2	Very high	82.6	Confident	87 Å²	87	55.1 Å²	55.1	34%	0.341	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	148.6	167.3	56.9	-86.9	0	0	0	109.9	D196 A210 S211 P213 E353	Y194-D196 WeakPolarHBondContact CE2-OD1 3.48Å; Y194-A210 CarbonylContact O-C 3.6Å; Y194-A210 VanDerWaalsContact O-CA 3.24Å; Y194-A210 WeakPolarHBondContact O-CA 3.49Å; Y194-A210 WeakPolarHBondContact O-CB 3.35Å; Y194-S211 WeakPolarHBondContact CD1-O 3.43Å; Y194-S211 WeakPolarHBondContact CE2-OG 3.43Å; Y194-S211 PolarHBondContact N-O 3.21Å; Y194-S211 PolarHBondContact O-N 3.17Å; Y194-S211 PolarHBondContact OH-OG 2.96Å; Y194-P213 HydrophobicContact CD1-CB 4.3Å; Y194-P213 HydrophobicContact CD1-CG 3.99Å; Y194-P213 HydrophobicContact CE1-CB 3.9Å; Y194-P213 HydrophobicContact CE1-CG 4.07Å; Y194-E353 WeakPolarHBondContact CA-O 3.48Å
195	I	89.4	Confident	82.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	120.4	179.3	-67.6	177.1	0	0	0	109.6	T197 V199 V208 A210 I236 V264 V349 G352 E353 V355	I195-T197 WeakPolarHBondContact CG2-O 3.41Å; I195-V199 HydrophobicContact CG2-CG2 4.33Å; I195-V208 HydrophobicContact CG2-CG1 3.8Å; I195-A210 HydrophobicContact CG1-CB 4.22Å; I195-I236 HydrophobicContact CD1-CD1 3.93Å; I195-V264 HydrophobicContact CD1-CG1 4.01Å; I195-V349 HydrophobicContact CB-CG1 4.47Å; I195-V349 HydrophobicContact CD1-CG1 3.66Å; I195-V349 HydrophobicContact CG2-CG1 4.21Å; I195-G352 PolarHBondContact O-N 2.82Å; I195-E353 PolarHBondContact N-O 3.04Å; I195-V355 HydrophobicContact CD1-CG1 3.79Å; I195-V355 HydrophobicContact CD1-CG2 4.2Å; I195-V355 HydrophobicContact CG1-CG1 4.27Å; I195-V355 HydrophobicContact CG1-CG2 3.93Å
196	D	86.6	Confident	82	Confident	48 Å²	48	58 Å²	58	26%	0.257	32%	0.324	S	S	.	.			trans	-80.6	-20.6	-176.1	-79.8	-69.5	0	0	0	113.6	Y194 V209 S211 R351	Y194-D196 WeakPolarHBondContact CE2-OD1 3.48Å; D196-V209 HydrophobicContact CB-CB 4.1Å; D196-V209 HydrophobicContact CB-CG1 4.06Å; D196-V209 PolarHBondContact N-O 2.89Å; D196-S211 VanDerWaalsContact OD2-CB 3.31Å; D196-S211 WeakPolarHBondContact OD2-CB 3.28Å; D196-S211 PolarHBondContact OD2-N 3.44Å; D196-S211 PolarHBondContact OD2-OG 2.87Å; D196-R351 WeakPolarHBondContact O-CD 3.09Å; D196-R351 WeakPolarHBondContact O-CG 3.49Å; D196-R351 PolarHBondContact O-NE 3.34Å; D196-R351 VanDerWaalsContact O-NE 3.11Å
197	T	85.8	Confident	82.2	Confident	39 Å²	39	62.8 Å²	62.8	24%	0.239	33%	0.334	C	S	.	.	S	Bend	trans	-118.6	131.4	-172.5	48.6	0	0	0	0	111.6	I195 V199 V208 V209	I195-T197 WeakPolarHBondContact CG2-O 3.41Å; T197-V199 WeakPolarHBondContact O-CG2 3.33Å; T197-V208 WeakPolarHBondContact OG1-CA 3.4Å; T197-V209 HydrophobicContact CG2-CB 3.89Å; T197-V209 HydrophobicContact CG2-CG2 3.94Å; T197-V209 PolarHBondContact OG1-N 3.05Å; T197-V209 PolarHBondContact OG1-O 3.38Å
198	E	83.5	Confident	82.4	Confident	150 Å²	150	60.6 Å²	60.6	70%	0.701	32%	0.317	S	S	*	.			trans	-62.7	138.1	168.5	-57.3	-166.7	131.8	0	0	110.8	V349 R351	E198-V349 WeakPolarHBondContact CA-O 3.47Å; E198-R351 HydrophobicContact CG-CB 3.77Å
199	V	79.7	Confident	82.8	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.018	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	131.2	-179.2	-154.7	0	0	0	0	108.4	I195 T197 V208 A227 M234 T348 V349	I195-V199 HydrophobicContact CG2-CG2 4.33Å; T197-V199 WeakPolarHBondContact O-CG2 3.33Å; V199-V208 HydrophobicContact CG1-CG2 3.88Å; V199-V208 HydrophobicContact CG2-CG1 4.06Å; V199-V208 HydrophobicContact CG2-CG2 3.74Å; V199-A227 HydrophobicContact CG1-CB 3.89Å; V199-M234 HydrophobicContact CB-SD 4.13Å; V199-M234 HydrophobicContact CG1-CE 4.15Å; V199-M234 HydrophobicContact CG1-SD 3.57Å; V199-M234 VanDerWaalsContact CG1-SD 3.57Å; V199-T348 CarbonylContact O-C 3.59Å; V199-T348 VanDerWaalsContact O-CA 3.28Å; V199-T348 WeakPolarHBondContact O-CA 3.42Å; V199-V349 HydrophobicContact CB-CB 3.87Å; V199-V349 HydrophobicContact CB-CG2 4.31Å; V199-V349 HydrophobicContact CG2-CB 3.87Å; V199-V349 HydrophobicContact CG2-CG1 4.08Å; V199-V349 PolarHBondContact N-O 2.96Å; V199-V349 PolarHBondContact O-N 2.65Å
200	D	79.6	Confident	83	Confident	49 Å²	49	55.1 Å²	55.1	26%	0.262	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132.9	176.5	-171.3	-20.5	0	0	0	109.1	D202 N203 S206 Q346 T348	D200-D202 PolarHBondContact O-N 3.42Å; D200-D202 PolarHBondContact OD1-N 2.85Å; D200-N203 PolarHBondContact O-N 2.86Å; D200-S206 PolarHBondContact O-OG 2.95Å; D200-Q346 VanDerWaalsContact CG-NE2 3.32Å; D200-Q346 WeakPolarHBondContact OD1-CG 3.41Å; D200-Q346 PolarHBondContact OD1-NE2 3.23Å; D200-Q346 VanDerWaalsContact OD1-NE2 3.14Å; D200-Q346 PolarHBondContact OD2-NE2 3.43Å; D200-T348 HydrophobicContact CB-CG2 4.44Å
201	S	78.6	Confident	83.2	Confident	21 Å²	21	49.8 Å²	49.8	15%	0.147	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-21.9	176.4	60	0	0	0	0	114.4	N203 Q346 V347	S201-N203 VanDerWaalsContact C-N 3.31Å; S201-Q346 WeakPolarHBondContact OG-CA 3.31Å; S201-V347 PolarHBondContact N-O 3.21Å; S201-V347 PolarHBondContact OG-N 3.09Å; S201-V347 PolarHBondContact OG-O 2.88Å
202	D	74.8	Confident	83.2	Confident	80 Å²	80	49.8 Å²	49.8	43%	0.428	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-26.5	177.4	-78.8	-2.1	0	0	0	112.9	D200 A204 R271	D200-D202 PolarHBondContact O-N 3.42Å; D200-D202 PolarHBondContact OD1-N 2.85Å; D202-A204 PolarHBondContact O-N 3.41Å; D202-R271 IonicContact OD1-CZ 2.96Å; D202-R271 IonicContact OD1-NH2 2.68Å; D202-R271 PolarHBondContact OD1-NH2 3.31Å; D202-R271 IonicContact OD2-CZ 2.66Å; D202-R271 IonicContact OD2-NH2 3.92Å; D202-R271 PolarHBondContact OD2-NH2 3Å
203	N	73.8	Confident	83.1	Confident	93 Å²	93	50.5 Å²	50.5	50%	0.497	28%	0.275	S	S	.	.	S	Bend	trans	-86.5	103.3	-176.1	173.1	47.4	0	0	0	110.3	D200 S201 V205 S206	D200-N203 PolarHBondContact O-N 2.86Å; S201-N203 VanDerWaalsContact C-N 3.31Å; N203-V205 PolarHBondContact ND2-O 2.97Å; N203-V205 PolarHBondContact O-N 3.01Å; N203-S206 WeakPolarHBondContact CB-OG 3.34Å; N203-S206 VanDerWaalsContact ND2-CA 3.35Å; N203-S206 WeakPolarHBondContact ND2-CA 3.43Å; N203-S206 PolarHBondContact ND2-N 2.91Å; N203-S206 PolarHBondContact ND2-OG 2.76Å; N203-S206 PolarHBondContact O-N 3.23Å; N203-S206 VanDerWaalsContact O-N 3.12Å; N203-S206 PolarHBondContact O-OG 2.68Å
204	A	63	Low	82.7	Confident	100 Å²	100	53 Å²	53	83%	0.826	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-12.9	-169.8	0	0	0	0	0	116.6	D202	D202-A204 PolarHBondContact O-N 3.41Å
205	V	68.6	Low	82.3	Confident	88 Å²	88	51.3 Å²	51.3	53%	0.533	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.1	68.1	168.9	-169.5	0	0	0	0	109.3	N203 R207	N203-V205 PolarHBondContact ND2-O 2.97Å; N203-V205 PolarHBondContact O-N 3.01Å; V205-R207 PolarHBondContact O-N 2.91Å
206	S	76.8	Confident	82	Confident	5 Å²	5	55.6 Å²	55.6	4%	0.035	33%	0.332	C	S	.	.			trans	-70.9	116.9	171.8	-82.4	0	0	0	0	111	D200 N203 A227	D200-S206 PolarHBondContact O-OG 2.95Å; N203-S206 WeakPolarHBondContact CB-OG 3.34Å; N203-S206 VanDerWaalsContact ND2-CA 3.35Å; N203-S206 WeakPolarHBondContact ND2-CA 3.43Å; N203-S206 PolarHBondContact ND2-N 2.91Å; N203-S206 PolarHBondContact ND2-OG 2.76Å; N203-S206 PolarHBondContact O-N 3.23Å; N203-S206 VanDerWaalsContact O-N 3.12Å; N203-S206 PolarHBondContact O-OG 2.68Å; S206-A227 PolarHBondContact O-N 3.33Å
207	R	86.7	Confident	81.9	Confident	162 Å²	162	55.3 Å²	55.3	61%	0.611	33%	0.327	S	S	*	.			trans	-96	125.9	179.4	-60.5	172.7	-175.5	-178.5	1.8	109	V205 Y223 S224	V205-R207 PolarHBondContact O-N 2.91Å; R207-Y223 HydrophobicContact CB-CE2 4.37Å; R207-S224 WeakPolarHBondContact CA-O 3.21Å
208	V	87.8	Confident	81.8	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.8	-175.5	-166.5	0	0	0	0	110.4	I195 T197 V199 Y223 S224 A227 I236 F238	I195-V208 HydrophobicContact CG2-CG1 3.8Å; T197-V208 WeakPolarHBondContact OG1-CA 3.4Å; V199-V208 HydrophobicContact CG1-CG2 3.88Å; V199-V208 HydrophobicContact CG2-CG1 4.06Å; V199-V208 HydrophobicContact CG2-CG2 3.74Å; V208-Y223 WeakPolarHBondContact O-CA 3.46Å; V208-S224 PolarHBondContact N-O 3.11Å; V208-S224 VanDerWaalsContact N-O 3.07Å; V208-S224 PolarHBondContact O-N 3.09Å; V208-A227 HydrophobicContact CG2-CB 3.66Å; V208-I236 HydrophobicContact CB-CG2 3.96Å; V208-I236 HydrophobicContact CG1-CG2 4.09Å; V208-I236 HydrophobicContact CG2-CD1 4.46Å; V208-I236 HydrophobicContact CG2-CG2 3.87Å; V208-F238 HydrophobicContact CB-CE1 4.42Å; V208-F238 HydrophobicContact CG1-CE1 4.26Å; V208-F238 HydrophobicContact CG1-CZ 4.48Å
209	V	91.8	Very high	82	Confident	39 Å²	39	51.3 Å²	51.3	24%	0.236	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	136.3	164.4	-178	0	0	0	0	107.9	D196 T197 V221 L222 Y223	D196-V209 HydrophobicContact CB-CB 4.1Å; D196-V209 HydrophobicContact CB-CG1 4.06Å; D196-V209 PolarHBondContact N-O 2.89Å; T197-V209 HydrophobicContact CG2-CB 3.89Å; T197-V209 HydrophobicContact CG2-CG2 3.94Å; T197-V209 PolarHBondContact OG1-N 3.05Å; T197-V209 PolarHBondContact OG1-O 3.38Å; V209-V221 HydrophobicContact CG1-CG1 3.56Å; V209-L222 WeakPolarHBondContact CA-O 3.44Å; V209-Y223 HydrophobicContact CG2-CD2 4.1Å
210	A	90.9	Very high	82.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	145.9	170.6	0	0	0	0	0	109.8	Y194 I195 V221 L222 F238 I357	Y194-A210 CarbonylContact O-C 3.6Å; Y194-A210 VanDerWaalsContact O-CA 3.24Å; Y194-A210 WeakPolarHBondContact O-CA 3.49Å; Y194-A210 WeakPolarHBondContact O-CB 3.35Å; I195-A210 HydrophobicContact CG1-CB 4.22Å; A210-V221 CarbonylContact O-C 3.58Å; A210-L222 PolarHBondContact N-O 2.84Å; A210-L222 PolarHBondContact O-N 3.49Å; A210-F238 HydrophobicContact CB-CE1 3.85Å; A210-F238 HydrophobicContact CB-CZ 3.63Å; A210-I357 HydrophobicContact CB-CD1 4.1Å
211	S	91.7	Very high	83	Confident	11 Å²	11	51 Å²	51	8%	0.077	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.3	-179.7	53.8	0	0	0	0	113.3	A193 Y194 D196 P213 A220	A193-S211 VanDerWaalsContact CA-O 3.29Å; A193-S211 WeakPolarHBondContact CA-O 3.49Å; A193-S211 WeakPolarHBondContact CB-O 3.43Å; Y194-S211 WeakPolarHBondContact CD1-O 3.43Å; Y194-S211 WeakPolarHBondContact CE2-OG 3.43Å; Y194-S211 PolarHBondContact N-O 3.21Å; Y194-S211 PolarHBondContact O-N 3.17Å; Y194-S211 PolarHBondContact OH-OG 2.96Å; D196-S211 VanDerWaalsContact OD2-CB 3.31Å; D196-S211 WeakPolarHBondContact OD2-CB 3.28Å; D196-S211 PolarHBondContact OD2-N 3.44Å; D196-S211 PolarHBondContact OD2-OG 2.87Å; S211-P213 WeakPolarHBondContact O-CD 3.49Å; S211-A220 WeakPolarHBondContact CA-O 3.47Å
212	V	91	Very high	83.7	Confident	5 Å²	5	50 Å²	50	3%	0.03	32%	0.323	C	S	.	.			trans	-95.4	109.4	-172.9	176.6	0	0	0	0	109.4	V191 A193 A214 A218 G219 A220 L222	V191-V212 HydrophobicContact CG1-CB 4.44Å; V191-V212 HydrophobicContact CG1-CG1 3.58Å; V191-V212 HydrophobicContact CG1-CG2 3.92Å; A193-V212 HydrophobicContact CB-CG2 4.24Å; V212-A214 VanDerWaalsContact CG1-O 3.27Å; V212-A214 WeakPolarHBondContact CG1-O 3.37Å; V212-A218 WeakPolarHBondContact O-CA 3.49Å; V212-G219 PolarHBondContact O-N 3.36Å; V212-A220 HydrophobicContact CB-CB 4.22Å; V212-A220 HydrophobicContact CG2-CB 4.08Å; V212-A220 PolarHBondContact N-O 3.37Å; V212-L222 HydrophobicContact CG2-CD1 4.09Å
213	P	86.7	Confident	84.5	Confident	79 Å²	79	49.1 Å²	49.1	51%	0.513	31%	0.314	S	S	.	.			trans	-74.3	-29.9	-178.2	26	-31.8	0	0	0	113.6	Y194 S211	Y194-P213 HydrophobicContact CD1-CB 4.3Å; Y194-P213 HydrophobicContact CD1-CG 3.99Å; Y194-P213 HydrophobicContact CE1-CB 3.9Å; Y194-P213 HydrophobicContact CE1-CG 4.07Å; S211-P213 WeakPolarHBondContact O-CD 3.49Å
214	A	80	Confident	85.1	Confident	53 Å²	53	44.7 Å²	44.7	44%	0.438	29%	0.29	S	S	.	.	S	Bend	trans	-147.5	165.2	-164.3	0	0	0	0	0	112.9	V212	V212-A214 VanDerWaalsContact CG1-O 3.27Å; V212-A214 WeakPolarHBondContact CG1-O 3.37Å
215	G	82.5	Confident	86.1	Confident	52 Å²	52	44.4 Å²	44.4	54%	0.536	27%	0.271	S	S	.	.	S	Bend	trans	89.5	-175.9	-175.4	0	0	0	0	0	113.3	W217 A218	G215-W217 PolarHBondContact O-N 3.34Å; G215-W217 VanDerWaalsContact O-N 3.15Å; G215-A218 WeakPolarHBondContact O-CB 3.42Å; G215-A218 PolarHBondContact O-N 2.96Å; G215-A218 VanDerWaalsContact O-N 3.09Å
216	P	82.1	Confident	86.5	Confident	90 Å²	90	43.3 Å²	43.3	58%	0.584	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-18	-172.8	24.9	-32.3	0	0	0	113.9	W243	P216-W243 WeakPolarHBondContact O-CZ2 3.25Å
217	W	84.3	Confident	86.7	Confident	42 Å²	42	43.4 Å²	43.4	16%	0.159	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	22.5	176.2	-47.3	-75.4	0	0	0	113.2	L184 I185 T189 V191 G215 G219 A220	L184-W217 PolarHBondContact O-NE1 2.86Å; I185-W217 HydrophobicContact CD1-CD2 4.48Å; I185-W217 HydrophobicContact CD1-CG 4.4Å; I185-W217 HydrophobicContact CG1-CD2 4.47Å; I185-W217 HydrophobicContact CG1-CZ2 4.32Å; I185-W217 HydrophobicContact CG2-CH2 4.5Å; I185-W217 HydrophobicContact CG2-CZ2 4.21Å; T189-W217 HydrophobicContact CG2-CH2 3.7Å; T189-W217 HydrophobicContact CG2-CZ3 3.74Å; V191-W217 HydrophobicContact CG1-CE3 4.26Å; V191-W217 HydrophobicContact CG2-CE3 3.58Å; V191-W217 HydrophobicContact CG2-CZ3 3.65Å; G215-W217 PolarHBondContact O-N 3.34Å; G215-W217 VanDerWaalsContact O-N 3.15Å; W217-G219 PolarHBondContact O-N 3.38Å; W217-A220 HydrophobicContact CB-CB 4.35Å; W217-A220 WeakPolarHBondContact O-CB 3.44Å; W217-A220 PolarHBondContact O-N 3Å
218	A	84.7	Confident	86.3	Confident	49 Å²	49	43.4 Å²	43.4	41%	0.405	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	137.6	173.3	0	0	0	0	0	111.6	V212 G215 A220 W243	V212-A218 WeakPolarHBondContact O-CA 3.49Å; G215-A218 WeakPolarHBondContact O-CB 3.42Å; G215-A218 PolarHBondContact O-N 2.96Å; G215-A218 VanDerWaalsContact O-N 3.09Å; A218-A220 VanDerWaalsContact C-N 3.31Å; A218-W243 PolarHBondContact O-NE1 3.01Å
219	G	86.2	Confident	85.8	Confident	56 Å²	56	46.8 Å²	46.8	58%	0.577	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	11.9	-172.8	0	0	0	0	0	114.9	V212 W217	V212-G219 PolarHBondContact O-N 3.36Å; W217-G219 PolarHBondContact O-N 3.38Å
220	A	90.1	Very high	84.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	28%	0.282	C	S	.	.			trans	-74.2	133.6	164.7	0	0	0	0	0	110	S211 V212 W217 A218 M241 W243	S211-A220 WeakPolarHBondContact CA-O 3.47Å; V212-A220 HydrophobicContact CB-CB 4.22Å; V212-A220 HydrophobicContact CG2-CB 4.08Å; V212-A220 PolarHBondContact N-O 3.37Å; W217-A220 HydrophobicContact CB-CB 4.35Å; W217-A220 WeakPolarHBondContact O-CB 3.44Å; W217-A220 PolarHBondContact O-N 3Å; A218-A220 VanDerWaalsContact C-N 3.31Å; A220-M241 HydrophobicContact CB-CG 4.17Å; A220-M241 HydrophobicContact CB-SD 3.86Å; A220-W243 HydrophobicContact CB-CB 4.17Å; A220-W243 HydrophobicContact CB-CG 4.16Å
221	V	91.4	Very high	83.9	Confident	47 Å²	47	49.2 Å²	49.2	29%	0.285	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115	175.8	-177	0	0	0	0	107.8	V209 A210 M241 M242	V209-V221 HydrophobicContact CG1-CG1 3.56Å; A210-V221 CarbonylContact O-C 3.58Å; V221-M241 CarbonylContact O-C 3.58Å; V221-M241 WeakPolarHBondContact O-CA 3.36Å; V221-M242 HydrophobicContact CB-CE 4.44Å; V221-M242 HydrophobicContact CG2-CE 4.37Å; V221-M242 PolarHBondContact N-O 3.07Å; V221-M242 PolarHBondContact O-N 2.94Å
222	L	92.1	Very high	82.8	Confident	0 Å²	0	55 Å²	55	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	148.9	175.5	-69.7	89.5	0	0	0	110.6	V209 A210 V212 F238 R240 M241 V250 A252 I357 F359	V209-L222 WeakPolarHBondContact CA-O 3.44Å; A210-L222 PolarHBondContact N-O 2.84Å; A210-L222 PolarHBondContact O-N 3.49Å; V212-L222 HydrophobicContact CG2-CD1 4.09Å; L222-F238 HydrophobicContact CB-CB 4.19Å; L222-F238 HydrophobicContact CB-CD1 3.65Å; L222-F238 HydrophobicContact CB-CE1 4.13Å; L222-F238 HydrophobicContact CB-CG 3.89Å; L222-F238 HydrophobicContact CD2-CB 3.87Å; L222-F238 HydrophobicContact CD2-CD2 4.21Å; L222-F238 HydrophobicContact CD2-CG 4Å; L222-R240 WeakPolarHBondContact CA-O 3.43Å; L222-M241 HydrophobicContact CD1-CG 4.13Å; L222-M241 HydrophobicContact CD1-SD 4.21Å; L222-M241 HydrophobicContact CG-CB 4.07Å; L222-M241 HydrophobicContact CG-CG 3.9Å; L222-M241 HydrophobicContact CG-SD 4.33Å; L222-V250 HydrophobicContact CD2-CG2 4.38Å; L222-A252 HydrophobicContact CD2-CB 4.32Å; L222-I357 HydrophobicContact CD1-CD1 3.84Å; L222-I357 HydrophobicContact CD2-CD1 4.11Å; L222-I357 HydrophobicContact CD2-CG2 3.84Å; L222-I357 HydrophobicContact CG-CD1 4.36Å; L222-F359 HydrophobicContact CD2-CE1 4.13Å; L222-F359 HydrophobicContact CD2-CZ 3.97Å
223	Y	91.8	Very high	82.3	Confident	61 Å²	61	54.8 Å²	54.8	24%	0.239	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	140.9	-177.4	178.7	-104.8	0	0	0	110.5	R207 V208 V209 Q225 F238 D239 R240	R207-Y223 HydrophobicContact CB-CE2 4.37Å; V208-Y223 WeakPolarHBondContact O-CA 3.46Å; V209-Y223 HydrophobicContact CG2-CD2 4.1Å; Y223-Q225 HydrophobicContact CD1-CG 4.31Å; Y223-Q225 HydrophobicContact CE1-CG 3.37Å; Y223-F238 WeakPolarHBondContact O-CA 3.23Å; Y223-D239 PolarHBondContact O-N 2.66Å; Y223-R240 HydrophobicContact CD1-CB 4.48Å; Y223-R240 PolarHBondContact N-O 3.31Å; Y223-R240 PolarHBondContact O-N 3.35Å
224	S	87.9	Confident	82.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	140.4	175.2	177.2	0	0	0	0	110	R207 V208 D226 H237	R207-S224 WeakPolarHBondContact CA-O 3.21Å; V208-S224 PolarHBondContact N-O 3.11Å; V208-S224 VanDerWaalsContact N-O 3.07Å; V208-S224 PolarHBondContact O-N 3.09Å; S224-D226 PolarHBondContact OG-N 3.2Å; S224-D226 VanDerWaalsContact OG-N 3.14Å; S224-D226 PolarHBondContact OG-O 3.09Å; S224-H237 WeakPolarHBondContact CB-O 3.36Å; S224-H237 PolarHBondContact OG-O 2.91Å
225	Q	82.7	Confident	82.4	Confident	93 Å²	93	51 Å²	51	44%	0.435	30%	0.304	S	S	.	.	S	Bend	trans	-96.8	-6.8	170	-62.3	-162.5	-26.4	0	0	113.6	Y223	Y223-Q225 HydrophobicContact CD1-CG 4.31Å; Y223-Q225 HydrophobicContact CE1-CG 3.37Å
226	D	78.5	Confident	82.7	Confident	65 Å²	65	48.6 Å²	48.6	35%	0.348	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	98.9	-166	-161.6	-1.5	0	0	0	110.7	S224 R228	S224-D226 PolarHBondContact OG-N 3.2Å; S224-D226 VanDerWaalsContact OG-N 3.14Å; S224-D226 PolarHBondContact OG-O 3.09Å; D226-R228 VanDerWaalsContact CG-NE 3.31Å; D226-R228 WeakPolarHBondContact OD1-CG 3.39Å; D226-R228 IonicContact OD1-CZ 3.61Å; D226-R228 IonicContact OD1-NE 2.77Å; D226-R228 PolarHBondContact OD1-NE 3.03Å; D226-R228 IonicContact OD1-NH2 3.6Å; D226-R228 IonicContact OD2-CZ 3.3Å; D226-R228 VanDerWaalsContact OD2-CZ 3.3Å; D226-R228 IonicContact OD2-NE 3.11Å; D226-R228 PolarHBondContact OD2-NE 3.27Å; D226-R228 VanDerWaalsContact OD2-NE 3.11Å; D226-R228 IonicContact OD2-NH2 2.68Å; D226-R228 PolarHBondContact OD2-NH2 3.03Å
227	A	79.6	Confident	83.1	Confident	8 Å²	8	47.1 Å²	47.1	7%	0.066	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.9	167.8	0	0	0	0	0	109	V199 S206 V208 M234 D235 I236	V199-A227 HydrophobicContact CG1-CB 3.89Å; S206-A227 PolarHBondContact O-N 3.33Å; V208-A227 HydrophobicContact CG2-CB 3.66Å; A227-M234 HydrophobicContact CB-CE 3.95Å; A227-M234 WeakPolarHBondContact O-CE 3.46Å; A227-D235 CarbonylContact C-O 3.58Å; A227-D235 WeakPolarHBondContact CA-O 3.3Å; A227-I236 HydrophobicContact CB-CG1 3.99Å
228	R	79.3	Confident	83.5	Confident	162 Å²	162	45.1 Å²	45.1	61%	0.611	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	149	-172.8	-59.1	-167.4	-174.4	-165.5	5.9	112.6	D226 A230 M234 D235	D226-R228 VanDerWaalsContact CG-NE 3.31Å; D226-R228 WeakPolarHBondContact OD1-CG 3.39Å; D226-R228 IonicContact OD1-CZ 3.61Å; D226-R228 IonicContact OD1-NE 2.77Å; D226-R228 PolarHBondContact OD1-NE 3.03Å; D226-R228 IonicContact OD1-NH2 3.6Å; D226-R228 IonicContact OD2-CZ 3.3Å; D226-R228 VanDerWaalsContact OD2-CZ 3.3Å; D226-R228 IonicContact OD2-NE 3.11Å; D226-R228 PolarHBondContact OD2-NE 3.27Å; D226-R228 VanDerWaalsContact OD2-NE 3.11Å; D226-R228 IonicContact OD2-NH2 2.68Å; D226-R228 PolarHBondContact OD2-NH2 3.03Å; R228-A230 PolarHBondContact O-N 3.31Å; R228-M234 CarbonylContact O-C 3.58Å; R228-M234 VanDerWaalsContact O-CA 3.29Å; R228-M234 WeakPolarHBondContact O-CA 3.45Å; R228-D235 PolarHBondContact N-O 2.94Å; R228-D235 PolarHBondContact O-N 2.88Å
229	L	76.4	Confident	83.8	Confident	70 Å²	70	44.6 Å²	44.6	37%	0.366	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	118.2	174.4	-178.4	63.5	0	0	0	110.6	P343 V347	L229-P343 HydrophobicContact CD2-CB 4.36Å; L229-V347 HydrophobicContact CD1-CB 3.89Å; L229-V347 HydrophobicContact CD1-CG2 3.36Å
230	A	71.9	Confident	83.9	Confident	31 Å²	31	46.4 Å²	46.4	26%	0.256	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	105.2	-177.1	0	0	0	0	0	110.7	R228 Q232 G233 D235 T263	R228-A230 PolarHBondContact O-N 3.31Å; A230-Q232 PolarHBondContact O-N 2.91Å; A230-G233 CarbonylContact C-O 3.58Å; A230-G233 PolarHBondContact N-O 3.18Å; A230-G233 PolarHBondContact O-N 2.85Å; A230-G233 VanDerWaalsContact O-N 3.08Å; A230-G233 VanDerWaalsContact O-O 3.06Å; A230-D235 HydrophobicContact CB-CB 3.77Å; A230-T263 HydrophobicContact CB-CG2 3.96Å; A230-T263 WeakPolarHBondContact O-CG2 3.37Å
231	G	70.2	Confident	83.9	Confident	60 Å²	60	46.5 Å²	46.5	62%	0.619	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.9	-89.8	175.3	0	0	0	0	0	114.3	R345	G231-R345 PolarHBondContact O-NH1 2.88Å
232	Q	69.6	Low	83.8	Confident	133 Å²	133	48 Å²	48	62%	0.621	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.6	-2	178.2	-73.3	-174	-21.3	0	0	113.6	A230	A230-Q232 PolarHBondContact O-N 2.91Å
233	G	80	Confident	83.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	-165.2	177.1	0	0	0	0	0	112.3	A230 V264	A230-G233 CarbonylContact C-O 3.58Å; A230-G233 PolarHBondContact N-O 3.18Å; A230-G233 PolarHBondContact O-N 2.85Å; A230-G233 VanDerWaalsContact O-N 3.08Å; A230-G233 VanDerWaalsContact O-O 3.06Å; G233-V264 CarbonylContact C-O 3.59Å; G233-V264 WeakPolarHBondContact CA-O 3.2Å
234	M	82.5	Confident	83.1	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.4	170.1	-62.3	-154.3	73.7	0	0	111	V199 A227 R228 I236 T263 V264 V347 V349	V199-M234 HydrophobicContact CB-SD 4.13Å; V199-M234 HydrophobicContact CG1-CE 4.15Å; V199-M234 HydrophobicContact CG1-SD 3.57Å; V199-M234 VanDerWaalsContact CG1-SD 3.57Å; A227-M234 HydrophobicContact CB-CE 3.95Å; A227-M234 WeakPolarHBondContact O-CE 3.46Å; R228-M234 CarbonylContact O-C 3.58Å; R228-M234 VanDerWaalsContact O-CA 3.29Å; R228-M234 WeakPolarHBondContact O-CA 3.45Å; M234-I236 HydrophobicContact CB-CG1 4.24Å; M234-T263 CarbonylContact O-C 3.38Å; M234-T263 WeakPolarHBondContact O-CA 3.22Å; M234-V264 PolarHBondContact N-O 3.02Å; M234-V264 PolarHBondContact O-N 3.25Å; M234-V347 HydrophobicContact CG-CB 4.16Å; M234-V347 HydrophobicContact CG-CG1 3.76Å; M234-V349 HydrophobicContact CB-CG2 4.49Å; M234-V349 HydrophobicContact CG-CG2 4.48Å
235	D	87.2	Confident	82.7	Confident	51 Å²	51	58.6 Å²	58.6	27%	0.273	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	131.2	162.4	-177	23.6	0	0	0	108.4	A227 R228 A230 Y253	A227-D235 CarbonylContact C-O 3.58Å; A227-D235 WeakPolarHBondContact CA-O 3.3Å; R228-D235 PolarHBondContact N-O 2.94Å; R228-D235 PolarHBondContact O-N 2.88Å; A230-D235 HydrophobicContact CB-CB 3.77Å; D235-Y253 VanDerWaalsContact OD1-CD1 3.29Å; D235-Y253 WeakPolarHBondContact OD1-CD1 3.37Å
236	I	87.8	Confident	82.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	107.1	-173.3	-55.6	174.6	0	0	0	108.1	I195 V208 A227 M234 F238 Y253 A254 V264	I195-I236 HydrophobicContact CD1-CD1 3.93Å; V208-I236 HydrophobicContact CB-CG2 3.96Å; V208-I236 HydrophobicContact CG1-CG2 4.09Å; V208-I236 HydrophobicContact CG2-CD1 4.46Å; V208-I236 HydrophobicContact CG2-CG2 3.87Å; A227-I236 HydrophobicContact CB-CG1 3.99Å; M234-I236 HydrophobicContact CB-CG1 4.24Å; I236-F238 HydrophobicContact CG2-CE1 4.12Å; I236-F238 HydrophobicContact CG2-CE2 4.09Å; I236-F238 HydrophobicContact CG2-CZ 3.79Å; I236-Y253 WeakPolarHBondContact O-CA 3.42Å; I236-A254 HydrophobicContact CB-CB 3.94Å; I236-A254 HydrophobicContact CD1-CB 4.47Å; I236-A254 HydrophobicContact CG2-CB 4.47Å; I236-A254 PolarHBondContact O-N 3.16Å; I236-V264 HydrophobicContact CD1-CB 4.14Å; I236-V264 HydrophobicContact CD1-CG1 4.49Å; I236-V264 HydrophobicContact CD1-CG2 4.36Å
237	H	91.2	Very high	82.8	Confident	59 Å²	59	58.9 Å²	58.9	27%	0.273	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	115.8	-179	177.6	78.7	0	0	0	110.7	S224 N251 Y253	S224-H237 WeakPolarHBondContact CB-O 3.36Å; S224-H237 PolarHBondContact OG-O 2.91Å; H237-N251 PolarHBondContact CE1-OD1 2.99Å; H237-N251 VanDerWaalsContact CE1-OD1 3.3Å; H237-Y253 HydrophobicContact CB-CD1 4.32Å; H237-Y253 HydrophobicContact CB-CE1 3.99Å; H237-Y253 AromaticContact CE1-CE2 3.98Å; H237-Y253 AromaticContact ND1-CD2 3.94Å; H237-Y253 AromaticContact ND1-CE1 3.73Å; H237-Y253 AromaticContact ND1-CE2 3.35Å; H237-Y253 VanDerWaalsContact ND1-CE2 3.35Å; H237-Y253 WeakPolarHBondContact ND1-CE2 3.36Å; H237-Y253 AromaticContact ND1-CZ 3.24Å; H237-Y253 PolarHBondContact ND1-OH 3.36Å
238	F	91.5	Very high	83	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.4	176.7	-59.2	-77.9	0	0	0	110.5	V208 A210 L222 Y223 I236 A252 A254 I357	V208-F238 HydrophobicContact CB-CE1 4.42Å; V208-F238 HydrophobicContact CG1-CE1 4.26Å; V208-F238 HydrophobicContact CG1-CZ 4.48Å; A210-F238 HydrophobicContact CB-CE1 3.85Å; A210-F238 HydrophobicContact CB-CZ 3.63Å; L222-F238 HydrophobicContact CB-CB 4.19Å; L222-F238 HydrophobicContact CB-CD1 3.65Å; L222-F238 HydrophobicContact CB-CE1 4.13Å; L222-F238 HydrophobicContact CB-CG 3.89Å; L222-F238 HydrophobicContact CD2-CB 3.87Å; L222-F238 HydrophobicContact CD2-CD2 4.21Å; L222-F238 HydrophobicContact CD2-CG 4Å; Y223-F238 WeakPolarHBondContact O-CA 3.23Å; I236-F238 HydrophobicContact CG2-CE1 4.12Å; I236-F238 HydrophobicContact CG2-CE2 4.09Å; I236-F238 HydrophobicContact CG2-CZ 3.79Å; F238-A252 HydrophobicContact CB-CB 4.44Å; F238-A252 PolarHBondContact N-O 3.1Å; F238-A252 PolarHBondContact O-N 3.42Å; F238-A254 HydrophobicContact CE2-CB 3.98Å; F238-I357 HydrophobicContact CD2-CD1 4.43Å; F238-I357 HydrophobicContact CD2-CG2 4.37Å; F238-I357 HydrophobicContact CE2-CD1 3.94Å; F238-I357 HydrophobicContact CE2-CG1 4.03Å; F238-I357 HydrophobicContact CZ-CD1 4.32Å
239	D	91.2	Very high	83.4	Confident	39 Å²	39	57.7 Å²	57.7	21%	0.209	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-18.2	-178	75.4	-50.2	0	0	0	113	Y223 V250	Y223-D239 PolarHBondContact O-N 2.66Å; D239-V250 CarbonylContact C-O 3.52Å; D239-V250 WeakPolarHBondContact CA-O 3.47Å; D239-V250 PolarHBondContact O-N 2.86Å
240	R	89.8	Confident	84	Confident	93 Å²	93	54.8 Å²	54.8	35%	0.351	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	141.8	-176.5	-84.5	166.2	-87.9	-155.1	-11.7	111.7	L222 Y223	L222-R240 WeakPolarHBondContact CA-O 3.43Å; Y223-R240 HydrophobicContact CD1-CB 4.48Å; Y223-R240 PolarHBondContact N-O 3.31Å; Y223-R240 PolarHBondContact O-N 3.35Å
241	M	90.2	Very high	84.8	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.7	170.5	-176.3	-179.2	72.2	0	0	110.1	I185 A220 V221 L222 W243 L248 V250 F359	I185-M241 HydrophobicContact CD1-CE 3.84Å; I185-M241 HydrophobicContact CD1-SD 4.14Å; A220-M241 HydrophobicContact CB-CG 4.17Å; A220-M241 HydrophobicContact CB-SD 3.86Å; V221-M241 CarbonylContact O-C 3.58Å; V221-M241 WeakPolarHBondContact O-CA 3.36Å; L222-M241 HydrophobicContact CD1-CG 4.13Å; L222-M241 HydrophobicContact CD1-SD 4.21Å; L222-M241 HydrophobicContact CG-CB 4.07Å; L222-M241 HydrophobicContact CG-CG 3.9Å; L222-M241 HydrophobicContact CG-SD 4.33Å; M241-W243 HydrophobicContact CE-CB 4.17Å; M241-L248 HydrophobicContact CE-CB 4.36Å; M241-L248 HydrophobicContact CE-CD1 3.53Å; M241-L248 PolarHBondContact N-O 2.96Å; M241-L248 PolarHBondContact O-N 3.3Å; M241-V250 HydrophobicContact CB-CG1 3.62Å; M241-V250 HydrophobicContact CB-CG2 4.13Å; M241-V250 HydrophobicContact CE-CG1 4.41Å; M241-F359 HydrophobicContact SD-CE1 4.12Å; M241-F359 HydrophobicContact SD-CZ 4.02Å
242	M	89.4	Confident	85.8	Confident	79 Å²	79	52 Å²	52	39%	0.389	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	121.2	166.6	-174.1	-176.4	66.7	0	0	109	V221 M246 F247	V221-M242 HydrophobicContact CB-CE 4.44Å; V221-M242 HydrophobicContact CG2-CE 4.37Å; V221-M242 PolarHBondContact N-O 3.07Å; V221-M242 PolarHBondContact O-N 2.94Å; M242-M246 WeakPolarHBondContact CA-O 3.4Å; M242-F247 HydrophobicContact CB-CD1 4.14Å; M242-F247 HydrophobicContact CB-CE1 3.97Å; M242-F247 HydrophobicContact CG-CD1 4.32Å; M242-F247 HydrophobicContact CG-CE1 3.97Å; M242-F247 HydrophobicContact CG-CZ 4.18Å; M242-F247 HydrophobicContact SD-CE1 3.98Å; M242-F247 HydrophobicContact SD-CZ 3.8Å
243	W	85.5	Confident	86.7	Confident	26 Å²	26	49.1 Å²	49.1	10%	0.098	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	130.8	174.5	-176.1	62.9	0	0	0	110.4	L184 P216 A218 A220 M241 G245 M246	L184-W243 HydrophobicContact CD2-CE3 4.41Å; L184-W243 HydrophobicContact CD2-CZ3 4.26Å; P216-W243 WeakPolarHBondContact O-CZ2 3.25Å; A218-W243 PolarHBondContact O-NE1 3.01Å; A220-W243 HydrophobicContact CB-CB 4.17Å; A220-W243 HydrophobicContact CB-CG 4.16Å; M241-W243 HydrophobicContact CE-CB 4.17Å; W243-G245 PolarHBondContact O-N 2.86Å; W243-G245 VanDerWaalsContact O-N 3.08Å; W243-M246 PolarHBondContact N-O 3.14Å; W243-M246 WeakPolarHBondContact O-CB 3.31Å; W243-M246 PolarHBondContact O-N 2.95Å
244	R	83.5	Confident	87.2	Confident	196 Å²	196	49.1 Å²	49.1	74%	0.74	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	31.7	-177.7	-60.9	178.4	175.6	176.8	1.9	114.2	M246	R244-M246 VanDerWaalsContact C-N 3.28Å; R244-M246 PolarHBondContact O-N 2.79Å
245	G	78.6	Confident	87.4	Confident	62 Å²	62	49.9 Å²	49.9	64%	0.639	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.3	-2.9	-176.7	0	0	0	0	0	115.4	W243	W243-G245 PolarHBondContact O-N 2.86Å; W243-G245 VanDerWaalsContact O-N 3.08Å
246	M	80.1	Confident	87.3	Confident	55 Å²	55	48.8 Å²	48.8	27%	0.271	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	127.6	172.9	-64.6	160.7	47.8	0	0	109.9	L184 M242 W243 R244 L248 I368	L184-M246 HydrophobicContact CD2-CE 3.73Å; M242-M246 WeakPolarHBondContact CA-O 3.4Å; W243-M246 PolarHBondContact N-O 3.14Å; W243-M246 WeakPolarHBondContact O-CB 3.31Å; W243-M246 PolarHBondContact O-N 2.95Å; R244-M246 VanDerWaalsContact C-N 3.28Å; R244-M246 PolarHBondContact O-N 2.79Å; M246-L248 HydrophobicContact CB-CG 4.48Å; M246-L248 HydrophobicContact CE-CD1 4.37Å; M246-L248 HydrophobicContact CE-CD2 4.17Å; M246-L248 HydrophobicContact CE-CG 4.49Å; M246-I368 HydrophobicContact CE-CD1 3.63Å; M246-I368 HydrophobicContact CE-CG1 3.88Å
247	F	83	Confident	87	Confident	108 Å²	108	53.8 Å²	53.8	47%	0.474	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	108.2	167.4	-71.7	-80.6	0	0	0	109.2	M242 I368 S369	M242-F247 HydrophobicContact CB-CD1 4.14Å; M242-F247 HydrophobicContact CB-CE1 3.97Å; M242-F247 HydrophobicContact CG-CD1 4.32Å; M242-F247 HydrophobicContact CG-CE1 3.97Å; M242-F247 HydrophobicContact CG-CZ 4.18Å; M242-F247 HydrophobicContact SD-CE1 3.98Å; M242-F247 HydrophobicContact SD-CZ 3.8Å; F247-I368 CarbonylContact O-C 3.6Å; F247-I368 WeakPolarHBondContact O-CA 3.38Å; F247-S369 PolarHBondContact O-N 2.96Å
248	L	83.9	Confident	86.4	Confident	0 Å²	0	62 Å²	62	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	134.3	178.4	-67.7	158.5	0	0	0	108.9	L184 M241 M246 V250 V363 I368	L184-L248 HydrophobicContact CD2-CD1 3.71Å; L184-L248 HydrophobicContact CD2-CD2 4.22Å; M241-L248 HydrophobicContact CE-CB 4.36Å; M241-L248 HydrophobicContact CE-CD1 3.53Å; M241-L248 PolarHBondContact N-O 2.96Å; M241-L248 PolarHBondContact O-N 3.3Å; M246-L248 HydrophobicContact CB-CG 4.48Å; M246-L248 HydrophobicContact CE-CD1 4.37Å; M246-L248 HydrophobicContact CE-CD2 4.17Å; M246-L248 HydrophobicContact CE-CG 4.49Å; L248-V250 HydrophobicContact CB-CG1 4.39Å; L248-V363 HydrophobicContact CB-CG1 4.11Å; L248-V363 HydrophobicContact CD1-CG1 4.24Å; L248-V363 HydrophobicContact CD2-CG1 4.17Å; L248-V363 HydrophobicContact CG-CG1 4.4Å; L248-I368 HydrophobicContact CD2-CG1 3.81Å
249	K	87.9	Confident	85.7	Confident	146 Å²	146	65.8 Å²	65.8	64%	0.635	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	136.5	163.9	-169.5	-175.2	177.2	-167	0	108.3	D367	K249-D367 PolarHBondContact N-O 3.46Å; K249-D367 VanDerWaalsContact N-O 3.09Å
250	V	88.5	Confident	85	Confident	9 Å²	9	65.4 Å²	65.4	6%	0.055	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	159.5	179.9	-57.9	0	0	0	0	110.7	L222 D239 M241 L248 F359 V363	L222-V250 HydrophobicContact CD2-CG2 4.38Å; D239-V250 CarbonylContact C-O 3.52Å; D239-V250 WeakPolarHBondContact CA-O 3.47Å; D239-V250 PolarHBondContact O-N 2.86Å; M241-V250 HydrophobicContact CB-CG1 3.62Å; M241-V250 HydrophobicContact CB-CG2 4.13Å; M241-V250 HydrophobicContact CE-CG1 4.41Å; L248-V250 HydrophobicContact CB-CG1 4.39Å; V250-F359 HydrophobicContact CB-CD1 4.48Å; V250-F359 HydrophobicContact CB-CE1 4.33Å; V250-F359 HydrophobicContact CG1-CE1 4.19Å; V250-V363 HydrophobicContact CB-CG2 4.31Å; V250-V363 HydrophobicContact CG1-CG1 4.18Å; V250-V363 HydrophobicContact CG1-CG2 3.76Å
251	N	90	Very high	84.5	Confident	32 Å²	32	66 Å²	66	17%	0.171	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	101.1	165.8	176.7	-8.7	0	0	0	106.5	H237 V360 E361	H237-N251 PolarHBondContact CE1-OD1 2.99Å; H237-N251 VanDerWaalsContact CE1-OD1 3.3Å; N251-V360 PolarHBondContact O-N 3.42Å; N251-E361 HydrophobicContact CB-CB 4.18Å; N251-E361 HydrophobicContact CB-CG 4.19Å; N251-E361 PolarHBondContact ND2-OE1 2.94Å
252	A	89.6	Confident	83.9	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	148.9	-176.2	0	0	0	0	0	112.8	L222 F238 I357 L358 F359	L222-A252 HydrophobicContact CD2-CB 4.32Å; F238-A252 HydrophobicContact CB-CB 4.44Å; F238-A252 PolarHBondContact N-O 3.1Å; F238-A252 PolarHBondContact O-N 3.42Å; A252-I357 HydrophobicContact CB-CG2 3.8Å; A252-L358 CarbonylContact C-O 3.58Å; A252-L358 WeakPolarHBondContact CA-O 3.44Å; A252-L358 WeakPolarHBondContact CB-O 3.31Å; A252-F359 HydrophobicContact CB-CD1 3.88Å; A252-F359 HydrophobicContact CB-CE1 4.18Å; A252-F359 HydrophobicContact CB-CG 4.2Å
253	Y	89	Confident	83.5	Confident	72 Å²	72	66.4 Å²	66.4	28%	0.282	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	143.6	-177.5	-74.1	-97	0	0	0	111.5	D235 I236 H237 I357 L358 V360	D235-Y253 VanDerWaalsContact OD1-CD1 3.29Å; D235-Y253 WeakPolarHBondContact OD1-CD1 3.37Å; I236-Y253 WeakPolarHBondContact O-CA 3.42Å; H237-Y253 HydrophobicContact CB-CD1 4.32Å; H237-Y253 HydrophobicContact CB-CE1 3.99Å; H237-Y253 AromaticContact CE1-CE2 3.98Å; H237-Y253 AromaticContact ND1-CD2 3.94Å; H237-Y253 AromaticContact ND1-CE1 3.73Å; H237-Y253 AromaticContact ND1-CE2 3.35Å; H237-Y253 VanDerWaalsContact ND1-CE2 3.35Å; H237-Y253 WeakPolarHBondContact ND1-CE2 3.36Å; H237-Y253 AromaticContact ND1-CZ 3.24Å; H237-Y253 PolarHBondContact ND1-OH 3.36Å; Y253-I357 WeakPolarHBondContact O-CA 3.45Å; Y253-L358 PolarHBondContact N-O 3.47Å; Y253-L358 PolarHBondContact O-N 3.35Å; Y253-V360 HydrophobicContact CD2-CG2 3.66Å; Y253-V360 HydrophobicContact CE2-CG2 4.03Å
254	A	90	Very high	83	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	129.1	170.5	0	0	0	0	0	111.2	I236 F238 V264	I236-A254 HydrophobicContact CB-CB 3.94Å; I236-A254 HydrophobicContact CD1-CB 4.47Å; I236-A254 HydrophobicContact CG2-CB 4.47Å; I236-A254 PolarHBondContact O-N 3.16Å; F238-A254 HydrophobicContact CE2-CB 3.98Å; A254-V264 HydrophobicContact CB-CG2 3.63Å
255	L	88.5	Confident	82.5	Confident	18 Å²	18	57.2 Å²	57.2	9%	0.094	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.9	168.4	-60.1	116.6	0	0	0	110.7	E257 G260 M261 S356 L358	L255-E257 PolarHBondContact O-N 3.03Å; L255-G260 WeakPolarHBondContact CD2-O 3.37Å; L255-M261 CarbonylContact C-O 3.53Å; L255-M261 VanDerWaalsContact CA-O 3.22Å; L255-M261 WeakPolarHBondContact CA-O 3.41Å; L255-M261 WeakPolarHBondContact CB-O 3.23Å; L255-S356 PolarHBondContact N-O 3.24Å; L255-S356 PolarHBondContact O-N 3.41Å; L255-L358 HydrophobicContact CD1-CB 3.29Å; L255-L358 HydrophobicContact CD1-CD2 4.03Å; L255-L358 HydrophobicContact CD1-CG 4.29Å
256	N	84.1	Confident	82.1	Confident	28 Å²	28	57 Å²	57	15%	0.15	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	128.7	170.1	-177	-74.4	0	0	0	109.9	R258 T259 G260 M261	N256-R258 VanDerWaalsContact C-N 3.32Å; N256-R258 PolarHBondContact O-N 3.39Å; N256-R258 PolarHBondContact OD1-N 3.39Å; N256-T259 WeakPolarHBondContact CB-OG1 3.4Å; N256-T259 PolarHBondContact OD1-N 3.28Å; N256-T259 VanDerWaalsContact OD1-N 3.11Å; N256-T259 PolarHBondContact OD1-OG1 3.12Å; N256-G260 WeakPolarHBondContact O-CA 3.46Å; N256-G260 PolarHBondContact O-N 3.14Å; N256-M261 PolarHBondContact N-O 3.07Å
257	E	82.5	Confident	81.3	Confident	105 Å²	105	58.8 Å²	58.8	49%	0.491	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-38.4	-175.5	-174.9	-178.9	-137.7	0	0	112.7	L255	L255-E257 PolarHBondContact O-N 3.03Å
258	R	78	Confident	80.5	Confident	232 Å²	232	55.6 Å²	55.6	88%	0.875	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-40.2	-172.8	-61.2	-178.4	-177.1	170.2	2.9	113.3	N256	N256-R258 VanDerWaalsContact C-N 3.32Å; N256-R258 PolarHBondContact O-N 3.39Å; N256-R258 PolarHBondContact OD1-N 3.39Å
259	T	76.1	Confident	79.4	Confident	79 Å²	79	59.1 Å²	59.1	49%	0.485	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-18.1	-175.1	63.6	0	0	0	0	113.5	N256 M261	N256-T259 WeakPolarHBondContact CB-OG1 3.4Å; N256-T259 PolarHBondContact OD1-N 3.28Å; N256-T259 VanDerWaalsContact OD1-N 3.11Å; N256-T259 PolarHBondContact OD1-OG1 3.12Å; T259-M261 HydrophobicContact CG2-CE 4.5Å; T259-M261 HydrophobicContact CG2-SD 4.29Å; T259-M261 PolarHBondContact O-N 3.27Å; T259-M261 WeakPolarHBondContact OG1-CB 3.44Å; T259-M261 VanDerWaalsContact OG1-CG 3.29Å; T259-M261 WeakPolarHBondContact OG1-CG 3.27Å; T259-M261 PolarHBondContact OG1-N 3.04Å
260	G	76.3	Confident	78	Confident	31 Å²	31	56.2 Å²	56.2	32%	0.32	30%	0.296	S	S	.	.			trans	66	12.9	-171.3	0	0	0	0	0	114.1	L255 N256	L255-G260 WeakPolarHBondContact CD2-O 3.37Å; N256-G260 WeakPolarHBondContact O-CA 3.46Å; N256-G260 PolarHBondContact O-N 3.14Å
261	M	79.4	Confident	76.8	Confident	105 Å²	105	57.5 Å²	57.5	52%	0.517	30%	0.3	S	S	.	.			trans	-73.7	143.4	175.8	-66.8	169.6	177.4	0	0	110.7	L255 N256 T259 T263	L255-M261 CarbonylContact C-O 3.53Å; L255-M261 VanDerWaalsContact CA-O 3.22Å; L255-M261 WeakPolarHBondContact CA-O 3.41Å; L255-M261 WeakPolarHBondContact CB-O 3.23Å; N256-M261 PolarHBondContact N-O 3.07Å; T259-M261 HydrophobicContact CG2-CE 4.5Å; T259-M261 HydrophobicContact CG2-SD 4.29Å; T259-M261 PolarHBondContact O-N 3.27Å; T259-M261 WeakPolarHBondContact OG1-CB 3.44Å; T259-M261 VanDerWaalsContact OG1-CG 3.29Å; T259-M261 WeakPolarHBondContact OG1-CG 3.27Å; T259-M261 PolarHBondContact OG1-N 3.04Å; M261-T263 PolarHBondContact O-N 2.74Å
262	S	78	Confident	74.9	Confident	53 Å²	53	63.5 Å²	63.5	37%	0.371	32%	0.32	S	S	.	.	S	Bend	trans	-74.6	25.4	175.8	-162.8	0	0	0	0	113.3
263	T	80.5	Confident	72.9	Confident	37 Å²	37	69.1 Å²	69.1	23%	0.227	35%	0.345	C	S	.	.			trans	-139.6	121.2	-175.1	58.4	0	0	0	0	108.7	A230 M234 M261	A230-T263 HydrophobicContact CB-CG2 3.96Å; A230-T263 WeakPolarHBondContact O-CG2 3.37Å; M234-T263 CarbonylContact O-C 3.38Å; M234-T263 WeakPolarHBondContact O-CA 3.22Å; M261-T263 PolarHBondContact O-N 2.74Å
264	V	75.2	Confident	71.3	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-100.6	141	-174.4	-178.4	0	0	0	0	109.5	I195 G233 M234 I236 A254 V349 E353 V355	I195-V264 HydrophobicContact CD1-CG1 4.01Å; G233-V264 CarbonylContact C-O 3.59Å; G233-V264 WeakPolarHBondContact CA-O 3.2Å; M234-V264 PolarHBondContact N-O 3.02Å; M234-V264 PolarHBondContact O-N 3.25Å; I236-V264 HydrophobicContact CD1-CB 4.14Å; I236-V264 HydrophobicContact CD1-CG1 4.49Å; I236-V264 HydrophobicContact CD1-CG2 4.36Å; A254-V264 HydrophobicContact CB-CG2 3.63Å; V264-V349 HydrophobicContact CB-CG2 4.32Å; V264-V349 HydrophobicContact CG1-CG1 3.93Å; V264-V349 HydrophobicContact CG1-CG2 3.91Å; V264-E353 HydrophobicContact CG1-CG 4.2Å; V264-E353 WeakPolarHBondContact CG1-OE1 3.49Å; V264-V355 HydrophobicContact CB-CG1 4.5Å; V264-V355 HydrophobicContact CG1-CG1 3.67Å; V264-V355 HydrophobicContact CG2-CG1 3.9Å
265	A	72.8	Confident	69.2	Low	30 Å²	30	70.8 Å²	70.8	25%	0.248	35%	0.354	C	S	.	.			trans	-166.1	123.1	-175.5	0	0	0	0	0	111.9	V268 V347 E353	A265-V268 HydrophobicContact CB-CG2 4.21Å; A265-V347 HydrophobicContact CB-CG1 3.92Å; A265-E353 VanDerWaalsContact C-OE2 3.3Å; A265-E353 PolarHBondContact N-OE1 3.44Å
266	S	70.7	Confident	67.3	Low	56 Å²	56	75 Å²	75	39%	0.392	38%	0.375	S	S	.	.	S	Bend	trans	-91.6	-42.4	170.3	-71.9	0	0	0	0	111.9	T348 S350 E353	S266-T348 PolarHBondContact N-O 2.87Å; S266-S350 WeakPolarHBondContact CB-OG 3.28Å; S266-S350 WeakPolarHBondContact OG-CB 3.29Å; S266-S350 PolarHBondContact OG-N 3.44Å; S266-E353 PolarHBondContact N-OE2 3.02Å; S266-E353 VanDerWaalsContact N-OE2 3.09Å; S266-E353 PolarHBondContact OG-OE2 3.12Å
267	D	63.9	Low	65.4	Low	94 Å²	94	75.9 Å²	75.9	50%	0.503	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	153.1	174	-178.5	38.1	0	0	0	111.8	V347 T348	D267-V347 WeakPolarHBondContact O-CA 3.33Å; D267-T348 PolarHBondContact N-O 2.62Å; D267-T348 PolarHBondContact O-N 2.91Å
268	V	65.1	Low	63.8	Low	40 Å²	40	74.6 Å²	74.6	24%	0.242	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	76.3	-177.7	-168.6	0	0	0	0	110	A265 H270 Q346 V347	A265-V268 HydrophobicContact CB-CG2 4.21Å; V268-H270 VanDerWaalsContact CG1-CE1 3.49Å; V268-H270 WeakPolarHBondContact CG1-CE1 3.06Å; V268-H270 PolarHBondContact O-N 3.07Å; V268-H270 PolarHBondContact O-ND1 3.21Å; V268-Q346 CarbonylContact C-O 3.58Å; V268-Q346 WeakPolarHBondContact CA-O 3.26Å; V268-V347 HydrophobicContact CG1-CG2 4.08Å; V268-V347 HydrophobicContact CG2-CG2 4.32Å
269	N	62	Low	61.9	Low	74 Å²	74	65 Å²	65	40%	0.396	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	98	177.4	-178.1	-1.2	0	0	0	111	R271 Q346	N269-R271 PolarHBondContact O-N 3.41Å; N269-Q346 HydrophobicContact CB-CB 4.18Å; N269-Q346 PolarHBondContact N-O 3.08Å; N269-Q346 PolarHBondContact O-N 3.4Å
270	H	57.3	Low	60.4	Low	86 Å²	86	64.6 Å²	64.6	40%	0.398	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	112.7	169	-70.7	69.4	0	0	0	108.5	V268 W272 R345	V268-H270 VanDerWaalsContact CG1-CE1 3.49Å; V268-H270 WeakPolarHBondContact CG1-CE1 3.06Å; V268-H270 PolarHBondContact O-N 3.07Å; V268-H270 PolarHBondContact O-ND1 3.21Å; H270-W272 PolarHBondContact O-N 3.48Å; H270-R345 PolarHBondContact NE2-NE 3.38Å
271	R	63	Low	58.8	Low	35 Å²	35	67.9 Å²	67.9	13%	0.132	36%	0.359	C	S	.	.			trans	-75.3	36	-171.6	-58.5	-174.1	-166.8	-76.4	8.9	114	D202 N269 F273 K274 H275 P343 Y344 Q346	D202-R271 IonicContact OD1-CZ 2.96Å; D202-R271 IonicContact OD1-NH2 2.68Å; D202-R271 PolarHBondContact OD1-NH2 3.31Å; D202-R271 IonicContact OD2-CZ 2.66Å; D202-R271 IonicContact OD2-NH2 3.92Å; D202-R271 PolarHBondContact OD2-NH2 3Å; N269-R271 PolarHBondContact O-N 3.41Å; R271-F273 PolarHBondContact O-N 3.42Å; R271-F273 VanDerWaalsContact O-N 3.08Å; R271-K274 HydrophobicContact CB-CB 4.39Å; R271-K274 PolarHBondContact O-N 3.48Å; R271-H275 VanDerWaalsContact CB-CD2 3.47Å; R271-H275 WeakPolarHBondContact CB-CD2 3.47Å; R271-H275 PolarHBondContact O-CD2 3.43Å; R271-H275 PolarHBondContact O-N 2.95Å; R271-H275 VanDerWaalsContact O-N 3.09Å; R271-P343 PolarHBondContact NE-O 3.03Å; R271-Y344 PolarHBondContact N-O 2.77Å; R271-Q346 VanDerWaalsContact NH2-CD 3.31Å
272	W	50.8	Low	56.9	Low	159 Å²	159	68.9 Å²	68.9	60%	0.602	37%	0.366	S	S	*	.	H	α-helix	trans	-51.1	-38.3	-173.6	61.7	-95.2	0	0	0	113.1	H270 K274 I276 V277	H270-W272 PolarHBondContact O-N 3.48Å; W272-K274 VanDerWaalsContact C-N 3.34Å; W272-K274 PolarHBondContact O-N 3.21Å; W272-I276 HydrophobicContact CB-CD1 4.29Å; W272-I276 WeakPolarHBondContact O-CA 3.32Å; W272-I276 VanDerWaalsContact O-CB 3.26Å; W272-I276 WeakPolarHBondContact O-CB 3.43Å; W272-I276 PolarHBondContact O-N 2.95Å; W272-V277 HydrophobicContact CE3-CG2 3.82Å; W272-V277 HydrophobicContact CZ3-CG2 3.83Å; W272-V277 PolarHBondContact O-N 2.95Å
273	F	46.9	Very low	55.2	Low	118 Å²	118	68.8 Å²	68.8	52%	0.518	37%	0.373	S	S	.	.	I	π-helix	trans	-64.3	-37.9	177.8	-170.8	-102.4	0	0	0	112.3	R271 V277 L278	R271-F273 PolarHBondContact O-N 3.42Å; R271-F273 VanDerWaalsContact O-N 3.08Å; F273-V277 HydrophobicContact CD2-CB 3.93Å; F273-V277 HydrophobicContact CD2-CG1 4.02Å; F273-V277 HydrophobicContact CD2-CG2 4.41Å; F273-V277 HydrophobicContact CE2-CB 4.29Å; F273-V277 HydrophobicContact CE2-CG1 3.88Å; F273-V277 PolarHBondContact O-N 3.32Å; F273-L278 HydrophobicContact CD1-CD1 4.25Å; F273-L278 HydrophobicContact CE1-CD1 3.62Å; F273-L278 HydrophobicContact CZ-CD1 3.99Å; F273-L278 PolarHBondContact O-N 2.87Å
274	K	55.4	Low	53.3	Low	94 Å²	94	69.9 Å²	69.9	41%	0.409	39%	0.392	S	S	.	.	I	π-helix	trans	-81	-34.4	-177.6	-164.2	180	-177	-171	0	113.6	R271 W272 P279 E342	R271-K274 HydrophobicContact CB-CB 4.39Å; R271-K274 PolarHBondContact O-N 3.48Å; W272-K274 VanDerWaalsContact C-N 3.34Å; W272-K274 PolarHBondContact O-N 3.21Å; K274-P279 VanDerWaalsContact O-CD 3.22Å; K274-P279 WeakPolarHBondContact O-CD 3.34Å; K274-P279 WeakPolarHBondContact O-CG 3.45Å; K274-E342 WeakPolarHBondContact CD-OE2 3.32Å; K274-E342 WeakPolarHBondContact CE-OE2 3.48Å; K274-E342 IonicContact NZ-OE1 2.74Å; K274-E342 PolarHBondContact NZ-OE1 2.81Å; K274-E342 IonicContact NZ-OE2 2.62Å; K274-E342 PolarHBondContact NZ-OE2 3.49Å
275	H	47.4	Very low	51.6	Low	12 Å²	12	74.1 Å²	74.1	6%	0.056	42%	0.418	C	S	.	.	I	π-helix	trans	-100.5	-22.2	-177.3	-62.8	-105.2	0	0	0	114.9	R271 P279 E342 Y344	R271-H275 VanDerWaalsContact CB-CD2 3.47Å; R271-H275 WeakPolarHBondContact CB-CD2 3.47Å; R271-H275 PolarHBondContact O-CD2 3.43Å; R271-H275 PolarHBondContact O-N 2.95Å; R271-H275 VanDerWaalsContact O-N 3.09Å; H275-P279 WeakPolarHBondContact O-CG 3.43Å; H275-E342 PolarHBondContact CE1-O 3.33Å; H275-Y344 HydrophobicContact CB-CD1 3.74Å; H275-Y344 HydrophobicContact CB-CE1 3.35Å; H275-Y344 AromaticContact CG-CD1 3.79Å; H275-Y344 AromaticContact CG-CE1 3.72Å; H275-Y344 AromaticContact ND1-CD1 3.99Å; H275-Y344 AromaticContact ND1-CD2 3.83Å; H275-Y344 AromaticContact ND1-CE1 3.83Å; H275-Y344 AromaticContact ND1-CE2 3.65Å; H275-Y344 AromaticContact ND1-CG 3.99Å; H275-Y344 AromaticContact ND1-CZ 3.65Å
276	I	47.9	Very low	50	Low	106 Å²	106	74.8 Å²	74.8	54%	0.544	43%	0.428	S	S	.	.	I	π-helix	trans	-110.6	-55.5	-178.4	-52.2	177	0	0	0	110.4	W272 S280	W272-I276 HydrophobicContact CB-CD1 4.29Å; W272-I276 WeakPolarHBondContact O-CA 3.32Å; W272-I276 VanDerWaalsContact O-CB 3.26Å; W272-I276 WeakPolarHBondContact O-CB 3.43Å; W272-I276 PolarHBondContact O-N 2.95Å; I276-S280 VanDerWaalsContact O-CB 3.26Å; I276-S280 WeakPolarHBondContact O-CB 3.36Å; I276-S280 PolarHBondContact O-N 3.14Å; I276-S280 VanDerWaalsContact O-N 3.08Å; I276-S280 PolarHBondContact O-OG 3.09Å
277	V	44.6	Very low	48.3	Very low	48 Å²	48	75 Å²	75	29%	0.291	43%	0.425	S	S	.	.	I	π-helix	trans	-75.9	-51.1	-172.7	-179.3	0	0	0	0	112.2	W272 F273 S280 V281	W272-V277 HydrophobicContact CE3-CG2 3.82Å; W272-V277 HydrophobicContact CZ3-CG2 3.83Å; W272-V277 PolarHBondContact O-N 2.95Å; F273-V277 HydrophobicContact CD2-CB 3.93Å; F273-V277 HydrophobicContact CD2-CG1 4.02Å; F273-V277 HydrophobicContact CD2-CG2 4.41Å; F273-V277 HydrophobicContact CE2-CB 4.29Å; F273-V277 HydrophobicContact CE2-CG1 3.88Å; F273-V277 PolarHBondContact O-N 3.32Å; V277-S280 PolarHBondContact O-N 3.28Å; V277-S280 PolarHBondContact O-OG 3.46Å; V277-S280 VanDerWaalsContact O-OG 3.09Å; V277-V281 HydrophobicContact CG1-CG2 4.25Å; V277-V281 WeakPolarHBondContact O-CB 3.33Å; V277-V281 VanDerWaalsContact O-CG2 3.31Å; V277-V281 WeakPolarHBondContact O-CG2 3.4Å; V277-V281 PolarHBondContact O-N 3.37Å
278	L	47.6	Very low	47.2	Very low	77 Å²	77	76 Å²	76	40%	0.403	43%	0.434	S	S	.	.	H	α-helix	trans	-56.6	-47.5	176.6	-125.8	71.1	0	0	0	112.5	F273 V281 L282	F273-L278 HydrophobicContact CD1-CD1 4.25Å; F273-L278 HydrophobicContact CE1-CD1 3.62Å; F273-L278 HydrophobicContact CZ-CD1 3.99Å; F273-L278 PolarHBondContact O-N 2.87Å; L278-V281 PolarHBondContact O-N 3.32Å; L278-L282 HydrophobicContact CG-CD1 4.22Å; L278-L282 VanDerWaalsContact O-CB 3.27Å; L278-L282 WeakPolarHBondContact O-CB 3.42Å; L278-L282 VanDerWaalsContact O-CG 3.3Å; L278-L282 WeakPolarHBondContact O-CG 3.49Å; L278-L282 PolarHBondContact O-N 3.01Å
279	P	39.3	Very low	45.9	Very low	31 Å²	31	77 Å²	77	20%	0.201	45%	0.452	C	S	.	.	H	α-helix	trans	-77.1	-21.2	-178.3	-20.7	37.6	0	0	0	114.2	K274 H275 G283	K274-P279 VanDerWaalsContact O-CD 3.22Å; K274-P279 WeakPolarHBondContact O-CD 3.34Å; K274-P279 WeakPolarHBondContact O-CG 3.45Å; H275-P279 WeakPolarHBondContact O-CG 3.43Å; P279-G283 WeakPolarHBondContact O-CA 3.37Å; P279-G283 PolarHBondContact O-N 2.78Å
280	S	44	Very low	45	Very low	70 Å²	70	75.9 Å²	75.9	49%	0.49	45%	0.45	S	S	.	.	H	α-helix	trans	-78.2	-37.2	169.6	55.1	0	0	0	0	112.2	I276 V277 G284	I276-S280 VanDerWaalsContact O-CB 3.26Å; I276-S280 WeakPolarHBondContact O-CB 3.36Å; I276-S280 PolarHBondContact O-N 3.14Å; I276-S280 VanDerWaalsContact O-N 3.08Å; I276-S280 PolarHBondContact O-OG 3.09Å; V277-S280 PolarHBondContact O-N 3.28Å; V277-S280 PolarHBondContact O-OG 3.46Å; V277-S280 VanDerWaalsContact O-OG 3.09Å; S280-G284 PolarHBondContact O-N 2.78Å
281	V	42.3	Very low	44.2	Very low	100 Å²	100	76.2 Å²	76.2	61%	0.606	45%	0.454	S	S	*	.	H	α-helix	trans	-69.7	-36.3	174.1	172.3	0	0	0	0	111.9	V277 L278	V277-V281 HydrophobicContact CG1-CG2 4.25Å; V277-V281 WeakPolarHBondContact O-CB 3.33Å; V277-V281 VanDerWaalsContact O-CG2 3.31Å; V277-V281 WeakPolarHBondContact O-CG2 3.4Å; V277-V281 PolarHBondContact O-N 3.37Å; L278-V281 PolarHBondContact O-N 3.32Å
282	L	40.1	Very low	43.1	Very low	126 Å²	126	83.4 Å²	83.4	66%	0.66	48%	0.483	S	S	*	.	H	α-helix	trans	-87	-31.3	177.1	-67.5	167.8	0	0	0	113.3	L278	L278-L282 HydrophobicContact CG-CD1 4.22Å; L278-L282 VanDerWaalsContact O-CB 3.27Å; L278-L282 WeakPolarHBondContact O-CB 3.42Å; L278-L282 VanDerWaalsContact O-CG 3.3Å; L278-L282 WeakPolarHBondContact O-CG 3.49Å; L278-L282 PolarHBondContact O-N 3.01Å
283	G	42.2	Very low	42.6	Very low	51 Å²	51	83.8 Å²	83.8	53%	0.526	49%	0.488	S	S	.	.	H	α-helix	trans	-87.5	-21.2	-178.6	0	0	0	0	0	114.5	P279 V285	P279-G283 WeakPolarHBondContact O-CA 3.37Å; P279-G283 PolarHBondContact O-N 2.78Å; G283-V285 PolarHBondContact O-N 2.84Å; G283-V285 VanDerWaalsContact O-N 3.13Å
284	G	40.1	Very low	42.5	Very low	60 Å²	60	84.9 Å²	84.9	62%	0.619	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-2.4	172.4	0	0	0	0	0	114.5	S280	S280-G284 PolarHBondContact O-N 2.78Å
285	V	40.7	Very low	41.7	Very low	89 Å²	89	84.4 Å²	84.4	54%	0.539	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	49.3	-171.4	-164.4	0	0	0	0	111.1	G283 F640	G283-V285 PolarHBondContact O-N 2.84Å; G283-V285 VanDerWaalsContact O-N 3.13Å; V285-F640 HydrophobicContact CG1-CD2 4.31Å; V285-F640 HydrophobicContact CG1-CE1 4.41Å; V285-F640 HydrophobicContact CG1-CE2 3.29Å; V285-F640 HydrophobicContact CG1-CZ 3.37Å
286	G	38.4	Very low	41.1	Very low	45 Å²	45	89.4 Å²	89.4	46%	0.464	54%	0.541	S	S	.	.			trans	-150.7	80.7	-174	0	0	0	0	0	115.6
287	N	35.8	Very low	40.6	Very low	61 Å²	61	89.9 Å²	89.9	33%	0.326	55%	0.548	S	S	.	.	S	Bend	trans	-168.3	-21.9	148	-102.3	-32.6	0	0	0	116.4	G289 S290	N287-G289 VanDerWaalsContact C-N 3.25Å; N287-G289 PolarHBondContact O-N 2.93Å; N287-G289 VanDerWaalsContact O-N 3.09Å; N287-S290 PolarHBondContact O-N 3.34Å; N287-S290 PolarHBondContact O-OG 3Å
288	V	41.1	Very low	40.3	Very low	115 Å²	115	94.6 Å²	94.6	70%	0.697	57%	0.567	S	S	*	*	H	α-helix	trans	-52.6	-39.9	-171.3	-162.7	0	0	0	0	113.3	S290	V288-S290 VanDerWaalsContact C-N 3.27Å; V288-S290 PolarHBondContact O-N 2.64Å
289	G	37.9	Very low	39.8	Very low	59 Å²	59	97 Å²	97	61%	0.608	58%	0.579	S	S	*	*	H	α-helix	trans	-73.9	-2.5	180	0	0	0	0	0	116.5	N287	N287-G289 VanDerWaalsContact C-N 3.25Å; N287-G289 PolarHBondContact O-N 2.93Å; N287-G289 VanDerWaalsContact O-N 3.09Å
290	S	41.4	Very low	39.9	Very low	51 Å²	51	101.7 Å²	101.7	36%	0.357	60%	0.602	S	S	.	*	H	α-helix	trans	-87.2	-39.6	173.2	64.7	0	0	0	0	112.1	N287 V288 Y292 K293	N287-S290 PolarHBondContact O-N 3.34Å; N287-S290 PolarHBondContact O-OG 3Å; V288-S290 VanDerWaalsContact C-N 3.27Å; V288-S290 PolarHBondContact O-N 2.64Å; S290-Y292 VanDerWaalsContact C-N 3.3Å; S290-Y292 PolarHBondContact O-N 3.4Å; S290-K293 VanDerWaalsContact O-CB 3.25Å; S290-K293 WeakPolarHBondContact O-CB 3.36Å; S290-K293 PolarHBondContact O-N 3.18Å
291	L	41	Very low	39.5	Very low	93 Å²	93	107 Å²	107	49%	0.487	62%	0.619	S	S	.	*	H	α-helix	trans	-68.2	-28.1	-179.3	-64.3	171.7	0	0	0	112.9	K293 A295 L319	L291-K293 VanDerWaalsContact C-N 3.26Å; L291-K293 PolarHBondContact O-N 3.04Å; L291-A295 WeakPolarHBondContact O-CB 3.39Å; L291-L319 HydrophobicContact CD1-CD1 4.39Å
292	Y	40.1	Very low	39.5	Very low	187 Å²	187	104.4 Å²	104.4	73%	0.733	61%	0.613	S	S	*	*	H	α-helix	trans	-75.7	-10	169.6	-83.2	-89.2	0	0	0	114.1	S290	S290-Y292 VanDerWaalsContact C-N 3.3Å; S290-Y292 PolarHBondContact O-N 3.4Å
293	K	40.1	Very low	40	Very low	166 Å²	166	105.8 Å²	105.8	72%	0.722	62%	0.621	S	S	*	*	H	α-helix	trans	-92.6	-33.2	-171.1	-131.5	173.1	-175	177.9	0	113.6	S290 L291	S290-K293 VanDerWaalsContact O-CB 3.25Å; S290-K293 WeakPolarHBondContact O-CB 3.36Å; S290-K293 PolarHBondContact O-N 3.18Å; L291-K293 VanDerWaalsContact C-N 3.26Å; L291-K293 PolarHBondContact O-N 3.04Å
294	D	45	Very low	39.7	Very low	141 Å²	141	114.1 Å²	114.1	75%	0.754	64%	0.638	S	S	*	*	H	α-helix	trans	-87.8	-18	171.7	-68.6	-38.7	0	0	0	112.6	N296	D294-N296 PolarHBondContact O-N 3.01Å
295	A	39.8	Very low	39.5	Very low	85 Å²	85	114.1 Å²	114.1	70%	0.702	64%	0.638	S	S	*	*	S	Bend	trans	-71.6	-1.8	175.9	0	0	0	0	0	114.3	L291	L291-A295 WeakPolarHBondContact O-CB 3.39Å
296	N	33.7	Very low	39.2	Very low	117 Å²	117	113.6 Å²	113.6	63%	0.626	64%	0.638	S	S	*	*	S	Bend	trans	-138.9	117.1	-177.6	-165.6	16.4	0	0	0	111.5	D294	D294-N296 PolarHBondContact O-N 3.01Å
297	T	37.7	Very low	39	Very low	115 Å²	115	119.7 Å²	119.7	71%	0.706	66%	0.658	S	S	*	*			trans	73.5	42.4	173.2	70.1	0	0	0	0	119.7	I299	T297-I299 PolarHBondContact O-N 3.27Å
298	Q	37.6	Very low	39.3	Very low	147 Å²	147	122.9 Å²	122.9	69%	0.687	68%	0.681	S	S	*	*			trans	-76	85.6	161.6	-154.4	-175.1	52.3	0	0	111.9	L300	Q298-L300 HydrophobicContact CG-CD2 4.49Å; Q298-L300 HydrophobicContact CG-CG 4.14Å; Q298-L300 PolarHBondContact O-N 3.13Å
299	I	36.7	Very low	39.1	Very low	128 Å²	128	120.4 Å²	120.4	66%	0.656	68%	0.678	S	S	*	*			trans	-76.5	88.3	171.6	-57.3	174.1	0	0	0	108.6	T297 Q301	T297-I299 PolarHBondContact O-N 3.27Å; I299-Q301 VanDerWaalsContact C-N 3.33Å; I299-Q301 PolarHBondContact O-N 3Å
300	L	43	Very low	38.9	Very low	129 Å²	129	129.6 Å²	129.6	68%	0.675	69%	0.694	S	S	*	*			trans	-70.8	87	175.3	-78.3	165.1	0	0	0	110.6	Q298 G302	Q298-L300 HydrophobicContact CG-CD2 4.49Å; Q298-L300 HydrophobicContact CG-CG 4.14Å; Q298-L300 PolarHBondContact O-N 3.13Å; L300-G302 VanDerWaalsContact C-N 3.27Å; L300-G302 PolarHBondContact O-N 3.06Å
301	Q	35.8	Very low	38.8	Very low	181 Å²	181	133.9 Å²	133.9	85%	0.846	72%	0.718	S	S	*	*			trans	-76.4	73.4	-179	-166.7	173.4	12.3	0	0	111.7	I299	I299-Q301 VanDerWaalsContact C-N 3.33Å; I299-Q301 PolarHBondContact O-N 3Å
302	G	41.1	Very low	38.8	Very low	46 Å²	46	132.8 Å²	132.8	47%	0.474	73%	0.73	S	S	.	*			trans	-69.2	158	169.8	0	0	0	0	0	112.5	L300 Y304	L300-G302 VanDerWaalsContact C-N 3.27Å; L300-G302 PolarHBondContact O-N 3.06Å; G302-Y304 PolarHBondContact O-N 3.44Å
303	N	50	Low	38.9	Very low	156 Å²	156	133 Å²	133	83%	0.834	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	6.4	-174.3	-155.2	56.7	0	0	0	114.9
304	Y	35.8	Very low	38.9	Very low	225 Å²	225	130.1 Å²	130.1	88%	0.882	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.4	59.2	-178.3	-76.1	-80.3	0	0	0	111.7	G302	G302-Y304 PolarHBondContact O-N 3.44Å
305	G	36.1	Very low	38.4	Very low	60 Å²	60	129.7 Å²	129.7	62%	0.619	74%	0.736	S	S	*	*			trans	84.6	153.8	170.3	0	0	0	0	0	115.5
306	S	35.2	Very low	38.5	Very low	79 Å²	79	128.3 Å²	128.3	55%	0.552	73%	0.73	S	S	*	*			trans	-109.7	115	-177.8	57.8	0	0	0	0	111.6
307	I	34.9	Very low	38.8	Very low	172 Å²	172	131.3 Å²	131.3	88%	0.882	74%	0.74	S	S	*	*			trans	-99.5	116.6	174.8	-60.4	175.1	0	0	0	108.9	G309	I307-G309 PolarHBondContact O-N 3.37Å
308	T	40.8	Very low	39.1	Very low	129 Å²	129	128.7 Å²	128.7	79%	0.791	73%	0.73	S	S	*	*			trans	-91.3	82.4	-176.9	49.2	0	0	0	0	112
309	G	36.9	Very low	39.3	Very low	63 Å²	63	125.9 Å²	125.9	65%	0.649	72%	0.719	S	S	*	*			trans	-77.9	123.9	171.8	0	0	0	0	0	112.2	I307	I307-G309 PolarHBondContact O-N 3.37Å
310	R	33.3	Very low	39.3	Very low	251 Å²	251	122.6 Å²	122.6	95%	0.947	71%	0.711	S	S	*	*			trans	-78.5	135.5	160.8	-70.4	-175.3	177.9	-169.8	-0	108.6
311	V	40.2	Very low	39	Very low	142 Å²	142	118.8 Å²	118.8	86%	0.861	70%	0.703	S	S	*	*			trans	-126	147.6	173.4	-157.3	0	0	0	0	108.6
312	G	41.6	Very low	39.4	Very low	70 Å²	70	114.4 Å²	114.4	72%	0.722	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-74.3	172.8	-170.2	0	0	0	0	0	115.3
313	M	42.1	Very low	39.4	Very low	190 Å²	190	117 Å²	117	94%	0.936	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-65.1	142.3	172.4	-66.9	173.4	171.6	0	0	111
314	P	39.8	Very low	38.8	Very low	106 Å²	106	113.9 Å²	113.9	69%	0.688	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-79.7	150	173	33	-34.7	0	0	0	112.2
315	D	34.4	Very low	38.8	Very low	133 Å²	133	105.3 Å²	105.3	71%	0.711	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-69.5	151.1	-177	-65.6	-67.4	0	0	0	114.6	E317 A318 L319	D315-E317 VanDerWaalsContact C-N 3.3Å; D315-E317 PolarHBondContact O-N 3.07Å; D315-A318 WeakPolarHBondContact O-CB 3.46Å; D315-A318 PolarHBondContact O-N 3.09Å; D315-A318 VanDerWaalsContact O-N 3.14Å; D315-L319 PolarHBondContact O-N 2.74Å
316	G	41.9	Very low	39	Very low	56 Å²	56	104 Å²	104	58%	0.577	65%	0.653	S	S	*	*	H	α-helix	trans	-62	-28	-173.6	0	0	0	0	0	115.4	L319 A320	G316-L319 WeakPolarHBondContact O-CB 3.46Å; G316-L319 PolarHBondContact O-N 2.76Å; G316-A320 PolarHBondContact O-N 2.85Å
317	E	39.4	Very low	39.1	Very low	179 Å²	179	104.7 Å²	104.7	84%	0.836	65%	0.648	S	S	*	*	H	α-helix	trans	-72.4	-34.5	177	-64.4	-169.2	127.5	0	0	112.3	D315 L319 A320 G321	D315-E317 VanDerWaalsContact C-N 3.3Å; D315-E317 PolarHBondContact O-N 3.07Å; E317-L319 VanDerWaalsContact C-N 3.3Å; E317-L319 PolarHBondContact O-N 3.1Å; E317-A320 PolarHBondContact O-N 3.41Å; E317-G321 PolarHBondContact O-N 3.26Å; E317-G321 VanDerWaalsContact O-N 3.09Å
318	A	45.1	Very low	39.2	Very low	61 Å²	61	99.9 Å²	99.9	50%	0.504	63%	0.634	S	S	.	*	H	α-helix	trans	-65.8	-36.7	172.1	0	0	0	0	0	111.1	D315 V322	D315-A318 WeakPolarHBondContact O-CB 3.46Å; D315-A318 PolarHBondContact O-N 3.09Å; D315-A318 VanDerWaalsContact O-N 3.14Å; A318-V322 WeakPolarHBondContact O-CG2 3.34Å; A318-V322 PolarHBondContact O-N 3.34Å
319	L	40.7	Very low	39.3	Very low	88 Å²	88	100.6 Å²	100.6	46%	0.461	63%	0.629	S	S	.	*	H	α-helix	trans	-63	-43.6	174.1	-157.3	75.8	0	0	0	111.5	L291 D315 G316 E317 V322 I323	L291-L319 HydrophobicContact CD1-CD1 4.39Å; D315-L319 PolarHBondContact O-N 2.74Å; G316-L319 WeakPolarHBondContact O-CB 3.46Å; G316-L319 PolarHBondContact O-N 2.76Å; E317-L319 VanDerWaalsContact C-N 3.3Å; E317-L319 PolarHBondContact O-N 3.1Å; L319-V322 PolarHBondContact O-N 3.17Å; L319-I323 HydrophobicContact CG-CD1 4.19Å; L319-I323 WeakPolarHBondContact O-CD1 3.37Å; L319-I323 VanDerWaalsContact O-CG1 3.29Å; L319-I323 WeakPolarHBondContact O-CG1 3.44Å; L319-I323 PolarHBondContact O-N 3.21Å; L319-I323 VanDerWaalsContact O-N 3.15Å
320	A	36.7	Very low	39.6	Very low	58 Å²	58	105.2 Å²	105.2	48%	0.479	63%	0.627	S	S	.	*	H	α-helix	trans	-63.1	-43	178.5	0	0	0	0	0	112.9	G316 E317 V322 I323 A324	G316-A320 PolarHBondContact O-N 2.85Å; E317-A320 PolarHBondContact O-N 3.41Å; A320-V322 PolarHBondContact O-N 3.13Å; A320-I323 PolarHBondContact O-N 2.95Å; A320-A324 PolarHBondContact O-N 3.12Å
321	G	36.5	Very low	40	Very low	49 Å²	49	94.9 Å²	94.9	51%	0.505	60%	0.598	S	S	.	*	H	α-helix	trans	-61.5	-41.1	178.2	0	0	0	0	0	113.5	E317 A324 G325	E317-G321 PolarHBondContact O-N 3.26Å; E317-G321 VanDerWaalsContact O-N 3.09Å; G321-A324 PolarHBondContact O-N 3.37Å; G321-G325 PolarHBondContact O-N 3.21Å
322	V	44.7	Very low	39.8	Very low	89 Å²	89	90.8 Å²	90.8	54%	0.539	58%	0.576	S	S	.	*	H	α-helix	trans	-71	-35	178.3	178.3	0	0	0	0	111.8	A318 L319 A320 A324 G325 G326	A318-V322 WeakPolarHBondContact O-CG2 3.34Å; A318-V322 PolarHBondContact O-N 3.34Å; L319-V322 PolarHBondContact O-N 3.17Å; A320-V322 PolarHBondContact O-N 3.13Å; V322-A324 VanDerWaalsContact C-N 3.32Å; V322-A324 PolarHBondContact O-N 2.97Å; V322-G325 PolarHBondContact O-N 3.34Å; V322-G326 PolarHBondContact O-N 3.17Å
323	I	41.8	Very low	40.1	Very low	102 Å²	102	92.6 Å²	92.6	52%	0.523	57%	0.565	S	S	.	*	H	α-helix	trans	-65.5	-35.5	174.7	-70.3	166.9	0	0	0	111.4	L319 A320	L319-I323 HydrophobicContact CG-CD1 4.19Å; L319-I323 WeakPolarHBondContact O-CD1 3.37Å; L319-I323 VanDerWaalsContact O-CG1 3.29Å; L319-I323 WeakPolarHBondContact O-CG1 3.44Å; L319-I323 PolarHBondContact O-N 3.21Å; L319-I323 VanDerWaalsContact O-N 3.15Å; A320-I323 PolarHBondContact O-N 2.95Å
324	A	38	Very low	40.3	Very low	89 Å²	89	88.9 Å²	88.9	74%	0.736	55%	0.549	S	S	*	.	H	α-helix	trans	-71.8	-33.1	177.3	0	0	0	0	0	113.9	A320 G321 V322	A320-A324 PolarHBondContact O-N 3.12Å; G321-A324 PolarHBondContact O-N 3.37Å; V322-A324 VanDerWaalsContact C-N 3.32Å; V322-A324 PolarHBondContact O-N 2.97Å
325	G	35.2	Very low	40.5	Very low	46 Å²	46	88 Å²	88	47%	0.474	54%	0.537	S	S	.	.	H	α-helix	trans	-94.7	-43.2	-177.9	0	0	0	0	0	115.4	G321 V322 M327	G321-G325 PolarHBondContact O-N 3.21Å; V322-G325 PolarHBondContact O-N 3.34Å; G325-M327 VanDerWaalsContact C-N 3.28Å; G325-M327 PolarHBondContact O-N 3.15Å; G325-M327 VanDerWaalsContact O-N 3.14Å
326	G	40	Very low	41.5	Very low	32 Å²	32	85.1 Å²	85.1	33%	0.33	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-10.4	-163.1	0	0	0	0	0	116.7	V322	V322-G326 PolarHBondContact O-N 3.17Å
327	M	36.8	Very low	42	Very low	93 Å²	93	90.9 Å²	90.9	46%	0.458	53%	0.529	S	S	.	.	H	α-helix	trans	-78.1	-26.7	-178.5	-64.8	-59.2	-157.6	0	0	113.4	G325 G331	G325-M327 VanDerWaalsContact C-N 3.28Å; G325-M327 PolarHBondContact O-N 3.15Å; G325-M327 VanDerWaalsContact O-N 3.14Å; M327-G331 PolarHBondContact O-N 3.41Å
328	A	38	Very low	42	Very low	72 Å²	72	87.7 Å²	87.7	60%	0.595	51%	0.514	S	S	*	.	H	α-helix	trans	-69.1	-44.4	-172.8	0	0	0	0	0	113.4	S332	A328-S332 VanDerWaalsContact O-CB 3.31Å; A328-S332 WeakPolarHBondContact O-CB 3.31Å; A328-S332 PolarHBondContact O-N 3.43Å; A328-S332 VanDerWaalsContact O-N 3.13Å; A328-S332 PolarHBondContact O-OG 2.8Å
329	E	41.4	Very low	42.1	Very low	143 Å²	143	86.4 Å²	86.4	67%	0.668	50%	0.504	S	S	*	.	H	α-helix	trans	-77	-35.8	-170.7	-62.3	-172.6	140.8	0	0	113.7	S332 Q333	E329-S332 PolarHBondContact O-OG 3.1Å; E329-S332 VanDerWaalsContact O-OG 3.05Å; E329-Q333 WeakPolarHBondContact O-CG 3.46Å; E329-Q333 PolarHBondContact O-N 3.36Å
330	R	43.7	Very low	42.7	Very low	161 Å²	161	89.1 Å²	89.1	61%	0.608	51%	0.514	S	S	*	.	H	α-helix	trans	-89.9	-30.3	178.9	-67.4	-175.4	-175.8	144.8	6.3	112.9	L334	R330-L334 WeakPolarHBondContact O-CB 3.48Å; R330-L334 WeakPolarHBondContact O-CG 3.31Å; R330-L334 PolarHBondContact O-N 2.9Å
331	G	41.5	Very low	43.6	Very low	33 Å²	33	90.2 Å²	90.2	34%	0.34	52%	0.518	S	S	.	.	H	α-helix	trans	-60.3	-48.3	168.6	0	0	0	0	0	111.3	M327 L334 L335	M327-G331 PolarHBondContact O-N 3.41Å; G331-L334 PolarHBondContact O-N 3.47Å; G331-L335 WeakPolarHBondContact O-CB 3.3Å; G331-L335 WeakPolarHBondContact O-CD1 3.37Å; G331-L335 VanDerWaalsContact O-CG 3.26Å; G331-L335 WeakPolarHBondContact O-CG 3.37Å; G331-L335 PolarHBondContact O-N 3.24Å
332	S	35.7	Very low	44.5	Very low	57 Å²	57	91.3 Å²	91.3	40%	0.399	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-47.2	175.1	53.1	0	0	0	0	112.7	A328 E329 L334 L335 T336	A328-S332 VanDerWaalsContact O-CB 3.31Å; A328-S332 WeakPolarHBondContact O-CB 3.31Å; A328-S332 PolarHBondContact O-N 3.43Å; A328-S332 VanDerWaalsContact O-N 3.13Å; A328-S332 PolarHBondContact O-OG 2.8Å; E329-S332 PolarHBondContact O-OG 3.1Å; E329-S332 VanDerWaalsContact O-OG 3.05Å; S332-L334 VanDerWaalsContact C-N 3.32Å; S332-L334 PolarHBondContact O-N 2.8Å; S332-L335 CarbonylContact O-C 3.49Å; S332-L335 WeakPolarHBondContact O-CB 3.14Å; S332-L335 PolarHBondContact O-N 3.02Å; S332-L335 VanDerWaalsContact O-N 3.16Å; S332-T336 PolarHBondContact O-N 2.82Å; S332-T336 PolarHBondContact O-OG1 2.96Å
333	Q	49.3	Very low	45.3	Very low	108 Å²	108	89.9 Å²	89.9	51%	0.505	50%	0.503	S	S	.	.	H	α-helix	trans	-63.1	-33	179.5	-73.2	171.1	21.1	0	0	114.1	E329 R337	E329-Q333 WeakPolarHBondContact O-CG 3.46Å; E329-Q333 PolarHBondContact O-N 3.36Å; Q333-R337 WeakPolarHBondContact O-CG 2.9Å; Q333-R337 PolarHBondContact O-N 2.81Å
334	L	45.7	Very low	46.1	Very low	112 Å²	112	89.8 Å²	89.8	59%	0.586	50%	0.497	S	S	*	.	H	α-helix	trans	-74.4	-40	172.7	-73.1	170	0	0	0	111.8	R330 G331 S332 T336 R337 Q338	R330-L334 WeakPolarHBondContact O-CB 3.48Å; R330-L334 WeakPolarHBondContact O-CG 3.31Å; R330-L334 PolarHBondContact O-N 2.9Å; G331-L334 PolarHBondContact O-N 3.47Å; S332-L334 VanDerWaalsContact C-N 3.32Å; S332-L334 PolarHBondContact O-N 2.8Å; L334-T336 VanDerWaalsContact C-N 3.33Å; L334-T336 PolarHBondContact O-N 3.46Å; L334-R337 PolarHBondContact O-N 3.47Å; L334-Q338 VanDerWaalsContact O-CB 3.32Å; L334-Q338 WeakPolarHBondContact O-CB 3.31Å; L334-Q338 PolarHBondContact O-N 3.33Å
335	L	44.6	Very low	47.4	Very low	86 Å²	86	90.1 Å²	90.1	45%	0.45	48%	0.479	S	S	.	.	H	α-helix	trans	-59.5	-42.5	171.9	-75.5	165.1	0	0	0	111.4	G331 S332 Q338 A339	G331-L335 WeakPolarHBondContact O-CB 3.3Å; G331-L335 WeakPolarHBondContact O-CD1 3.37Å; G331-L335 VanDerWaalsContact O-CG 3.26Å; G331-L335 WeakPolarHBondContact O-CG 3.37Å; G331-L335 PolarHBondContact O-N 3.24Å; S332-L335 CarbonylContact O-C 3.49Å; S332-L335 WeakPolarHBondContact O-CB 3.14Å; S332-L335 PolarHBondContact O-N 3.02Å; S332-L335 VanDerWaalsContact O-N 3.16Å; L335-Q338 PolarHBondContact O-N 2.66Å; L335-A339 WeakPolarHBondContact O-CB 3.46Å; L335-A339 PolarHBondContact O-N 3.16Å
336	T	54.3	Low	49.1	Very low	74 Å²	74	89.4 Å²	89.4	45%	0.454	46%	0.463	S	S	.	.	H	α-helix	trans	-62.4	-53.9	176.7	-53.5	0	0	0	0	111.4	S332 L334 Q338 A339 E340	S332-T336 PolarHBondContact O-N 2.82Å; S332-T336 PolarHBondContact O-OG1 2.96Å; L334-T336 VanDerWaalsContact C-N 3.33Å; L334-T336 PolarHBondContact O-N 3.46Å; T336-Q338 PolarHBondContact O-N 3Å; T336-A339 WeakPolarHBondContact O-CB 3.22Å; T336-A339 PolarHBondContact O-N 3.17Å; T336-E340 WeakPolarHBondContact CG2-OE1 3.42Å; T336-E340 VanDerWaalsContact O-CG 3.28Å; T336-E340 WeakPolarHBondContact O-CG 3.48Å; T336-E340 PolarHBondContact O-N 3.17Å
337	R	53.9	Low	50.8	Low	177 Å²	177	87.9 Å²	87.9	67%	0.668	45%	0.448	S	S	*	.	H	α-helix	trans	-62.6	-26.3	-178.7	-70.7	-179	-170.7	176.6	5.2	114.3	Q333 L334	Q333-R337 WeakPolarHBondContact O-CG 2.9Å; Q333-R337 PolarHBondContact O-N 2.81Å; L334-R337 PolarHBondContact O-N 3.47Å
338	Q	38.7	Very low	52.8	Low	111 Å²	111	85.4 Å²	85.4	52%	0.519	44%	0.437	S	S	.	.	H	α-helix	trans	-97.5	-16.9	179.8	-158.5	167.7	-29.7	0	0	112.8	L334 L335 T336 S341	L334-Q338 VanDerWaalsContact O-CB 3.32Å; L334-Q338 WeakPolarHBondContact O-CB 3.31Å; L334-Q338 PolarHBondContact O-N 3.33Å; L335-Q338 PolarHBondContact O-N 2.66Å; T336-Q338 PolarHBondContact O-N 3Å; Q338-S341 PolarHBondContact O-OG 3.48Å
339	A	45.9	Very low	54.8	Low	35 Å²	35	82 Å²	82	29%	0.289	41%	0.41	S	S	.	.	H	α-helix	trans	-71.8	-33.5	162.4	0	0	0	0	0	112	L335 T336 S341 Y344	L335-A339 WeakPolarHBondContact O-CB 3.46Å; L335-A339 PolarHBondContact O-N 3.16Å; T336-A339 WeakPolarHBondContact O-CB 3.22Å; T336-A339 PolarHBondContact O-N 3.17Å; A339-S341 VanDerWaalsContact C-N 3.28Å; A339-S341 PolarHBondContact O-N 3.18Å; A339-Y344 HydrophobicContact CB-CE2 3.61Å
340	E	54.8	Low	56.6	Low	145 Å²	145	77.8 Å²	77.8	68%	0.678	40%	0.396	S	S	*	.	S	Bend	trans	-68.9	-22	177.2	-75	165.2	173.1	0	0	113.4	T336	T336-E340 WeakPolarHBondContact CG2-OE1 3.42Å; T336-E340 VanDerWaalsContact O-CG 3.28Å; T336-E340 WeakPolarHBondContact O-CG 3.48Å; T336-E340 PolarHBondContact O-N 3.17Å
341	S	54.9	Low	58.5	Low	80 Å²	80	78.5 Å²	78.5	56%	0.559	40%	0.398	S	S	*	.	S	Bend	trans	-90.7	-22.3	-173.5	55.4	0	0	0	0	116	Q338 A339	Q338-S341 PolarHBondContact O-OG 3.48Å; A339-S341 VanDerWaalsContact C-N 3.28Å; A339-S341 PolarHBondContact O-N 3.18Å
342	E	56.5	Low	60.5	Low	72 Å²	72	78.9 Å²	78.9	34%	0.336	40%	0.402	S	S	.	.	S	Bend	trans	-148.9	137.5	-177.6	-66.8	-175.1	174.6	0	0	111.6	K274 H275 Y344	K274-E342 WeakPolarHBondContact CD-OE2 3.32Å; K274-E342 WeakPolarHBondContact CE-OE2 3.48Å; K274-E342 IonicContact NZ-OE1 2.74Å; K274-E342 PolarHBondContact NZ-OE1 2.81Å; K274-E342 IonicContact NZ-OE2 2.62Å; K274-E342 PolarHBondContact NZ-OE2 3.49Å; H275-E342 PolarHBondContact CE1-O 3.33Å; E342-Y344 PolarHBondContact O-N 2.61Å
343	P	60.3	Low	62.9	Low	59 Å²	59	77.2 Å²	77.2	38%	0.383	39%	0.388	S	S	.	.			trans	-69.2	130.5	175.6	28.3	-33.4	0	0	0	111.7	L229 R271 R345	L229-P343 HydrophobicContact CD2-CB 4.36Å; R271-P343 PolarHBondContact NE-O 3.03Å; P343-R345 PolarHBondContact O-N 3.06Å
344	Y	58.4	Low	64.7	Low	100 Å²	100	75.4 Å²	75.4	39%	0.392	39%	0.385	S	S	.	.	S	Bend	trans	-59.5	-14.8	179.2	-83.8	-106.7	0	0	0	114.9	R271 H275 A339 E342	R271-Y344 PolarHBondContact N-O 2.77Å; H275-Y344 HydrophobicContact CB-CD1 3.74Å; H275-Y344 HydrophobicContact CB-CE1 3.35Å; H275-Y344 AromaticContact CG-CD1 3.79Å; H275-Y344 AromaticContact CG-CE1 3.72Å; H275-Y344 AromaticContact ND1-CD1 3.99Å; H275-Y344 AromaticContact ND1-CD2 3.83Å; H275-Y344 AromaticContact ND1-CE1 3.83Å; H275-Y344 AromaticContact ND1-CE2 3.65Å; H275-Y344 AromaticContact ND1-CG 3.99Å; H275-Y344 AromaticContact ND1-CZ 3.65Å; A339-Y344 HydrophobicContact CB-CE2 3.61Å; E342-Y344 PolarHBondContact O-N 2.61Å
345	R	65.2	Low	66.8	Low	97 Å²	97	70.1 Å²	70.1	37%	0.366	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130	179.7	-64.4	179.4	179.3	140.6	10.7	108.5	G231 H270 P343	G231-R345 PolarHBondContact O-NH1 2.88Å; H270-R345 PolarHBondContact NE2-NE 3.38Å; P343-R345 PolarHBondContact O-N 3.06Å
346	Q	71.3	Confident	68.9	Low	31 Å²	31	66.8 Å²	66.8	15%	0.145	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	135.8	156.2	-155.7	171.3	-6.5	0	0	107.3	D200 S201 V268 N269 R271 T348	D200-Q346 VanDerWaalsContact CG-NE2 3.32Å; D200-Q346 WeakPolarHBondContact OD1-CG 3.41Å; D200-Q346 PolarHBondContact OD1-NE2 3.23Å; D200-Q346 VanDerWaalsContact OD1-NE2 3.14Å; D200-Q346 PolarHBondContact OD2-NE2 3.43Å; S201-Q346 WeakPolarHBondContact OG-CA 3.31Å; V268-Q346 CarbonylContact C-O 3.58Å; V268-Q346 WeakPolarHBondContact CA-O 3.26Å; N269-Q346 HydrophobicContact CB-CB 4.18Å; N269-Q346 PolarHBondContact N-O 3.08Å; N269-Q346 PolarHBondContact O-N 3.4Å; R271-Q346 VanDerWaalsContact NH2-CD 3.31Å; Q346-T348 HydrophobicContact CG-CG2 4.45Å
347	V	76	Confident	70.6	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	132.5	164.4	173.7	0	0	0	0	107.1	S201 L229 M234 A265 D267 V268	S201-V347 PolarHBondContact N-O 3.21Å; S201-V347 PolarHBondContact OG-N 3.09Å; S201-V347 PolarHBondContact OG-O 2.88Å; L229-V347 HydrophobicContact CD1-CB 3.89Å; L229-V347 HydrophobicContact CD1-CG2 3.36Å; M234-V347 HydrophobicContact CG-CB 4.16Å; M234-V347 HydrophobicContact CG-CG1 3.76Å; A265-V347 HydrophobicContact CB-CG1 3.92Å; D267-V347 WeakPolarHBondContact O-CA 3.33Å; V268-V347 HydrophobicContact CG1-CG2 4.08Å; V268-V347 HydrophobicContact CG2-CG2 4.32Å
348	T	79.9	Confident	72.4	Confident	40 Å²	40	56.7 Å²	56.7	25%	0.245	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146.7	170.7	57.4	0	0	0	0	111	V199 D200 S266 D267 Q346	V199-T348 CarbonylContact O-C 3.59Å; V199-T348 VanDerWaalsContact O-CA 3.28Å; V199-T348 WeakPolarHBondContact O-CA 3.42Å; D200-T348 HydrophobicContact CB-CG2 4.44Å; S266-T348 PolarHBondContact N-O 2.87Å; D267-T348 PolarHBondContact N-O 2.62Å; D267-T348 PolarHBondContact O-N 2.91Å; Q346-T348 HydrophobicContact CG-CG2 4.45Å
349	V	79.4	Confident	74.8	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	113.2	173.2	172.8	0	0	0	0	106.1	I195 E198 V199 M234 V264 E353	I195-V349 HydrophobicContact CB-CG1 4.47Å; I195-V349 HydrophobicContact CD1-CG1 3.66Å; I195-V349 HydrophobicContact CG2-CG1 4.21Å; E198-V349 WeakPolarHBondContact CA-O 3.47Å; V199-V349 HydrophobicContact CB-CB 3.87Å; V199-V349 HydrophobicContact CB-CG2 4.31Å; V199-V349 HydrophobicContact CG2-CB 3.87Å; V199-V349 HydrophobicContact CG2-CG1 4.08Å; V199-V349 PolarHBondContact N-O 2.96Å; V199-V349 PolarHBondContact O-N 2.65Å; M234-V349 HydrophobicContact CB-CG2 4.49Å; M234-V349 HydrophobicContact CG-CG2 4.48Å; V264-V349 HydrophobicContact CB-CG2 4.32Å; V264-V349 HydrophobicContact CG1-CG1 3.93Å; V264-V349 HydrophobicContact CG1-CG2 3.91Å; V349-E353 HydrophobicContact CG1-CB 4.1Å; V349-E353 WeakPolarHBondContact CG1-OE2 3.45Å
350	S	79.1	Confident	76.9	Confident	54 Å²	54	52.5 Å²	52.5	38%	0.378	28%	0.275	S	S	.	.			trans	-74.4	149.3	-177.4	-65.4	0	0	0	0	111.2	S266 G352 E353	S266-S350 WeakPolarHBondContact CB-OG 3.28Å; S266-S350 WeakPolarHBondContact OG-CB 3.29Å; S266-S350 PolarHBondContact OG-N 3.44Å; S350-G352 PolarHBondContact O-N 3.34Å; S350-E353 WeakPolarHBondContact O-CB 3.46Å; S350-E353 PolarHBondContact O-N 2.87Å
351	R	82.8	Confident	78.4	Confident	175 Å²	175	50.8 Å²	50.8	66%	0.66	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	126.4	173.8	-176.2	168.8	-176	-131.8	-7.2	110.1	D196 E198	D196-R351 WeakPolarHBondContact O-CD 3.09Å; D196-R351 WeakPolarHBondContact O-CG 3.49Å; D196-R351 PolarHBondContact O-NE 3.34Å; D196-R351 VanDerWaalsContact O-NE 3.11Å; E198-R351 HydrophobicContact CG-CB 3.77Å
352	G	84.4	Confident	79.8	Confident	41 Å²	41	49.2 Å²	49.2	42%	0.423	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	6.6	-174.3	0	0	0	0	0	115.2	I195 S350 V354	I195-G352 PolarHBondContact O-N 2.82Å; S350-G352 PolarHBondContact O-N 3.34Å; G352-V354 PolarHBondContact O-N 3.28Å
353	E	86.3	Confident	81	Confident	23 Å²	23	46 Å²	46	11%	0.107	24%	0.24	C	C	.	.			trans	-58.3	126.5	170.2	-171.8	171.1	163.4	0	0	110	Y194 I195 V264 A265 S266 V349 S350 V355	Y194-E353 WeakPolarHBondContact CA-O 3.48Å; I195-E353 PolarHBondContact N-O 3.04Å; V264-E353 HydrophobicContact CG1-CG 4.2Å; V264-E353 WeakPolarHBondContact CG1-OE1 3.49Å; A265-E353 VanDerWaalsContact C-OE2 3.3Å; A265-E353 PolarHBondContact N-OE1 3.44Å; S266-E353 PolarHBondContact N-OE2 3.02Å; S266-E353 VanDerWaalsContact N-OE2 3.09Å; S266-E353 PolarHBondContact OG-OE2 3.12Å; V349-E353 HydrophobicContact CG1-CB 4.1Å; V349-E353 WeakPolarHBondContact CG1-OE2 3.45Å; S350-E353 WeakPolarHBondContact O-CB 3.46Å; S350-E353 PolarHBondContact O-N 2.87Å; E353-V355 HydrophobicContact CG-CG1 4.43Å
354	V	87.1	Confident	81.9	Confident	70 Å²	70	45.6 Å²	45.6	42%	0.424	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125	-177.7	-176.7	0	0	0	0	109.4	G352	G352-V354 PolarHBondContact O-N 3.28Å
355	V	88.4	Confident	82.5	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	151.9	-173.1	-64.2	0	0	0	0	111.6	A193 I195 V264 E353 I357	A193-V355 HydrophobicContact CB-CG2 4.3Å; A193-V355 PolarHBondContact N-O 3.16Å; A193-V355 PolarHBondContact O-N 2.85Å; A193-V355 VanDerWaalsContact O-O 3.11Å; I195-V355 HydrophobicContact CD1-CG1 3.79Å; I195-V355 HydrophobicContact CD1-CG2 4.2Å; I195-V355 HydrophobicContact CG1-CG1 4.27Å; I195-V355 HydrophobicContact CG1-CG2 3.93Å; V264-V355 HydrophobicContact CB-CG1 4.5Å; V264-V355 HydrophobicContact CG1-CG1 3.67Å; V264-V355 HydrophobicContact CG2-CG1 3.9Å; E353-V355 HydrophobicContact CG-CG1 4.43Å; V355-I357 HydrophobicContact CG2-CG1 4.36Å
356	S	89.4	Confident	82.7	Confident	15 Å²	15	43.3 Å²	43.3	11%	0.105	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	111.9	167.3	-68.6	0	0	0	0	109.7	R190 L255	R190-S356 PolarHBondContact NH2-OG 3.28Å; L255-S356 PolarHBondContact N-O 3.24Å; L255-S356 PolarHBondContact O-N 3.41Å
357	I	90.2	Very high	82.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	119.8	172.9	-61.6	-179.9	0	0	0	108.7	R190 V191 A193 A210 L222 F238 A252 Y253 V355 F359	R190-I357 CarbonylContact C-O 3.5Å; R190-I357 VanDerWaalsContact CA-O 3.32Å; R190-I357 WeakPolarHBondContact CA-O 3.34Å; V191-I357 PolarHBondContact N-O 3.06Å; V191-I357 PolarHBondContact O-N 2.93Å; A193-I357 HydrophobicContact CB-CD1 3.43Å; A193-I357 VanDerWaalsContact CB-CD1 3.43Å; A193-I357 HydrophobicContact CB-CG1 3.86Å; A210-I357 HydrophobicContact CB-CD1 4.1Å; L222-I357 HydrophobicContact CD1-CD1 3.84Å; L222-I357 HydrophobicContact CD2-CD1 4.11Å; L222-I357 HydrophobicContact CD2-CG2 3.84Å; L222-I357 HydrophobicContact CG-CD1 4.36Å; F238-I357 HydrophobicContact CD2-CD1 4.43Å; F238-I357 HydrophobicContact CD2-CG2 4.37Å; F238-I357 HydrophobicContact CE2-CD1 3.94Å; F238-I357 HydrophobicContact CE2-CG1 4.03Å; F238-I357 HydrophobicContact CZ-CD1 4.32Å; A252-I357 HydrophobicContact CB-CG2 3.8Å; Y253-I357 WeakPolarHBondContact O-CA 3.45Å; V355-I357 HydrophobicContact CG2-CG1 4.36Å; I357-F359 HydrophobicContact CG2-CD2 4.39Å; I357-F359 HydrophobicContact CG2-CE2 3.97Å; I357-F359 HydrophobicContact CG2-CZ 4.25Å
358	L	90.9	Very high	82	Confident	39 Å²	39	47.6 Å²	47.6	20%	0.204	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	116	173.3	172.3	67.8	0	0	0	109.7	L188 T189 R190 A252 Y253 L255 V360	L188-L358 HydrophobicContact CB-CD1 4.47Å; L188-L358 WeakPolarHBondContact O-CD1 3.31Å; T189-L358 WeakPolarHBondContact O-CA 3.45Å; R190-L358 HydrophobicContact CG-CB 4.23Å; R190-L358 HydrophobicContact CG-CD1 3.75Å; A252-L358 CarbonylContact C-O 3.58Å; A252-L358 WeakPolarHBondContact CA-O 3.44Å; A252-L358 WeakPolarHBondContact CB-O 3.31Å; Y253-L358 PolarHBondContact N-O 3.47Å; Y253-L358 PolarHBondContact O-N 3.35Å; L255-L358 HydrophobicContact CD1-CB 3.29Å; L255-L358 HydrophobicContact CD1-CD2 4.03Å; L255-L358 HydrophobicContact CD1-CG 4.29Å; L358-V360 PolarHBondContact O-N 2.77Å
359	F	90.7	Very high	81	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.018	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	116.3	168.8	-66.4	-94.2	0	0	0	108.8	I185 L188 T189 V191 L222 M241 V250 A252 I357 V363	I185-F359 HydrophobicContact CD1-CD1 4Å; I185-F359 HydrophobicContact CD1-CD2 4.43Å; I185-F359 HydrophobicContact CD1-CE1 3.57Å; I185-F359 HydrophobicContact CD1-CE2 4.05Å; I185-F359 HydrophobicContact CD1-CG 4.42Å; I185-F359 HydrophobicContact CD1-CZ 3.59Å; I185-F359 HydrophobicContact CG2-CB 4.21Å; I185-F359 HydrophobicContact CG2-CD1 4.35Å; I185-F359 HydrophobicContact CG2-CD2 3.99Å; I185-F359 HydrophobicContact CG2-CE2 4.49Å; I185-F359 HydrophobicContact CG2-CG 3.91Å; L188-F359 WeakPolarHBondContact CA-O 3.44Å; L188-F359 PolarHBondContact N-O 2.88Å; T189-F359 PolarHBondContact O-N 3.02Å; V191-F359 HydrophobicContact CB-CE2 4.22Å; V191-F359 HydrophobicContact CG2-CD2 4.1Å; V191-F359 HydrophobicContact CG2-CE2 3.7Å; L222-F359 HydrophobicContact CD2-CE1 4.13Å; L222-F359 HydrophobicContact CD2-CZ 3.97Å; M241-F359 HydrophobicContact SD-CE1 4.12Å; M241-F359 HydrophobicContact SD-CZ 4.02Å; V250-F359 HydrophobicContact CB-CD1 4.48Å; V250-F359 HydrophobicContact CB-CE1 4.33Å; V250-F359 HydrophobicContact CG1-CE1 4.19Å; A252-F359 HydrophobicContact CB-CD1 3.88Å; A252-F359 HydrophobicContact CB-CE1 4.18Å; A252-F359 HydrophobicContact CB-CG 4.2Å; I357-F359 HydrophobicContact CG2-CD2 4.39Å; I357-F359 HydrophobicContact CG2-CE2 3.97Å; I357-F359 HydrophobicContact CG2-CZ 4.25Å; F359-V363 HydrophobicContact CD1-CG2 3.9Å; F359-V363 HydrophobicContact CE1-CG2 4.33Å
360	V	89	Confident	79.4	Confident	55 Å²	55	54.3 Å²	54.3	33%	0.333	31%	0.306	S	S	.	.			trans	-78.7	-43.8	-178.3	178.8	0	0	0	0	110.4	N251 Y253 L358	N251-V360 PolarHBondContact O-N 3.42Å; Y253-V360 HydrophobicContact CD2-CG2 3.66Å; Y253-V360 HydrophobicContact CE2-CG2 4.03Å; L358-V360 PolarHBondContact O-N 2.77Å
361	E	87	Confident	77.7	Confident	108 Å²	108	57.1 Å²	57.1	51%	0.505	32%	0.323	S	S	.	.	S	Bend	trans	-102.7	154.6	179.3	-71.6	170.5	-146.8	0	0	111.4	N251	N251-E361 HydrophobicContact CB-CB 4.18Å; N251-E361 HydrophobicContact CB-CG 4.19Å; N251-E361 PolarHBondContact ND2-OE1 2.94Å
362	P	83.7	Confident	75.4	Confident	47 Å²	47	54.3 Å²	54.3	31%	0.305	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-76.1	125.6	176.1	31.1	-30.6	0	0	0	110.5	Q183 I185 A187 M364	Q183-P362 VanDerWaalsContact NE2-CB 3.32Å; I185-P362 CarbonylContact O-C 3.56Å; I185-P362 WeakPolarHBondContact O-CA 3.48Å; A187-P362 HydrophobicContact CB-CB 4.16Å; A187-P362 HydrophobicContact CB-CG 4.38Å; P362-M364 HydrophobicContact CB-CE 3.9Å; P362-M364 HydrophobicContact CG-CE 3.91Å
363	V	81.9	Confident	72.9	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.024	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	121.1	178.9	-173.7	0	0	0	0	109.3	L184 I185 L248 V250 F359	L184-V363 PolarHBondContact N-O 2.92Å; I185-V363 HydrophobicContact CB-CB 4Å; I185-V363 HydrophobicContact CB-CG2 4.07Å; I185-V363 HydrophobicContact CD1-CB 4.49Å; I185-V363 HydrophobicContact CD1-CG2 4.22Å; I185-V363 HydrophobicContact CG1-CB 4.15Å; I185-V363 HydrophobicContact CG1-CG2 4.31Å; I185-V363 PolarHBondContact N-O 3.28Å; I185-V363 PolarHBondContact O-N 2.98Å; L248-V363 HydrophobicContact CB-CG1 4.11Å; L248-V363 HydrophobicContact CD1-CG1 4.24Å; L248-V363 HydrophobicContact CD2-CG1 4.17Å; L248-V363 HydrophobicContact CG-CG1 4.4Å; V250-V363 HydrophobicContact CB-CG2 4.31Å; V250-V363 HydrophobicContact CG1-CG1 4.18Å; V250-V363 HydrophobicContact CG1-CG2 3.76Å; F359-V363 HydrophobicContact CD1-CG2 3.9Å; F359-V363 HydrophobicContact CE1-CG2 4.33Å
364	M	80	Confident	70.3	Confident	52 Å²	52	60 Å²	60	26%	0.256	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	156.4	-174.7	-55.4	-65.4	-165	0	0	112.2	Q183 P362 N366 D367	Q183-M364 HydrophobicContact CB-SD 3.67Å; Q183-M364 HydrophobicContact CG-CE 4.35Å; Q183-M364 HydrophobicContact CG-SD 3.8Å; P362-M364 HydrophobicContact CB-CE 3.9Å; P362-M364 HydrophobicContact CG-CE 3.91Å; M364-N366 WeakPolarHBondContact CB-OD1 3.22Å; M364-N366 PolarHBondContact O-N 3.23Å; M364-N366 VanDerWaalsContact O-N 3.08Å; M364-D367 WeakPolarHBondContact CA-OD2 3.38Å; M364-D367 WeakPolarHBondContact CB-OD2 3.36Å; M364-D367 PolarHBondContact N-OD2 2.91Å; M364-D367 WeakPolarHBondContact O-CB 3.26Å; M364-D367 PolarHBondContact O-N 3.26Å
365	S	69.1	Low	67.6	Low	42 Å²	42	63.3 Å²	63.3	29%	0.294	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-8	-178.9	-156.3	0	0	0	0	114.1	I182 I368	I182-S365 WeakPolarHBondContact O-CB 3.44Å; I182-S365 PolarHBondContact O-N 2.9Å; S365-I368 WeakPolarHBondContact O-CD1 3.5Å; S365-I368 WeakPolarHBondContact O-CG1 3.4Å
366	N	70.5	Confident	64.6	Low	107 Å²	107	67 Å²	67	57%	0.572	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-8.4	170.4	54.7	-88.3	0	0	0	113.6	M364 I368	M364-N366 WeakPolarHBondContact CB-OD1 3.22Å; M364-N366 PolarHBondContact O-N 3.23Å; M364-N366 VanDerWaalsContact O-N 3.08Å; N366-I368 PolarHBondContact O-N 3.35Å
367	D	68.2	Low	61.9	Low	53 Å²	53	71.6 Å²	71.6	28%	0.283	46%	0.455	S	S	.	.			trans	-86.7	13.7	179.4	-51.9	-40.8	0	0	0	112.5	K249 M364 S369	K249-D367 PolarHBondContact N-O 3.46Å; K249-D367 VanDerWaalsContact N-O 3.09Å; M364-D367 WeakPolarHBondContact CA-OD2 3.38Å; M364-D367 WeakPolarHBondContact CB-OD2 3.36Å; M364-D367 PolarHBondContact N-OD2 2.91Å; M364-D367 WeakPolarHBondContact O-CB 3.26Å; M364-D367 PolarHBondContact O-N 3.26Å; D367-S369 PolarHBondContact O-N 2.98Å
368	I	63.6	Low	59	Low	67 Å²	67	77.2 Å²	77.2	34%	0.344	50%	0.495	S	S	.	.	B	Isolated β-bridge	trans	-69	112.1	174.4	-58.3	171.9	0	0	0	108.5	M246 F247 L248 S365 N366 T370	M246-I368 HydrophobicContact CE-CD1 3.63Å; M246-I368 HydrophobicContact CE-CG1 3.88Å; F247-I368 CarbonylContact O-C 3.6Å; F247-I368 WeakPolarHBondContact O-CA 3.38Å; L248-I368 HydrophobicContact CD2-CG1 3.81Å; S365-I368 WeakPolarHBondContact O-CD1 3.5Å; S365-I368 WeakPolarHBondContact O-CG1 3.4Å; N366-I368 PolarHBondContact O-N 3.35Å; I368-T370 PolarHBondContact O-N 2.99Å; I368-T370 VanDerWaalsContact O-N 3.1Å
369	S	59.3	Low	56.2	Low	64 Å²	64	83.6 Å²	83.6	45%	0.448	52%	0.523	S	S	.	.			trans	-69.9	104	171.1	-62.9	0	0	0	0	109.1	F247 D367	F247-S369 PolarHBondContact O-N 2.96Å; D367-S369 PolarHBondContact O-N 2.98Å
370	T	46.3	Very low	53.2	Low	120 Å²	120	88.1 Å²	88.1	74%	0.736	56%	0.555	S	S	*	*			trans	-57.1	126.4	171.4	49.4	0	0	0	0	109.4	I368 S372	I368-T370 PolarHBondContact O-N 2.99Å; I368-T370 VanDerWaalsContact O-N 3.1Å; T370-S372 PolarHBondContact O-N 3.24Å; T370-S372 VanDerWaalsContact O-N 3.16Å
371	P	42.6	Very low	50.3	Low	113 Å²	113	91.7 Å²	91.7	73%	0.734	58%	0.58	S	S	*	*			trans	-60.7	123.4	175.9	25.7	-33.2	0	0	0	108.5	S373	P371-S373 VanDerWaalsContact C-N 3.29Å; P371-S373 PolarHBondContact O-N 2.89Å
372	S	34.5	Very low	47.7	Very low	116 Å²	116	91.9 Å²	91.9	81%	0.811	59%	0.593	S	S	*	*			trans	-73.2	82.6	-175	56.7	0	0	0	0	110.7	T370 G374	T370-S372 PolarHBondContact O-N 3.24Å; T370-S372 VanDerWaalsContact O-N 3.16Å; S372-G374 PolarHBondContact O-N 3.46Å
373	S	31.7	Very low	45.3	Very low	130 Å²	130	96 Å²	96	91%	0.909	62%	0.623	S	S	*	*			trans	-70.8	63	165.4	59	0	0	0	0	110	P371	P371-S373 VanDerWaalsContact C-N 3.29Å; P371-S373 PolarHBondContact O-N 2.89Å
374	G	32.5	Very low	42.9	Very low	54 Å²	54	99.1 Å²	99.1	56%	0.557	66%	0.656	S	S	*	*			trans	-131	111.7	-177.3	0	0	0	0	0	109.9	S372	S372-G374 PolarHBondContact O-N 3.46Å
375	T	30.3	Very low	41.2	Very low	138 Å²	138	106 Å²	106	85%	0.847	68%	0.679	S	S	*	*			trans	31.9	109.4	158	-46.1	0	0	0	0	117.3
376	A	24.4	Very low	39.7	Very low	79 Å²	79	109.3 Å²	109.3	65%	0.653	70%	0.699	S	S	*	*			trans	-53.6	135.1	166.9	0	0	0	0	0	110.7	S378	A376-S378 VanDerWaalsContact C-N 3.34Å; A376-S378 PolarHBondContact O-N 2.97Å
377	P	32.9	Very low	38.3	Very low	111 Å²	111	109.4 Å²	109.4	72%	0.721	70%	0.699	S	S	*	*			trans	-69.9	93.3	175	28.3	-33.2	0	0	0	109.5	E379	P377-E379 HydrophobicContact CB-CG 4.3Å; P377-E379 PolarHBondContact O-N 3.13Å
378	S	29.2	Very low	37.8	Very low	119 Å²	119	110 Å²	110	83%	0.832	71%	0.705	S	S	*	*			trans	-71.6	55.8	157.2	-63.7	0	0	0	0	110	A376 S380	A376-S378 VanDerWaalsContact C-N 3.34Å; A376-S378 PolarHBondContact O-N 2.97Å; S378-S380 PolarHBondContact O-N 2.85Å; S378-S380 VanDerWaalsContact O-N 3.14Å
379	E	32.4	Very low	37.3	Very low	173 Å²	173	113.8 Å²	113.8	81%	0.808	72%	0.721	S	S	*	*			trans	-69.9	106.5	164.2	-73.8	-166.8	117.5	0	0	107.6	P377	P377-E379 HydrophobicContact CB-CG 4.3Å; P377-E379 PolarHBondContact O-N 3.13Å
380	S	28.2	Very low	37.3	Very low	99 Å²	99	113.4 Å²	113.4	69%	0.692	72%	0.722	S	S	*	*			trans	-54.7	148.2	173.7	-60.2	0	0	0	0	110.7	S378 S382	S378-S380 PolarHBondContact O-N 2.85Å; S378-S380 VanDerWaalsContact O-N 3.14Å; S380-S382 PolarHBondContact O-N 3.38Å
381	P	28	Very low	38.4	Very low	130 Å²	130	112 Å²	112	84%	0.844	71%	0.707	S	S	*	*			trans	-63.7	98.4	-175.6	26.1	-35.1	0	0	0	111.3	S383	P381-S383 PolarHBondContact O-N 3.39Å
382	S	33.3	Very low	39.1	Very low	112 Å²	112	108.8 Å²	108.8	78%	0.783	69%	0.69	S	S	*	*			trans	-73.7	108.3	176.6	51.4	0	0	0	0	109.5	S380 G384	S380-S382 PolarHBondContact O-N 3.38Å; S382-G384 PolarHBondContact O-N 3.39Å
383	S	31.6	Very low	40.6	Very low	134 Å²	134	108.2 Å²	108.2	94%	0.937	68%	0.675	S	S	*	*			trans	-55.7	101.3	-176.8	-59.9	0	0	0	0	112.4	P381	P381-S383 PolarHBondContact O-N 3.39Å
384	G	32.6	Very low	42	Very low	69 Å²	69	108.2 Å²	108.2	71%	0.711	66%	0.66	S	S	*	*			trans	-131.5	69.7	-169.2	0	0	0	0	0	114.3	S382	S382-G384 PolarHBondContact O-N 3.39Å
385	R	43.3	Very low	43.8	Very low	195 Å²	195	111.2 Å²	111.2	74%	0.736	66%	0.659	S	S	*	*			trans	60.7	124.4	171.5	-177.8	172.6	173.1	142.8	-6.5	115.8	L387	R385-L387 PolarHBondContact O-N 2.88Å
386	P	37.8	Very low	45.6	Very low	112 Å²	112	106.9 Å²	106.9	73%	0.727	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-64.3	135.9	170	28.6	-33.7	0	0	0	109.9	T388	P386-T388 PolarHBondContact O-N 3.44Å
387	L	41.4	Very low	47.8	Very low	109 Å²	109	105.8 Å²	105.8	57%	0.571	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-56.4	133.7	166.3	-90	76.6	0	0	0	108.5	R385 E391	R385-L387 PolarHBondContact O-N 2.88Å; L387-E391 HydrophobicContact CB-CB 4.43Å; L387-E391 HydrophobicContact CD2-CB 4.18Å; L387-E391 HydrophobicContact CG-CB 4.28Å
388	T	57.2	Low	49.6	Very low	66 Å²	66	104.5 Å²	104.5	41%	0.405	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-68.8	152	166.7	65.1	0	0	0	0	109.2	P386 A390 E391 A392	P386-T388 PolarHBondContact O-N 3.44Å; T388-A390 PolarHBondContact O-N 3Å; T388-A390 VanDerWaalsContact O-N 3.14Å; T388-E391 VanDerWaalsContact CB-OE2 3.31Å; T388-E391 WeakPolarHBondContact CB-OE2 3.23Å; T388-E391 WeakPolarHBondContact CG2-OE2 3.46Å; T388-E391 PolarHBondContact N-OE2 3.2Å; T388-E391 WeakPolarHBondContact O-CB 3.41Å; T388-E391 PolarHBondContact O-N 3.25Å; T388-E391 VanDerWaalsContact OG1-CD 3.28Å; T388-E391 WeakPolarHBondContact OG1-CG 3.48Å; T388-E391 PolarHBondContact OG1-OE2 2.92Å; T388-A392 PolarHBondContact O-N 3.1Å
389	Q	53.2	Low	51.4	Low	146 Å²	146	107.7 Å²	107.7	68%	0.682	61%	0.606	S	S	*	*	H	α-helix	trans	-56.8	-34.1	-177	-174.6	175.5	-32.2	0	0	112.4	E391 A392 E393	Q389-E391 PolarHBondContact O-N 3.39Å; Q389-A392 PolarHBondContact O-N 3.22Å; Q389-E393 HydrophobicContact CG-CG 4.37Å; Q389-E393 WeakPolarHBondContact CG-OE1 3.31Å; Q389-E393 PolarHBondContact NE2-OE1 2.72Å; Q389-E393 WeakPolarHBondContact O-CB 3.19Å; Q389-E393 WeakPolarHBondContact O-CG 3.26Å; Q389-E393 PolarHBondContact O-N 2.99Å
390	A	60.3	Low	53	Low	56 Å²	56	104.3 Å²	104.3	46%	0.463	59%	0.593	S	S	.	*	H	α-helix	trans	-63.8	-36.5	175.1	0	0	0	0	0	113.6	T388 H394	T388-A390 PolarHBondContact O-N 3Å; T388-A390 VanDerWaalsContact O-N 3.14Å; A390-H394 WeakPolarHBondContact O-CB 3.21Å; A390-H394 PolarHBondContact O-CD2 2.9Å; A390-H394 PolarHBondContact O-N 2.91Å
391	E	68.8	Low	55.1	Low	90 Å²	90	107.2 Å²	107.2	42%	0.421	59%	0.588	S	S	.	*	H	α-helix	trans	-69.4	-37.9	176.2	-69.1	160.3	130.6	0	0	110.8	L387 T388 Q389 Q395	L387-E391 HydrophobicContact CB-CB 4.43Å; L387-E391 HydrophobicContact CD2-CB 4.18Å; L387-E391 HydrophobicContact CG-CB 4.28Å; T388-E391 VanDerWaalsContact CB-OE2 3.31Å; T388-E391 WeakPolarHBondContact CB-OE2 3.23Å; T388-E391 WeakPolarHBondContact CG2-OE2 3.46Å; T388-E391 PolarHBondContact N-OE2 3.2Å; T388-E391 WeakPolarHBondContact O-CB 3.41Å; T388-E391 PolarHBondContact O-N 3.25Å; T388-E391 VanDerWaalsContact OG1-CD 3.28Å; T388-E391 WeakPolarHBondContact OG1-CG 3.48Å; T388-E391 PolarHBondContact OG1-OE2 2.92Å; Q389-E391 PolarHBondContact O-N 3.39Å; E391-Q395 WeakPolarHBondContact O-CB 3.44Å; E391-Q395 PolarHBondContact O-N 2.92Å
392	A	57.7	Low	57.1	Low	46 Å²	46	103.7 Å²	103.7	38%	0.38	57%	0.57	S	S	.	*	H	α-helix	trans	-68.2	-41.3	174	0	0	0	0	0	112.5	T388 Q389 Q395 A396	T388-A392 PolarHBondContact O-N 3.1Å; Q389-A392 PolarHBondContact O-N 3.22Å; A392-Q395 PolarHBondContact O-N 3.21Å; A392-A396 WeakPolarHBondContact O-CB 3.08Å; A392-A396 PolarHBondContact O-N 3.42Å
393	E	65.1	Low	58.7	Low	104 Å²	104	101 Å²	101	49%	0.486	55%	0.554	S	S	.	*	H	α-helix	trans	-66.8	-37.1	176.8	-76.1	172.1	-173.1	0	0	112.3	Q389 S397	Q389-E393 HydrophobicContact CG-CG 4.37Å; Q389-E393 WeakPolarHBondContact CG-OE1 3.31Å; Q389-E393 PolarHBondContact NE2-OE1 2.72Å; Q389-E393 WeakPolarHBondContact O-CB 3.19Å; Q389-E393 WeakPolarHBondContact O-CG 3.26Å; Q389-E393 PolarHBondContact O-N 2.99Å; E393-S397 VanDerWaalsContact O-CB 3.32Å; E393-S397 WeakPolarHBondContact O-CB 3.5Å; E393-S397 PolarHBondContact O-N 3.45Å; E393-S397 PolarHBondContact O-OG 2.95Å
394	H	62.4	Low	60.3	Low	130 Å²	130	98.4 Å²	98.4	60%	0.602	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-49.2	169.7	-98	-86	0	0	0	111.9	A390 A396 S397 D398	A390-H394 WeakPolarHBondContact O-CB 3.21Å; A390-H394 PolarHBondContact O-CD2 2.9Å; A390-H394 PolarHBondContact O-N 2.91Å; H394-A396 VanDerWaalsContact C-N 3.28Å; H394-A396 PolarHBondContact O-N 2.68Å; H394-S397 WeakPolarHBondContact O-CB 3.39Å; H394-S397 PolarHBondContact O-N 3.43Å; H394-S397 VanDerWaalsContact O-N 3.12Å; H394-D398 PolarHBondContact O-N 3.24Å
395	Q	70.3	Confident	62.1	Low	117 Å²	117	100.7 Å²	100.7	55%	0.547	53%	0.528	S	S	.	.	H	α-helix	trans	-64	-33.3	179.8	-165.8	-180	47.7	0	0	112.5	E391 A392 R399	E391-Q395 WeakPolarHBondContact O-CB 3.44Å; E391-Q395 PolarHBondContact O-N 2.92Å; A392-Q395 PolarHBondContact O-N 3.21Å; Q395-R399 WeakPolarHBondContact O-CB 3.45Å; Q395-R399 WeakPolarHBondContact O-CG 3.26Å; Q395-R399 PolarHBondContact O-N 3.42Å
396	A	66.7	Low	63.3	Low	48 Å²	48	100.3 Å²	100.3	40%	0.397	53%	0.527	S	S	.	.	H	α-helix	trans	-68	-44.6	171.5	0	0	0	0	0	111.7	A392 H394 D398 R399 I400	A392-A396 WeakPolarHBondContact O-CB 3.08Å; A392-A396 PolarHBondContact O-N 3.42Å; H394-A396 VanDerWaalsContact C-N 3.28Å; H394-A396 PolarHBondContact O-N 2.68Å; A396-D398 PolarHBondContact O-N 3.15Å; A396-R399 PolarHBondContact O-N 3.44Å; A396-I400 VanDerWaalsContact O-CG1 3.31Å; A396-I400 WeakPolarHBondContact O-CG1 3.49Å; A396-I400 PolarHBondContact O-N 3.23Å
397	S	71.4	Confident	64.3	Low	56 Å²	56	102.9 Å²	102.9	39%	0.392	53%	0.527	S	S	.	.	H	α-helix	trans	-60.6	-44.2	-180	-63.3	0	0	0	0	112.5	E393 H394 I400 R401	E393-S397 VanDerWaalsContact O-CB 3.32Å; E393-S397 WeakPolarHBondContact O-CB 3.5Å; E393-S397 PolarHBondContact O-N 3.45Å; E393-S397 PolarHBondContact O-OG 2.95Å; H394-S397 WeakPolarHBondContact O-CB 3.39Å; H394-S397 PolarHBondContact O-N 3.43Å; H394-S397 VanDerWaalsContact O-N 3.12Å; S397-I400 PolarHBondContact O-N 3.23Å; S397-R401 WeakPolarHBondContact O-CG 3.22Å; S397-R401 PolarHBondContact O-N 3.32Å
398	D	70.4	Confident	64.7	Low	83 Å²	83	103 Å²	103	44%	0.444	53%	0.527	S	S	.	.	H	α-helix	trans	-73.4	-31.1	178.2	-72.1	-23.4	0	0	0	112.5	H394 A396 I400 R401 A402	H394-D398 PolarHBondContact O-N 3.24Å; A396-D398 PolarHBondContact O-N 3.15Å; D398-I400 VanDerWaalsContact C-N 3.35Å; D398-R401 PolarHBondContact O-N 3.05Å; D398-R401 IonicContact OD1-CZ 3.32Å; D398-R401 IonicContact OD1-NH1 2.97Å; D398-R401 PolarHBondContact OD1-NH1 3.18Å; D398-A402 WeakPolarHBondContact O-CB 3.33Å; D398-A402 PolarHBondContact O-N 3.04Å
399	R	66.7	Low	64.3	Low	187 Å²	187	103.2 Å²	103.2	71%	0.706	53%	0.531	S	S	*	.	H	α-helix	trans	-63.1	-39	168.1	-81.7	-177	167.5	-160.1	-2.4	112.4	Q395 A396 A403	Q395-R399 WeakPolarHBondContact O-CB 3.45Å; Q395-R399 WeakPolarHBondContact O-CG 3.26Å; Q395-R399 PolarHBondContact O-N 3.42Å; A396-R399 PolarHBondContact O-N 3.44Å; R399-A403 WeakPolarHBondContact O-CB 3.46Å; R399-A403 PolarHBondContact O-N 3.13Å
400	I	67	Low	64.1	Low	101 Å²	101	102.4 Å²	102.4	52%	0.518	53%	0.529	S	S	.	.	H	α-helix	trans	-66.7	-45.7	175.6	-68.9	163.4	0	0	0	110.3	A396 S397 D398 A402 A403 V404	A396-I400 VanDerWaalsContact O-CG1 3.31Å; A396-I400 WeakPolarHBondContact O-CG1 3.49Å; A396-I400 PolarHBondContact O-N 3.23Å; S397-I400 PolarHBondContact O-N 3.23Å; D398-I400 VanDerWaalsContact C-N 3.35Å; I400-A402 PolarHBondContact O-N 2.69Å; I400-A403 PolarHBondContact O-N 2.93Å; I400-V404 HydrophobicContact CG2-CG2 4.47Å; I400-V404 WeakPolarHBondContact O-CG2 3.31Å; I400-V404 PolarHBondContact O-N 3.17Å
401	R	72.8	Confident	63.2	Low	160 Å²	160	108.2 Å²	108.2	60%	0.604	54%	0.544	S	S	*	.	H	α-helix	trans	-57.4	-47.7	174.7	-74.4	169.9	170.9	162.6	-5.5	112.4	S397 D398 A403 V404 L405	S397-R401 WeakPolarHBondContact O-CG 3.22Å; S397-R401 PolarHBondContact O-N 3.32Å; D398-R401 PolarHBondContact O-N 3.05Å; D398-R401 IonicContact OD1-CZ 3.32Å; D398-R401 IonicContact OD1-NH1 2.97Å; D398-R401 PolarHBondContact OD1-NH1 3.18Å; R401-A403 VanDerWaalsContact C-N 3.31Å; R401-A403 PolarHBondContact O-N 3.44Å; R401-V404 PolarHBondContact O-N 3.05Å; R401-L405 WeakPolarHBondContact O-CG 3.39Å; R401-L405 PolarHBondContact O-N 2.65Å
402	A	69.4	Low	62.1	Low	56 Å²	56	111.1 Å²	111.1	46%	0.463	56%	0.562	S	S	.	*	H	α-helix	trans	-61.6	-37.6	176.6	0	0	0	0	0	112.5	D398 I400 R406	D398-A402 WeakPolarHBondContact O-CB 3.33Å; D398-A402 PolarHBondContact O-N 3.04Å; I400-A402 PolarHBondContact O-N 2.69Å; A402-R406 PolarHBondContact O-N 3.28Å
403	A	66.4	Low	61.2	Low	55 Å²	55	116 Å²	116	46%	0.455	58%	0.578	S	S	.	*	H	α-helix	trans	-69.6	-36.4	175.6	0	0	0	0	0	113.1	R399 I400 R401 K407	R399-A403 WeakPolarHBondContact O-CB 3.46Å; R399-A403 PolarHBondContact O-N 3.13Å; I400-A403 PolarHBondContact O-N 2.93Å; R401-A403 VanDerWaalsContact C-N 3.31Å; R401-A403 PolarHBondContact O-N 3.44Å; A403-K407 PolarHBondContact O-N 2.78Å
404	V	66.6	Low	59.8	Low	81 Å²	81	118.9 Å²	118.9	49%	0.491	59%	0.591	S	S	.	*	H	α-helix	trans	-66.3	-46.2	174.3	169.8	0	0	0	0	110.8	I400 R401 R406 K407 L408	I400-V404 HydrophobicContact CG2-CG2 4.47Å; I400-V404 WeakPolarHBondContact O-CG2 3.31Å; I400-V404 PolarHBondContact O-N 3.17Å; R401-V404 PolarHBondContact O-N 3.05Å; V404-R406 PolarHBondContact O-N 3.08Å; V404-K407 CarbonylContact O-C 3.58Å; V404-K407 PolarHBondContact O-N 3.46Å; V404-K407 VanDerWaalsContact O-N 3.09Å; V404-L408 HydrophobicContact CG1-CD1 4.13Å; V404-L408 PolarHBondContact O-N 2.96Å
405	L	69.6	Low	58.6	Low	116 Å²	116	122.5 Å²	122.5	61%	0.607	61%	0.608	S	S	*	*	H	α-helix	trans	-59	-44.3	175.3	-71.4	167.8	0	0	0	111.7	R401 K407 L408 S409	R401-L405 WeakPolarHBondContact O-CG 3.39Å; R401-L405 PolarHBondContact O-N 2.65Å; L405-K407 VanDerWaalsContact C-N 3.32Å; L405-K407 PolarHBondContact O-N 3.09Å; L405-L408 PolarHBondContact O-N 3.47Å; L405-L408 VanDerWaalsContact O-N 3.13Å; L405-S409 PolarHBondContact O-N 3.14Å
406	R	67.8	Low	57.3	Low	187 Å²	187	124 Å²	124	71%	0.706	62%	0.619	S	S	*	*	H	α-helix	trans	-58.5	-38.8	172.6	-101.4	-176.8	171	175.8	-2.3	113.5	A402 V404 L408 M410	A402-R406 PolarHBondContact O-N 3.28Å; V404-R406 PolarHBondContact O-N 3.08Å; R406-L408 VanDerWaalsContact C-N 3.33Å; R406-M410 WeakPolarHBondContact O-CB 3.32Å; R406-M410 WeakPolarHBondContact O-CG 3.36Å; R406-M410 PolarHBondContact O-N 3.35Å
407	K	58.9	Low	56	Low	167 Å²	167	127.2 Å²	127.2	73%	0.726	64%	0.637	S	S	*	*	H	α-helix	trans	-76	-16.6	177	-82.1	-165.5	173.2	-174.3	0	114.3	A403 V404 L405	A403-K407 PolarHBondContact O-N 2.78Å; V404-K407 CarbonylContact O-C 3.58Å; V404-K407 PolarHBondContact O-N 3.46Å; V404-K407 VanDerWaalsContact O-N 3.09Å; L405-K407 VanDerWaalsContact C-N 3.32Å; L405-K407 PolarHBondContact O-N 3.09Å
408	L	49.9	Very low	54.3	Low	111 Å²	111	128.4 Å²	128.4	58%	0.581	66%	0.657	S	S	*	*	H	α-helix	trans	-81.9	-46.6	170.9	-71.9	165.9	0	0	0	110.8	V404 L405 R406 K411	V404-L408 HydrophobicContact CG1-CD1 4.13Å; V404-L408 PolarHBondContact O-N 2.96Å; L405-L408 PolarHBondContact O-N 3.47Å; L405-L408 VanDerWaalsContact O-N 3.13Å; R406-L408 VanDerWaalsContact C-N 3.33Å; L408-K411 PolarHBondContact O-N 2.97Å
409	S	48.2	Very low	52.5	Low	70 Å²	70	130.2 Å²	130.2	49%	0.49	68%	0.676	S	S	.	*	H	α-helix	trans	-58	-54.1	174.8	153.5	0	0	0	0	111.9	L405 K411 N412	L405-S409 PolarHBondContact O-N 3.14Å; S409-K411 PolarHBondContact O-N 3.23Å; S409-N412 PolarHBondContact O-N 2.86Å; S409-N412 VanDerWaalsContact O-N 3.1Å
410	M	49.2	Very low	50.5	Low	130 Å²	130	131.3 Å²	131.3	64%	0.64	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	10.6	179.8	-65.2	-169	-56.8	0	0	115.1	R406	R406-M410 WeakPolarHBondContact O-CB 3.32Å; R406-M410 WeakPolarHBondContact O-CG 3.36Å; R406-M410 PolarHBondContact O-N 3.35Å
411	K	42.9	Very low	49	Very low	178 Å²	178	130.2 Å²	130.2	77%	0.774	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-2.5	171.4	-144.6	-165.4	172	-166.7	0	114	L408 S409	L408-K411 PolarHBondContact O-N 2.97Å; S409-K411 PolarHBondContact O-N 3.23Å
412	N	44	Very low	47	Very low	150 Å²	150	130.9 Å²	130.9	80%	0.802	71%	0.71	S	S	*	*	S	Bend	trans	-102.1	-3.2	175.4	-75.1	0.1	0	0	0	113.7	S409	S409-N412 PolarHBondContact O-N 2.86Å; S409-N412 VanDerWaalsContact O-N 3.1Å
413	E	39.3	Very low	45.2	Very low	150 Å²	150	133.6 Å²	133.6	70%	0.701	72%	0.721	S	S	*	*	S	Bend	trans	-121.4	52.5	-175.4	-65.6	-179.6	92.6	0	0	112.3
414	H	36.7	Very low	43.7	Very low	164 Å²	164	137 Å²	137	76%	0.759	74%	0.736	S	S	*	*			trans	-148	59.9	177.5	-154.2	63.7	0	0	0	115.4
415	E	36.2	Very low	42.1	Very low	205 Å²	205	137.9 Å²	137.9	96%	0.958	75%	0.752	S	S	*	*			trans	-127.4	112.3	149.1	-70.5	-164.9	123.8	0	0	108
416	D	43.6	Very low	40.5	Very low	148 Å²	148	137.8 Å²	137.8	79%	0.791	76%	0.759	S	S	*	*			trans	-114.1	174.4	-174.4	-139.7	8.4	0	0	0	108.9
417	P	40	Very low	38.6	Very low	117 Å²	117	133.6 Å²	133.6	76%	0.76	76%	0.764	S	S	*	*				-121.1	160.4	-123.2	32	-12.3	0	0	0	114.8
418	G	35	Very low	37.3	Very low	80 Å²	80	130.3 Å²	130.3	83%	0.825	76%	0.762	S	S	*	*			trans	157.7	110.4	157.4	0	0	0	0	0	117.3
419	S	32.7	Very low	36.5	Very low	121 Å²	121	128.9 Å²	128.9	85%	0.846	77%	0.774	S	S	*	*				-166.9	132.2	120	-164.4	0	0	0	0	110.8
420	F	25.6	Very low	35.8	Very low	210 Å²	210	134.7 Å²	134.7	92%	0.921	79%	0.79	S	S	*	*			trans	-67.5	153.2	154.4	-96.9	-117.6	0	0	0	109
421	G	35.5	Very low	35.1	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	79%	0.788	S	S	*	*			trans	173.1	92.2	-177.8	0	0	0	0	0	113.1
422	E	30.7	Very low	35	Very low	175 Å²	175	131.6 Å²	131.6	82%	0.818	79%	0.785	S	S	*	*			trans	-73.6	163.9	-165.7	-146.5	165.4	115.6	0	0	116
423	T	30.6	Very low	35	Very low	113 Å²	113	129.6 Å²	129.6	69%	0.693	77%	0.773	S	S	*	*			trans	80.7	141.7	153.1	26.8	0	0	0	0	124.1
424	T	34.6	Very low	35.1	Very low	125 Å²	125	127.7 Å²	127.7	77%	0.767	76%	0.762	S	S	*	*			trans	65.5	112.1	155.1	55.1	0	0	0	0	121.1
425	A	34	Very low	35.1	Very low	100 Å²	100	128.1 Å²	128.1	83%	0.826	76%	0.758	S	S	*	*			trans	-77.8	141.8	149.1	0	0	0	0	0	110.2
426	P	35.6	Very low	35.4	Very low	115 Å²	115	125.8 Å²	125.8	75%	0.747	75%	0.747	S	S	*	*				-146.5	150.3	121.5	36.5	-21.6	0	0	0	116.5
427	A	28.6	Very low	35.2	Very low	98 Å²	98	127.1 Å²	127.1	81%	0.81	74%	0.742	S	S	*	*			trans	32.3	122.4	145.4	0	0	0	0	0	123.2
428	S	31.2	Very low	35.2	Very low	98 Å²	98	125.6 Å²	125.6	69%	0.685	73%	0.726	S	S	*	*			trans	66.2	71.8	131.9	-178.6	0	0	0	0	120.2
429	G	31.6	Very low	35.8	Very low	81 Å²	81	124.9 Å²	124.9	84%	0.835	72%	0.718	S	S	*	*			trans	-98.4	104.7	157.1	0	0	0	0	0	113	S431	G429-S431 PolarHBondContact O-N 3.5Å
430	K	34.6	Very low	36.5	Very low	192 Å²	192	125.3 Å²	125.3	84%	0.835	70%	0.702	S	S	*	*			trans	-82	114.1	-177.9	-68.7	173.1	-176.5	169.7	0	111.7
431	S	34.8	Very low	38	Very low	85 Å²	85	118 Å²	118	59%	0.594	68%	0.676	S	S	*	*			trans	-65.2	138.2	-177.4	59.8	0	0	0	0	113.6	G429 L433 K434	G429-S431 PolarHBondContact O-N 3.5Å; S431-L433 VanDerWaalsContact C-N 3.31Å; S431-L433 PolarHBondContact O-N 2.73Å; S431-K434 PolarHBondContact O-N 2.87Å
432	F	40.5	Very low	39	Very low	159 Å²	159	118 Å²	118	70%	0.697	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-65.8	-27.3	-164.7	-163.4	-101.4	0	0	0	114.3	K434 R435	F432-K434 PolarHBondContact O-N 3.2Å; F432-R435 PolarHBondContact O-N 2.81Å
433	L	44	Very low	40.6	Very low	108 Å²	108	114.3 Å²	114.3	57%	0.565	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-66.4	-14.2	-177.5	-88.5	73.9	0	0	0	114.6	S431 R435 L442	S431-L433 VanDerWaalsContact C-N 3.31Å; S431-L433 PolarHBondContact O-N 2.73Å; L433-R435 VanDerWaalsContact C-N 3.29Å; L433-R435 PolarHBondContact O-N 2.92Å; L433-L442 WeakPolarHBondContact O-CD1 3.44Å
434	K	40.4	Very low	42.4	Very low	109 Å²	109	111.9 Å²	111.9	47%	0.474	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-78	-2.3	178.9	-87	-174.8	175.8	-171.8	0	115.1	S431 F432 Q436 D521	S431-K434 PolarHBondContact O-N 2.87Å; F432-K434 PolarHBondContact O-N 3.2Å; K434-Q436 PolarHBondContact O-N 3.34Å; K434-D521 WeakPolarHBondContact CE-OD1 3.41Å; K434-D521 WeakPolarHBondContact CE-OD2 3.47Å; K434-D521 VanDerWaalsContact NZ-CG 3.25Å; K434-D521 IonicContact NZ-OD1 3.78Å; K434-D521 IonicContact NZ-OD2 3.15Å; K434-D521 PolarHBondContact NZ-OD2 3Å
435	R	37.5	Very low	44.3	Very low	174 Å²	174	110.5 Å²	110.5	66%	0.657	62%	0.615	S	S	*	*			trans	-70.7	100.9	-178.8	-72.2	-174.6	177	-122.2	1.2	111.8	F432 L433 Y437	F432-R435 PolarHBondContact O-N 2.81Å; L433-R435 VanDerWaalsContact C-N 3.29Å; L433-R435 PolarHBondContact O-N 2.92Å; R435-Y437 PolarHBondContact O-N 3.16Å; R435-Y437 VanDerWaalsContact O-N 3.07Å
436	Q	41.7	Very low	46.1	Very low	156 Å²	156	108.6 Å²	108.6	73%	0.729	60%	0.599	S	S	*	*			trans	-66.1	100.2	167.5	-70.3	174.4	-54.6	0	0	110.1	K434	K434-Q436 PolarHBondContact O-N 3.34Å
437	Y	40.3	Very low	48	Very low	176 Å²	176	104.7 Å²	104.7	69%	0.69	58%	0.579	S	S	*	*	B	Isolated β-bridge	trans	-87.6	120.6	175.5	-149.7	-96.7	0	0	0	109.6	R435 G439 Y440 W445	R435-Y437 PolarHBondContact O-N 3.16Å; R435-Y437 VanDerWaalsContact O-N 3.07Å; Y437-G439 VanDerWaalsContact C-N 3.27Å; Y437-G439 PolarHBondContact O-N 3.31Å; Y437-Y440 PolarHBondContact O-N 3.02Å; Y437-W445 HydrophobicContact CD1-CZ2 4.21Å; Y437-W445 PolarHBondContact O-NE1 2.96Å
438	M	39.6	Very low	49.8	Very low	85 Å²	85	102.8 Å²	102.8	42%	0.419	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	55.5	32.6	177.7	-148.4	-168.8	-150.9	0	0	115.8	Y440 W445 K890	M438-Y440 VanDerWaalsContact C-N 3.34Å; M438-Y440 PolarHBondContact O-N 3.3Å; M438-W445 HydrophobicContact CB-CZ2 4.1Å; M438-K890 HydrophobicContact CE-CB 4.12Å; M438-K890 HydrophobicContact CE-CD 3.73Å; M438-K890 HydrophobicContact CE-CG 3.84Å; M438-K890 HydrophobicContact SD-CD 3.81Å
439	G	48.1	Very low	51.8	Low	64 Å²	64	100.5 Å²	100.5	66%	0.66	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	-2.1	174.5	0	0	0	0	0	116	Y437	Y437-G439 VanDerWaalsContact C-N 3.27Å; Y437-G439 PolarHBondContact O-N 3.31Å
440	Y	46.4	Very low	54	Low	131 Å²	131	102 Å²	102	51%	0.514	54%	0.535	S	S	.	.	B	Isolated β-bridge	trans	-112.7	157	175.9	-71.6	-87.5	0	0	0	111.2	Y437 M438 V444	Y437-Y440 PolarHBondContact O-N 3.02Å; M438-Y440 VanDerWaalsContact C-N 3.34Å; M438-Y440 PolarHBondContact O-N 3.3Å; Y440-V444 HydrophobicContact CD1-CG1 3.82Å; Y440-V444 HydrophobicContact CG-CG1 4.25Å
441	S	56.7	Low	56	Low	55 Å²	55	98.4 Å²	98.4	39%	0.385	52%	0.524	S	S	.	.			trans	-77.3	155.9	179.5	64.3	0	0	0	0	111.7	V444 W445	S441-V444 PolarHBondContact O-N 3.37Å; S441-V444 WeakPolarHBondContact OG-CG2 3.35Å; S441-W445 PolarHBondContact O-N 3.03Å
442	L	56.9	Low	57.8	Low	79 Å²	79	98.9 Å²	98.9	41%	0.414	52%	0.518	S	S	.	.	H	α-helix	trans	-54.1	-42	175.5	-111.6	155.3	0	0	0	114.1	L433 V444 W445 A446	L433-L442 WeakPolarHBondContact O-CD1 3.44Å; L442-V444 VanDerWaalsContact C-N 3.35Å; L442-V444 PolarHBondContact O-N 2.93Å; L442-W445 PolarHBondContact O-N 2.85Å; L442-A446 PolarHBondContact O-N 3.47Å
443	P	65.2	Low	59.3	Low	97 Å²	97	97 Å²	97	63%	0.63	52%	0.515	S	S	*	.	H	α-helix	trans	-65.6	-29.6	172.2	21.4	-32.6	0	0	0	114.4	A446 G447	P443-A446 PolarHBondContact O-N 2.76Å; P443-G447 PolarHBondContact O-N 2.93Å
444	V	68.2	Low	60.7	Low	62 Å²	62	95.6 Å²	95.6	38%	0.376	51%	0.511	S	S	.	.	H	α-helix	trans	-68.4	-40.8	171.5	171.9	0	0	0	0	110.7	Y440 S441 L442 A446 G447 C448	Y440-V444 HydrophobicContact CD1-CG1 3.82Å; Y440-V444 HydrophobicContact CG-CG1 4.25Å; S441-V444 PolarHBondContact O-N 3.37Å; S441-V444 WeakPolarHBondContact OG-CG2 3.35Å; L442-V444 VanDerWaalsContact C-N 3.35Å; L442-V444 PolarHBondContact O-N 2.93Å; V444-A446 VanDerWaalsContact C-N 3.31Å; V444-A446 PolarHBondContact O-N 2.94Å; V444-G447 PolarHBondContact O-N 2.95Å; V444-C448 PolarHBondContact O-N 3.02Å; V444-C448 PolarHBondContact O-SG 2.89Å; V444-C448 VanDerWaalsContact O-SG 3.37Å
445	W	74.5	Confident	61.8	Low	96 Å²	96	93 Å²	93	36%	0.364	51%	0.509	S	S	.	.	H	α-helix	trans	-61.5	-37.9	171.7	-85	102.1	0	0	0	112.8	Y437 M438 S441 L442 C448 A449	Y437-W445 HydrophobicContact CD1-CZ2 4.21Å; Y437-W445 PolarHBondContact O-NE1 2.96Å; M438-W445 HydrophobicContact CB-CZ2 4.1Å; S441-W445 PolarHBondContact O-N 3.03Å; L442-W445 PolarHBondContact O-N 2.85Å; W445-C448 PolarHBondContact O-N 3.28Å; W445-A449 VanDerWaalsContact O-CB 3.3Å; W445-A449 WeakPolarHBondContact O-CB 3.25Å; W445-A449 PolarHBondContact O-N 3.33Å
446	A	72.2	Confident	63.3	Low	60 Å²	60	87.6 Å²	87.6	50%	0.496	49%	0.493	S	S	.	.	H	α-helix	trans	-64.6	-42.5	173.2	0	0	0	0	0	112	L442 P443 V444 A449 L450	L442-A446 PolarHBondContact O-N 3.47Å; P443-A446 PolarHBondContact O-N 2.76Å; V444-A446 VanDerWaalsContact C-N 3.31Å; V444-A446 PolarHBondContact O-N 2.94Å; A446-A449 PolarHBondContact O-N 3.21Å; A446-L450 WeakPolarHBondContact O-CB 3.47Å; A446-L450 PolarHBondContact O-N 2.99Å
447	G	74	Confident	64.4	Low	33 Å²	33	84.5 Å²	84.5	34%	0.34	48%	0.475	S	S	.	.	H	α-helix	trans	-60.9	-46.9	173.4	0	0	0	0	0	112.7	P443 V444 A449 L450 I451	P443-G447 PolarHBondContact O-N 2.93Å; V444-G447 PolarHBondContact O-N 2.95Å; G447-A449 PolarHBondContact O-N 3.38Å; G447-L450 PolarHBondContact O-N 3.07Å; G447-I451 VanDerWaalsContact O-CG1 3.32Å; G447-I451 WeakPolarHBondContact O-CG1 3.49Å; G447-I451 PolarHBondContact O-N 2.92Å
448	C	67.9	Low	65.5	Low	58 Å²	58	82.2 Å²	82.2	39%	0.392	47%	0.466	S	S	.	.	H	α-helix	trans	-61.8	-41.9	174.6	-68.3	0	0	0	0	112.2	V444 W445 L450 I451 I452	V444-C448 PolarHBondContact O-N 3.02Å; V444-C448 PolarHBondContact O-SG 2.89Å; V444-C448 VanDerWaalsContact O-SG 3.37Å; W445-C448 PolarHBondContact O-N 3.28Å; C448-L450 VanDerWaalsContact C-N 3.34Å; C448-L450 PolarHBondContact O-N 3.34Å; C448-I451 PolarHBondContact O-N 3.24Å; C448-I452 WeakPolarHBondContact O-CB 3.34Å; C448-I452 WeakPolarHBondContact O-CD1 3.39Å; C448-I452 VanDerWaalsContact O-CG1 3.22Å; C448-I452 WeakPolarHBondContact O-CG1 3.43Å; C448-I452 PolarHBondContact O-N 3.43Å
449	A	73.6	Confident	66.2	Low	50 Å²	50	86.9 Å²	86.9	41%	0.413	48%	0.484	S	S	.	.	H	α-helix	trans	-63.8	-37.9	176.4	0	0	0	0	0	112.3	W445 A446 G447 I452 L453	W445-A449 VanDerWaalsContact O-CB 3.3Å; W445-A449 WeakPolarHBondContact O-CB 3.25Å; W445-A449 PolarHBondContact O-N 3.33Å; A446-A449 PolarHBondContact O-N 3.21Å; G447-A449 PolarHBondContact O-N 3.38Å; A449-I452 PolarHBondContact O-N 3.14Å; A449-L453 WeakPolarHBondContact O-CB 3.36Å; A449-L453 PolarHBondContact O-N 2.83Å
450	L	77.7	Confident	66.4	Low	112 Å²	112	89.7 Å²	89.7	59%	0.586	48%	0.478	S	S	*	.	H	α-helix	trans	-68.1	-43.6	175.3	-168.3	153.4	0	0	0	111.5	A446 G447 C448 I452 L453 V454	A446-L450 WeakPolarHBondContact O-CB 3.47Å; A446-L450 PolarHBondContact O-N 2.99Å; G447-L450 PolarHBondContact O-N 3.07Å; C448-L450 VanDerWaalsContact C-N 3.34Å; C448-L450 PolarHBondContact O-N 3.34Å; L450-I452 VanDerWaalsContact C-N 3.33Å; L450-I452 PolarHBondContact O-N 2.89Å; L450-L453 PolarHBondContact O-N 3.46Å; L450-V454 HydrophobicContact CD2-CG2 4.08Å; L450-V454 WeakPolarHBondContact O-CG2 3.3Å; L450-V454 PolarHBondContact O-N 3.01Å
451	I	75.4	Confident	66.4	Low	117 Å²	117	87 Å²	87	60%	0.6	47%	0.472	S	S	*	.	H	α-helix	trans	-62.2	-40.8	174.7	-68	164.7	0	0	0	110.9	G447 C448 V454 A455	G447-I451 VanDerWaalsContact O-CG1 3.32Å; G447-I451 WeakPolarHBondContact O-CG1 3.49Å; G447-I451 PolarHBondContact O-N 2.92Å; C448-I451 PolarHBondContact O-N 3.24Å; I451-V454 PolarHBondContact O-N 3.13Å; I451-A455 WeakPolarHBondContact O-CB 3.35Å; I451-A455 PolarHBondContact O-N 2.94Å
452	I	72.8	Confident	65.6	Low	95 Å²	95	91.7 Å²	91.7	49%	0.487	48%	0.481	S	S	.	.	H	α-helix	trans	-65.3	-40.9	174.9	-70.8	164.8	0	0	0	111	C448 A449 L450 A455 I456	C448-I452 WeakPolarHBondContact O-CB 3.34Å; C448-I452 WeakPolarHBondContact O-CD1 3.39Å; C448-I452 VanDerWaalsContact O-CG1 3.22Å; C448-I452 WeakPolarHBondContact O-CG1 3.43Å; C448-I452 PolarHBondContact O-N 3.43Å; A449-I452 PolarHBondContact O-N 3.14Å; L450-I452 VanDerWaalsContact C-N 3.33Å; L450-I452 PolarHBondContact O-N 2.89Å; I452-A455 PolarHBondContact O-N 2.84Å; I452-I456 HydrophobicContact CG2-CD1 3.73Å; I452-I456 HydrophobicContact CG2-CG1 4.38Å; I452-I456 WeakPolarHBondContact O-CB 3.24Å; I452-I456 VanDerWaalsContact O-CG1 3.26Å; I452-I456 WeakPolarHBondContact O-CG1 3.43Å; I452-I456 PolarHBondContact O-N 2.94Å
453	L	72.6	Confident	64.9	Low	119 Å²	119	93.6 Å²	93.6	62%	0.623	50%	0.497	S	S	*	.	H	α-helix	trans	-62.3	-41.6	173.4	-88.3	166.6	0	0	0	112.4	A449 L450 I456 W457	A449-L453 WeakPolarHBondContact O-CB 3.36Å; A449-L453 PolarHBondContact O-N 2.83Å; L450-L453 PolarHBondContact O-N 3.46Å; L453-I456 PolarHBondContact O-N 2.78Å; L453-W457 VanDerWaalsContact O-CB 3.25Å; L453-W457 WeakPolarHBondContact O-CB 3.43Å; L453-W457 PolarHBondContact O-N 2.82Å
454	V	73	Confident	63.7	Low	79 Å²	79	94.6 Å²	94.6	48%	0.479	50%	0.503	S	S	.	.	H	α-helix	trans	-66.2	-39.7	175.2	171.3	0	0	0	0	111.2	L450 I451 W457 Y458	L450-V454 HydrophobicContact CD2-CG2 4.08Å; L450-V454 WeakPolarHBondContact O-CG2 3.3Å; L450-V454 PolarHBondContact O-N 3.01Å; I451-V454 PolarHBondContact O-N 3.13Å; V454-W457 PolarHBondContact O-N 2.97Å; V454-Y458 VanDerWaalsContact O-CB 3.32Å; V454-Y458 WeakPolarHBondContact O-CB 3.27Å; V454-Y458 PolarHBondContact O-N 2.89Å
455	A	63.1	Low	62.2	Low	54 Å²	54	97.1 Å²	97.1	45%	0.446	52%	0.524	S	S	.	.	H	α-helix	trans	-65.7	-43.6	175.5	0	0	0	0	0	112.2	I451 I452 Y458 K459	I451-A455 WeakPolarHBondContact O-CB 3.35Å; I451-A455 PolarHBondContact O-N 2.94Å; I452-A455 PolarHBondContact O-N 2.84Å; A455-Y458 PolarHBondContact O-N 2.97Å; A455-K459 WeakPolarHBondContact O-CB 3.33Å; A455-K459 PolarHBondContact O-N 3.27Å
456	I	68.6	Low	60.5	Low	61 Å²	61	101 Å²	101	31%	0.313	55%	0.546	S	S	.	.	H	α-helix	trans	-63.1	-43.3	173.6	-69.7	167.7	0	0	0	110.2	I452 L453 Y458 K459 F460	I452-I456 HydrophobicContact CG2-CD1 3.73Å; I452-I456 HydrophobicContact CG2-CG1 4.38Å; I452-I456 WeakPolarHBondContact O-CB 3.24Å; I452-I456 VanDerWaalsContact O-CG1 3.26Å; I452-I456 WeakPolarHBondContact O-CG1 3.43Å; I452-I456 PolarHBondContact O-N 2.94Å; L453-I456 PolarHBondContact O-N 2.78Å; I456-Y458 VanDerWaalsContact C-N 3.35Å; I456-Y458 PolarHBondContact O-N 2.98Å; I456-K459 PolarHBondContact O-N 3.49Å; I456-F460 HydrophobicContact CG2-CB 4.33Å; I456-F460 WeakPolarHBondContact O-CA 3.15Å; I456-F460 WeakPolarHBondContact O-CB 3.3Å; I456-F460 PolarHBondContact O-N 3.11Å
457	W	64.5	Low	58.8	Low	91 Å²	91	103.4 Å²	103.4	35%	0.345	56%	0.556	S	S	.	*	H	α-helix	trans	-59.8	-44.3	175.4	179.1	87	0	0	0	112	L453 V454 L461	L453-W457 VanDerWaalsContact O-CB 3.25Å; L453-W457 WeakPolarHBondContact O-CB 3.43Å; L453-W457 PolarHBondContact O-N 2.82Å; V454-W457 PolarHBondContact O-N 2.97Å; W457-L461 PolarHBondContact O-N 3.1Å; W457-L461 VanDerWaalsContact O-N 3.09Å
458	Y	65.1	Low	57	Low	128 Å²	128	107.7 Å²	107.7	50%	0.502	58%	0.578	S	S	.	*	H	α-helix	trans	-66.7	-40.5	178.4	-168.9	-84.3	0	0	0	113.1	V454 A455 I456 R462	V454-Y458 VanDerWaalsContact O-CB 3.32Å; V454-Y458 WeakPolarHBondContact O-CB 3.27Å; V454-Y458 PolarHBondContact O-N 2.89Å; A455-Y458 PolarHBondContact O-N 2.97Å; I456-Y458 VanDerWaalsContact C-N 3.35Å; I456-Y458 PolarHBondContact O-N 2.98Å; Y458-R462 VanDerWaalsContact CE2-CZ 3.41Å; Y458-R462 VanDerWaalsContact CE2-NH2 3.35Å; Y458-R462 WeakPolarHBondContact O-CB 3.3Å; Y458-R462 PolarHBondContact OH-NH1 3.24Å
459	K	53	Low	55.2	Low	184 Å²	184	109.8 Å²	109.8	80%	0.8	60%	0.599	S	S	*	*	H	α-helix	trans	-84.7	-30.6	-178.1	-99.6	-75.1	-174.6	176.6	0	114.6	A455 I456	A455-K459 WeakPolarHBondContact O-CB 3.33Å; A455-K459 PolarHBondContact O-N 3.27Å; I456-K459 PolarHBondContact O-N 3.49Å
460	F	52.6	Low	53.5	Low	123 Å²	123	115 Å²	115	54%	0.539	62%	0.62	S	S	.	*	H	α-helix	trans	-113.4	-11.1	-167.7	-130.1	-80.8	0	0	0	113.8	I456	I456-F460 HydrophobicContact CG2-CB 4.33Å; I456-F460 WeakPolarHBondContact O-CA 3.15Å; I456-F460 WeakPolarHBondContact O-CB 3.3Å; I456-F460 PolarHBondContact O-N 3.11Å
461	L	46.5	Very low	51.3	Low	75 Å²	75	114.7 Å²	114.7	39%	0.393	63%	0.634	S	S	.	*	S	Bend	trans	-128.6	31.3	175.4	-56.8	88.2	0	0	0	113.5	W457 R805	W457-L461 PolarHBondContact O-N 3.1Å; W457-L461 VanDerWaalsContact O-N 3.09Å; L461-R805 PolarHBondContact O-NH1 2.63Å
462	R	39.4	Very low	49.3	Very low	152 Å²	152	112.9 Å²	112.9	57%	0.574	65%	0.645	S	S	*	*			trans	-117.9	64.1	167.8	-170.1	178.4	-74.1	-147.8	-5.6	110.3	Y458	Y458-R462 VanDerWaalsContact CE2-CZ 3.41Å; Y458-R462 VanDerWaalsContact CE2-NH2 3.35Å; Y458-R462 WeakPolarHBondContact O-CB 3.3Å; Y458-R462 PolarHBondContact OH-NH1 3.24Å
463	T	43.2	Very low	47.1	Very low	120 Å²	120	118.5 Å²	118.5	74%	0.736	67%	0.666	S	S	*	*			trans	-67.7	135.3	163.7	47.7	0	0	0	0	109.3	S465	T463-S465 PolarHBondContact O-N 2.62Å
464	P	40	Very low	45.1	Very low	117 Å²	117	116.5 Å²	116.5	76%	0.76	67%	0.667	S	S	*	*			trans	-65.9	127.2	174.1	28.1	-33.2	0	0	0	109.8	E466	P464-E466 PolarHBondContact O-N 3.19Å
465	S	36.6	Very low	43.3	Very low	116 Å²	116	119.6 Å²	119.6	81%	0.811	69%	0.686	S	S	*	*			trans	-91.5	92.1	170	55.4	0	0	0	0	108.9	T463	T463-S465 PolarHBondContact O-N 2.62Å
466	E	37.9	Very low	41.9	Very low	178 Å²	178	123.1 Å²	123.1	83%	0.832	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-64.8	135.4	169.4	-73	175.6	107.3	0	0	110	P464	P464-E466 PolarHBondContact O-N 3.19Å
467	P	37	Very low	40.6	Very low	109 Å²	109	125.5 Å²	125.5	71%	0.708	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-70.5	158.1	168.7	32.1	-34.4	0	0	0	110.3	A469	P467-A469 PolarHBondContact O-N 3.16Å
468	P	36.1	Very low	39.4	Very low	124 Å²	124	126.7 Å²	126.7	81%	0.805	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-60.5	139.1	173.8	27.2	-34.6	0	0	0	110.7
469	A	31.6	Very low	37.8	Very low	101 Å²	101	125 Å²	125	84%	0.835	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-89	119.9	-176.1	0	0	0	0	0	111.5	P467	P467-A469 PolarHBondContact O-N 3.16Å
470	D	36.3	Very low	37	Very low	159 Å²	159	120.1 Å²	120.1	85%	0.85	75%	0.747	S	S	*	*			trans	-130.4	135.7	169.4	-91.9	-52.1	0	0	0	111.1
471	A	32.3	Very low	36.2	Very low	106 Å²	106	122.5 Å²	122.5	88%	0.876	76%	0.76	S	S	*	*			trans	0.7	124.3	175.3	0	0	0	0	0	121.5
472	G	33.8	Very low	35.3	Very low	80 Å²	80	123 Å²	123	83%	0.825	77%	0.77	S	S	*	*			trans	-176.5	119.9	160.2	0	0	0	0	0	113.6
473	F	26.6	Very low	35	Very low	212 Å²	212	127.8 Å²	127.8	93%	0.93	79%	0.788	S	S	*	*			trans	-85.9	135.7	-172.8	-110.6	-107.3	0	0	0	114.4
474	A	31.1	Very low	34.5	Very low	78 Å²	78	126.3 Å²	126.3	65%	0.645	79%	0.788	S	S	*	*			trans	28.8	133.1	145.2	0	0	0	0	0	122.5
475	V	34.3	Very low	34.1	Very low	144 Å²	144	129.8 Å²	129.8	87%	0.873	79%	0.794	S	S	*	*				-167.5	160	101.6	150	0	0	0	0	109
476	T	34.2	Very low	33.9	Very low	128 Å²	128	130 Å²	130	79%	0.785	79%	0.793	S	S	*	*			trans	-121.2	-169.7	-154.4	-11.1	0	0	0	0	113.6
477	P	40.2	Very low	33.8	Very low	111 Å²	111	130.5 Å²	130.5	72%	0.721	80%	0.797	S	S	*	*			trans	-120.5	-131.8	-135.2	40.8	-17.4	0	0	0	111.9
478	P	40.7	Very low	33.4	Very low	116 Å²	116	131.4 Å²	131.4	75%	0.753	80%	0.801	S	S	*	*			cis	-134.5	-164	-28.4	35.9	-14.6	0	0	0	114.6
479	A	30.8	Very low	33.2	Very low	91 Å²	91	133.8 Å²	133.8	75%	0.752	80%	0.803	S	S	*	*			trans	129.8	164.8	132.2	0	0	0	0	0	118.6
480	A	36.9	Very low	33.4	Very low	83 Å²	83	136.4 Å²	136.4	69%	0.686	81%	0.809	S	S	*	*			trans	71.8	106.5	-173.4	0	0	0	0	0	116
481	E	34.9	Very low	33.1	Very low	173 Å²	173	137.7 Å²	137.7	81%	0.808	81%	0.81	S	S	*	*			cis	80.6	144.8	42.7	-59.7	171.6	111.1	0	0	114.9
482	S	27.4	Very low	33.3	Very low	86 Å²	86	138.3 Å²	138.3	60%	0.601	81%	0.808	S	S	*	*			cis	164.3	89.9	-45.1	52.9	0	0	0	0	110.4
483	W	32.4	Very low	33.3	Very low	252 Å²	252	137.5 Å²	137.5	96%	0.955	80%	0.8	S	S	*	*			trans	-155.1	147.8	174.9	-64.2	100.1	0	0	0	108.9
484	A	34.2	Very low	33.7	Very low	89 Å²	89	136.1 Å²	136.1	74%	0.736	80%	0.8	S	S	*	*			cis	-158.3	166.7	-13.4	0	0	0	0	0	109.8
485	E	31.6	Very low	33.8	Very low	189 Å²	189	135.1 Å²	135.1	88%	0.883	80%	0.797	S	S	*	*			trans	-87.2	160.8	176.6	-79.7	-171.9	117.6	0	0	114
486	P	31.5	Very low	34.1	Very low	121 Å²	121	136.6 Å²	136.6	79%	0.786	80%	0.8	S	S	*	*			trans	-85.6	151.7	-176.4	34.4	-36.1	0	0	0	114.4
487	M	35.9	Very low	34.1	Very low	189 Å²	189	138.1 Å²	138.1	93%	0.931	80%	0.803	S	S	*	*			trans	-133.3	173.1	168.1	-97.4	-171.8	-79	0	0	112.4
488	T	28.8	Very low	34	Very low	127 Å²	127	142 Å²	142	78%	0.779	82%	0.815	S	S	*	*			trans	-123.3	164.2	-143.6	50.5	0	0	0	0	116.4
489	M	32.2	Very low	33.8	Very low	175 Å²	175	142 Å²	142	86%	0.862	82%	0.815	S	S	*	*			trans	67.1	126.4	159.1	-69.3	-178.6	177.4	0	0	120.2
490	T	35.2	Very low	33.9	Very low	156 Å²	156	142.2 Å²	142.2	96%	0.957	82%	0.816	S	S	*	*				-158.2	176.4	112.4	5.5	0	0	0	0	110.7
491	E	30.9	Very low	34	Very low	186 Å²	186	143.6 Å²	143.6	87%	0.869	82%	0.818	S	S	*	*			trans	-123.5	-180	-152.5	-158.5	-178.6	109.1	0	0	114.2
492	S	34.7	Very low	34.1	Very low	119 Å²	119	141.3 Å²	141.3	83%	0.832	82%	0.818	S	S	*	*			trans	89.8	140.2	170.5	78.3	0	0	0	0	117.4
493	G	35.1	Very low	34.9	Very low	63 Å²	63	143.6 Å²	143.6	65%	0.649	83%	0.828	S	S	*	*			cis	175.9	173.7	-8.4	0	0	0	0	0	113.8
494	I	35.5	Very low	35.3	Very low	183 Å²	183	137.5 Å²	137.5	94%	0.938	82%	0.819	S	S	*	*			trans	69.2	133.5	173.1	-44.3	170.9	0	0	0	114.8
495	G	33.3	Very low	36	Very low	57 Å²	57	137.5 Å²	137.5	59%	0.588	81%	0.812	S	S	*	*			cis	138.1	119.9	-9.4	0	0	0	0	0	113.8
496	N	39.9	Very low	36.5	Very low	175 Å²	175	134.9 Å²	134.9	94%	0.936	80%	0.799	S	S	*	*			trans	178.8	151.8	148.1	-94.4	-23.9	0	0	0	112.7
497	N	34.2	Very low	37.3	Very low	159 Å²	159	132.3 Å²	132.3	85%	0.85	79%	0.788	S	S	*	*			trans	-114.6	153.7	-175.6	-73.1	-39.7	0	0	0	112.7
498	M	37.4	Very low	37.8	Very low	194 Å²	194	129.2 Å²	129.2	96%	0.956	78%	0.775	S	S	*	*			trans	-167	158	132.1	-107.3	172.9	-177.3	0	0	112.7
499	P	36.3	Very low	38.4	Very low	116 Å²	116	129 Å²	129	75%	0.753	77%	0.767	S	S	*	*			trans	-125.6	173.2	-160.2	43.1	-30.7	0	0	0	118.1
500	A	32.9	Very low	39.6	Very low	95 Å²	95	126 Å²	126	79%	0.785	75%	0.751	S	S	*	*			trans	72.7	163.2	163.3	0	0	0	0	0	117.9
501	P	39.9	Very low	40.8	Very low	112 Å²	112	123.9 Å²	123.9	73%	0.727	73%	0.73	S	S	*	*			cis	-120.7	175.8	-4.3	41.8	-28.7	0	0	0	114.4
502	P	37.7	Very low	42.2	Very low	124 Å²	124	121 Å²	121	81%	0.805	72%	0.72	S	S	*	*			trans	-91.3	148.1	178.1	35.4	-34.1	0	0	0	114.3
503	V	42.8	Very low	43.5	Very low	135 Å²	135	118.2 Å²	118.2	82%	0.818	71%	0.705	S	S	*	*			trans	-139	143.7	171.7	-164.6	0	0	0	0	109.4	P505	V503-P505 WeakPolarHBondContact O-CD 3.17Å
504	T	40.9	Very low	45.1	Very low	123 Å²	123	122.2 Å²	122.2	76%	0.755	70%	0.7	S	S	*	*			trans	-113.9	104.8	-163.4	50.9	0	0	0	0	115.1
505	P	48.7	Very low	46.6	Very low	90 Å²	90	119.3 Å²	119.3	58%	0.584	69%	0.686	S	S	*	*			trans	-100.8	29.2	175.5	38.5	-33.5	0	0	0	113	V503 M509	V503-P505 WeakPolarHBondContact O-CD 3.17Å; P505-M509 HydrophobicContact CG-CE 4.27Å; P505-M509 WeakPolarHBondContact O-CE 3.44Å
506	Q	41.8	Very low	47.8	Very low	133 Å²	133	121.9 Å²	121.9	62%	0.621	69%	0.686	S	S	*	*	H	α-helix	trans	-89.3	-11	-159.8	-156.2	166.6	7.8	0	0	115	Q510	Q506-Q510 VanDerWaalsContact O-CG 3.31Å; Q506-Q510 WeakPolarHBondContact O-CG 3.39Å
507	A	49.3	Very low	49.3	Very low	67 Å²	67	117.6 Å²	117.6	55%	0.554	66%	0.659	S	S	*	*	H	α-helix	trans	-79.9	-49.6	-177.9	0	0	0	0	0	113.1	M509 Q510 Q511	A507-M509 PolarHBondContact O-N 2.74Å; A507-Q510 CarbonylContact O-C 3.56Å; A507-Q510 WeakPolarHBondContact O-CA 3.17Å; A507-Q510 WeakPolarHBondContact O-CB 3.29Å; A507-Q510 PolarHBondContact O-N 3.29Å; A507-Q511 PolarHBondContact O-N 2.96Å; A507-Q511 VanDerWaalsContact O-N 3.1Å
508	D	45.3	Very low	50.9	Low	124 Å²	124	112.7 Å²	112.7	66%	0.663	64%	0.641	S	S	*	*	H	α-helix	trans	-67.4	-36.6	-174.9	-62.7	-48.3	0	0	0	112.6	Q510 Q511 L512	D508-Q510 PolarHBondContact O-N 2.83Å; D508-Q511 WeakPolarHBondContact O-CA 3.39Å; D508-Q511 WeakPolarHBondContact O-CB 3.28Å; D508-Q511 PolarHBondContact O-N 3.24Å; D508-L512 PolarHBondContact O-N 2.98Å
509	M	43.3	Very low	52.1	Low	122 Å²	122	106.7 Å²	106.7	60%	0.601	61%	0.61	S	S	*	*	H	α-helix	trans	-60.3	-33	170.7	-78.4	-172.4	-82.7	0	0	112.4	P505 A507 Q511 A513	P505-M509 HydrophobicContact CG-CE 4.27Å; P505-M509 WeakPolarHBondContact O-CE 3.44Å; A507-M509 PolarHBondContact O-N 2.74Å; M509-Q511 VanDerWaalsContact C-N 3.33Å; M509-A513 WeakPolarHBondContact O-CB 3.46Å; M509-A513 PolarHBondContact O-N 3.07Å
510	Q	55.8	Low	53.1	Low	112 Å²	112	106.4 Å²	106.4	52%	0.523	60%	0.602	S	S	.	*	H	α-helix	trans	-76.2	-18.8	173.2	-68.4	176.9	13	0	0	113.1	Q506 A507 D508 R514	Q506-Q510 VanDerWaalsContact O-CG 3.31Å; Q506-Q510 WeakPolarHBondContact O-CG 3.39Å; A507-Q510 CarbonylContact O-C 3.56Å; A507-Q510 WeakPolarHBondContact O-CA 3.17Å; A507-Q510 WeakPolarHBondContact O-CB 3.29Å; A507-Q510 PolarHBondContact O-N 3.29Å; D508-Q510 PolarHBondContact O-N 2.83Å; Q510-R514 WeakPolarHBondContact O-CG 3.37Å; Q510-R514 PolarHBondContact O-NE 2.7Å; Q510-R514 PolarHBondContact O-NH2 3.46Å
511	Q	61	Low	54.8	Low	113 Å²	113	104 Å²	104	53%	0.528	58%	0.576	S	S	.	*	H	α-helix	trans	-80.8	-51.1	172.7	-159.8	114.5	-60.2	0	0	110.1	A507 D508 M509 A513 R514 D515	A507-Q511 PolarHBondContact O-N 2.96Å; A507-Q511 VanDerWaalsContact O-N 3.1Å; D508-Q511 WeakPolarHBondContact O-CA 3.39Å; D508-Q511 WeakPolarHBondContact O-CB 3.28Å; D508-Q511 PolarHBondContact O-N 3.24Å; M509-Q511 VanDerWaalsContact C-N 3.33Å; Q511-A513 VanDerWaalsContact C-N 3.33Å; Q511-A513 PolarHBondContact O-N 3.06Å; Q511-R514 WeakPolarHBondContact O-CB 3.48Å; Q511-R514 PolarHBondContact O-N 2.89Å; Q511-R514 VanDerWaalsContact OE1-CZ 3.29Å; Q511-R514 VanDerWaalsContact OE1-NH1 3.09Å; Q511-D515 PolarHBondContact O-N 3.47Å; Q511-D515 VanDerWaalsContact O-N 3.16Å
512	L	60.4	Low	56.4	Low	124 Å²	124	107.7 Å²	107.7	65%	0.649	58%	0.575	S	S	*	*	H	α-helix	trans	-58	-42	175.8	-171.5	70.1	0	0	0	112.3	D508 R514 D515 L516	D508-L512 PolarHBondContact O-N 2.98Å; L512-R514 VanDerWaalsContact C-N 3.26Å; L512-R514 PolarHBondContact O-N 2.87Å; L512-D515 PolarHBondContact O-N 3.42Å; L512-L516 WeakPolarHBondContact O-CB 3.47Å; L512-L516 PolarHBondContact O-N 3.31Å
513	A	62.6	Low	57.5	Low	62 Å²	62	108.7 Å²	108.7	51%	0.512	56%	0.563	S	S	.	*	H	α-helix	trans	-69.1	-19.1	177.1	0	0	0	0	0	114.2	M509 Q511 K517	M509-A513 WeakPolarHBondContact O-CB 3.46Å; M509-A513 PolarHBondContact O-N 3.07Å; Q511-A513 VanDerWaalsContact C-N 3.33Å; Q511-A513 PolarHBondContact O-N 3.06Å; A513-K517 VanDerWaalsContact O-CB 3.31Å; A513-K517 WeakPolarHBondContact O-CB 3.43Å
514	R	68.6	Low	58.5	Low	146 Å²	146	106 Å²	106	55%	0.551	54%	0.544	S	S	*	.	H	α-helix	trans	-78.7	-41.5	170.6	-85.3	177.4	-80	141.8	-4.6	111.3	Q510 Q511 L512 K517 A518	Q510-R514 WeakPolarHBondContact O-CG 3.37Å; Q510-R514 PolarHBondContact O-NE 2.7Å; Q510-R514 PolarHBondContact O-NH2 3.46Å; Q511-R514 WeakPolarHBondContact O-CB 3.48Å; Q511-R514 PolarHBondContact O-N 2.89Å; Q511-R514 VanDerWaalsContact OE1-CZ 3.29Å; Q511-R514 VanDerWaalsContact OE1-NH1 3.09Å; L512-R514 VanDerWaalsContact C-N 3.26Å; L512-R514 PolarHBondContact O-N 2.87Å; R514-K517 PolarHBondContact O-N 3.19Å; R514-A518 PolarHBondContact O-N 2.92Å; R514-A518 VanDerWaalsContact O-N 3.1Å
515	D	66.2	Low	59.9	Low	122 Å²	122	104.4 Å²	104.4	65%	0.652	53%	0.528	S	S	*	.	H	α-helix	trans	-73.9	-48.4	-175.4	-152.1	47	0	0	0	111.8	Q511 L512 K517 A518 E519	Q511-D515 PolarHBondContact O-N 3.47Å; Q511-D515 VanDerWaalsContact O-N 3.16Å; L512-D515 PolarHBondContact O-N 3.42Å; D515-K517 PolarHBondContact O-N 3.28Å; D515-K517 VanDerWaalsContact O-N 3.13Å; D515-A518 WeakPolarHBondContact O-CB 3.39Å; D515-A518 PolarHBondContact O-N 2.83Å; D515-E519 PolarHBondContact O-N 3.22Å; D515-E519 VanDerWaalsContact O-N 3.12Å
516	L	58.2	Low	60.6	Low	111 Å²	111	106.1 Å²	106.1	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-56.2	-32.2	171.8	-172.3	71	0	0	0	112	L512 L520	L512-L516 WeakPolarHBondContact O-CB 3.47Å; L512-L516 PolarHBondContact O-N 3.31Å; L516-L520 PolarHBondContact O-N 3.4Å; L516-L520 VanDerWaalsContact O-N 3.17Å
517	K	71.3	Confident	61.5	Low	86 Å²	86	104.5 Å²	104.5	37%	0.374	52%	0.523	S	S	.	.	H	α-helix	trans	-69.1	-45.9	174	175.9	147	-173.1	47.3	0	112	A513 R514 D515 E519 L520 D521	A513-K517 VanDerWaalsContact O-CB 3.31Å; A513-K517 WeakPolarHBondContact O-CB 3.43Å; R514-K517 PolarHBondContact O-N 3.19Å; D515-K517 PolarHBondContact O-N 3.28Å; D515-K517 VanDerWaalsContact O-N 3.13Å; K517-E519 VanDerWaalsContact C-N 3.27Å; K517-E519 PolarHBondContact O-N 3.47Å; K517-L520 PolarHBondContact O-N 2.88Å; K517-D521 WeakPolarHBondContact CG-OD2 3.19Å; K517-D521 IonicContact NZ-OD1 2.76Å; K517-D521 PolarHBondContact NZ-OD1 3.03Å; K517-D521 IonicContact NZ-OD2 3.65Å; K517-D521 PolarHBondContact NZ-OD2 3.39Å; K517-D521 VanDerWaalsContact O-CG 3.26Å; K517-D521 PolarHBondContact O-N 3.21Å
518	A	69.1	Low	62.5	Low	56 Å²	56	107 Å²	107	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-58.5	-40.4	179.4	0	0	0	0	0	111.9	R514 D515 D521 R522	R514-A518 PolarHBondContact O-N 2.92Å; R514-A518 VanDerWaalsContact O-N 3.1Å; D515-A518 WeakPolarHBondContact O-CB 3.39Å; D515-A518 PolarHBondContact O-N 2.83Å; A518-D521 PolarHBondContact O-N 2.89Å; A518-R522 PolarHBondContact O-N 3.04Å
519	E	61.3	Low	63.8	Low	68 Å²	68	108.8 Å²	108.8	32%	0.318	52%	0.516	S	S	.	.	H	α-helix	trans	-65.9	-43.6	174.7	175.5	58.2	-170.4	0	0	112.8	D515 K517 D521 R522 R523	D515-E519 PolarHBondContact O-N 3.22Å; D515-E519 VanDerWaalsContact O-N 3.12Å; K517-E519 VanDerWaalsContact C-N 3.27Å; K517-E519 PolarHBondContact O-N 3.47Å; E519-D521 VanDerWaalsContact C-N 3.33Å; E519-D521 PolarHBondContact O-N 3.41Å; E519-R522 VanDerWaalsContact O-CB 3.3Å; E519-R522 WeakPolarHBondContact O-CB 3.31Å; E519-R522 PolarHBondContact O-N 3.06Å; E519-R522 VanDerWaalsContact O-N 3.15Å; E519-R523 PolarHBondContact O-N 3.04Å; E519-R523 IonicContact OE1-CZ 2.74Å; E519-R523 IonicContact OE1-NE 3.73Å; E519-R523 PolarHBondContact OE1-NE 3.45Å; E519-R523 IonicContact OE1-NH2 3.51Å; E519-R523 PolarHBondContact OE1-NH2 3.37Å
520	L	58.1	Low	64.7	Low	110 Å²	110	106.8 Å²	106.8	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-60.2	-42.4	175.1	-109.7	74.9	0	0	0	112.5	L516 K517 R522 R523 D524	L516-L520 PolarHBondContact O-N 3.4Å; L516-L520 VanDerWaalsContact O-N 3.17Å; K517-L520 PolarHBondContact O-N 2.88Å; L520-R522 PolarHBondContact O-N 3.21Å; L520-R523 PolarHBondContact O-N 3.46Å; L520-D524 PolarHBondContact O-N 3.04Å; L520-D524 VanDerWaalsContact O-N 3.1Å
521	D	67.9	Low	64.7	Low	45 Å²	45	107 Å²	107	24%	0.241	51%	0.514	C	S	.	.	H	α-helix	trans	-67.3	-25	179	-62.3	-61.3	0	0	0	112.2	K434 K517 A518 E519	K434-D521 WeakPolarHBondContact CE-OD1 3.41Å; K434-D521 WeakPolarHBondContact CE-OD2 3.47Å; K434-D521 VanDerWaalsContact NZ-CG 3.25Å; K434-D521 IonicContact NZ-OD1 3.78Å; K434-D521 IonicContact NZ-OD2 3.15Å; K434-D521 PolarHBondContact NZ-OD2 3Å; K517-D521 WeakPolarHBondContact CG-OD2 3.19Å; K517-D521 IonicContact NZ-OD1 2.76Å; K517-D521 PolarHBondContact NZ-OD1 3.03Å; K517-D521 IonicContact NZ-OD2 3.65Å; K517-D521 PolarHBondContact NZ-OD2 3.39Å; K517-D521 VanDerWaalsContact O-CG 3.26Å; K517-D521 PolarHBondContact O-N 3.21Å; A518-D521 PolarHBondContact O-N 2.89Å; E519-D521 VanDerWaalsContact C-N 3.33Å; E519-D521 PolarHBondContact O-N 3.41Å
522	R	73.9	Confident	65	Low	188 Å²	188	105 Å²	105	71%	0.709	51%	0.51	S	S	*	.	H	α-helix	trans	-70	-45.1	174.5	-161.2	-179.2	-154.4	146.6	4.6	111.4	A518 E519 L520 E525 E526	A518-R522 PolarHBondContact O-N 3.04Å; E519-R522 VanDerWaalsContact O-CB 3.3Å; E519-R522 WeakPolarHBondContact O-CB 3.31Å; E519-R522 PolarHBondContact O-N 3.06Å; E519-R522 VanDerWaalsContact O-N 3.15Å; L520-R522 PolarHBondContact O-N 3.21Å; R522-E525 PolarHBondContact O-N 3.34Å; R522-E526 PolarHBondContact O-N 3.45Å
523	R	60.5	Low	65.3	Low	145 Å²	145	105.9 Å²	105.9	55%	0.547	51%	0.512	S	S	.	.	H	α-helix	trans	-67.9	-35.7	177.7	-62.9	-177.1	-171.9	-147.2	-2	112.7	E519 L520 E525 E526 I527	E519-R523 PolarHBondContact O-N 3.04Å; E519-R523 IonicContact OE1-CZ 2.74Å; E519-R523 IonicContact OE1-NE 3.73Å; E519-R523 PolarHBondContact OE1-NE 3.45Å; E519-R523 IonicContact OE1-NH2 3.51Å; E519-R523 PolarHBondContact OE1-NH2 3.37Å; L520-R523 PolarHBondContact O-N 3.46Å; R523-E525 VanDerWaalsContact C-N 3.28Å; R523-E525 PolarHBondContact O-N 3.2Å; R523-E526 PolarHBondContact O-N 2.84Å; R523-I527 WeakPolarHBondContact O-CB 3.42Å; R523-I527 VanDerWaalsContact O-CG1 3.26Å; R523-I527 WeakPolarHBondContact O-CG1 3.25Å; R523-I527 PolarHBondContact O-N 3.47Å
524	D	63.9	Low	65.5	Low	80 Å²	80	107.7 Å²	107.7	43%	0.428	51%	0.513	S	S	.	.	H	α-helix	trans	-64	-33.5	178.1	-154.4	67.8	0	0	0	112.1	L520 R528	L520-D524 PolarHBondContact O-N 3.04Å; L520-D524 VanDerWaalsContact O-N 3.1Å; D524-R528 VanDerWaalsContact O-CD 3.31Å; D524-R528 WeakPolarHBondContact O-CD 3.42Å; D524-R528 WeakPolarHBondContact O-CG 3.45Å; D524-R528 PolarHBondContact O-N 2.92Å; D524-R528 IonicContact OD2-CZ 2.81Å; D524-R528 IonicContact OD2-NE 3.26Å; D524-R528 PolarHBondContact OD2-NE 3.07Å; D524-R528 IonicContact OD2-NH2 3.17Å; D524-R528 PolarHBondContact OD2-NH2 3.25Å; D524-R528 VanDerWaalsContact OD2-NH2 3.15Å
525	E	71	Confident	65.7	Low	88 Å²	88	106.5 Å²	106.5	41%	0.411	51%	0.512	S	S	.	.	H	α-helix	trans	-72.2	-40.7	173.4	174.9	62.4	-168.5	0	0	112.2	R522 R523 R528 R529	R522-E525 PolarHBondContact O-N 3.34Å; R523-E525 VanDerWaalsContact C-N 3.28Å; R523-E525 PolarHBondContact O-N 3.2Å; E525-R528 WeakPolarHBondContact O-CB 3.49Å; E525-R528 PolarHBondContact O-N 2.83Å; E525-R529 WeakPolarHBondContact O-CG 3.36Å; E525-R529 PolarHBondContact O-N 3.5Å; E525-R529 IonicContact OE1-CZ 2.64Å; E525-R529 VanDerWaalsContact OE1-CZ 3.26Å; E525-R529 IonicContact OE1-NE 3.18Å; E525-R529 PolarHBondContact OE1-NE 3.47Å; E525-R529 IonicContact OE1-NH2 2.74Å; E525-R529 PolarHBondContact OE1-NH2 3.33Å
526	E	62.4	Low	65.8	Low	126 Å²	126	103.8 Å²	103.8	59%	0.589	50%	0.497	S	S	*	.	H	α-helix	trans	-64.6	-41.4	176.3	-167.8	158.5	-137.9	0	0	111.8	R522 R523 R528 R529 T530	R522-E526 PolarHBondContact O-N 3.45Å; R523-E526 PolarHBondContact O-N 2.84Å; E526-R528 VanDerWaalsContact C-N 3.34Å; E526-R528 PolarHBondContact O-N 2.82Å; E526-R529 PolarHBondContact O-N 3.32Å; E526-T530 PolarHBondContact O-N 2.89Å; E526-T530 PolarHBondContact O-OG1 2.92Å; E526-T530 VanDerWaalsContact O-OG1 3.13Å
527	I	60.6	Low	65.9	Low	100 Å²	100	100.9 Å²	100.9	51%	0.513	49%	0.486	S	S	.	.	H	α-helix	trans	-60.3	-40.9	172.5	-70.2	164.9	0	0	0	111.4	R523 T530 L531	R523-I527 WeakPolarHBondContact O-CB 3.42Å; R523-I527 VanDerWaalsContact O-CG1 3.26Å; R523-I527 WeakPolarHBondContact O-CG1 3.25Å; R523-I527 PolarHBondContact O-N 3.47Å; I527-T530 WeakPolarHBondContact CA-OG1 3.25Å; I527-T530 PolarHBondContact O-OG1 3.08Å; I527-L531 VanDerWaalsContact O-CB 3.23Å; I527-L531 WeakPolarHBondContact O-CB 3.32Å; I527-L531 PolarHBondContact O-N 3.19Å
528	R	71.6	Confident	65.5	Low	118 Å²	118	101 Å²	101	45%	0.445	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-41.2	175.8	-72.8	161	-172.2	-106.2	-3.8	112.2	D524 E525 E526 L531 T532	D524-R528 VanDerWaalsContact O-CD 3.31Å; D524-R528 WeakPolarHBondContact O-CD 3.42Å; D524-R528 WeakPolarHBondContact O-CG 3.45Å; D524-R528 PolarHBondContact O-N 2.92Å; D524-R528 IonicContact OD2-CZ 2.81Å; D524-R528 IonicContact OD2-NE 3.26Å; D524-R528 PolarHBondContact OD2-NE 3.07Å; D524-R528 IonicContact OD2-NH2 3.17Å; D524-R528 PolarHBondContact OD2-NH2 3.25Å; D524-R528 VanDerWaalsContact OD2-NH2 3.15Å; E525-R528 WeakPolarHBondContact O-CB 3.49Å; E525-R528 PolarHBondContact O-N 2.83Å; E526-R528 VanDerWaalsContact C-N 3.34Å; E526-R528 PolarHBondContact O-N 2.82Å; R528-L531 PolarHBondContact O-N 2.89Å; R528-T532 WeakPolarHBondContact O-CB 3.08Å; R528-T532 PolarHBondContact O-N 3.21Å; R528-T532 PolarHBondContact O-OG1 3.38Å
529	R	73.3	Confident	65.5	Low	163 Å²	163	101.4 Å²	101.4	62%	0.615	49%	0.487	S	S	*	.	H	α-helix	trans	-64.4	-49.5	176.6	-70.6	171	-173	-152.4	-1.1	111.3	E525 E526 L531 T532 M533	E525-R529 WeakPolarHBondContact O-CG 3.36Å; E525-R529 PolarHBondContact O-N 3.5Å; E525-R529 IonicContact OE1-CZ 2.64Å; E525-R529 VanDerWaalsContact OE1-CZ 3.26Å; E525-R529 IonicContact OE1-NE 3.18Å; E525-R529 PolarHBondContact OE1-NE 3.47Å; E525-R529 IonicContact OE1-NH2 2.74Å; E525-R529 PolarHBondContact OE1-NH2 3.33Å; E526-R529 PolarHBondContact O-N 3.32Å; R529-L531 VanDerWaalsContact C-N 3.34Å; R529-L531 PolarHBondContact O-N 3.46Å; R529-T532 PolarHBondContact O-N 3.15Å; R529-M533 WeakPolarHBondContact O-CB 3.44Å; R529-M533 PolarHBondContact O-N 3.46Å
530	T	61.9	Low	65.9	Low	79 Å²	79	102.7 Å²	102.7	49%	0.485	50%	0.5	S	S	.	.	H	α-helix	trans	-60.4	-42.6	175.6	49.5	0	0	0	0	111.7	E526 I527 T532 M533 L534	E526-T530 PolarHBondContact O-N 2.89Å; E526-T530 PolarHBondContact O-OG1 2.92Å; E526-T530 VanDerWaalsContact O-OG1 3.13Å; I527-T530 WeakPolarHBondContact CA-OG1 3.25Å; I527-T530 PolarHBondContact O-OG1 3.08Å; T530-T532 VanDerWaalsContact C-N 3.3Å; T530-T532 PolarHBondContact O-N 3.32Å; T530-M533 PolarHBondContact O-N 2.9Å; T530-L534 WeakPolarHBondContact O-CB 3.42Å; T530-L534 PolarHBondContact O-N 2.9Å
531	L	55.8	Low	65.8	Low	117 Å²	117	102.5 Å²	102.5	61%	0.613	50%	0.498	S	S	*	.	H	α-helix	trans	-67.7	-29.7	179.4	-170	142.9	0	0	0	112.7	I527 R528 R529 K535	I527-L531 VanDerWaalsContact O-CB 3.23Å; I527-L531 WeakPolarHBondContact O-CB 3.32Å; I527-L531 PolarHBondContact O-N 3.19Å; R528-L531 PolarHBondContact O-N 2.89Å; R529-L531 VanDerWaalsContact C-N 3.34Å; R529-L531 PolarHBondContact O-N 3.46Å; L531-K535 VanDerWaalsContact O-CB 3.3Å; L531-K535 WeakPolarHBondContact O-CB 3.42Å; L531-K535 PolarHBondContact O-N 3.48Å
532	T	67.4	Low	65.5	Low	70 Å²	70	103.5 Å²	103.5	43%	0.429	51%	0.509	S	S	.	.	H	α-helix	trans	-72.7	-49.3	174	-53.7	0	0	0	0	110.8	R528 R529 T530 L534 K535 D536	R528-T532 WeakPolarHBondContact O-CB 3.08Å; R528-T532 PolarHBondContact O-N 3.21Å; R528-T532 PolarHBondContact O-OG1 3.38Å; R529-T532 PolarHBondContact O-N 3.15Å; T530-T532 VanDerWaalsContact C-N 3.3Å; T530-T532 PolarHBondContact O-N 3.32Å; T532-L534 VanDerWaalsContact C-N 3.28Å; T532-L534 PolarHBondContact O-N 2.83Å; T532-K535 WeakPolarHBondContact O-CB 3.19Å; T532-K535 PolarHBondContact O-N 3.31Å; T532-D536 VanDerWaalsContact O-CG 3.3Å; T532-D536 PolarHBondContact O-N 3.42Å
533	M	65	Low	65.4	Low	143 Å²	143	99.7 Å²	99.7	70%	0.704	50%	0.503	S	S	*	.	H	α-helix	trans	-56.4	-40.4	173.5	179.2	-173.8	-84.5	0	0	112.2	R529 T530 D536 S537	R529-M533 WeakPolarHBondContact O-CB 3.44Å; R529-M533 PolarHBondContact O-N 3.46Å; T530-M533 PolarHBondContact O-N 2.9Å; M533-D536 PolarHBondContact O-N 2.74Å; M533-S537 WeakPolarHBondContact O-CB 3.44Å; M533-S537 PolarHBondContact O-N 2.97Å; M533-S537 PolarHBondContact O-OG 2.85Å
534	L	68.4	Low	65.6	Low	101 Å²	101	95.1 Å²	95.1	53%	0.529	50%	0.496	S	S	.	.	H	α-helix	trans	-72.9	-37.4	180	-146.6	165.2	0	0	0	111.5	T530 T532 S537 I538	T530-L534 WeakPolarHBondContact O-CB 3.42Å; T530-L534 PolarHBondContact O-N 2.9Å; T532-L534 VanDerWaalsContact C-N 3.28Å; T532-L534 PolarHBondContact O-N 2.83Å; L534-S537 PolarHBondContact O-OG 2.86Å; L534-I538 HydrophobicContact CD2-CD1 3.52Å; L534-I538 HydrophobicContact CD2-CG1 4.11Å; L534-I538 WeakPolarHBondContact O-CB 3.35Å; L534-I538 WeakPolarHBondContact O-CD1 3.45Å; L534-I538 VanDerWaalsContact O-CG1 3.24Å; L534-I538 WeakPolarHBondContact O-CG1 3.34Å; L534-I538 PolarHBondContact O-N 3.02Å
535	K	72.8	Confident	65.1	Low	120 Å²	120	96.1 Å²	96.1	52%	0.522	50%	0.501	S	S	.	.	H	α-helix	trans	-59.1	-47.9	169.7	171.5	-168.8	154.3	-93.1	0	111	L531 T532 I538 T539	L531-K535 VanDerWaalsContact O-CB 3.3Å; L531-K535 WeakPolarHBondContact O-CB 3.42Å; L531-K535 PolarHBondContact O-N 3.48Å; T532-K535 WeakPolarHBondContact O-CB 3.19Å; T532-K535 PolarHBondContact O-N 3.31Å; K535-I538 PolarHBondContact O-N 3.12Å; K535-T539 PolarHBondContact O-N 2.86Å
536	D	68.1	Low	65	Low	65 Å²	65	98.1 Å²	98.1	35%	0.348	51%	0.51	S	S	.	.	H	α-helix	trans	-74.8	-31.5	-174.5	-61.2	-23	0	0	0	111.5	T532 M533 T539 T540	T532-D536 VanDerWaalsContact O-CG 3.3Å; T532-D536 PolarHBondContact O-N 3.42Å; M533-D536 PolarHBondContact O-N 2.74Å; D536-T539 PolarHBondContact O-N 2.7Å; D536-T539 PolarHBondContact O-OG1 2.88Å; D536-T540 WeakPolarHBondContact O-CB 3.49Å; D536-T540 PolarHBondContact O-N 3.27Å; D536-T540 PolarHBondContact O-OG1 3.43Å
537	S	59.5	Low	65.4	Low	51 Å²	51	99.6 Å²	99.6	36%	0.357	51%	0.514	S	S	.	.	H	α-helix	trans	-66.6	-36.7	169.3	74.8	0	0	0	0	112.3	M533 L534 T540 L541	M533-S537 WeakPolarHBondContact O-CB 3.44Å; M533-S537 PolarHBondContact O-N 2.97Å; M533-S537 PolarHBondContact O-OG 2.85Å; L534-S537 PolarHBondContact O-OG 2.86Å; S537-T540 PolarHBondContact O-N 3.47Å; S537-L541 WeakPolarHBondContact O-CB 3.3Å; S537-L541 WeakPolarHBondContact O-CG 3.36Å; S537-L541 PolarHBondContact O-N 3.47Å
538	I	64.2	Low	65.4	Low	87 Å²	87	100.1 Å²	100.1	45%	0.446	52%	0.518	S	S	.	.	H	α-helix	trans	-64.3	-41.5	173.1	-74.8	168.1	0	0	0	111.6	L534 K535 L541 S542	L534-I538 HydrophobicContact CD2-CD1 3.52Å; L534-I538 HydrophobicContact CD2-CG1 4.11Å; L534-I538 WeakPolarHBondContact O-CB 3.35Å; L534-I538 WeakPolarHBondContact O-CD1 3.45Å; L534-I538 VanDerWaalsContact O-CG1 3.24Å; L534-I538 WeakPolarHBondContact O-CG1 3.34Å; L534-I538 PolarHBondContact O-N 3.02Å; K535-I538 PolarHBondContact O-N 3.12Å; I538-L541 PolarHBondContact O-N 3.07Å; I538-S542 WeakPolarHBondContact O-CB 3.5Å; I538-S542 PolarHBondContact O-N 3.46Å
539	T	68.5	Low	65.3	Low	66 Å²	66	100.1 Å²	100.1	41%	0.405	52%	0.523	S	S	.	.	H	α-helix	trans	-69.9	-35.1	176	58.4	0	0	0	0	111.9	K535 D536 S542 N543	K535-T539 PolarHBondContact O-N 2.86Å; D536-T539 PolarHBondContact O-N 2.7Å; D536-T539 PolarHBondContact O-OG1 2.88Å; T539-S542 PolarHBondContact O-N 2.81Å; T539-N543 WeakPolarHBondContact O-CB 3.3Å; T539-N543 PolarHBondContact O-N 2.87Å; T539-N543 PolarHBondContact O-ND2 3.21Å
540	T	68.4	Low	65.4	Low	95 Å²	95	95 Å²	95	58%	0.583	52%	0.516	S	S	*	.	H	α-helix	trans	-62.3	-47.8	172.4	-53.7	0	0	0	0	111.3	D536 S537 N543 A544	D536-T540 WeakPolarHBondContact O-CB 3.49Å; D536-T540 PolarHBondContact O-N 3.27Å; D536-T540 PolarHBondContact O-OG1 3.43Å; S537-T540 PolarHBondContact O-N 3.47Å; T540-N543 PolarHBondContact O-N 3.41Å; T540-A544 WeakPolarHBondContact O-CB 3.33Å; T540-A544 PolarHBondContact O-N 2.84Å
541	L	57.4	Low	65.2	Low	105 Å²	105	98.4 Å²	98.4	55%	0.55	52%	0.52	S	S	.	.	H	α-helix	trans	-61.7	-42.3	174.9	-77.8	165.6	0	0	0	112	S537 I538 N543 A544 I545	S537-L541 WeakPolarHBondContact O-CB 3.3Å; S537-L541 WeakPolarHBondContact O-CG 3.36Å; S537-L541 PolarHBondContact O-N 3.47Å; I538-L541 PolarHBondContact O-N 3.07Å; L541-N543 VanDerWaalsContact C-N 3.35Å; L541-N543 PolarHBondContact O-N 2.81Å; L541-A544 PolarHBondContact O-N 3.45Å; L541-I545 VanDerWaalsContact O-CG1 3.28Å; L541-I545 WeakPolarHBondContact O-CG1 3.35Å; L541-I545 PolarHBondContact O-N 3.4Å
542	S	61.4	Low	65.4	Low	67 Å²	67	94.5 Å²	94.5	47%	0.469	51%	0.505	S	S	.	.	H	α-helix	trans	-60.4	-43.7	176.6	-169.2	0	0	0	0	112	I538 T539 A544 Q546	I538-S542 WeakPolarHBondContact O-CB 3.5Å; I538-S542 PolarHBondContact O-N 3.46Å; T539-S542 PolarHBondContact O-N 2.81Å; S542-A544 VanDerWaalsContact C-N 3.34Å; S542-Q546 WeakPolarHBondContact O-CB 3.48Å; S542-Q546 PolarHBondContact O-N 2.95Å
543	N	71.4	Confident	65.7	Low	107 Å²	107	97 Å²	97	57%	0.572	51%	0.511	S	S	*	.	H	α-helix	trans	-69.4	-31	176.9	-71.9	-30.9	0	0	0	112.5	T539 T540 L541 K547	T539-N543 WeakPolarHBondContact O-CB 3.3Å; T539-N543 PolarHBondContact O-N 2.87Å; T539-N543 PolarHBondContact O-ND2 3.21Å; T540-N543 PolarHBondContact O-N 3.41Å; L541-N543 VanDerWaalsContact C-N 3.35Å; L541-N543 PolarHBondContact O-N 2.81Å; N543-K547 WeakPolarHBondContact O-CB 3.33Å; N543-K547 PolarHBondContact O-N 3.35Å
544	A	64.1	Low	66.1	Low	49 Å²	49	95.4 Å²	95.4	41%	0.405	50%	0.502	S	S	.	.	H	α-helix	trans	-69.6	-49.2	173.8	0	0	0	0	0	111.5	T540 L541 S542 Q546 K547 D548	T540-A544 WeakPolarHBondContact O-CB 3.33Å; T540-A544 PolarHBondContact O-N 2.84Å; L541-A544 PolarHBondContact O-N 3.45Å; S542-A544 VanDerWaalsContact C-N 3.34Å; A544-Q546 PolarHBondContact O-N 2.78Å; A544-K547 WeakPolarHBondContact O-CB 3.43Å; A544-K547 PolarHBondContact O-N 3.21Å; A544-D548 PolarHBondContact O-N 3.01Å
545	I	53.6	Low	65.9	Low	102 Å²	102	93.1 Å²	93.1	52%	0.523	49%	0.493	S	S	.	.	H	α-helix	trans	-58.5	-46.6	178.1	-68.4	163	0	0	0	110.8	L541 K547 D548 E549	L541-I545 VanDerWaalsContact O-CG1 3.28Å; L541-I545 WeakPolarHBondContact O-CG1 3.35Å; L541-I545 PolarHBondContact O-N 3.4Å; I545-K547 PolarHBondContact O-N 3.17Å; I545-D548 PolarHBondContact O-N 3.47Å; I545-E549 PolarHBondContact O-N 3.06Å
546	Q	70	Confident	65.9	Low	129 Å²	129	95.8 Å²	95.8	60%	0.603	50%	0.499	S	S	*	.	H	α-helix	trans	-62.7	-27.6	178.6	-168.3	175.7	17.1	0	0	112.8	S542 A544 A550	S542-Q546 WeakPolarHBondContact O-CB 3.48Å; S542-Q546 PolarHBondContact O-N 2.95Å; A544-Q546 PolarHBondContact O-N 2.78Å; Q546-A550 PolarHBondContact O-N 2.78Å
547	K	69.4	Low	66.4	Low	157 Å²	157	99.1 Å²	99.1	68%	0.683	51%	0.513	S	S	*	.	H	α-helix	trans	-80.1	-38.8	175.5	-170.4	-174.2	174.1	-163.2	0	112.3	N543 A544 I545 E549 A550 W551	N543-K547 WeakPolarHBondContact O-CB 3.33Å; N543-K547 PolarHBondContact O-N 3.35Å; A544-K547 WeakPolarHBondContact O-CB 3.43Å; A544-K547 PolarHBondContact O-N 3.21Å; I545-K547 PolarHBondContact O-N 3.17Å; K547-E549 VanDerWaalsContact C-N 3.35Å; K547-A550 PolarHBondContact O-N 3.34Å; K547-W551 PolarHBondContact O-N 3.33Å
548	D	61.6	Low	67.1	Low	112 Å²	112	101.4 Å²	101.4	60%	0.599	52%	0.52	S	S	*	.	H	α-helix	trans	-65.7	-37.3	173.3	-91.3	20.7	0	0	0	111.4	A544 I545 A550 W551 A552	A544-D548 PolarHBondContact O-N 3.01Å; I545-D548 PolarHBondContact O-N 3.47Å; D548-A550 VanDerWaalsContact C-N 3.33Å; D548-A550 PolarHBondContact O-N 2.92Å; D548-W551 PolarHBondContact O-N 3.04Å; D548-A552 VanDerWaalsContact O-CB 3.26Å; D548-A552 WeakPolarHBondContact O-CB 3.26Å; D548-A552 PolarHBondContact O-N 2.99Å
549	E	68.5	Low	67.3	Low	118 Å²	118	103.1 Å²	103.1	55%	0.551	53%	0.53	S	S	*	.	H	α-helix	trans	-60.3	-41.2	171.5	-76	-168.8	140.6	0	0	112.2	I545 K547 A552 Q553	I545-E549 PolarHBondContact O-N 3.06Å; K547-E549 VanDerWaalsContact C-N 3.35Å; E549-A552 PolarHBondContact O-N 3.44Å; E549-Q553 WeakPolarHBondContact O-CG 3.25Å; E549-Q553 PolarHBondContact O-N 2.8Å; E549-Q553 VanDerWaalsContact O-N 3.08Å
550	A	75.3	Confident	67.6	Low	55 Å²	55	105.3 Å²	105.3	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-64.6	-44.2	175.8	0	0	0	0	0	111.7	Q546 K547 D548 A552 Q553 E554	Q546-A550 PolarHBondContact O-N 2.78Å; K547-A550 PolarHBondContact O-N 3.34Å; D548-A550 VanDerWaalsContact C-N 3.33Å; D548-A550 PolarHBondContact O-N 2.92Å; A550-A552 VanDerWaalsContact C-N 3.34Å; A550-A552 PolarHBondContact O-N 3.02Å; A550-Q553 WeakPolarHBondContact O-CB 3.44Å; A550-Q553 PolarHBondContact O-N 2.9Å; A550-Q553 VanDerWaalsContact O-N 3.15Å; A550-E554 PolarHBondContact O-N 2.96Å
551	W	58.9	Low	67.9	Low	150 Å²	150	106.1 Å²	106.1	57%	0.568	53%	0.533	S	S	*	.	H	α-helix	trans	-68	-32.7	177.2	-172	67.5	0	0	0	112.9	K547 D548 Q553 E554 T555	K547-W551 PolarHBondContact O-N 3.33Å; D548-W551 PolarHBondContact O-N 3.04Å; W551-Q553 VanDerWaalsContact C-N 3.29Å; W551-Q553 PolarHBondContact O-N 2.89Å; W551-E554 PolarHBondContact O-N 3.04Å; W551-T555 HydrophobicContact CD2-CG2 4.2Å; W551-T555 HydrophobicContact CH2-CG2 4.16Å; W551-T555 HydrophobicContact CZ2-CG2 3.72Å; W551-T555 PolarHBondContact O-N 2.92Å; W551-T555 PolarHBondContact O-OG1 3.49Å
552	A	58.7	Low	68.4	Low	36 Å²	36	104.7 Å²	104.7	30%	0.298	53%	0.528	S	S	.	.	H	α-helix	trans	-69.4	-23.6	172.2	0	0	0	0	0	113.3	D548 E549 A550 T555 R556	D548-A552 VanDerWaalsContact O-CB 3.26Å; D548-A552 WeakPolarHBondContact O-CB 3.26Å; D548-A552 PolarHBondContact O-N 2.99Å; E549-A552 PolarHBondContact O-N 3.44Å; A550-A552 VanDerWaalsContact C-N 3.34Å; A550-A552 PolarHBondContact O-N 3.02Å; A552-T555 WeakPolarHBondContact CA-OG1 3.32Å; A552-T555 PolarHBondContact O-OG1 3.37Å; A552-R556 WeakPolarHBondContact O-CD 3.41Å; A552-R556 VanDerWaalsContact O-CG 3.25Å; A552-R556 WeakPolarHBondContact O-CG 3.48Å
553	Q	74	Confident	68.9	Low	121 Å²	121	109.9 Å²	109.9	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-79.7	-43.7	170.3	-70.2	174.2	28.5	0	0	111.3	E549 A550 W551 R556 Q557	E549-Q553 WeakPolarHBondContact O-CG 3.25Å; E549-Q553 PolarHBondContact O-N 2.8Å; E549-Q553 VanDerWaalsContact O-N 3.08Å; A550-Q553 WeakPolarHBondContact O-CB 3.44Å; A550-Q553 PolarHBondContact O-N 2.9Å; A550-Q553 VanDerWaalsContact O-N 3.15Å; W551-Q553 VanDerWaalsContact C-N 3.29Å; W551-Q553 PolarHBondContact O-N 2.89Å; Q553-R556 WeakPolarHBondContact O-CB 3.41Å; Q553-R556 PolarHBondContact O-N 3.15Å; Q553-Q557 PolarHBondContact O-N 3.43Å
554	E	73.7	Confident	69	Low	111 Å²	111	110.3 Å²	110.3	52%	0.519	54%	0.535	S	S	.	.	H	α-helix	trans	-59.9	-45.9	177.5	-170.3	173.8	-131.3	0	0	112	A550 W551 R556 Q557 L558	A550-E554 PolarHBondContact O-N 2.96Å; W551-E554 PolarHBondContact O-N 3.04Å; E554-R556 VanDerWaalsContact C-N 3.33Å; E554-R556 PolarHBondContact O-N 3.08Å; E554-Q557 PolarHBondContact O-N 2.99Å; E554-L558 PolarHBondContact O-N 2.91Å
555	T	65.1	Low	69.1	Low	53 Å²	53	114 Å²	114	33%	0.325	54%	0.543	S	S	.	.	H	α-helix	trans	-65.4	-30.8	174.7	45.9	0	0	0	0	113.6	W551 A552 L559	W551-T555 HydrophobicContact CD2-CG2 4.2Å; W551-T555 HydrophobicContact CH2-CG2 4.16Å; W551-T555 HydrophobicContact CZ2-CG2 3.72Å; W551-T555 PolarHBondContact O-N 2.92Å; W551-T555 PolarHBondContact O-OG1 3.49Å; A552-T555 WeakPolarHBondContact CA-OG1 3.32Å; A552-T555 PolarHBondContact O-OG1 3.37Å; T555-L559 WeakPolarHBondContact O-CB 3.4Å; T555-L559 PolarHBondContact O-N 2.94Å
556	R	72.6	Confident	69.6	Low	175 Å²	175	112.9 Å²	112.9	66%	0.66	54%	0.541	S	S	*	.	H	α-helix	trans	-69.1	-39.3	171.7	-78.3	172.5	178.5	165.2	1.4	112.3	A552 Q553 E554 L559 E560	A552-R556 WeakPolarHBondContact O-CD 3.41Å; A552-R556 VanDerWaalsContact O-CG 3.25Å; A552-R556 WeakPolarHBondContact O-CG 3.48Å; Q553-R556 WeakPolarHBondContact O-CB 3.41Å; Q553-R556 PolarHBondContact O-N 3.15Å; E554-R556 VanDerWaalsContact C-N 3.33Å; E554-R556 PolarHBondContact O-N 3.08Å; R556-L559 PolarHBondContact O-N 3.37Å; R556-E560 PolarHBondContact O-N 3.48Å
557	Q	79.2	Confident	69	Low	135 Å²	135	111.6 Å²	111.6	63%	0.631	54%	0.535	S	S	*	.	H	α-helix	trans	-63.4	-46.6	175.3	-71.7	179.8	-12.6	0	0	111.2	Q553 E554 L559 E560 E561	Q553-Q557 PolarHBondContact O-N 3.43Å; E554-Q557 PolarHBondContact O-N 2.99Å; Q557-L559 VanDerWaalsContact C-N 3.29Å; Q557-L559 PolarHBondContact O-N 3.47Å; Q557-E560 WeakPolarHBondContact O-CB 3.46Å; Q557-E560 PolarHBondContact O-N 2.88Å; Q557-E560 VanDerWaalsContact O-N 3.11Å; Q557-E561 PolarHBondContact O-N 3.44Å
558	L	73.7	Confident	68.5	Low	99 Å²	99	108.4 Å²	108.4	52%	0.518	53%	0.529	S	S	.	.	H	α-helix	trans	-59.1	-38.2	174.6	-71.5	168.1	0	0	0	112.6	E554 E561 T562	E554-L558 PolarHBondContact O-N 2.91Å; L558-E561 PolarHBondContact O-N 3.23Å; L558-T562 WeakPolarHBondContact O-CB 3.49Å; L558-T562 PolarHBondContact O-N 3.35Å; L558-T562 PolarHBondContact O-OG1 2.92Å
559	L	66.9	Low	68	Low	123 Å²	123	108.5 Å²	108.5	64%	0.644	53%	0.529	S	S	*	.	H	α-helix	trans	-67.4	-38.1	175.8	-175.1	64.5	0	0	0	111.9	T555 R556 Q557 R563	T555-L559 WeakPolarHBondContact O-CB 3.4Å; T555-L559 PolarHBondContact O-N 2.94Å; R556-L559 PolarHBondContact O-N 3.37Å; Q557-L559 VanDerWaalsContact C-N 3.29Å; Q557-L559 PolarHBondContact O-N 3.47Å; L559-R563 VanDerWaalsContact O-CB 3.24Å; L559-R563 WeakPolarHBondContact O-CB 3.24Å; L559-R563 PolarHBondContact O-N 2.86Å
560	E	75.4	Confident	67.2	Low	113 Å²	113	109.6 Å²	109.6	53%	0.528	53%	0.534	S	S	.	.	H	α-helix	trans	-67.4	-41.8	173.3	-82.4	-161.8	-163.3	0	0	113.3	R556 Q557 R563 K564	R556-E560 PolarHBondContact O-N 3.48Å; Q557-E560 WeakPolarHBondContact O-CB 3.46Å; Q557-E560 PolarHBondContact O-N 2.88Å; Q557-E560 VanDerWaalsContact O-N 3.11Å; E560-R563 PolarHBondContact O-N 3.34Å; E560-K564 WeakPolarHBondContact O-CB 3.49Å; E560-K564 VanDerWaalsContact O-CD 3.32Å; E560-K564 WeakPolarHBondContact O-CD 3.42Å; E560-K564 WeakPolarHBondContact O-CG 3.36Å; E560-K564 PolarHBondContact O-N 3.29Å; E560-K564 IonicContact OE2-NZ 2.66Å; E560-K564 PolarHBondContact OE2-NZ 2.93Å
561	E	74.8	Confident	65.9	Low	111 Å²	111	114.2 Å²	114.2	52%	0.519	55%	0.548	S	S	.	.	H	α-helix	trans	-63.3	-46	175.3	-70.9	-169.9	153.6	0	0	111.3	Q557 L558 R563 K564 Q565	Q557-E561 PolarHBondContact O-N 3.44Å; L558-E561 PolarHBondContact O-N 3.23Å; E561-R563 VanDerWaalsContact C-N 3.3Å; E561-R563 PolarHBondContact O-N 2.95Å; E561-K564 WeakPolarHBondContact O-CB 3.36Å; E561-K564 PolarHBondContact O-N 3.07Å; E561-K564 VanDerWaalsContact O-N 3.12Å; E561-Q565 WeakPolarHBondContact O-CG 3.48Å; E561-Q565 PolarHBondContact O-N 3.46Å
562	T	68.3	Low	65.3	Low	75 Å²	75	115.1 Å²	115.1	46%	0.46	56%	0.558	S	S	.	*	H	α-helix	trans	-57.5	-44	173.2	-52.5	0	0	0	0	111.1	L558 K564 Q565 V566	L558-T562 WeakPolarHBondContact O-CB 3.49Å; L558-T562 PolarHBondContact O-N 3.35Å; L558-T562 PolarHBondContact O-OG1 2.92Å; T562-K564 VanDerWaalsContact C-N 3.34Å; T562-K564 PolarHBondContact O-N 3.18Å; T562-Q565 PolarHBondContact O-N 3.05Å; T562-V566 WeakPolarHBondContact O-CG2 3.48Å; T562-V566 PolarHBondContact O-N 3.23Å
563	R	72.1	Confident	64.3	Low	177 Å²	177	116.8 Å²	116.8	67%	0.668	58%	0.579	S	S	*	*	H	α-helix	trans	-64.2	-35.9	176.5	-172.7	176.4	-173.4	169.8	3.9	112.7	L559 E560 E561 H567	L559-R563 VanDerWaalsContact O-CB 3.24Å; L559-R563 WeakPolarHBondContact O-CB 3.24Å; L559-R563 PolarHBondContact O-N 2.86Å; E560-R563 PolarHBondContact O-N 3.34Å; E561-R563 VanDerWaalsContact C-N 3.3Å; E561-R563 PolarHBondContact O-N 2.95Å; R563-H567 WeakPolarHBondContact O-CB 3.3Å; R563-H567 PolarHBondContact O-N 3.14Å
564	K	72.4	Confident	62.3	Low	116 Å²	116	115.2 Å²	115.2	50%	0.504	59%	0.587	S	S	.	*	H	α-helix	trans	-66.8	-43.3	174.2	-70.8	156.1	-166.2	161.2	0	110.8	E560 E561 T562 H567 T568	E560-K564 WeakPolarHBondContact O-CB 3.49Å; E560-K564 VanDerWaalsContact O-CD 3.32Å; E560-K564 WeakPolarHBondContact O-CD 3.42Å; E560-K564 WeakPolarHBondContact O-CG 3.36Å; E560-K564 PolarHBondContact O-N 3.29Å; E560-K564 IonicContact OE2-NZ 2.66Å; E560-K564 PolarHBondContact OE2-NZ 2.93Å; E561-K564 WeakPolarHBondContact O-CB 3.36Å; E561-K564 PolarHBondContact O-N 3.07Å; E561-K564 VanDerWaalsContact O-N 3.12Å; T562-K564 VanDerWaalsContact C-N 3.34Å; T562-K564 PolarHBondContact O-N 3.18Å; K564-H567 PolarHBondContact O-N 3.09Å; K564-T568 PolarHBondContact O-N 3.04Å; K564-T568 PolarHBondContact O-OG1 3.35Å
565	Q	67.5	Low	60.8	Low	125 Å²	125	117.9 Å²	117.9	58%	0.584	60%	0.604	S	S	*	*	H	α-helix	trans	-63.7	-42	175.1	-69.9	-179.8	7.6	0	0	113	E561 T562 H567 T568 L569	E561-Q565 WeakPolarHBondContact O-CG 3.48Å; E561-Q565 PolarHBondContact O-N 3.46Å; T562-Q565 PolarHBondContact O-N 3.05Å; Q565-H567 VanDerWaalsContact C-N 3.32Å; Q565-H567 PolarHBondContact O-N 3.31Å; Q565-T568 PolarHBondContact O-N 3.49Å; Q565-T568 PolarHBondContact O-OG1 3.32Å; Q565-L569 WeakPolarHBondContact O-CG 3.48Å; Q565-L569 PolarHBondContact O-N 2.76Å
566	V	64	Low	59.5	Low	80 Å²	80	121.3 Å²	121.3	49%	0.485	63%	0.627	S	S	.	*	H	α-helix	trans	-63.5	-39.6	174.3	172.4	0	0	0	0	110.9	T562 L569 Q570	T562-V566 WeakPolarHBondContact O-CG2 3.48Å; T562-V566 PolarHBondContact O-N 3.23Å; V566-L569 PolarHBondContact O-N 2.93Å; V566-Q570 VanDerWaalsContact O-CB 3.3Å; V566-Q570 WeakPolarHBondContact O-CB 3.35Å; V566-Q570 PolarHBondContact O-N 3.26Å
567	H	57.7	Low	57.6	Low	101 Å²	101	117.5 Å²	117.5	47%	0.468	63%	0.633	S	S	.	*	H	α-helix	trans	-64.6	-39	175.6	-102.2	-74.2	0	0	0	113.6	R563 K564 Q565 Q570 M571	R563-H567 WeakPolarHBondContact O-CB 3.3Å; R563-H567 PolarHBondContact O-N 3.14Å; K564-H567 PolarHBondContact O-N 3.09Å; Q565-H567 VanDerWaalsContact C-N 3.32Å; Q565-H567 PolarHBondContact O-N 3.31Å; H567-Q570 PolarHBondContact O-N 2.95Å; H567-M571 WeakPolarHBondContact O-CG 3.47Å; H567-M571 PolarHBondContact O-N 2.89Å
568	T	58	Low	55.6	Low	90 Å²	90	117.2 Å²	117.2	55%	0.552	64%	0.643	S	S	*	*	H	α-helix	trans	-70.6	-40	177	50.8	0	0	0	0	112	K564 Q565 Q570 M571	K564-T568 PolarHBondContact O-N 3.04Å; K564-T568 PolarHBondContact O-OG1 3.35Å; Q565-T568 PolarHBondContact O-N 3.49Å; Q565-T568 PolarHBondContact O-OG1 3.32Å; T568-Q570 VanDerWaalsContact C-N 3.33Å; T568-Q570 PolarHBondContact O-N 3.09Å; T568-M571 PolarHBondContact O-N 3.05Å
569	L	51.3	Low	53.6	Low	115 Å²	115	119.7 Å²	119.7	60%	0.602	66%	0.662	S	S	*	*	H	α-helix	trans	-60.7	-41.4	172	-71.6	168.1	0	0	0	111.8	Q565 V566 M571 Q572	Q565-L569 WeakPolarHBondContact O-CG 3.48Å; Q565-L569 PolarHBondContact O-N 2.76Å; V566-L569 PolarHBondContact O-N 2.93Å; L569-M571 VanDerWaalsContact C-N 3.25Å; L569-M571 PolarHBondContact O-N 2.92Å; L569-Q572 PolarHBondContact O-N 3.37Å; L569-Q572 VanDerWaalsContact O-N 3.11Å
570	Q	50.8	Low	52.2	Low	141 Å²	141	117.6 Å²	117.6	66%	0.659	67%	0.67	S	S	*	*	H	α-helix	trans	-67.1	-23.3	179.3	-167.3	170.5	2.7	0	0	113.3	V566 H567 T568	V566-Q570 VanDerWaalsContact O-CB 3.3Å; V566-Q570 WeakPolarHBondContact O-CB 3.35Å; V566-Q570 PolarHBondContact O-N 3.26Å; H567-Q570 PolarHBondContact O-N 2.95Å; T568-Q570 VanDerWaalsContact C-N 3.33Å; T568-Q570 PolarHBondContact O-N 3.09Å
571	M	48.5	Very low	50.2	Low	151 Å²	151	120.1 Å²	120.1	74%	0.744	69%	0.687	S	S	*	*	H	α-helix	trans	-77.2	-19.7	172.6	-71	-171.7	-177.1	0	0	113.9	H567 T568 L569	H567-M571 WeakPolarHBondContact O-CG 3.47Å; H567-M571 PolarHBondContact O-N 2.89Å; T568-M571 PolarHBondContact O-N 3.05Å; L569-M571 VanDerWaalsContact C-N 3.25Å; L569-M571 PolarHBondContact O-N 2.92Å
572	Q	46.8	Very low	48.5	Very low	170 Å²	170	122.9 Å²	122.9	79%	0.794	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-6.9	179.3	-74.5	-178.3	-26	0	0	114.1	L569	L569-Q572 PolarHBondContact O-N 3.37Å; L569-Q572 VanDerWaalsContact O-N 3.11Å
573	G	38.3	Very low	46.7	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	1.4	-176.2	0	0	0	0	0	116.9
574	A	31.8	Very low	45.2	Very low	88 Å²	88	131.6 Å²	131.6	73%	0.727	74%	0.738	S	S	*	*			trans	-100.8	84.9	-167.2	0	0	0	0	0	113.9
575	L	40.9	Very low	43.4	Very low	167 Å²	167	132.4 Å²	132.4	87%	0.874	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-96	141.5	167.5	-76.7	166.6	0	0	0	111.4
576	P	37.8	Very low	41.6	Very low	124 Å²	124	131 Å²	131	81%	0.805	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-80.7	151.1	-171.7	32.4	-36	0	0	0	113.7
577	A	33	Very low	40.2	Very low	96 Å²	96	136.4 Å²	136.4	79%	0.793	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-95.1	142.8	-179	0	0	0	0	0	113.2
578	P	36.9	Very low	39	Very low	128 Å²	128	138.7 Å²	138.7	83%	0.831	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-83.7	145.3	170.5	33.8	-33.4	0	0	0	112.2
579	T	32.8	Very low	37.9	Very low	152 Å²	152	141 Å²	141	93%	0.933	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-85.7	142.4	176.7	33.7	0	0	0	0	112.6
580	G	36.8	Very low	37.4	Very low	79 Å²	79	140.5 Å²	140.5	81%	0.814	82%	0.815	S	S	*	*			trans	-151.4	106.7	176.2	0	0	0	0	0	112.4
581	N	33.8	Very low	37.2	Very low	165 Å²	165	137.1 Å²	137.1	88%	0.882	81%	0.807	S	S	*	*			trans	-86.5	126.5	175.5	-83.4	-32.5	0	0	0	111
582	N	38.9	Very low	37.5	Very low	169 Å²	169	135 Å²	135	90%	0.904	81%	0.805	S	S	*	*			trans	-165.5	150.3	130.3	-106.7	-39.3	0	0	0	113
583	R	31.3	Very low	37.8	Very low	242 Å²	242	132.9 Å²	132.9	91%	0.913	80%	0.798	S	S	*	*			trans	-98.4	131	179.4	-69.5	174.6	173.7	152.3	-4.4	111
584	Q	40	Very low	38.2	Very low	193 Å²	193	136.3 Å²	136.3	90%	0.902	80%	0.795	S	S	*	*			trans	-140.2	138.8	147.7	-75.9	-166	-15.5	0	0	110
585	P	34.2	Very low	39.6	Very low	133 Å²	133	135 Å²	135	86%	0.864	79%	0.79	S	S	*	*			trans	-96.1	119.9	-177.5	34.5	-30.4	0	0	0	112
586	A	30.9	Very low	40.7	Very low	95 Å²	95	132.1 Å²	132.1	79%	0.785	77%	0.774	S	S	*	*			trans	-150.5	132	173	0	0	0	0	0	113.2
587	K	32.8	Very low	42	Very low	195 Å²	195	133.6 Å²	133.6	85%	0.848	77%	0.767	S	S	*	*			trans	50.6	110.6	164.3	-68	-179.9	176.4	177.4	0	117.8	L589	K587-L589 PolarHBondContact O-N 2.9Å; K587-L589 VanDerWaalsContact O-N 3.14Å
588	T	33.1	Very low	43.6	Very low	149 Å²	149	134 Å²	134	91%	0.914	76%	0.755	S	S	*	*			trans	-60	108.6	163.9	-43.2	0	0	0	0	110.8
589	L	34.3	Very low	44.9	Very low	139 Å²	139	133.8 Å²	133.8	73%	0.728	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-74.7	147.7	162.8	-83.1	75.9	0	0	0	109.4	K587	K587-L589 PolarHBondContact O-N 2.9Å; K587-L589 VanDerWaalsContact O-N 3.14Å
590	P	42.7	Very low	46.2	Very low	103 Å²	103	129.1 Å²	129.1	67%	0.669	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-61.1	144.4	171.3	27.6	-34.4	0	0	0	110.4
591	S	45.7	Very low	47.2	Very low	70 Å²	70	130.2 Å²	130.2	49%	0.49	71%	0.709	S	S	.	*	P	Polyproline II helix	trans	-73	140.8	-173.5	62.2	0	0	0	0	111.5	L593 Q594	S591-L593 PolarHBondContact O-N 3.24Å; S591-Q594 WeakPolarHBondContact O-CB 3.29Å; S591-Q594 PolarHBondContact O-N 2.79Å
592	P	55.2	Low	48.2	Very low	107 Å²	107	127.9 Å²	127.9	70%	0.695	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-4.1	-175.4	26.6	-35.4	0	0	0	114.5	W610	P592-W610 WeakPolarHBondContact O-CZ2 3.47Å; P592-W610 PolarHBondContact O-NE1 3.47Å
593	L	53.1	Low	48.5	Very low	125 Å²	125	129.6 Å²	129.6	65%	0.654	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-8.3	177.3	-60.4	173.1	0	0	0	113	S591 G595 M596	S591-L593 PolarHBondContact O-N 3.24Å; L593-G595 PolarHBondContact O-N 2.87Å; L593-M596 PolarHBondContact O-N 3.26Å
594	Q	46.3	Very low	49.5	Very low	144 Å²	144	120.8 Å²	120.8	67%	0.673	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	115.2	-175.5	-165.2	164	1.5	0	0	110.8	S591	S591-Q594 WeakPolarHBondContact O-CB 3.29Å; S591-Q594 PolarHBondContact O-N 2.79Å
595	G	61.8	Low	50.1	Low	61 Å²	61	115.6 Å²	115.6	63%	0.629	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	103.7	4.6	-177	0	0	0	0	0	116	L593 K597	L593-G595 PolarHBondContact O-N 2.87Å; G595-K597 PolarHBondContact O-N 2.75Å
596	M	63.7	Low	51.4	Low	106 Å²	106	110.4 Å²	110.4	52%	0.522	62%	0.621	S	S	.	*			trans	-72.9	121	170.7	-163.9	175	87.9	0	0	110.8	L593 I608 R609 W610	L593-M596 PolarHBondContact O-N 3.26Å; M596-I608 HydrophobicContact CG-CG2 3.37Å; M596-I608 HydrophobicContact SD-CG2 3.92Å; M596-R609 WeakPolarHBondContact CA-O 3.44Å; M596-W610 HydrophobicContact CG-CB 4.46Å
597	K	65	Low	52.9	Low	154 Å²	154	110.1 Å²	110.1	67%	0.67	60%	0.6	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-134.7	123.6	-179.4	-173.8	172.3	-178.1	176.8	0	111.6	G595 R609	G595-K597 PolarHBondContact O-N 2.75Å; K597-R609 PolarHBondContact N-O 3.01Å; K597-R609 PolarHBondContact O-N 2.93Å
598	I	66	Low	54.6	Low	106 Å²	106	102.6 Å²	102.6	54%	0.544	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.1	130.4	171.2	-55.7	172	0	0	0	108.2	V601	I598-V601 HydrophobicContact CG2-CG2 4.13Å
599	M	64.1	Low	56.4	Low	123 Å²	123	101.7 Å²	101.7	61%	0.606	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	-41.5	179.7	-74.9	-163.9	60.1	0	0	112.9	W607 R609	M599-W607 HydrophobicContact CB-CB 4.48Å; M599-W607 PolarHBondContact N-O 3.26Å; M599-R609 HydrophobicContact CG-CB 4.02Å; M599-R609 HydrophobicContact SD-CB 3.89Å; M599-R609 HydrophobicContact SD-CG 4.32Å
600	S	60.9	Low	58.1	Low	54 Å²	54	98.9 Å²	98.9	38%	0.378	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	159.9	175.2	54.1	0	0	0	0	110.4	W607	S600-W607 PolarHBondContact O-N 3.39Å
601	V	58.7	Low	59.1	Low	102 Å²	102	101.4 Å²	101.4	62%	0.618	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	114.7	171.4	-179.4	0	0	0	0	106.9	I598 M605 A606	I598-V601 HydrophobicContact CG2-CG2 4.13Å; V601-M605 WeakPolarHBondContact CA-O 3.25Å; V601-A606 HydrophobicContact CG2-CB 4.44Å
602	E	54.1	Low	59.9	Low	115 Å²	115	100.7 Å²	100.7	54%	0.537	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	124.2	-171.7	-173.7	170	-166.2	0	0	110.4	G604 M605	E602-G604 PolarHBondContact O-N 2.92Å; E602-G604 VanDerWaalsContact O-N 3.08Å; E602-M605 PolarHBondContact N-O 3.21Å; E602-M605 PolarHBondContact O-N 2.76Å
603	K	45.9	Very low	59.2	Low	206 Å²	206	98.6 Å²	98.6	90%	0.896	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.7	44.8	176.5	-64	-178.1	179.8	174.9	0	114.7	M605	K603-M605 VanDerWaalsContact C-N 3.33Å; K603-M605 PolarHBondContact O-N 3.28Å
604	G	52.2	Low	59.3	Low	56 Å²	56	95.7 Å²	95.7	58%	0.577	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-8.5	177.4	0	0	0	0	0	115.4	E602	E602-G604 PolarHBondContact O-N 2.92Å; E602-G604 VanDerWaalsContact O-N 3.08Å
605	M	51.5	Low	59.5	Low	84 Å²	84	95.7 Å²	95.7	41%	0.414	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.8	170.2	-61.4	-162.9	-60.9	0	0	110.7	V601 E602 K603 W607 A616	V601-M605 WeakPolarHBondContact CA-O 3.25Å; E602-M605 PolarHBondContact N-O 3.21Å; E602-M605 PolarHBondContact O-N 2.76Å; K603-M605 VanDerWaalsContact C-N 3.33Å; K603-M605 PolarHBondContact O-N 3.28Å; M605-W607 HydrophobicContact CE-CZ2 4.13Å; M605-A616 HydrophobicContact SD-CB 4.18Å
606	A	62.2	Low	59.2	Low	24 Å²	24	94.8 Å²	94.8	20%	0.198	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	118.3	170	0	0	0	0	0	109	V601 I608 P617	V601-A606 HydrophobicContact CG2-CB 4.44Å; A606-I608 PolarHBondContact O-N 2.72Å; A606-P617 WeakPolarHBondContact O-CD 3.4Å
607	W	62.3	Low	59	Low	90 Å²	90	92.7 Å²	92.7	34%	0.341	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	107.2	177.2	-67.7	96.1	0	0	0	109.5	M599 S600 M605 A616	M599-W607 HydrophobicContact CB-CB 4.48Å; M599-W607 PolarHBondContact N-O 3.26Å; S600-W607 PolarHBondContact O-N 3.39Å; M605-W607 HydrophobicContact CE-CZ2 4.13Å; W607-A616 HydrophobicContact CD2-CB 4.43Å; W607-A616 HydrophobicContact CE3-CB 4.02Å; W607-A616 HydrophobicContact CH2-CB 4.24Å; W607-A616 HydrophobicContact CZ3-CB 3.92Å
608	I	67.9	Low	58.2	Low	36 Å²	36	87.6 Å²	87.6	19%	0.185	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.9	-177.2	-58	176	0	0	0	109.1	M596 A606 W615 P617	M596-I608 HydrophobicContact CG-CG2 3.37Å; M596-I608 HydrophobicContact SD-CG2 3.92Å; A606-I608 PolarHBondContact O-N 2.72Å; I608-W615 PolarHBondContact N-O 3.11Å; I608-W615 PolarHBondContact O-N 3.3Å; I608-P617 HydrophobicContact CD1-CG 4.16Å
609	R	71.7	Confident	57.2	Low	130 Å²	130	87.8 Å²	87.8	49%	0.491	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	126	169.6	-166.7	176.3	-170.3	178.8	-0.8	109.9	M596 K597 M599 G612 S613	M596-R609 WeakPolarHBondContact CA-O 3.44Å; K597-R609 PolarHBondContact N-O 3.01Å; K597-R609 PolarHBondContact O-N 2.93Å; M599-R609 HydrophobicContact CG-CB 4.02Å; M599-R609 HydrophobicContact SD-CB 3.89Å; M599-R609 HydrophobicContact SD-CG 4.32Å; R609-G612 PolarHBondContact NE-O 3.45Å; R609-S613 CarbonylContact C-O 3.58Å; R609-S613 WeakPolarHBondContact CA-O 3.28Å
610	W	68.5	Low	56.4	Low	81 Å²	81	89.5 Å²	89.5	31%	0.307	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	134.4	176.6	-176.4	72.5	0	0	0	110	P592 M596 G612 S613	P592-W610 WeakPolarHBondContact O-CZ2 3.47Å; P592-W610 PolarHBondContact O-NE1 3.47Å; M596-W610 HydrophobicContact CG-CB 4.46Å; W610-G612 VanDerWaalsContact C-N 3.31Å; W610-G612 PolarHBondContact O-N 2.92Å; W610-S613 PolarHBondContact N-O 3.11Å; W610-S613 PolarHBondContact O-N 3.47Å
611	Q	63.8	Low	55.4	Low	155 Å²	155	93.6 Å²	93.6	72%	0.724	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	48.6	-172.8	-62.5	-163.2	53.6	0	0	114	S613	Q611-S613 PolarHBondContact O-N 3.49Å
612	G	62.4	Low	54.4	Low	55 Å²	55	96.8 Å²	96.8	57%	0.567	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	-42.1	179.7	0	0	0	0	0	114.1	R609 W610	R609-G612 PolarHBondContact NE-O 3.45Å; W610-G612 VanDerWaalsContact C-N 3.31Å; W610-G612 PolarHBondContact O-N 2.92Å
613	S	42.3	Very low	53.4	Low	63 Å²	63	96.3 Å²	96.3	44%	0.441	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	152.6	179.8	-61.1	0	0	0	0	113.8	R609 W610 Q611	R609-S613 CarbonylContact C-O 3.58Å; R609-S613 WeakPolarHBondContact CA-O 3.28Å; W610-S613 PolarHBondContact N-O 3.11Å; W610-S613 PolarHBondContact O-N 3.47Å; Q611-S613 PolarHBondContact O-N 3.49Å
614	A	55.2	Low	52.8	Low	64 Å²	64	97.7 Å²	97.7	53%	0.529	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	135.7	169.4	0	0	0	0	0	110.1
615	W	50.3	Low	52.2	Low	145 Å²	145	105.5 Å²	105.5	55%	0.549	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	136.9	-177.4	-56.2	84.4	0	0	0	109.6	I608	I608-W615 PolarHBondContact N-O 3.11Å; I608-W615 PolarHBondContact O-N 3.3Å
616	A	55.3	Low	51.4	Low	42 Å²	42	107.8 Å²	107.8	35%	0.347	56%	0.559	S	S	.	*			trans	-116.1	106.4	171.4	0	0	0	0	0	108.5	M605 W607 G618	M605-A616 HydrophobicContact SD-CB 4.18Å; W607-A616 HydrophobicContact CD2-CB 4.43Å; W607-A616 HydrophobicContact CE3-CB 4.02Å; W607-A616 HydrophobicContact CH2-CB 4.24Å; W607-A616 HydrophobicContact CZ3-CB 3.92Å; A616-G618 PolarHBondContact O-N 3.31Å
617	P	58	Low	50	Low	61 Å²	61	113.3 Å²	113.3	40%	0.396	59%	0.59	S	S	.	*			trans	-67.2	126.7	178.5	-21	33.8	0	0	0	111.6	A606 I608	A606-P617 WeakPolarHBondContact O-CD 3.4Å; I608-P617 HydrophobicContact CD1-CG 4.16Å
618	G	48.3	Very low	48.4	Very low	47 Å²	47	115.2 Å²	115.2	49%	0.485	61%	0.605	S	S	.	*			trans	-67.9	152	172.9	0	0	0	0	0	112.4	A616 H620 H621	A616-G618 PolarHBondContact O-N 3.31Å; G618-H620 PolarHBondContact O-N 3.15Å; G618-H621 PolarHBondContact O-N 3.5Å
619	S	46.5	Very low	47.1	Very low	110 Å²	110	122 Å²	122	77%	0.769	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	2.2	-165.2	54.2	0	0	0	0	118
620	H	47.4	Very low	45.3	Very low	160 Å²	160	120.6 Å²	120.6	74%	0.741	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.5	4.4	-175.2	-63.7	-69.9	0	0	0	114.7	G618	G618-H620 PolarHBondContact O-N 3.15Å
621	H	39.5	Very low	44.2	Very low	140 Å²	140	122.5 Å²	122.5	65%	0.648	66%	0.662	S	S	*	*	S	Bend	trans	-129.3	124.2	-175.4	-57.3	-72.1	0	0	0	113.5	G618	G618-H621 PolarHBondContact O-N 3.5Å
622	L	36.6	Very low	43.8	Very low	169 Å²	169	120.5 Å²	120.5	89%	0.885	66%	0.657	S	S	*	*			trans	68.6	93.3	163.2	-58.7	162	0	0	0	118.1
623	C	33.8	Very low	43.3	Very low	104 Å²	104	121.1 Å²	121.1	70%	0.703	66%	0.657	S	S	*	*				-176.3	128.6	101.2	-109	0	0	0	0	112.9	Y625	C623-Y625 PolarHBondContact O-N 3.33Å
624	R	34.1	Very low	43.9	Very low	236 Å²	236	121.3 Å²	121.3	89%	0.891	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	6.3	-164.2	-167.2	169.4	170.6	-177.4	-2.9	116.9
625	Y	38	Very low	44.4	Very low	219 Å²	219	121.1 Å²	121.1	86%	0.859	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.5	7.2	-175.6	-84.4	-76.8	0	0	0	115.6	C623	C623-Y625 PolarHBondContact O-N 3.33Å
626	I	36.1	Very low	44.7	Very low	132 Å²	132	116.4 Å²	116.4	68%	0.677	64%	0.636	S	S	*	*			trans	-128.7	97.6	177.8	-56.3	176.6	0	0	0	109.5	M628	I626-M628 HydrophobicContact CG2-CG 4.14Å; I626-M628 PolarHBondContact O-N 3.13Å; I626-M628 VanDerWaalsContact O-N 3.1Å
627	T	32	Very low	45	Very low	141 Å²	141	118.5 Å²	118.5	87%	0.865	64%	0.641	S	S	*	*			trans	-77	86.9	168.4	47.2	0	0	0	0	109.7	M629	T627-M629 PolarHBondContact O-N 3.49Å
628	M	29.2	Very low	45.3	Very low	130 Å²	130	118.1 Å²	118.1	64%	0.64	63%	0.634	S	S	*	*			trans	-67.5	101.4	163.2	-75.8	-151.7	-64	0	0	108.6	I626 S630	I626-M628 HydrophobicContact CG2-CG 4.14Å; I626-M628 PolarHBondContact O-N 3.13Å; I626-M628 VanDerWaalsContact O-N 3.1Å; M628-S630 PolarHBondContact O-N 3.39Å; M628-S630 VanDerWaalsContact O-N 3.11Å
629	M	39.8	Very low	46.3	Very low	179 Å²	179	120.9 Å²	120.9	88%	0.882	64%	0.638	S	S	*	*			trans	-74.2	99.1	179	-168.1	169.6	-176.5	0	0	109	T627 I631	T627-M629 PolarHBondContact O-N 3.49Å; M629-I631 PolarHBondContact O-N 2.92Å
630	S	33.4	Very low	47.2	Very low	100 Å²	100	120.6 Å²	120.6	70%	0.699	62%	0.623	S	S	*	*			trans	-61.8	114.4	169.6	50.6	0	0	0	0	108.9	M628 D632	M628-S630 PolarHBondContact O-N 3.39Å; M628-S630 VanDerWaalsContact O-N 3.11Å; S630-D632 PolarHBondContact O-N 3.29Å; S630-D632 VanDerWaalsContact O-N 3.13Å
631	I	47.1	Very low	48.2	Very low	120 Å²	120	113.1 Å²	113.1	62%	0.615	59%	0.588	S	S	*	*			trans	-70.5	109.2	171.3	-58.2	174.7	0	0	0	106.6	M629 T635 A636	M629-I631 PolarHBondContact O-N 2.92Å; I631-T635 HydrophobicContact CG2-CG2 4.2Å; I631-A636 HydrophobicContact CG2-CB 4.04Å
632	D	54.3	Low	49.9	Very low	114 Å²	114	109.6 Å²	109.6	61%	0.61	58%	0.58	S	S	*	*			trans	-56	146.5	174.6	-94.8	-55.1	0	0	0	110.9	S630 L634 T635 A636	S630-D632 PolarHBondContact O-N 3.29Å; S630-D632 VanDerWaalsContact O-N 3.13Å; D632-L634 PolarHBondContact O-N 3.15Å; D632-L634 VanDerWaalsContact O-N 3.11Å; D632-T635 PolarHBondContact O-N 3Å; D632-A636 PolarHBondContact O-N 2.89Å
633	A	51.4	Low	51.7	Low	68 Å²	68	103.5 Å²	103.5	56%	0.562	56%	0.557	S	S	*	*	H	α-helix	trans	-57.3	-32.4	-176.9	0	0	0	0	0	112.5	A636 I637	A633-A636 PolarHBondContact O-N 3.07Å; A633-I637 WeakPolarHBondContact O-CD1 3.48Å; A633-I637 VanDerWaalsContact O-CG1 3.25Å; A633-I637 WeakPolarHBondContact O-CG1 3.16Å; A633-I637 PolarHBondContact O-N 3.41Å
634	L	55.9	Low	53.9	Low	67 Å²	67	101.3 Å²	101.3	35%	0.351	54%	0.538	S	S	.	.	H	α-helix	trans	-65.9	-48.2	173.4	-86.8	61.5	0	0	0	111.6	D632 A636 I637 E638 A728	D632-L634 PolarHBondContact O-N 3.15Å; D632-L634 VanDerWaalsContact O-N 3.11Å; L634-A636 VanDerWaalsContact C-N 3.26Å; L634-A636 PolarHBondContact O-N 3.45Å; L634-I637 CarbonylContact O-C 3.56Å; L634-I637 WeakPolarHBondContact O-CA 3.25Å; L634-I637 WeakPolarHBondContact O-CB 3.34Å; L634-I637 PolarHBondContact O-N 2.96Å; L634-I637 VanDerWaalsContact O-N 3.07Å; L634-E638 WeakPolarHBondContact O-CG 3.35Å; L634-E638 PolarHBondContact O-N 3.16Å; L634-A728 HydrophobicContact CD2-CB 3.59Å
635	T	65.1	Low	56.3	Low	59 Å²	59	90.3 Å²	90.3	36%	0.362	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-30.8	176.7	-50.4	0	0	0	0	112.1	I631 D632 N639	I631-T635 HydrophobicContact CG2-CG2 4.2Å; D632-T635 PolarHBondContact O-N 3Å; T635-N639 WeakPolarHBondContact O-CB 3.42Å; T635-N639 PolarHBondContact O-N 3.4Å; T635-N639 VanDerWaalsContact O-N 3.1Å; T635-N639 PolarHBondContact O-ND2 3.22Å
636	A	56.8	Low	58.4	Low	46 Å²	46	83.5 Å²	83.5	38%	0.38	48%	0.481	S	S	.	.	H	α-helix	trans	-65.9	-44.3	170.3	0	0	0	0	0	111.6	I631 D632 A633 L634 F640	I631-A636 HydrophobicContact CG2-CB 4.04Å; D632-A636 PolarHBondContact O-N 2.89Å; A633-A636 PolarHBondContact O-N 3.07Å; L634-A636 VanDerWaalsContact C-N 3.26Å; L634-A636 PolarHBondContact O-N 3.45Å; A636-F640 WeakPolarHBondContact O-CB 3.48Å; A636-F640 PolarHBondContact O-N 3.37Å
637	I	61.1	Low	60.6	Low	86 Å²	86	80.2 Å²	80.2	44%	0.441	47%	0.474	S	S	.	.	H	α-helix	trans	-63.6	-43	175.5	-70.2	162.2	0	0	0	111.4	A633 L634 F640 A641	A633-I637 WeakPolarHBondContact O-CD1 3.48Å; A633-I637 VanDerWaalsContact O-CG1 3.25Å; A633-I637 WeakPolarHBondContact O-CG1 3.16Å; A633-I637 PolarHBondContact O-N 3.41Å; L634-I637 CarbonylContact O-C 3.56Å; L634-I637 WeakPolarHBondContact O-CA 3.25Å; L634-I637 WeakPolarHBondContact O-CB 3.34Å; L634-I637 PolarHBondContact O-N 2.96Å; L634-I637 VanDerWaalsContact O-N 3.07Å; I637-F640 PolarHBondContact O-N 3.39Å; I637-A641 WeakPolarHBondContact O-CB 3.45Å; I637-A641 PolarHBondContact O-N 3.46Å
638	E	64.7	Low	63.2	Low	53 Å²	53	74.3 Å²	74.3	25%	0.248	44%	0.441	C	S	.	.	H	α-helix	trans	-63.5	-46.9	179.3	-73.7	163.8	-172.4	0	0	112.3	L634 S642 G731	L634-E638 WeakPolarHBondContact O-CG 3.35Å; L634-E638 PolarHBondContact O-N 3.16Å; E638-S642 VanDerWaalsContact O-CB 3.31Å; E638-S642 WeakPolarHBondContact O-CB 3.28Å; E638-S642 PolarHBondContact O-N 3.17Å; E638-S642 PolarHBondContact O-OG 2.91Å; E638-G731 VanDerWaalsContact OE1-CA 3.28Å; E638-G731 WeakPolarHBondContact OE1-CA 3.22Å
639	N	69.4	Low	66	Low	105 Å²	105	68.5 Å²	68.5	56%	0.561	41%	0.412	S	S	*	.	H	α-helix	trans	-65	-43	175.9	-76.3	-53	0	0	0	111.6	T635 G643	T635-N639 WeakPolarHBondContact O-CB 3.42Å; T635-N639 PolarHBondContact O-N 3.4Å; T635-N639 VanDerWaalsContact O-N 3.1Å; T635-N639 PolarHBondContact O-ND2 3.22Å; N639-G643 PolarHBondContact O-N 2.88Å
640	F	65.4	Low	68.3	Low	105 Å²	105	65.8 Å²	65.8	46%	0.461	40%	0.397	S	S	.	.	H	α-helix	trans	-61.9	-50.9	177	172.3	-120.9	0	0	0	111.5	V285 A636 I637 S642 G643 I644	V285-F640 HydrophobicContact CG1-CD2 4.31Å; V285-F640 HydrophobicContact CG1-CE1 4.41Å; V285-F640 HydrophobicContact CG1-CE2 3.29Å; V285-F640 HydrophobicContact CG1-CZ 3.37Å; A636-F640 WeakPolarHBondContact O-CB 3.48Å; A636-F640 PolarHBondContact O-N 3.37Å; I637-F640 PolarHBondContact O-N 3.39Å; F640-S642 VanDerWaalsContact C-N 3.35Å; F640-S642 PolarHBondContact O-N 2.94Å; F640-G643 WeakPolarHBondContact O-CA 3.42Å; F640-G643 PolarHBondContact O-N 3.17Å; F640-G643 VanDerWaalsContact O-N 3.11Å; F640-I644 HydrophobicContact CD1-CD1 3.99Å; F640-I644 HydrophobicContact CD2-CD1 3.98Å; F640-I644 HydrophobicContact CD2-CG1 3.92Å; F640-I644 HydrophobicContact CE1-CD1 3.73Å; F640-I644 HydrophobicContact CE1-CG1 4.38Å; F640-I644 HydrophobicContact CE2-CD1 3.71Å; F640-I644 HydrophobicContact CE2-CG1 3.45Å; F640-I644 VanDerWaalsContact CE2-CG1 3.45Å; F640-I644 HydrophobicContact CG-CD1 4.1Å; F640-I644 HydrophobicContact CZ-CD1 3.56Å; F640-I644 HydrophobicContact CZ-CG1 3.71Å; F640-I644 WeakPolarHBondContact O-CD1 3.32Å; F640-I644 WeakPolarHBondContact O-CG1 3.3Å; F640-I644 PolarHBondContact O-N 3.27Å
641	A	69.6	Low	70.9	Confident	2 Å²	2	66.8 Å²	66.8	2%	0.017	39%	0.389	C	S	.	.	H	α-helix	trans	-60.4	-42.2	178.8	0	0	0	0	0	112.2	I637 G643 F645 A735 L739	I637-A641 WeakPolarHBondContact O-CB 3.45Å; I637-A641 PolarHBondContact O-N 3.46Å; A641-G643 VanDerWaalsContact C-N 3.31Å; A641-G643 PolarHBondContact O-N 2.92Å; A641-F645 WeakPolarHBondContact O-CB 3.49Å; A641-F645 PolarHBondContact O-N 2.92Å; A641-A735 HydrophobicContact CB-CB 3.49Å; A641-A735 VanDerWaalsContact CB-CB 3.49Å; A641-L739 HydrophobicContact CB-CD1 4.14Å; A641-L739 HydrophobicContact CB-CG 4.43Å
642	S	74.9	Confident	72.9	Confident	67 Å²	67	62.3 Å²	62.3	47%	0.469	37%	0.366	S	S	.	.	H	α-helix	trans	-62.6	-39.5	174.7	-57.1	0	0	0	0	111.7	E638 F640 S646	E638-S642 VanDerWaalsContact O-CB 3.31Å; E638-S642 WeakPolarHBondContact O-CB 3.28Å; E638-S642 PolarHBondContact O-N 3.17Å; E638-S642 PolarHBondContact O-OG 2.91Å; F640-S642 VanDerWaalsContact C-N 3.35Å; F640-S642 PolarHBondContact O-N 2.94Å; S642-S646 PolarHBondContact O-N 3.27Å
643	G	74.1	Confident	74.6	Confident	40 Å²	40	58.4 Å²	58.4	41%	0.412	34%	0.344	S	S	.	.	H	α-helix	trans	-61.8	-56.5	176.2	0	0	0	0	0	113.4	N639 F640 A641 F645 A647	N639-G643 PolarHBondContact O-N 2.88Å; F640-G643 WeakPolarHBondContact O-CA 3.42Å; F640-G643 PolarHBondContact O-N 3.17Å; F640-G643 VanDerWaalsContact O-N 3.11Å; A641-G643 VanDerWaalsContact C-N 3.31Å; A641-G643 PolarHBondContact O-N 2.92Å; G643-F645 VanDerWaalsContact C-N 3.33Å; G643-F645 PolarHBondContact O-N 3.05Å; G643-A647 WeakPolarHBondContact O-CB 3.49Å; G643-A647 PolarHBondContact O-N 3.47Å
644	I	79.4	Confident	76.4	Confident	59 Å²	59	59 Å²	59	30%	0.303	34%	0.341	S	S	.	.	H	α-helix	trans	-72	-26.1	177.7	6.6	85.7	0	0	0	112.4	F640 G648 L739 L742	F640-I644 HydrophobicContact CD1-CD1 3.99Å; F640-I644 HydrophobicContact CD2-CD1 3.98Å; F640-I644 HydrophobicContact CD2-CG1 3.92Å; F640-I644 HydrophobicContact CE1-CD1 3.73Å; F640-I644 HydrophobicContact CE1-CG1 4.38Å; F640-I644 HydrophobicContact CE2-CD1 3.71Å; F640-I644 HydrophobicContact CE2-CG1 3.45Å; F640-I644 VanDerWaalsContact CE2-CG1 3.45Å; F640-I644 HydrophobicContact CG-CD1 4.1Å; F640-I644 HydrophobicContact CZ-CD1 3.56Å; F640-I644 HydrophobicContact CZ-CG1 3.71Å; F640-I644 WeakPolarHBondContact O-CD1 3.32Å; F640-I644 WeakPolarHBondContact O-CG1 3.3Å; F640-I644 PolarHBondContact O-N 3.27Å; I644-G648 VanDerWaalsContact O-CA 3.25Å; I644-G648 WeakPolarHBondContact O-CA 3.29Å; I644-G648 PolarHBondContact O-N 2.91Å; I644-L739 HydrophobicContact CD1-CD2 4.05Å; I644-L739 HydrophobicContact CG2-CD2 4.14Å; I644-L742 HydrophobicContact CG2-CD1 4.48Å; I644-L742 WeakPolarHBondContact O-CD1 3.25Å
645	F	85.4	Confident	77.9	Confident	5 Å²	5	61.2 Å²	61.2	2%	0.022	35%	0.345	C	S	.	.	H	α-helix	trans	-62.1	-54.5	171.4	-176.6	-92.3	0	0	0	111.4	A641 G643 M649 F715 P717 S738 K741 L742	A641-F645 WeakPolarHBondContact O-CB 3.49Å; A641-F645 PolarHBondContact O-N 2.92Å; G643-F645 VanDerWaalsContact C-N 3.33Å; G643-F645 PolarHBondContact O-N 3.05Å; F645-M649 HydrophobicContact CD1-CG 4.24Å; F645-M649 HydrophobicContact CD2-CG 4.1Å; F645-M649 HydrophobicContact CE1-CG 3.94Å; F645-M649 HydrophobicContact CE2-CE 4.47Å; F645-M649 HydrophobicContact CE2-CG 3.8Å; F645-M649 HydrophobicContact CE2-SD 4.02Å; F645-M649 HydrophobicContact CG-CG 4.33Å; F645-M649 HydrophobicContact CZ-CE 4.12Å; F645-M649 HydrophobicContact CZ-CG 3.72Å; F645-M649 HydrophobicContact CZ-SD 4.18Å; F645-M649 VanDerWaalsContact O-CB 3.31Å; F645-M649 WeakPolarHBondContact O-CB 3.3Å; F645-M649 WeakPolarHBondContact O-CG 3.49Å; F645-M649 PolarHBondContact O-N 3.12Å; F645-F715 WeakPolarHBondContact CE1-O 3.37Å; F645-F715 VanDerWaalsContact CZ-O 3.25Å; F645-F715 WeakPolarHBondContact CZ-O 3.49Å; F645-P717 HydrophobicContact CD1-CB 4.28Å; F645-P717 HydrophobicContact CD1-CG 3.71Å; F645-P717 HydrophobicContact CE1-CB 4.26Å; F645-P717 HydrophobicContact CE1-CG 3.76Å; F645-S738 WeakPolarHBondContact CD2-O 3.45Å; F645-S738 WeakPolarHBondContact CE2-O 3.37Å; F645-K741 HydrophobicContact CE2-CB 4.31Å; F645-K741 HydrophobicContact CE2-CD 4.07Å; F645-K741 HydrophobicContact CE2-CG 4.1Å; F645-K741 HydrophobicContact CZ-CD 3.83Å; F645-K741 HydrophobicContact CZ-CG 4.31Å; F645-L742 HydrophobicContact CD2-CB 3.97Å; F645-L742 HydrophobicContact CD2-CD1 4.35Å; F645-L742 HydrophobicContact CE2-CB 4.14Å
646	S	80.9	Confident	79	Confident	75 Å²	75	58.4 Å²	58.4	52%	0.524	33%	0.327	S	S	.	.	H	α-helix	trans	-62.2	-53.7	-179.9	177.1	0	0	0	0	111.7	S642 G648 M649 E650	S642-S646 PolarHBondContact O-N 3.27Å; S646-G648 VanDerWaalsContact C-N 3.33Å; S646-G648 PolarHBondContact O-N 3.44Å; S646-M649 PolarHBondContact O-N 2.88Å; S646-E650 WeakPolarHBondContact O-CG 3.38Å; S646-E650 PolarHBondContact O-N 3.38Å
647	A	83.4	Confident	80.5	Confident	64 Å²	64	60.7 Å²	60.7	53%	0.529	33%	0.33	S	S	.	.	H	α-helix	trans	-66.2	-34.9	-177.5	0	0	0	0	0	113	G643 F651	G643-A647 WeakPolarHBondContact O-CB 3.49Å; G643-A647 PolarHBondContact O-N 3.47Å; A647-F651 WeakPolarHBondContact O-CB 3.47Å; A647-F651 PolarHBondContact O-N 3.32Å
648	G	86.2	Confident	81.8	Confident	16 Å²	16	60.1 Å²	60.1	17%	0.165	33%	0.327	C	S	.	.	H	α-helix	trans	-77.8	-30.5	-179.2	0	0	0	0	0	113.9	I644 S646 L652	I644-G648 VanDerWaalsContact O-CA 3.25Å; I644-G648 WeakPolarHBondContact O-CA 3.29Å; I644-G648 PolarHBondContact O-N 2.91Å; S646-G648 VanDerWaalsContact C-N 3.33Å; S646-G648 PolarHBondContact O-N 3.44Å; G648-L652 WeakPolarHBondContact O-CB 3.48Å; G648-L652 WeakPolarHBondContact O-CG 3.36Å; G648-L652 PolarHBondContact O-N 3.04Å
649	M	88.2	Confident	82.9	Confident	8 Å²	8	59.2 Å²	59.2	4%	0.039	32%	0.324	C	S	.	.	H	α-helix	trans	-69.5	-47	172.7	-70	-68.8	-75.1	0	0	111.1	F645 S646 L652 F653 F715 K741 L742 V745	F645-M649 HydrophobicContact CD1-CG 4.24Å; F645-M649 HydrophobicContact CD2-CG 4.1Å; F645-M649 HydrophobicContact CE1-CG 3.94Å; F645-M649 HydrophobicContact CE2-CE 4.47Å; F645-M649 HydrophobicContact CE2-CG 3.8Å; F645-M649 HydrophobicContact CE2-SD 4.02Å; F645-M649 HydrophobicContact CG-CG 4.33Å; F645-M649 HydrophobicContact CZ-CE 4.12Å; F645-M649 HydrophobicContact CZ-CG 3.72Å; F645-M649 HydrophobicContact CZ-SD 4.18Å; F645-M649 VanDerWaalsContact O-CB 3.31Å; F645-M649 WeakPolarHBondContact O-CB 3.3Å; F645-M649 WeakPolarHBondContact O-CG 3.49Å; F645-M649 PolarHBondContact O-N 3.12Å; S646-M649 PolarHBondContact O-N 2.88Å; M649-L652 PolarHBondContact O-N 2.97Å; M649-F653 HydrophobicContact CE-CE2 4.18Å; M649-F653 HydrophobicContact CE-CZ 3.87Å; M649-F653 WeakPolarHBondContact O-CD2 3.49Å; M649-F653 WeakPolarHBondContact O-CG 3.24Å; M649-F653 PolarHBondContact O-N 3.35Å; M649-F715 HydrophobicContact CE-CB 3.65Å; M649-F715 HydrophobicContact CE-CD1 3.79Å; M649-F715 HydrophobicContact CE-CG 4.13Å; M649-K741 HydrophobicContact CE-CG 4.42Å; M649-L742 HydrophobicContact CG-CB 4.42Å; M649-L742 HydrophobicContact CG-CD1 4.26Å; M649-L742 HydrophobicContact CG-CG 4.43Å; M649-L742 HydrophobicContact SD-CB 3.84Å; M649-L742 HydrophobicContact SD-CG 4.1Å; M649-V745 HydrophobicContact CE-CG2 3.73Å; M649-V745 HydrophobicContact SD-CB 4.48Å; M649-V745 HydrophobicContact SD-CG2 3.83Å
650	E	87.2	Confident	83.7	Confident	122 Å²	122	54.2 Å²	54.2	57%	0.57	30%	0.298	S	S	*	.	H	α-helix	trans	-56.7	-51.4	172.1	-68.5	-62	152.9	0	0	110.9	S646 L652 F653 T654	S646-E650 WeakPolarHBondContact O-CG 3.38Å; S646-E650 PolarHBondContact O-N 3.38Å; E650-L652 VanDerWaalsContact C-N 3.33Å; E650-L652 PolarHBondContact O-N 3.4Å; E650-F653 PolarHBondContact O-N 3.02Å; E650-F653 VanDerWaalsContact O-N 3.13Å; E650-T654 PolarHBondContact O-N 2.81Å; E650-T654 PolarHBondContact O-OG1 3.2Å; E650-T654 VanDerWaalsContact O-OG1 3.1Å
651	F	89.5	Confident	84.7	Confident	122 Å²	122	53.3 Å²	53.3	54%	0.535	30%	0.297	S	S	.	.	H	α-helix	trans	-55.5	-44.5	176.6	174.4	-96.8	0	0	0	112.7	A647 W655	A647-F651 WeakPolarHBondContact O-CB 3.47Å; A647-F651 PolarHBondContact O-N 3.32Å; F651-W655 HydrophobicContact CZ-CD2 4.4Å; F651-W655 HydrophobicContact CZ-CG 4.42Å; F651-W655 WeakPolarHBondContact O-CB 3.32Å; F651-W655 PolarHBondContact O-N 3.45Å
652	L	88.6	Confident	85.5	Confident	25 Å²	25	58 Å²	58	13%	0.131	32%	0.32	C	S	.	.	H	α-helix	trans	-66.2	-37.2	178.5	-76.3	169.9	0	0	0	112.2	G648 M649 E650 G656 L742 V745 M749	G648-L652 WeakPolarHBondContact O-CB 3.48Å; G648-L652 WeakPolarHBondContact O-CG 3.36Å; G648-L652 PolarHBondContact O-N 3.04Å; M649-L652 PolarHBondContact O-N 2.97Å; E650-L652 VanDerWaalsContact C-N 3.33Å; E650-L652 PolarHBondContact O-N 3.4Å; L652-G656 PolarHBondContact O-N 3.06Å; L652-L742 HydrophobicContact CD1-CD2 4.12Å; L652-L742 HydrophobicContact CD1-CG 4.04Å; L652-V745 HydrophobicContact CB-CG1 4.02Å; L652-V745 HydrophobicContact CD1-CB 4.12Å; L652-V745 HydrophobicContact CD1-CG1 4.16Å; L652-M749 HydrophobicContact CB-CE 4.1Å; L652-M749 HydrophobicContact CD2-CE 3.66Å; L652-M749 WeakPolarHBondContact O-CE 3.19Å
653	F	89.8	Confident	85.9	Confident	32 Å²	32	55.2 Å²	55.2	14%	0.14	30%	0.302	C	S	.	.	H	α-helix	trans	-71	-47.9	176.1	-62.9	-36.3	0	0	0	111.7	M649 E650 W655 G656 E657 L697 P698 F715 V745	M649-F653 HydrophobicContact CE-CE2 4.18Å; M649-F653 HydrophobicContact CE-CZ 3.87Å; M649-F653 WeakPolarHBondContact O-CD2 3.49Å; M649-F653 WeakPolarHBondContact O-CG 3.24Å; M649-F653 PolarHBondContact O-N 3.35Å; E650-F653 PolarHBondContact O-N 3.02Å; E650-F653 VanDerWaalsContact O-N 3.13Å; F653-W655 VanDerWaalsContact C-N 3.3Å; F653-W655 PolarHBondContact O-N 3.44Å; F653-G656 WeakPolarHBondContact O-CA 3.49Å; F653-G656 PolarHBondContact O-N 2.81Å; F653-G656 VanDerWaalsContact O-N 3.08Å; F653-E657 PolarHBondContact O-N 2.86Å; F653-L697 HydrophobicContact CD1-CB 4.49Å; F653-P698 HydrophobicContact CD1-CG 3.82Å; F653-P698 HydrophobicContact CD2-CG 4.38Å; F653-P698 HydrophobicContact CE1-CB 4.43Å; F653-P698 HydrophobicContact CE1-CG 3.83Å; F653-P698 HydrophobicContact CE2-CG 4.37Å; F653-P698 HydrophobicContact CG-CG 4.12Å; F653-P698 HydrophobicContact CZ-CB 4.46Å; F653-P698 HydrophobicContact CZ-CG 4.11Å; F653-F715 HydrophobicContact CE2-CB 4.22Å; F653-F715 HydrophobicContact CE2-CG 4.24Å; F653-F715 HydrophobicContact CZ-CB 4.14Å; F653-F715 AromaticContact CZ-CD1 3.78Å; F653-F715 HydrophobicContact CZ-CD1 3.78Å; F653-F715 HydrophobicContact CZ-CD2 4.15Å; F653-F715 HydrophobicContact CZ-CE1 4.21Å; F653-F715 AromaticContact CZ-CG 3.74Å; F653-F715 HydrophobicContact CZ-CG 3.74Å; F653-V745 HydrophobicContact CD1-CG1 4.24Å; F653-V745 HydrophobicContact CE1-CG1 3.75Å; F653-V745 HydrophobicContact CE1-CG2 4.38Å
654	T	89.3	Confident	86.4	Confident	80 Å²	80	56.3 Å²	56.3	49%	0.491	30%	0.298	S	S	.	.	H	α-helix	trans	-59.3	-39.2	174.8	-50.6	0	0	0	0	112.2	E650 E657 L658	E650-T654 PolarHBondContact O-N 2.81Å; E650-T654 PolarHBondContact O-OG1 3.2Å; E650-T654 VanDerWaalsContact O-OG1 3.1Å; T654-E657 PolarHBondContact O-N 3.27Å; T654-L658 VanDerWaalsContact O-CB 3.3Å; T654-L658 WeakPolarHBondContact O-CB 3.48Å; T654-L658 PolarHBondContact O-N 3.49Å
655	W	87.7	Confident	86.6	Confident	115 Å²	115	57.4 Å²	57.4	44%	0.436	30%	0.304	S	S	.	.	H	α-helix	trans	-70.5	-33.4	176.3	-166.9	-110.2	0	0	0	112.3	F651 F653 L658 L659 M749	F651-W655 HydrophobicContact CZ-CD2 4.4Å; F651-W655 HydrophobicContact CZ-CG 4.42Å; F651-W655 WeakPolarHBondContact O-CB 3.32Å; F651-W655 PolarHBondContact O-N 3.45Å; F653-W655 VanDerWaalsContact C-N 3.3Å; F653-W655 PolarHBondContact O-N 3.44Å; W655-L658 HydrophobicContact CE3-CD2 3.99Å; W655-L658 HydrophobicContact CH2-CD2 4.33Å; W655-L658 HydrophobicContact CZ3-CD2 3.88Å; W655-L659 HydrophobicContact CG-CD1 4.47Å; W655-L659 VanDerWaalsContact O-CB 3.29Å; W655-L659 WeakPolarHBondContact O-CB 3.46Å; W655-L659 VanDerWaalsContact O-CG 3.25Å; W655-L659 WeakPolarHBondContact O-CG 3.37Å; W655-L659 PolarHBondContact O-N 3.37Å; W655-M749 HydrophobicContact CB-CE 4.45Å
656	G	87.8	Confident	86.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.9	-50.5	170.1	0	0	0	0	0	112.3	L652 F653 L659 G660 L694	L652-G656 PolarHBondContact O-N 3.06Å; F653-G656 WeakPolarHBondContact O-CA 3.49Å; F653-G656 PolarHBondContact O-N 2.81Å; F653-G656 VanDerWaalsContact O-N 3.08Å; G656-L659 PolarHBondContact O-N 3.31Å; G656-G660 PolarHBondContact O-N 2.89Å; G656-L694 CarbonylContact C-O 3.5Å; G656-L694 VanDerWaalsContact C-O 3.29Å; G656-L694 CarbonylContact O-C 3.53Å
657	E	88.7	Confident	86.3	Confident	94 Å²	94	55.5 Å²	55.5	44%	0.439	30%	0.297	S	S	.	.	H	α-helix	trans	-58.7	-49.8	174.8	-69.5	-176.5	164.7	0	0	111.8	F653 T654 L659 G660 I661 V695	F653-E657 PolarHBondContact O-N 2.86Å; T654-E657 PolarHBondContact O-N 3.27Å; E657-L659 PolarHBondContact O-N 3.46Å; E657-G660 CarbonylContact O-C 3.51Å; E657-G660 WeakPolarHBondContact O-CA 3.2Å; E657-G660 PolarHBondContact O-N 2.99Å; E657-G660 VanDerWaalsContact O-N 3.09Å; E657-I661 WeakPolarHBondContact O-CB 3.47Å; E657-I661 VanDerWaalsContact O-CG1 3.3Å; E657-I661 WeakPolarHBondContact O-CG1 3.32Å; E657-I661 PolarHBondContact O-N 2.89Å; E657-V695 HydrophobicContact CG-CG1 4.34Å
658	L	88.6	Confident	86.3	Confident	73 Å²	73	56.6 Å²	56.6	38%	0.382	29%	0.293	S	S	.	.	H	α-helix	trans	-59.7	-44.3	178.5	179.4	144.5	0	0	0	111.9	T654 W655 G660 I662	T654-L658 VanDerWaalsContact O-CB 3.3Å; T654-L658 WeakPolarHBondContact O-CB 3.48Å; T654-L658 PolarHBondContact O-N 3.49Å; W655-L658 HydrophobicContact CE3-CD2 3.99Å; W655-L658 HydrophobicContact CH2-CD2 4.33Å; W655-L658 HydrophobicContact CZ3-CD2 3.88Å; L658-G660 VanDerWaalsContact C-N 3.34Å; L658-I662 HydrophobicContact CD2-CD1 3.57Å; L658-I662 HydrophobicContact CG-CD1 3.93Å; L658-I662 WeakPolarHBondContact O-CB 3.42Å; L658-I662 VanDerWaalsContact O-CG1 3.27Å; L658-I662 WeakPolarHBondContact O-CG1 3.22Å; L658-I662 PolarHBondContact O-N 2.9Å
659	L	86.6	Confident	86	Confident	35 Å²	35	62 Å²	62	18%	0.183	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-35.2	174.4	-75.3	176.8	0	0	0	112.4	W655 G656 E657 G663 M749 R756	W655-L659 HydrophobicContact CG-CD1 4.47Å; W655-L659 VanDerWaalsContact O-CB 3.29Å; W655-L659 WeakPolarHBondContact O-CB 3.46Å; W655-L659 VanDerWaalsContact O-CG 3.25Å; W655-L659 WeakPolarHBondContact O-CG 3.37Å; W655-L659 PolarHBondContact O-N 3.37Å; G656-L659 PolarHBondContact O-N 3.31Å; E657-L659 PolarHBondContact O-N 3.46Å; L659-G663 PolarHBondContact O-N 3.01Å; L659-M749 HydrophobicContact CD1-SD 4.08Å; L659-R756 PolarHBondContact O-NH1 3.35Å
660	G	85.6	Confident	85.4	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-66.4	-46.5	175.5	0	0	0	0	0	112.4	G656 E657 L658 G663 L664	G656-G660 PolarHBondContact O-N 2.89Å; E657-G660 CarbonylContact O-C 3.51Å; E657-G660 WeakPolarHBondContact O-CA 3.2Å; E657-G660 PolarHBondContact O-N 2.99Å; E657-G660 VanDerWaalsContact O-N 3.09Å; L658-G660 VanDerWaalsContact C-N 3.34Å; G660-G663 PolarHBondContact O-N 3.17Å; G660-L664 WeakPolarHBondContact O-CB 3.38Å; G660-L664 PolarHBondContact O-N 2.92Å
661	I	87.9	Confident	84.7	Confident	86 Å²	86	62.7 Å²	62.7	44%	0.441	32%	0.321	S	S	.	.	H	α-helix	trans	-65.8	-49	178.3	-68	164.1	0	0	0	110.9	E657 G663 L664 I665 V695	E657-I661 WeakPolarHBondContact O-CB 3.47Å; E657-I661 VanDerWaalsContact O-CG1 3.3Å; E657-I661 WeakPolarHBondContact O-CG1 3.32Å; E657-I661 PolarHBondContact O-N 2.89Å; I661-G663 VanDerWaalsContact C-N 3.28Å; I661-G663 PolarHBondContact O-N 3.11Å; I661-L664 PolarHBondContact O-N 2.93Å; I661-I665 HydrophobicContact CG2-CD1 3.73Å; I661-I665 HydrophobicContact CG2-CG1 4.44Å; I661-I665 WeakPolarHBondContact O-CB 3.47Å; I661-I665 VanDerWaalsContact O-CG1 3.29Å; I661-I665 WeakPolarHBondContact O-CG1 3.44Å; I661-I665 PolarHBondContact O-N 2.92Å; I661-V695 HydrophobicContact CG1-CG2 4.27Å
662	I	85.8	Confident	84	Confident	100 Å²	100	67.5 Å²	67.5	51%	0.513	34%	0.336	S	S	.	.	H	α-helix	trans	-61.9	-38.9	176.1	-67.7	172.5	0	0	0	110.7	L658 G666	L658-I662 HydrophobicContact CD2-CD1 3.57Å; L658-I662 HydrophobicContact CG-CD1 3.93Å; L658-I662 WeakPolarHBondContact O-CB 3.42Å; L658-I662 VanDerWaalsContact O-CG1 3.27Å; L658-I662 WeakPolarHBondContact O-CG1 3.22Å; L658-I662 PolarHBondContact O-N 2.9Å; I662-G666 PolarHBondContact O-N 2.92Å
663	G	82.1	Confident	83.2	Confident	9 Å²	9	70.3 Å²	70.3	9%	0.093	36%	0.363	C	S	.	.	H	α-helix	trans	-60.8	-47.2	173.9	0	0	0	0	0	112.6	L659 G660 I661 G666 H667	L659-G663 PolarHBondContact O-N 3.01Å; G660-G663 PolarHBondContact O-N 3.17Å; I661-G663 VanDerWaalsContact C-N 3.28Å; I661-G663 PolarHBondContact O-N 3.11Å; G663-G666 PolarHBondContact O-N 3.28Å; G663-H667 VanDerWaalsContact O-CB 3.28Å; G663-H667 WeakPolarHBondContact O-CB 3.4Å; G663-H667 PolarHBondContact O-N 2.88Å
664	L	85.1	Confident	81.9	Confident	62 Å²	62	71.4 Å²	71.4	33%	0.325	37%	0.369	S	S	.	.	H	α-helix	trans	-64.6	-44.7	178.8	-177.3	62.7	0	0	0	111.6	G660 I661 H667 L668 I688 C691	G660-L664 WeakPolarHBondContact O-CB 3.38Å; G660-L664 PolarHBondContact O-N 2.92Å; I661-L664 PolarHBondContact O-N 2.93Å; L664-H667 PolarHBondContact O-N 3.38Å; L664-L668 HydrophobicContact CD1-CD1 4.21Å; L664-L668 HydrophobicContact CD1-CG 4.34Å; L664-L668 HydrophobicContact CG-CD1 4.04Å; L664-L668 WeakPolarHBondContact O-CB 3.29Å; L664-L668 VanDerWaalsContact O-CG 3.28Å; L664-L668 WeakPolarHBondContact O-CG 3.39Å; L664-L668 PolarHBondContact O-N 3.48Å; L664-I688 HydrophobicContact CD1-CG1 4.26Å; L664-C691 HydrophobicContact CB-CB 4.01Å
665	I	84.4	Confident	80	Confident	82 Å²	82	70.9 Å²	70.9	42%	0.421	38%	0.379	S	S	.	.	H	α-helix	trans	-60.2	-48.9	175.9	-69.7	168.5	0	0	0	110.3	I661 H667 L668 M669	I661-I665 HydrophobicContact CG2-CD1 3.73Å; I661-I665 HydrophobicContact CG2-CG1 4.44Å; I661-I665 WeakPolarHBondContact O-CB 3.47Å; I661-I665 VanDerWaalsContact O-CG1 3.29Å; I661-I665 WeakPolarHBondContact O-CG1 3.44Å; I661-I665 PolarHBondContact O-N 2.92Å; I665-H667 VanDerWaalsContact C-N 3.33Å; I665-H667 PolarHBondContact O-N 3.05Å; I665-L668 PolarHBondContact O-N 3.48Å; I665-M669 HydrophobicContact CG2-CE 3.75Å; I665-M669 HydrophobicContact CG2-CG 4.4Å; I665-M669 HydrophobicContact CG2-SD 4.39Å; I665-M669 WeakPolarHBondContact O-CB 3.28Å; I665-M669 WeakPolarHBondContact O-CG 3.37Å; I665-M669 PolarHBondContact O-N 3.47Å
666	G	81.8	Confident	78	Confident	37 Å²	37	77 Å²	77	38%	0.381	40%	0.402	S	S	.	.	H	α-helix	trans	-61.2	-39.9	177.8	0	0	0	0	0	113	I662 G663 M669 R670	I662-G666 PolarHBondContact O-N 2.92Å; G663-G666 PolarHBondContact O-N 3.28Å; G666-M669 PolarHBondContact O-N 3.12Å; G666-R670 VanDerWaalsContact O-CB 3.28Å; G666-R670 WeakPolarHBondContact O-CB 3.25Å; G666-R670 PolarHBondContact O-N 3.36Å
667	H	78.1	Confident	76.4	Confident	4 Å²	4	84.9 Å²	84.9	2%	0.019	44%	0.438	C	S	.	.	H	α-helix	trans	-66.7	-41.8	176.9	-169	56.3	0	0	0	112.4	G663 L664 I665 R670 A671 F684 L760	G663-H667 VanDerWaalsContact O-CB 3.28Å; G663-H667 WeakPolarHBondContact O-CB 3.4Å; G663-H667 PolarHBondContact O-N 2.88Å; L664-H667 PolarHBondContact O-N 3.38Å; I665-H667 VanDerWaalsContact C-N 3.33Å; I665-H667 PolarHBondContact O-N 3.05Å; H667-R670 PolarHBondContact O-N 3.23Å; H667-A671 WeakPolarHBondContact O-CB 3.44Å; H667-A671 PolarHBondContact O-N 2.94Å; H667-F684 AromaticContact NE2-CD2 3.73Å; H667-F684 PolarHBondContact NE2-O 3.1Å; H667-L760 VanDerWaalsContact ND1-CD2 3.35Å; H667-L760 WeakPolarHBondContact ND1-CD2 3.31Å
668	L	82.2	Confident	74.8	Confident	87 Å²	87	85.7 Å²	85.7	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-68.7	-39.8	174.7	-69.9	171.8	0	0	0	112.5	L664 I665 R670 R672 F684	L664-L668 HydrophobicContact CD1-CD1 4.21Å; L664-L668 HydrophobicContact CD1-CG 4.34Å; L664-L668 HydrophobicContact CG-CD1 4.04Å; L664-L668 WeakPolarHBondContact O-CB 3.29Å; L664-L668 VanDerWaalsContact O-CG 3.28Å; L664-L668 WeakPolarHBondContact O-CG 3.39Å; L664-L668 PolarHBondContact O-N 3.48Å; I665-L668 PolarHBondContact O-N 3.48Å; L668-R670 VanDerWaalsContact C-N 3.33Å; L668-R672 WeakPolarHBondContact O-CB 3.39Å; L668-R672 PolarHBondContact O-N 2.88Å; L668-F684 HydrophobicContact CD2-CE2 4.46Å; L668-F684 HydrophobicContact CD2-CZ 4.39Å
669	M	81.5	Confident	73.5	Confident	130 Å²	130	83.6 Å²	83.6	64%	0.64	44%	0.443	S	S	*	.	H	α-helix	trans	-60.7	-43.6	172.1	-75.6	-169.3	-176.5	0	0	111.1	I665 G666 R672 A673	I665-M669 HydrophobicContact CG2-CE 3.75Å; I665-M669 HydrophobicContact CG2-CG 4.4Å; I665-M669 HydrophobicContact CG2-SD 4.39Å; I665-M669 WeakPolarHBondContact O-CB 3.28Å; I665-M669 WeakPolarHBondContact O-CG 3.37Å; I665-M669 PolarHBondContact O-N 3.47Å; G666-M669 PolarHBondContact O-N 3.12Å; M669-R672 PolarHBondContact O-N 3.48Å; M669-A673 WeakPolarHBondContact O-CB 3.5Å; M669-A673 PolarHBondContact O-N 2.98Å
670	R	75.1	Confident	72.7	Confident	102 Å²	102	83.9 Å²	83.9	39%	0.385	46%	0.455	S	S	.	.	H	α-helix	trans	-66.3	-45	179.2	-172.2	170.6	174.5	-171.1	-6.4	112.1	G666 H667 L668 R672 A673 E674 M679 L760	G666-R670 VanDerWaalsContact O-CB 3.28Å; G666-R670 WeakPolarHBondContact O-CB 3.25Å; G666-R670 PolarHBondContact O-N 3.36Å; H667-R670 PolarHBondContact O-N 3.23Å; L668-R670 VanDerWaalsContact C-N 3.33Å; R670-R672 PolarHBondContact O-N 3.45Å; R670-A673 PolarHBondContact O-N 3.09Å; R670-E674 HydrophobicContact CG-CG 4.17Å; R670-E674 IonicContact CZ-OE1 2.71Å; R670-E674 VanDerWaalsContact CZ-OE1 3.32Å; R670-E674 IonicContact NE-OE1 2.86Å; R670-E674 PolarHBondContact NE-OE1 3.34Å; R670-E674 IonicContact NE-OE2 2.9Å; R670-E674 IonicContact NH2-OE1 3.85Å; R670-E674 PolarHBondContact NH2-OE1 3.44Å; R670-E674 WeakPolarHBondContact O-CG 3.46Å; R670-E674 PolarHBondContact O-N 2.99Å; R670-M679 HydrophobicContact CG-CE 3.87Å; R670-L760 PolarHBondContact NH1-O 3.02Å
671	A	72.9	Confident	72.2	Confident	41 Å²	41	88.5 Å²	88.5	34%	0.339	49%	0.485	S	S	.	.	H	α-helix	trans	-60.4	-29.4	173.5	0	0	0	0	0	113.1	H667 F684	H667-A671 WeakPolarHBondContact O-CB 3.44Å; H667-A671 PolarHBondContact O-N 2.94Å; A671-F684 HydrophobicContact CB-CD2 3.97Å; A671-F684 HydrophobicContact CB-CE2 3.64Å
672	R	75	Confident	71.7	Confident	223 Å²	223	87 Å²	87	84%	0.842	49%	0.49	S	S	*	.	H	α-helix	trans	-78	-33.3	172.1	-172.9	177.6	-178.7	178.5	1	113.2	L668 M669 R670	L668-R672 WeakPolarHBondContact O-CB 3.39Å; L668-R672 PolarHBondContact O-N 2.88Å; M669-R672 PolarHBondContact O-N 3.48Å; R670-R672 PolarHBondContact O-N 3.45Å
673	A	70.7	Confident	71.1	Confident	84 Å²	84	87.9 Å²	87.9	69%	0.694	49%	0.49	S	S	*	.	H	α-helix	trans	-78.5	-35.7	-178.3	0	0	0	0	0	113.1	M669 R670 G675	M669-A673 WeakPolarHBondContact O-CB 3.5Å; M669-A673 PolarHBondContact O-N 2.98Å; R670-A673 PolarHBondContact O-N 3.09Å; A673-G675 PolarHBondContact O-N 3.38Å
674	E	62.1	Low	70.9	Confident	56 Å²	56	90.7 Å²	90.7	26%	0.262	50%	0.5	S	S	.	.			trans	-76.4	33.6	-178.3	-67.3	177.1	158.7	0	0	113.2	R670 R676 H677 M679	R670-E674 HydrophobicContact CG-CG 4.17Å; R670-E674 IonicContact CZ-OE1 2.71Å; R670-E674 VanDerWaalsContact CZ-OE1 3.32Å; R670-E674 IonicContact NE-OE1 2.86Å; R670-E674 PolarHBondContact NE-OE1 3.34Å; R670-E674 IonicContact NE-OE2 2.9Å; R670-E674 IonicContact NH2-OE1 3.85Å; R670-E674 PolarHBondContact NH2-OE1 3.44Å; R670-E674 WeakPolarHBondContact O-CG 3.46Å; R670-E674 PolarHBondContact O-N 2.99Å; E674-R676 PolarHBondContact O-N 3.49Å; E674-H677 CarbonylContact O-C 3.59Å; E674-H677 PolarHBondContact O-N 3.15Å; E674-M679 WeakPolarHBondContact OE2-CE 3.29Å; E674-M679 VanDerWaalsContact OE2-CG 3.28Å; E674-M679 WeakPolarHBondContact OE2-CG 3.34Å
675	G	50.5	Low	70.7	Confident	69 Å²	69	91.9 Å²	91.9	71%	0.711	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	14.9	-167.2	0	0	0	0	0	118.8	A673	A673-G675 PolarHBondContact O-N 3.38Å
676	R	46.4	Very low	70.5	Confident	244 Å²	244	89.3 Å²	89.3	92%	0.921	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.2	-14.8	163	-79	-172.6	172.3	138.9	-1	114	E674	E674-R676 PolarHBondContact O-N 3.49Å
677	H	53.6	Low	70.4	Confident	164 Å²	164	87.7 Å²	87.7	76%	0.759	48%	0.48	S	S	*	.	S	Bend	trans	-114.8	77.7	176.8	-82.7	-79.3	0	0	0	109.3	E674 M679	E674-H677 CarbonylContact O-C 3.59Å; E674-H677 PolarHBondContact O-N 3.15Å; H677-M679 PolarHBondContact O-N 3.07Å
678	S	54.8	Low	70.8	Confident	112 Å²	112	90.7 Å²	90.7	78%	0.783	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-53.2	127.2	-178.3	-171.2	0	0	0	0	112	G680	S678-G680 PolarHBondContact O-N 3.21Å
679	M	61	Low	71	Confident	29 Å²	29	93 Å²	93	14%	0.143	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-54.5	124.6	160.9	-79.8	-162.3	178.5	0	0	108.5	R670 E674 H677 F684	R670-M679 HydrophobicContact CG-CE 3.87Å; E674-M679 WeakPolarHBondContact OE2-CE 3.29Å; E674-M679 VanDerWaalsContact OE2-CG 3.28Å; E674-M679 WeakPolarHBondContact OE2-CG 3.34Å; H677-M679 PolarHBondContact O-N 3.07Å; M679-F684 HydrophobicContact CB-CB 4.42Å
680	G	70.5	Confident	71.2	Confident	41 Å²	41	87.4 Å²	87.4	42%	0.423	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-51.5	132.7	173.2	0	0	0	0	0	109.9	S678 G682 K683 F684	S678-G680 PolarHBondContact O-N 3.21Å; G680-G682 PolarHBondContact O-N 3.25Å; G680-K683 WeakPolarHBondContact O-CB 3.27Å; G680-K683 PolarHBondContact O-N 3.14Å; G680-F684 PolarHBondContact O-N 3.22Å
681	P	73.8	Confident	71.6	Confident	97 Å²	97	82.7 Å²	82.7	63%	0.63	46%	0.457	S	S	*	.	H	α-helix	trans	-57.7	-32.4	-162.7	17.6	-31.4	0	0	0	113.5	K683 F684 I685	P681-K683 PolarHBondContact O-N 3.19Å; P681-F684 PolarHBondContact O-N 3.47Å; P681-I685 WeakPolarHBondContact O-CB 3.37Å; P681-I685 WeakPolarHBondContact O-CD1 3.4Å; P681-I685 VanDerWaalsContact O-CG1 3.26Å; P681-I685 WeakPolarHBondContact O-CG1 3.3Å; P681-I685 PolarHBondContact O-N 2.84Å
682	G	77.3	Confident	72.3	Confident	53 Å²	53	82.3 Å²	82.3	55%	0.546	46%	0.457	S	S	.	.	H	α-helix	trans	-59.8	-37.2	172.4	0	0	0	0	0	114.3	G680 A686	G680-G682 PolarHBondContact O-N 3.25Å; G682-A686 WeakPolarHBondContact O-CB 3.46Å; G682-A686 PolarHBondContact O-N 3.41Å
683	K	74.6	Confident	72.9	Confident	119 Å²	119	74 Å²	74	52%	0.517	43%	0.429	S	S	.	.	H	α-helix	trans	-70.3	-40.9	174.2	-70.1	-165.6	175.2	-164.8	0	111.8	G680 P681 G687	G680-K683 WeakPolarHBondContact O-CB 3.27Å; G680-K683 PolarHBondContact O-N 3.14Å; P681-K683 PolarHBondContact O-N 3.19Å; K683-G687 PolarHBondContact O-N 3.32Å
684	F	76.5	Confident	73.6	Confident	68 Å²	68	70 Å²	70	30%	0.298	40%	0.396	S	S	.	.	H	α-helix	trans	-61.4	-50.6	176.6	-179.7	-107.7	0	0	0	111	H667 L668 A671 M679 G680 P681 G687 I688	H667-F684 AromaticContact NE2-CD2 3.73Å; H667-F684 PolarHBondContact NE2-O 3.1Å; L668-F684 HydrophobicContact CD2-CE2 4.46Å; L668-F684 HydrophobicContact CD2-CZ 4.39Å; A671-F684 HydrophobicContact CB-CD2 3.97Å; A671-F684 HydrophobicContact CB-CE2 3.64Å; M679-F684 HydrophobicContact CB-CB 4.42Å; G680-F684 PolarHBondContact O-N 3.22Å; P681-F684 PolarHBondContact O-N 3.47Å; F684-G687 PolarHBondContact O-N 2.93Å; F684-I688 HydrophobicContact CD1-CD1 4.06Å; F684-I688 HydrophobicContact CE1-CD1 3.53Å; F684-I688 HydrophobicContact CE2-CD1 4.19Å; F684-I688 HydrophobicContact CZ-CD1 3.62Å; F684-I688 PolarHBondContact O-N 3.04Å; F684-I688 VanDerWaalsContact O-N 3.14Å
685	I	81.9	Confident	74.9	Confident	88 Å²	88	70 Å²	70	45%	0.451	40%	0.399	S	S	.	.	H	α-helix	trans	-61.8	-47.9	178	-68.6	165.6	0	0	0	111.2	P681 G687 I688 F689	P681-I685 WeakPolarHBondContact O-CB 3.37Å; P681-I685 WeakPolarHBondContact O-CD1 3.4Å; P681-I685 VanDerWaalsContact O-CG1 3.26Å; P681-I685 WeakPolarHBondContact O-CG1 3.3Å; P681-I685 PolarHBondContact O-N 2.84Å; I685-G687 VanDerWaalsContact C-N 3.34Å; I685-G687 PolarHBondContact O-N 3.42Å; I685-I688 PolarHBondContact O-N 2.87Å; I685-F689 HydrophobicContact CG2-CD2 3.66Å; I685-F689 HydrophobicContact CG2-CE2 3.62Å; I685-F689 WeakPolarHBondContact O-CD2 3.39Å; I685-F689 PolarHBondContact O-N 3.49Å
686	A	79.8	Confident	76.7	Confident	27 Å²	27	68.8 Å²	68.8	22%	0.223	38%	0.38	C	S	.	.	H	α-helix	trans	-62.8	-38.1	179.1	0	0	0	0	0	112.7	G682 F689 I690 L759	G682-A686 WeakPolarHBondContact O-CB 3.46Å; G682-A686 PolarHBondContact O-N 3.41Å; A686-F689 PolarHBondContact O-N 3.42Å; A686-I690 WeakPolarHBondContact O-CB 3.42Å; A686-I690 VanDerWaalsContact O-CG1 3.31Å; A686-I690 WeakPolarHBondContact O-CG1 3.28Å; A686-I690 PolarHBondContact O-N 2.92Å; A686-L759 HydrophobicContact CB-CD2 3.63Å
687	G	80.6	Confident	78.8	Confident	4 Å²	4	57.2 Å²	57.2	4%	0.041	34%	0.336	C	S	.	.	H	α-helix	trans	-62.3	-41.5	174.3	0	0	0	0	0	112.8	K683 F684 I685 C691	K683-G687 PolarHBondContact O-N 3.32Å; F684-G687 PolarHBondContact O-N 2.93Å; I685-G687 VanDerWaalsContact C-N 3.34Å; I685-G687 PolarHBondContact O-N 3.42Å; G687-C691 PolarHBondContact O-N 3.17Å; G687-C691 PolarHBondContact O-SG 2.91Å
688	I	84.9	Confident	80.5	Confident	66 Å²	66	51.3 Å²	51.3	34%	0.338	31%	0.313	S	S	.	.	H	α-helix	trans	-62.6	-48.7	173.4	-68.5	172.4	0	0	0	110.6	L664 F684 I685 I690 C691 G692	L664-I688 HydrophobicContact CD1-CG1 4.26Å; F684-I688 HydrophobicContact CD1-CD1 4.06Å; F684-I688 HydrophobicContact CE1-CD1 3.53Å; F684-I688 HydrophobicContact CE2-CD1 4.19Å; F684-I688 HydrophobicContact CZ-CD1 3.62Å; F684-I688 PolarHBondContact O-N 3.04Å; F684-I688 VanDerWaalsContact O-N 3.14Å; I685-I688 PolarHBondContact O-N 2.87Å; I688-I690 PolarHBondContact O-N 3.22Å; I688-C691 PolarHBondContact O-N 3.02Å; I688-G692 PolarHBondContact O-N 2.9Å
689	F	86.8	Confident	82.2	Confident	135 Å²	135	49.8 Å²	49.8	59%	0.592	30%	0.302	S	S	*	.	H	α-helix	trans	-58.1	-47.4	178.1	-87.7	-69.8	0	0	0	112.2	I685 A686 C691 G692 M693	I685-F689 HydrophobicContact CG2-CD2 3.66Å; I685-F689 HydrophobicContact CG2-CE2 3.62Å; I685-F689 WeakPolarHBondContact O-CD2 3.39Å; I685-F689 PolarHBondContact O-N 3.49Å; A686-F689 PolarHBondContact O-N 3.42Å; F689-C691 VanDerWaalsContact C-N 3.32Å; F689-C691 PolarHBondContact O-N 3.11Å; F689-G692 CarbonylContact O-C 3.6Å; F689-G692 WeakPolarHBondContact O-CA 3.49Å; F689-G692 PolarHBondContact O-N 3.34Å; F689-G692 VanDerWaalsContact O-N 3.09Å; F689-M693 WeakPolarHBondContact O-CG 3.28Å; F689-M693 PolarHBondContact O-N 2.86Å
690	I	85.4	Confident	83.5	Confident	14 Å²	14	50.3 Å²	50.3	7%	0.072	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-35.8	-179.9	-68.6	165.7	0	0	0	111.8	A686 I688 M693 L694 I752 W755 R756 L759	A686-I690 WeakPolarHBondContact O-CB 3.42Å; A686-I690 VanDerWaalsContact O-CG1 3.31Å; A686-I690 WeakPolarHBondContact O-CG1 3.28Å; A686-I690 PolarHBondContact O-N 2.92Å; I688-I690 PolarHBondContact O-N 3.22Å; I690-M693 PolarHBondContact O-N 3.38Å; I690-L694 PolarHBondContact O-N 2.94Å; I690-I752 HydrophobicContact CG2-CG2 3.92Å; I690-W755 HydrophobicContact CD1-CB 4.11Å; I690-R756 HydrophobicContact CG2-CB 3.66Å; I690-R756 HydrophobicContact CG2-CG 4.08Å; I690-L759 HydrophobicContact CD1-CD1 4.41Å; I690-L759 HydrophobicContact CD1-CD2 3.95Å
691	C	84.5	Confident	84.4	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.014	28%	0.284	C	S	.	.	H	α-helix	trans	-67.9	-39	172.3	-62.7	0	0	0	0	111.5	L664 G687 I688 F689 M693 L694 V695	L664-C691 HydrophobicContact CB-CB 4.01Å; G687-C691 PolarHBondContact O-N 3.17Å; G687-C691 PolarHBondContact O-SG 2.91Å; I688-C691 PolarHBondContact O-N 3.02Å; F689-C691 VanDerWaalsContact C-N 3.32Å; F689-C691 PolarHBondContact O-N 3.11Å; C691-M693 VanDerWaalsContact C-N 3.32Å; C691-M693 PolarHBondContact O-N 3.37Å; C691-L694 PolarHBondContact O-N 2.81Å; C691-V695 PolarHBondContact O-N 2.84Å; C691-V695 VanDerWaalsContact O-N 3.17Å
692	G	87	Confident	85.3	Confident	33 Å²	33	45.1 Å²	45.1	34%	0.34	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-35.7	170.9	0	0	0	0	0	113.5	I688 F689 L694 V695 S696	I688-G692 PolarHBondContact O-N 2.9Å; F689-G692 CarbonylContact O-C 3.6Å; F689-G692 WeakPolarHBondContact O-CA 3.49Å; F689-G692 PolarHBondContact O-N 3.34Å; F689-G692 VanDerWaalsContact O-N 3.09Å; G692-L694 VanDerWaalsContact C-N 3.31Å; G692-L694 PolarHBondContact O-N 3.09Å; G692-V695 PolarHBondContact O-N 3.43Å; G692-S696 WeakPolarHBondContact O-CB 3.29Å; G692-S696 PolarHBondContact O-N 3.39Å; G692-S696 PolarHBondContact O-OG 2.92Å
693	M	87.5	Confident	85.8	Confident	49 Å²	49	44.3 Å²	44.3	24%	0.241	25%	0.25	C	S	.	.	H	α-helix	trans	-66	-31.2	174.6	-67.2	-174.7	173.6	0	0	112.9	F689 I690 C691 L697 M700 I752 W755	F689-M693 WeakPolarHBondContact O-CG 3.28Å; F689-M693 PolarHBondContact O-N 2.86Å; I690-M693 PolarHBondContact O-N 3.38Å; C691-M693 VanDerWaalsContact C-N 3.32Å; C691-M693 PolarHBondContact O-N 3.37Å; M693-L697 PolarHBondContact O-N 2.96Å; M693-M700 HydrophobicContact CB-CE 4.38Å; M693-M700 HydrophobicContact CB-CG 4.25Å; M693-M700 HydrophobicContact CE-CE 4.26Å; M693-M700 HydrophobicContact CE-SD 4.16Å; M693-M700 HydrophobicContact CG-CE 3.72Å; M693-M700 HydrophobicContact CG-CG 4.34Å; M693-M700 HydrophobicContact CG-SD 4.05Å; M693-M700 HydrophobicContact SD-CE 4.44Å; M693-M700 HydrophobicContact SD-SD 4.11Å; M693-I752 HydrophobicContact CB-CD1 4.33Å; M693-I752 HydrophobicContact CB-CG2 4.04Å; M693-W755 HydrophobicContact SD-CE3 4.35Å; M693-W755 HydrophobicContact SD-CZ3 4.02Å
694	L	86.9	Confident	86.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-74	-40.4	175	-79	167.6	0	0	0	112	G656 I690 C691 G692 M749 I752	G656-L694 CarbonylContact C-O 3.5Å; G656-L694 VanDerWaalsContact C-O 3.29Å; G656-L694 CarbonylContact O-C 3.53Å; I690-L694 PolarHBondContact O-N 2.94Å; C691-L694 PolarHBondContact O-N 2.81Å; G692-L694 VanDerWaalsContact C-N 3.31Å; G692-L694 PolarHBondContact O-N 3.09Å; L694-M749 HydrophobicContact CD2-CG 4.16Å; L694-I752 HydrophobicContact CD1-CG2 4.48Å; L694-I752 HydrophobicContact CD2-CB 4.21Å; L694-I752 HydrophobicContact CD2-CG2 4.01Å; L694-I752 HydrophobicContact CG-CB 4.5Å; L694-I752 HydrophobicContact CG-CG2 3.76Å
695	V	88.6	Confident	86.9	Confident	55 Å²	55	35.6 Å²	35.6	33%	0.333	21%	0.213	S	C	.	.	H	α-helix	trans	-68.9	-42.4	175	-179	0	0	0	0	111.1	E657 I661 C691 G692 L697	E657-V695 HydrophobicContact CG-CG1 4.34Å; I661-V695 HydrophobicContact CG1-CG2 4.27Å; C691-V695 PolarHBondContact O-N 2.84Å; C691-V695 VanDerWaalsContact O-N 3.17Å; G692-V695 PolarHBondContact O-N 3.43Å; V695-L697 VanDerWaalsContact C-N 3.27Å; V695-L697 PolarHBondContact O-N 2.91Å
696	S	89.1	Confident	87.2	Confident	44 Å²	44	35.2 Å²	35.2	31%	0.308	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	32.4	179.4	63.9	0	0	0	0	113.7	G692 S699 M700	G692-S696 WeakPolarHBondContact O-CB 3.29Å; G692-S696 PolarHBondContact O-N 3.39Å; G692-S696 PolarHBondContact O-OG 2.92Å; S696-S699 CarbonylContact O-C 3.47Å; S696-S699 WeakPolarHBondContact O-CA 2.93Å; S696-S699 WeakPolarHBondContact O-CB 3.22Å; S696-S699 PolarHBondContact O-N 3.47Å; S696-M700 PolarHBondContact O-N 3.32Å
697	L	89.8	Confident	87.4	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-49.5	-47	-173.2	-136.6	170.2	0	0	0	113.9	F653 M693 V695 S699 M700 I701 V745 V748 M749	F653-L697 HydrophobicContact CD1-CB 4.49Å; M693-L697 PolarHBondContact O-N 2.96Å; V695-L697 VanDerWaalsContact C-N 3.27Å; V695-L697 PolarHBondContact O-N 2.91Å; L697-S699 PolarHBondContact O-N 2.92Å; L697-M700 PolarHBondContact O-N 3.08Å; L697-I701 HydrophobicContact CD2-CD1 3.4Å; L697-I701 HydrophobicContact CD2-CG1 3.9Å; L697-I701 WeakPolarHBondContact O-CG1 3.44Å; L697-I701 PolarHBondContact O-N 2.98Å; L697-V745 HydrophobicContact CD2-CG1 4.26Å; L697-V748 HydrophobicContact CD2-CG1 4.01Å; L697-M749 HydrophobicContact CD1-CB 4.09Å; L697-M749 HydrophobicContact CD1-CE 4Å; L697-M749 HydrophobicContact CD1-CG 4.11Å
698	P	89.7	Confident	87.5	Confident	41 Å²	41	45 Å²	45	27%	0.266	26%	0.256	S	S	.	.	H	α-helix	trans	-62.5	-41.6	177.2	-21.1	33.1	0	0	0	112.8	F653 N702 F715	F653-P698 HydrophobicContact CD1-CG 3.82Å; F653-P698 HydrophobicContact CD2-CG 4.38Å; F653-P698 HydrophobicContact CE1-CB 4.43Å; F653-P698 HydrophobicContact CE1-CG 3.83Å; F653-P698 HydrophobicContact CE2-CG 4.37Å; F653-P698 HydrophobicContact CG-CG 4.12Å; F653-P698 HydrophobicContact CZ-CB 4.46Å; F653-P698 HydrophobicContact CZ-CG 4.11Å; P698-N702 WeakPolarHBondContact O-CB 3.09Å; P698-N702 PolarHBondContact O-N 2.92Å; P698-F715 HydrophobicContact CB-CD2 4.21Å; P698-F715 HydrophobicContact CB-CE2 3.61Å; P698-F715 HydrophobicContact CB-CZ 4.14Å; P698-F715 WeakPolarHBondContact O-CZ 3.31Å
699	S	90.1	Very high	87.4	Confident	80 Å²	80	45 Å²	45	56%	0.559	27%	0.272	S	S	*	.	H	α-helix	trans	-67.1	-38.4	177.2	-49.2	0	0	0	0	111.8	S696 L697 N702 A703	S696-S699 CarbonylContact O-C 3.47Å; S696-S699 WeakPolarHBondContact O-CA 2.93Å; S696-S699 WeakPolarHBondContact O-CB 3.22Å; S696-S699 PolarHBondContact O-N 3.47Å; L697-S699 PolarHBondContact O-N 2.92Å; S699-N702 PolarHBondContact O-N 2.85Å; S699-A703 WeakPolarHBondContact O-CB 3.19Å; S699-A703 PolarHBondContact O-N 3.34Å
700	M	89	Confident	87.3	Confident	39 Å²	39	40.1 Å²	40.1	19%	0.192	25%	0.251	C	S	.	.	H	α-helix	trans	-68.2	-41.8	179.3	-171	54.2	41.1	0	0	112.2	M693 S696 L697 A703 G704 I752 F779	M693-M700 HydrophobicContact CB-CE 4.38Å; M693-M700 HydrophobicContact CB-CG 4.25Å; M693-M700 HydrophobicContact CE-CE 4.26Å; M693-M700 HydrophobicContact CE-SD 4.16Å; M693-M700 HydrophobicContact CG-CE 3.72Å; M693-M700 HydrophobicContact CG-CG 4.34Å; M693-M700 HydrophobicContact CG-SD 4.05Å; M693-M700 HydrophobicContact SD-CE 4.44Å; M693-M700 HydrophobicContact SD-SD 4.11Å; S696-M700 PolarHBondContact O-N 3.32Å; L697-M700 PolarHBondContact O-N 3.08Å; M700-A703 PolarHBondContact O-N 3.28Å; M700-G704 PolarHBondContact O-N 2.92Å; M700-I752 HydrophobicContact CG-CD1 4.29Å; M700-F779 HydrophobicContact CG-CE2 4.06Å; M700-F779 HydrophobicContact CG-CZ 4.34Å
701	I	89.5	Confident	87.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-46.6	172.2	-67.7	165.5	0	0	0	110.5	L697 A703 G704 G705 F715 V745 V748 V786 F787	L697-I701 HydrophobicContact CD2-CD1 3.4Å; L697-I701 HydrophobicContact CD2-CG1 3.9Å; L697-I701 WeakPolarHBondContact O-CG1 3.44Å; L697-I701 PolarHBondContact O-N 2.98Å; I701-A703 VanDerWaalsContact C-N 3.34Å; I701-A703 PolarHBondContact O-N 3.45Å; I701-G704 WeakPolarHBondContact O-CA 3.41Å; I701-G704 PolarHBondContact O-N 2.97Å; I701-G704 VanDerWaalsContact O-N 3.1Å; I701-G705 PolarHBondContact O-N 2.82Å; I701-F715 HydrophobicContact CB-CE1 4.15Å; I701-F715 HydrophobicContact CB-CZ 3.92Å; I701-F715 HydrophobicContact CD1-CE1 3.98Å; I701-F715 HydrophobicContact CD1-CZ 4.34Å; I701-F715 HydrophobicContact CG2-CE1 3.84Å; I701-F715 HydrophobicContact CG2-CZ 3.93Å; I701-V745 HydrophobicContact CD1-CB 4.37Å; I701-V745 HydrophobicContact CD1-CG1 4.15Å; I701-V745 HydrophobicContact CD1-CG2 4.01Å; I701-V748 HydrophobicContact CD1-CB 4.37Å; I701-V748 HydrophobicContact CD1-CG1 4.35Å; I701-V748 HydrophobicContact CG1-CB 4.15Å; I701-V748 HydrophobicContact CG1-CG1 3.78Å; I701-V748 HydrophobicContact CG1-CG2 4.08Å; I701-V786 HydrophobicContact CD1-CG2 4.45Å; I701-V786 HydrophobicContact CG2-CB 4.06Å; I701-V786 HydrophobicContact CG2-CG1 3.81Å; I701-V786 HydrophobicContact CG2-CG2 4.11Å; I701-F787 HydrophobicContact CG2-CE2 3.94Å
702	N	91.2	Very high	87.3	Confident	30 Å²	30	53.1 Å²	53.1	16%	0.16	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-37.4	179	-85.8	-29.8	0	0	0	112.7	P698 S699 G704 G705 T706 A712 D713 F715 F787	P698-N702 WeakPolarHBondContact O-CB 3.09Å; P698-N702 PolarHBondContact O-N 2.92Å; S699-N702 PolarHBondContact O-N 2.85Å; N702-G704 VanDerWaalsContact C-N 3.35Å; N702-G705 PolarHBondContact O-N 3.39Å; N702-T706 WeakPolarHBondContact O-CG2 3.32Å; N702-T706 PolarHBondContact O-N 2.99Å; N702-T706 PolarHBondContact O-OG1 3.06Å; N702-A712 HydrophobicContact CB-CB 4.05Å; N702-A712 WeakPolarHBondContact OD1-CA 3.25Å; N702-D713 PolarHBondContact ND2-O 3.5Å; N702-D713 PolarHBondContact OD1-N 3.11Å; N702-D713 PolarHBondContact OD1-O 3.15Å; N702-F715 WeakPolarHBondContact ND2-CE2 3.14Å; N702-F787 WeakPolarHBondContact OD1-CZ 3.38Å
703	A	89.1	Confident	87.2	Confident	36 Å²	36	53.2 Å²	53.2	30%	0.298	31%	0.305	S	S	.	.	H	α-helix	trans	-67	-32.6	172.1	0	0	0	0	0	113	S699 M700 I701 T706 Q707	S699-A703 WeakPolarHBondContact O-CB 3.19Å; S699-A703 PolarHBondContact O-N 3.34Å; M700-A703 PolarHBondContact O-N 3.28Å; I701-A703 VanDerWaalsContact C-N 3.34Å; I701-A703 PolarHBondContact O-N 3.45Å; A703-T706 PolarHBondContact O-OG1 3.42Å; A703-Q707 VanDerWaalsContact O-CG 3.3Å; A703-Q707 WeakPolarHBondContact O-CG 3.13Å; A703-Q707 PolarHBondContact O-N 2.83Å; A703-Q707 PolarHBondContact O-NE2 3.13Å
704	G	87.1	Confident	87.1	Confident	4 Å²	4	55.8 Å²	55.8	4%	0.041	33%	0.328	C	S	.	.	H	α-helix	trans	-67.5	-41.7	170.4	0	0	0	0	0	112.3	M700 I701 N702 Q707 M708	M700-G704 PolarHBondContact O-N 2.92Å; I701-G704 WeakPolarHBondContact O-CA 3.41Å; I701-G704 PolarHBondContact O-N 2.97Å; I701-G704 VanDerWaalsContact O-N 3.1Å; N702-G704 VanDerWaalsContact C-N 3.35Å; G704-Q707 PolarHBondContact O-N 3.47Å; G704-M708 WeakPolarHBondContact O-CG 3.37Å; G704-M708 PolarHBondContact O-N 2.98Å
705	G	86.2	Confident	87.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.3	-46.6	175.8	0	0	0	0	0	113.1	I701 N702 Q707 M708 G709 F710	I701-G705 PolarHBondContact O-N 2.82Å; N702-G705 PolarHBondContact O-N 3.39Å; G705-Q707 VanDerWaalsContact C-N 3.35Å; G705-Q707 PolarHBondContact O-N 3.1Å; G705-M708 CarbonylContact O-C 3.6Å; G705-M708 WeakPolarHBondContact O-CA 3.47Å; G705-M708 WeakPolarHBondContact O-CB 3.06Å; G705-M708 PolarHBondContact O-N 2.87Å; G705-G709 PolarHBondContact O-N 3.44Å; G705-G709 VanDerWaalsContact O-N 3.16Å; G705-F710 WeakPolarHBondContact O-CB 3.41Å; G705-F710 PolarHBondContact O-N 3.38Å
706	T	88.6	Confident	86.9	Confident	79 Å²	79	56.2 Å²	56.2	49%	0.485	33%	0.334	S	S	.	.	H	α-helix	trans	-67.4	-32.9	178.8	55.6	0	0	0	0	112.9	N702 A703 M708 G709 F710	N702-T706 WeakPolarHBondContact O-CG2 3.32Å; N702-T706 PolarHBondContact O-N 2.99Å; N702-T706 PolarHBondContact O-OG1 3.06Å; A703-T706 PolarHBondContact O-OG1 3.42Å; T706-M708 PolarHBondContact O-N 3.14Å; T706-G709 PolarHBondContact O-N 2.96Å; T706-F710 VanDerWaalsContact CA-O 3.29Å; T706-F710 WeakPolarHBondContact CA-O 3.16Å; T706-F710 WeakPolarHBondContact CG2-O 3.31Å
707	Q	84.9	Confident	86.6	Confident	165 Å²	165	58 Å²	58	77%	0.771	34%	0.344	S	S	*	.	H	α-helix	trans	-63.3	-28.3	169.3	-78	171	75.4	0	0	113.2	A703 G704 G705 G709	A703-Q707 VanDerWaalsContact O-CG 3.3Å; A703-Q707 WeakPolarHBondContact O-CG 3.13Å; A703-Q707 PolarHBondContact O-N 2.83Å; A703-Q707 PolarHBondContact O-NE2 3.13Å; G704-Q707 PolarHBondContact O-N 3.47Å; G705-Q707 VanDerWaalsContact C-N 3.35Å; G705-Q707 PolarHBondContact O-N 3.1Å; Q707-G709 VanDerWaalsContact C-N 3.33Å
708	M	82.6	Confident	86.1	Confident	71 Å²	71	58.4 Å²	58.4	35%	0.35	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-0.5	172	-62.1	-178.8	-166.3	0	0	113.4	G704 G705 T706 F710 V780 V783 L784	G704-M708 WeakPolarHBondContact O-CG 3.37Å; G704-M708 PolarHBondContact O-N 2.98Å; G705-M708 CarbonylContact O-C 3.6Å; G705-M708 WeakPolarHBondContact O-CA 3.47Å; G705-M708 WeakPolarHBondContact O-CB 3.06Å; G705-M708 PolarHBondContact O-N 2.87Å; T706-M708 PolarHBondContact O-N 3.14Å; M708-F710 HydrophobicContact CB-CD2 3.75Å; M708-F710 HydrophobicContact CB-CE2 3.72Å; M708-F710 HydrophobicContact SD-CE2 4.25Å; M708-V780 HydrophobicContact CE-CB 4.45Å; M708-V780 HydrophobicContact CE-CG1 4.01Å; M708-V780 HydrophobicContact CE-CG2 4.36Å; M708-V783 HydrophobicContact CE-CB 4.03Å; M708-V783 HydrophobicContact CE-CG1 3.73Å; M708-V783 HydrophobicContact SD-CG1 3.8Å; M708-L784 HydrophobicContact SD-CD2 3.8Å; M708-L784 HydrophobicContact SD-CG 4.11Å
709	G	81.4	Confident	85.8	Confident	67 Å²	67	60.5 Å²	60.5	69%	0.691	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	5.5	-178.6	0	0	0	0	0	115.3	G705 T706 Q707	G705-G709 PolarHBondContact O-N 3.44Å; G705-G709 VanDerWaalsContact O-N 3.16Å; T706-G709 PolarHBondContact O-N 2.96Å; Q707-G709 VanDerWaalsContact C-N 3.33Å
710	F	85.5	Confident	85.3	Confident	33 Å²	33	60 Å²	60	15%	0.145	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-80.9	146.8	173.8	-55.2	-56.9	0	0	0	111.3	G705 T706 M708 L784 F787 R790 V791 A794	G705-F710 WeakPolarHBondContact O-CB 3.41Å; G705-F710 PolarHBondContact O-N 3.38Å; T706-F710 VanDerWaalsContact CA-O 3.29Å; T706-F710 WeakPolarHBondContact CA-O 3.16Å; T706-F710 WeakPolarHBondContact CG2-O 3.31Å; M708-F710 HydrophobicContact CB-CD2 3.75Å; M708-F710 HydrophobicContact CB-CE2 3.72Å; M708-F710 HydrophobicContact SD-CE2 4.25Å; F710-L784 HydrophobicContact CE2-CD2 4.2Å; F710-F787 HydrophobicContact CB-CD1 3.88Å; F710-F787 HydrophobicContact CB-CE1 4.22Å; F710-F787 HydrophobicContact CB-CG 4.17Å; F710-F787 HydrophobicContact CD2-CB 3.91Å; F710-F787 HydrophobicContact CD2-CD2 4.32Å; F710-F787 HydrophobicContact CD2-CG 4.01Å; F710-F787 HydrophobicContact CE2-CB 4.29Å; F710-F787 HydrophobicContact CG-CB 4.22Å; F710-F787 HydrophobicContact CG-CD1 4.36Å; F710-F787 HydrophobicContact CG-CG 4.24Å; F710-R790 HydrophobicContact CD1-CB 3.45Å; F710-R790 VanDerWaalsContact CD1-CB 3.45Å; F710-R790 HydrophobicContact CD1-CG 4.33Å; F710-R790 HydrophobicContact CE1-CB 3.75Å; F710-R790 HydrophobicContact CG-CB 4.18Å; F710-V791 HydrophobicContact CE1-CG2 4.38Å; F710-V791 HydrophobicContact CE2-CG2 3.97Å; F710-V791 HydrophobicContact CZ-CG2 3.6Å; F710-A794 HydrophobicContact CE1-CB 4.46Å
711	R	84	Confident	84.7	Confident	223 Å²	223	59 Å²	59	84%	0.842	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-72.8	145.4	168.6	-68.3	-177	177.3	180	-1.2	109.5	F787	R711-F787 VanDerWaalsContact O-CE1 3.29Å; R711-F787 WeakPolarHBondContact O-CE1 3.26Å
712	A	84.9	Confident	83.9	Confident	65 Å²	65	65.9 Å²	65.9	54%	0.537	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-55	144.1	176.1	0	0	0	0	0	112.2	N702	N702-A712 HydrophobicContact CB-CB 4.05Å; N702-A712 WeakPolarHBondContact OD1-CA 3.25Å
713	D	85.9	Confident	82.9	Confident	35 Å²	35	69.1 Å²	69.1	19%	0.187	40%	0.404	C	S	.	.			trans	-108.1	148.9	-177.5	-163	-56.4	0	0	0	110	N702 F715 K741 F787	N702-D713 PolarHBondContact ND2-O 3.5Å; N702-D713 PolarHBondContact OD1-N 3.11Å; N702-D713 PolarHBondContact OD1-O 3.15Å; D713-F715 VanDerWaalsContact C-N 3.3Å; D713-F715 WeakPolarHBondContact OD1-CA 3.35Å; D713-F715 PolarHBondContact OD1-N 3.4Å; D713-K741 IonicContact OD1-NZ 3.06Å; D713-K741 PolarHBondContact OD1-NZ 3.06Å; D713-K741 WeakPolarHBondContact OD2-CE 3.46Å; D713-K741 IonicContact OD2-NZ 2.82Å; D713-K741 PolarHBondContact OD2-NZ 3.3Å; D713-F787 HydrophobicContact CB-CD1 4.42Å; D713-F787 HydrophobicContact CB-CE1 3.73Å; D713-F787 HydrophobicContact CB-CZ 4.3Å
714	S	84.5	Confident	81.8	Confident	103 Å²	103	71.3 Å²	71.3	72%	0.72	43%	0.431	S	S	*	.			trans	-88.7	5.5	175.7	57.1	0	0	0	0	113.4	A716	S714-A716 PolarHBondContact O-N 3.27Å
715	F	86.9	Confident	80.6	Confident	21 Å²	21	75.1 Å²	75.1	9%	0.092	46%	0.456	C	S	.	.			trans	62.9	15.2	-177.5	-60	-81.5	0	0	0	115	F645 M649 F653 P698 I701 N702 D713 V745 V786	F645-F715 WeakPolarHBondContact CE1-O 3.37Å; F645-F715 VanDerWaalsContact CZ-O 3.25Å; F645-F715 WeakPolarHBondContact CZ-O 3.49Å; M649-F715 HydrophobicContact CE-CB 3.65Å; M649-F715 HydrophobicContact CE-CD1 3.79Å; M649-F715 HydrophobicContact CE-CG 4.13Å; F653-F715 HydrophobicContact CE2-CB 4.22Å; F653-F715 HydrophobicContact CE2-CG 4.24Å; F653-F715 HydrophobicContact CZ-CB 4.14Å; F653-F715 AromaticContact CZ-CD1 3.78Å; F653-F715 HydrophobicContact CZ-CD1 3.78Å; F653-F715 HydrophobicContact CZ-CD2 4.15Å; F653-F715 HydrophobicContact CZ-CE1 4.21Å; F653-F715 AromaticContact CZ-CG 3.74Å; F653-F715 HydrophobicContact CZ-CG 3.74Å; P698-F715 HydrophobicContact CB-CD2 4.21Å; P698-F715 HydrophobicContact CB-CE2 3.61Å; P698-F715 HydrophobicContact CB-CZ 4.14Å; P698-F715 WeakPolarHBondContact O-CZ 3.31Å; I701-F715 HydrophobicContact CB-CE1 4.15Å; I701-F715 HydrophobicContact CB-CZ 3.92Å; I701-F715 HydrophobicContact CD1-CE1 3.98Å; I701-F715 HydrophobicContact CD1-CZ 4.34Å; I701-F715 HydrophobicContact CG2-CE1 3.84Å; I701-F715 HydrophobicContact CG2-CZ 3.93Å; N702-F715 WeakPolarHBondContact ND2-CE2 3.14Å; D713-F715 VanDerWaalsContact C-N 3.3Å; D713-F715 WeakPolarHBondContact OD1-CA 3.35Å; D713-F715 PolarHBondContact OD1-N 3.4Å; F715-V745 HydrophobicContact CD1-CG2 4.48Å; F715-V786 HydrophobicContact CD1-CG1 4.22Å; F715-V786 HydrophobicContact CE1-CG1 3.82Å
716	A	85.1	Confident	79.1	Confident	43 Å²	43	81.7 Å²	81.7	36%	0.355	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-67	160.9	174.4	0	0	0	0	0	113	S714 K741	S714-A716 PolarHBondContact O-N 3.27Å; A716-K741 PolarHBondContact O-NZ 3.33Å
717	P	82.2	Confident	78	Confident	82 Å²	82	79.8 Å²	79.8	53%	0.532	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-54.6	147.3	170.4	-21.8	31.4	0	0	0	112.1	F645	F645-P717 HydrophobicContact CD1-CB 4.28Å; F645-P717 HydrophobicContact CD1-CG 3.71Å; F645-P717 HydrophobicContact CE1-CB 4.26Å; F645-P717 HydrophobicContact CE1-CG 3.76Å
718	I	80.4	Confident	76.9	Confident	10 Å²	10	75.1 Å²	75.1	5%	0.051	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-91.5	116.9	-175	-70.3	153	0	0	0	110.2	N734 L737 S738 K741 N788 D789	I718-N734 WeakPolarHBondContact O-CA 3.5Å; I718-N734 WeakPolarHBondContact O-CB 3.38Å; I718-L737 HydrophobicContact CB-CB 4.09Å; I718-L737 HydrophobicContact CD1-CB 4.24Å; I718-L737 VanDerWaalsContact CD1-O 3.3Å; I718-L737 WeakPolarHBondContact CD1-O 3.28Å; I718-L737 HydrophobicContact CG2-CB 3.79Å; I718-L737 HydrophobicContact CG2-CD1 4.06Å; I718-S738 PolarHBondContact N-OG 3.33Å; I718-K741 HydrophobicContact CD1-CB 3.64Å; I718-K741 HydrophobicContact CD1-CD 4.05Å; I718-K741 HydrophobicContact CD1-CG 4.43Å; I718-K741 HydrophobicContact CG1-CD 4.41Å; I718-N788 WeakPolarHBondContact CD1-OD1 3.4Å; I718-D789 HydrophobicContact CG2-CB 4.2Å
719	A	82.1	Confident	76	Confident	84 Å²	84	74 Å²	74	69%	0.694	47%	0.473	S	S	*	.			trans	-105.1	57.4	176.9	0	0	0	0	0	111.2
720	Y	80.2	Confident	75.3	Confident	69 Å²	69	70.9 Å²	70.9	27%	0.271	44%	0.441	S	S	.	.			trans	-73.1	-45.6	-173.7	-171.4	-110.5	0	0	0	113	N734 L737 D789 I792 D793	Y720-N734 PolarHBondContact N-OD1 3.41Å; Y720-L737 HydrophobicContact CD1-CD1 4.08Å; Y720-L737 HydrophobicContact CG-CD1 4.08Å; Y720-D789 HydrophobicContact CD2-CB 4.46Å; Y720-D789 WeakPolarHBondContact CD2-OD2 3.48Å; Y720-I792 HydrophobicContact CE1-CG2 4.02Å; Y720-I792 WeakPolarHBondContact OH-CG2 3.47Å; Y720-D793 VanDerWaalsContact CE2-OD1 3.23Å; Y720-D793 WeakPolarHBondContact CE2-OD1 3.26Å; Y720-D793 PolarHBondContact OH-OD1 3.25Å
721	V	75.7	Confident	74.5	Confident	18 Å²	18	70.3 Å²	70.3	11%	0.109	44%	0.444	C	S	.	.	S	Bend	trans	-95.8	125.1	-177.7	-171.1	0	0	0	0	109.7	F726 A730 V733 N734	V721-F726 HydrophobicContact CG1-CB 3.97Å; V721-F726 HydrophobicContact CG1-CD2 3.32Å; V721-F726 HydrophobicContact CG1-CE2 4.07Å; V721-F726 HydrophobicContact CG1-CG 3.89Å; V721-A730 HydrophobicContact CB-CB 4.11Å; V721-A730 HydrophobicContact CG1-CB 3.68Å; V721-V733 HydrophobicContact CG2-CB 4.03Å; V721-V733 HydrophobicContact CG2-CG1 3.6Å; V721-N734 PolarHBondContact N-OD1 2.91Å; V721-N734 PolarHBondContact O-ND2 3.02Å
722	Q	74.2	Confident	73.6	Confident	146 Å²	146	60.8 Å²	60.8	68%	0.682	41%	0.413	S	S	*	.			trans	-84.8	142	175.8	-62.1	-176.4	11.5	0	0	111	G724 S725	Q722-G724 PolarHBondContact O-N 3.34Å; Q722-G724 VanDerWaalsContact O-N 3.09Å; Q722-S725 PolarHBondContact O-N 2.84Å; Q722-S725 PolarHBondContact O-OG 2.95Å
723	P	69.7	Low	73	Confident	97 Å²	97	60.6 Å²	60.6	63%	0.63	41%	0.405	S	S	*	.	H	α-helix	trans	-56.8	-26.7	178.1	-27.5	35.6	0	0	0	114.6	S725 G727	P723-S725 PolarHBondContact O-N 2.8Å; P723-G727 VanDerWaalsContact O-CA 3.24Å; P723-G727 WeakPolarHBondContact O-CA 3.4Å; P723-G727 PolarHBondContact O-N 2.72Å
724	G	64.9	Low	72.8	Confident	83 Å²	83	60 Å²	60	86%	0.856	40%	0.402	S	S	*	.	H	α-helix	trans	-65.6	-16.7	-178.1	0	0	0	0	0	115.8	Q722	Q722-G724 PolarHBondContact O-N 3.34Å; Q722-G724 VanDerWaalsContact O-N 3.09Å
725	S	61.9	Low	72.5	Confident	83 Å²	83	55.6 Å²	55.6	58%	0.58	37%	0.372	S	S	*	.	H	α-helix	trans	-113.3	-21.1	-178.7	51.4	0	0	0	0	115	Q722 P723	Q722-S725 PolarHBondContact O-N 2.84Å; Q722-S725 PolarHBondContact O-OG 2.95Å; P723-S725 PolarHBondContact O-N 2.8Å
726	F	55	Low	72	Confident	138 Å²	138	60.1 Å²	60.1	61%	0.605	40%	0.396	S	S	*	.	H	α-helix	trans	-128.5	4.2	-179.9	-70.4	-91	0	0	0	114.1	V721 A729 A730	V721-F726 HydrophobicContact CG1-CB 3.97Å; V721-F726 HydrophobicContact CG1-CD2 3.32Å; V721-F726 HydrophobicContact CG1-CE2 4.07Å; V721-F726 HydrophobicContact CG1-CG 3.89Å; F726-A729 WeakPolarHBondContact O-CB 3.39Å; F726-A729 PolarHBondContact O-N 3.34Å; F726-A730 HydrophobicContact CB-CB 4.3Å
727	G	65.5	Low	71.9	Confident	40 Å²	40	59 Å²	59	41%	0.412	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	-139.7	-176.9	0	0	0	0	0	111.9	P723 A729 A730	P723-G727 VanDerWaalsContact O-CA 3.24Å; P723-G727 WeakPolarHBondContact O-CA 3.4Å; P723-G727 PolarHBondContact O-N 2.72Å; G727-A729 PolarHBondContact O-N 2.88Å; G727-A730 VanDerWaalsContact O-CB 3.29Å; G727-A730 WeakPolarHBondContact O-CB 3.47Å; G727-A730 PolarHBondContact O-N 2.97Å; G727-A730 VanDerWaalsContact O-N 3.12Å
728	A	62.9	Low	72	Confident	67 Å²	67	55.4 Å²	55.4	55%	0.554	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-24.8	179.5	0	0	0	0	0	113.7	L634 A730 G731	L634-A728 HydrophobicContact CD2-CB 3.59Å; A728-A730 PolarHBondContact O-N 2.83Å; A728-G731 PolarHBondContact O-N 3.07Å
729	A	62.4	Low	72.2	Confident	47 Å²	47	57.8 Å²	57.8	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-66.4	-18.4	177.6	0	0	0	0	0	113.2	F726 G727 A732 V733	F726-A729 WeakPolarHBondContact O-CB 3.39Å; F726-A729 PolarHBondContact O-N 3.34Å; G727-A729 PolarHBondContact O-N 2.88Å; A729-A732 PolarHBondContact O-N 3.34Å; A729-V733 WeakPolarHBondContact O-CG2 3.1Å; A729-V733 PolarHBondContact O-N 3.26Å; A729-V733 VanDerWaalsContact O-N 3.09Å
730	A	67.8	Low	72.3	Confident	1 Å²	1	55 Å²	55	1%	0.008	35%	0.351	C	S	.	.	H	α-helix	trans	-60.6	-45.3	177.9	0	0	0	0	0	112.7	V721 F726 G727 A728 V733 N734	V721-A730 HydrophobicContact CB-CB 4.11Å; V721-A730 HydrophobicContact CG1-CB 3.68Å; F726-A730 HydrophobicContact CB-CB 4.3Å; G727-A730 VanDerWaalsContact O-CB 3.29Å; G727-A730 WeakPolarHBondContact O-CB 3.47Å; G727-A730 PolarHBondContact O-N 2.97Å; G727-A730 VanDerWaalsContact O-N 3.12Å; A728-A730 PolarHBondContact O-N 2.83Å; A730-V733 PolarHBondContact O-N 2.8Å; A730-N734 WeakPolarHBondContact O-CB 3.38Å; A730-N734 PolarHBondContact O-N 3.42Å; A730-N734 PolarHBondContact O-ND2 2.95Å
731	G	68.2	Low	72.8	Confident	22 Å²	22	52 Å²	52	23%	0.227	34%	0.338	C	S	.	.	H	α-helix	trans	-66.7	-39.9	179.9	0	0	0	0	0	112.4	E638 A728 V733 N734 A735	E638-G731 VanDerWaalsContact OE1-CA 3.28Å; E638-G731 WeakPolarHBondContact OE1-CA 3.22Å; A728-G731 PolarHBondContact O-N 3.07Å; G731-V733 PolarHBondContact O-N 3.25Å; G731-N734 PolarHBondContact O-N 3.25Å; G731-A735 WeakPolarHBondContact O-CB 3.44Å; G731-A735 PolarHBondContact O-N 3.34Å
732	A	65.8	Low	73.5	Confident	22 Å²	22	52.6 Å²	52.6	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-61	-40.4	172.9	0	0	0	0	0	113.2	A729 I736	A729-A732 PolarHBondContact O-N 3.34Å; A732-I736 WeakPolarHBondContact O-CD1 3.44Å; A732-I736 VanDerWaalsContact O-CG1 3.3Å; A732-I736 WeakPolarHBondContact O-CG1 3.48Å; A732-I736 PolarHBondContact O-N 3.27Å; A732-I736 VanDerWaalsContact O-N 3.08Å
733	V	70.8	Confident	74.1	Confident	61 Å²	61	47.6 Å²	47.6	37%	0.37	33%	0.325	S	S	.	.	H	α-helix	trans	-68.8	-41.2	175.8	175.7	0	0	0	0	111.5	V721 A729 A730 G731 A735 I736 L737	V721-V733 HydrophobicContact CG2-CB 4.03Å; V721-V733 HydrophobicContact CG2-CG1 3.6Å; A729-V733 WeakPolarHBondContact O-CG2 3.1Å; A729-V733 PolarHBondContact O-N 3.26Å; A729-V733 VanDerWaalsContact O-N 3.09Å; A730-V733 PolarHBondContact O-N 2.8Å; G731-V733 PolarHBondContact O-N 3.25Å; V733-A735 VanDerWaalsContact C-N 3.34Å; V733-A735 PolarHBondContact O-N 2.93Å; V733-I736 PolarHBondContact O-N 2.96Å; V733-L737 HydrophobicContact CG1-CD1 3.99Å; V733-L737 HydrophobicContact CG1-CG 4.45Å; V733-L737 WeakPolarHBondContact O-CG 3.5Å; V733-L737 PolarHBondContact O-N 3.43Å
734	N	82.3	Confident	75	Confident	24 Å²	24	43 Å²	43	13%	0.128	30%	0.295	C	S	.	.	H	α-helix	trans	-62.2	-39.8	175.4	-72.3	-15.8	0	0	0	112.4	I718 Y720 V721 A730 G731 L737 S738	I718-N734 WeakPolarHBondContact O-CA 3.5Å; I718-N734 WeakPolarHBondContact O-CB 3.38Å; Y720-N734 PolarHBondContact N-OD1 3.41Å; V721-N734 PolarHBondContact N-OD1 2.91Å; V721-N734 PolarHBondContact O-ND2 3.02Å; A730-N734 WeakPolarHBondContact O-CB 3.38Å; A730-N734 PolarHBondContact O-N 3.42Å; A730-N734 PolarHBondContact O-ND2 2.95Å; G731-N734 PolarHBondContact O-N 3.25Å; N734-L737 PolarHBondContact O-N 2.92Å; N734-S738 WeakPolarHBondContact O-CB 3.33Å; N734-S738 PolarHBondContact O-N 3.19Å; N734-S738 PolarHBondContact O-OG 3.09Å
735	A	78.4	Confident	76.3	Confident	10 Å²	10	39 Å²	39	8%	0.083	25%	0.254	C	S	.	.	H	α-helix	trans	-59.9	-47.6	171.9	0	0	0	0	0	112	A641 G731 V733 S738 L739	A641-A735 HydrophobicContact CB-CB 3.49Å; A641-A735 VanDerWaalsContact CB-CB 3.49Å; G731-A735 WeakPolarHBondContact O-CB 3.44Å; G731-A735 PolarHBondContact O-N 3.34Å; V733-A735 VanDerWaalsContact C-N 3.34Å; V733-A735 PolarHBondContact O-N 2.93Å; A735-S738 PolarHBondContact O-N 3.21Å; A735-L739 WeakPolarHBondContact O-CG 3.4Å; A735-L739 PolarHBondContact O-N 2.93Å
736	I	76.1	Confident	77.6	Confident	115 Å²	115	36.3 Å²	36.3	59%	0.59	24%	0.239	S	C	*	.	H	α-helix	trans	-63.3	-43.2	177.8	-68.2	163.4	0	0	0	111.4	A732 V733 S738 L739 A740	A732-I736 WeakPolarHBondContact O-CD1 3.44Å; A732-I736 VanDerWaalsContact O-CG1 3.3Å; A732-I736 WeakPolarHBondContact O-CG1 3.48Å; A732-I736 PolarHBondContact O-N 3.27Å; A732-I736 VanDerWaalsContact O-N 3.08Å; V733-I736 PolarHBondContact O-N 2.96Å; I736-S738 VanDerWaalsContact C-N 3.33Å; I736-S738 PolarHBondContact O-N 3.11Å; I736-L739 PolarHBondContact O-N 3.43Å; I736-A740 WeakPolarHBondContact O-CB 3.34Å; I736-A740 PolarHBondContact O-N 2.94Å
737	L	83.3	Confident	79.2	Confident	19 Å²	19	31.5 Å²	31.5	10%	0.099	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-40.1	176.1	-73.5	167.2	0	0	0	111.9	I718 Y720 V733 N734 A740 K741 N788 I792	I718-L737 HydrophobicContact CB-CB 4.09Å; I718-L737 HydrophobicContact CD1-CB 4.24Å; I718-L737 VanDerWaalsContact CD1-O 3.3Å; I718-L737 WeakPolarHBondContact CD1-O 3.28Å; I718-L737 HydrophobicContact CG2-CB 3.79Å; I718-L737 HydrophobicContact CG2-CD1 4.06Å; Y720-L737 HydrophobicContact CD1-CD1 4.08Å; Y720-L737 HydrophobicContact CG-CD1 4.08Å; V733-L737 HydrophobicContact CG1-CD1 3.99Å; V733-L737 HydrophobicContact CG1-CG 4.45Å; V733-L737 WeakPolarHBondContact O-CG 3.5Å; V733-L737 PolarHBondContact O-N 3.43Å; N734-L737 PolarHBondContact O-N 2.92Å; L737-A740 PolarHBondContact O-N 3.41Å; L737-K741 PolarHBondContact O-N 3.08Å; L737-N788 PolarHBondContact O-ND2 2.97Å; L737-I792 HydrophobicContact CD2-CD1 3.61Å
738	S	85.3	Confident	80.4	Confident	7 Å²	7	29.6 Å²	29.6	5%	0.049	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-48.3	175	-56.5	0	0	0	0	111.5	F645 I718 N734 A735 I736 A740 K741 L742	F645-S738 WeakPolarHBondContact CD2-O 3.45Å; F645-S738 WeakPolarHBondContact CE2-O 3.37Å; I718-S738 PolarHBondContact N-OG 3.33Å; N734-S738 WeakPolarHBondContact O-CB 3.33Å; N734-S738 PolarHBondContact O-N 3.19Å; N734-S738 PolarHBondContact O-OG 3.09Å; A735-S738 PolarHBondContact O-N 3.21Å; I736-S738 VanDerWaalsContact C-N 3.33Å; I736-S738 PolarHBondContact O-N 3.11Å; S738-A740 VanDerWaalsContact C-N 3.26Å; S738-A740 PolarHBondContact O-N 3.02Å; S738-K741 WeakPolarHBondContact O-CB 3.42Å; S738-K741 PolarHBondContact O-N 2.99Å; S738-K741 VanDerWaalsContact O-N 3.08Å; S738-L742 PolarHBondContact O-N 2.93Å
739	L	84	Confident	81.7	Confident	60 Å²	60	27.1 Å²	27.1	31%	0.314	18%	0.175	S	C	.	.	H	α-helix	trans	-61.5	-33.6	175.8	-68.2	172.6	0	0	0	112.4	A641 I644 A735 I736 L742 A743	A641-L739 HydrophobicContact CB-CD1 4.14Å; A641-L739 HydrophobicContact CB-CG 4.43Å; I644-L739 HydrophobicContact CD1-CD2 4.05Å; I644-L739 HydrophobicContact CG2-CD2 4.14Å; A735-L739 WeakPolarHBondContact O-CG 3.4Å; A735-L739 PolarHBondContact O-N 2.93Å; I736-L739 PolarHBondContact O-N 3.43Å; L739-L742 PolarHBondContact O-N 3.37Å; L739-A743 PolarHBondContact O-N 2.93Å
740	A	85	Confident	83	Confident	27 Å²	27	26.9 Å²	26.9	22%	0.223	17%	0.168	C	C	.	.	H	α-helix	trans	-68.8	-36.1	172.9	0	0	0	0	0	113.1	I736 L737 S738 A743 G744 L785 N788	I736-A740 WeakPolarHBondContact O-CB 3.34Å; I736-A740 PolarHBondContact O-N 2.94Å; L737-A740 PolarHBondContact O-N 3.41Å; S738-A740 VanDerWaalsContact C-N 3.26Å; S738-A740 PolarHBondContact O-N 3.02Å; A740-A743 PolarHBondContact O-N 3.47Å; A740-G744 PolarHBondContact O-N 2.94Å; A740-L785 HydrophobicContact CB-CD2 4.48Å; A740-N788 WeakPolarHBondContact CB-ND2 3.34Å
741	K	90.6	Very high	83.9	Confident	4 Å²	4	26.9 Å²	26.9	2%	0.017	17%	0.168	C	C	.	.	H	α-helix	trans	-61.5	-44.7	170.2	162.4	-179.4	-78.3	-176.4	0	111.3	F645 M649 D713 A716 I718 L737 S738 G744 V745 L785 V786	F645-K741 HydrophobicContact CE2-CB 4.31Å; F645-K741 HydrophobicContact CE2-CD 4.07Å; F645-K741 HydrophobicContact CE2-CG 4.1Å; F645-K741 HydrophobicContact CZ-CD 3.83Å; F645-K741 HydrophobicContact CZ-CG 4.31Å; M649-K741 HydrophobicContact CE-CG 4.42Å; D713-K741 IonicContact OD1-NZ 3.06Å; D713-K741 PolarHBondContact OD1-NZ 3.06Å; D713-K741 WeakPolarHBondContact OD2-CE 3.46Å; D713-K741 IonicContact OD2-NZ 2.82Å; D713-K741 PolarHBondContact OD2-NZ 3.3Å; A716-K741 PolarHBondContact O-NZ 3.33Å; I718-K741 HydrophobicContact CD1-CB 3.64Å; I718-K741 HydrophobicContact CD1-CD 4.05Å; I718-K741 HydrophobicContact CD1-CG 4.43Å; I718-K741 HydrophobicContact CG1-CD 4.41Å; L737-K741 PolarHBondContact O-N 3.08Å; S738-K741 WeakPolarHBondContact O-CB 3.42Å; S738-K741 PolarHBondContact O-N 2.99Å; S738-K741 VanDerWaalsContact O-N 3.08Å; K741-G744 WeakPolarHBondContact O-CA 3.42Å; K741-G744 PolarHBondContact O-N 3.25Å; K741-G744 VanDerWaalsContact O-N 3.09Å; K741-V745 PolarHBondContact O-N 2.85Å; K741-V745 VanDerWaalsContact O-N 3.11Å; K741-L785 WeakPolarHBondContact CA-O 3.24Å; K741-V786 WeakPolarHBondContact CE-O 3.3Å; K741-V786 HydrophobicContact CG-CG1 4.28Å
742	L	90.2	Very high	84.9	Confident	32 Å²	32	25.8 Å²	25.8	17%	0.168	16%	0.157	C	C	.	.	H	α-helix	trans	-60.9	-45.9	175.9	178.3	158.9	0	0	0	111.8	I644 F645 M649 L652 S738 L739 G744 V745 G746	I644-L742 HydrophobicContact CG2-CD1 4.48Å; I644-L742 WeakPolarHBondContact O-CD1 3.25Å; F645-L742 HydrophobicContact CD2-CB 3.97Å; F645-L742 HydrophobicContact CD2-CD1 4.35Å; F645-L742 HydrophobicContact CE2-CB 4.14Å; M649-L742 HydrophobicContact CG-CB 4.42Å; M649-L742 HydrophobicContact CG-CD1 4.26Å; M649-L742 HydrophobicContact CG-CG 4.43Å; M649-L742 HydrophobicContact SD-CB 3.84Å; M649-L742 HydrophobicContact SD-CG 4.1Å; L652-L742 HydrophobicContact CD1-CD2 4.12Å; L652-L742 HydrophobicContact CD1-CG 4.04Å; S738-L742 PolarHBondContact O-N 2.93Å; L739-L742 PolarHBondContact O-N 3.37Å; L742-G744 PolarHBondContact O-N 3.08Å; L742-V745 PolarHBondContact O-N 3.48Å; L742-G746 PolarHBondContact O-N 3.31Å
743	A	86.7	Confident	85.7	Confident	41 Å²	41	25.9 Å²	25.9	34%	0.339	16%	0.156	S	C	.	.	H	α-helix	trans	-59.1	-37.3	173	0	0	0	0	0	111.7	L739 A740 G746 F747	L739-A743 PolarHBondContact O-N 2.93Å; A740-A743 PolarHBondContact O-N 3.47Å; A743-G746 CarbonylContact O-C 3.6Å; A743-G746 WeakPolarHBondContact O-CA 3.5Å; A743-G746 PolarHBondContact O-N 3.29Å; A743-G746 VanDerWaalsContact O-N 3.17Å; A743-F747 WeakPolarHBondContact O-CD2 3.4Å; A743-F747 PolarHBondContact O-N 3.45Å
744	G	88.3	Confident	86.4	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.5	-45.4	173.8	0	0	0	0	0	113.8	A740 K741 L742 G746 F747 V748 G782 L785	A740-G744 PolarHBondContact O-N 2.94Å; K741-G744 WeakPolarHBondContact O-CA 3.42Å; K741-G744 PolarHBondContact O-N 3.25Å; K741-G744 VanDerWaalsContact O-N 3.09Å; L742-G744 PolarHBondContact O-N 3.08Å; G744-G746 VanDerWaalsContact C-N 3.31Å; G744-G746 PolarHBondContact O-N 3.46Å; G744-F747 PolarHBondContact O-N 3.46Å; G744-V748 PolarHBondContact O-N 2.92Å; G744-G782 CarbonylContact C-O 3.58Å; G744-G782 WeakPolarHBondContact CA-O 3.49Å; G744-G782 VanDerWaalsContact O-CA 3.26Å; G744-G782 WeakPolarHBondContact O-CA 3.32Å; G744-L785 VanDerWaalsContact CA-CB 3.48Å
745	V	91.6	Very high	86.4	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-59.2	-43.7	173.4	-179.5	0	0	0	0	110.8	M649 L652 F653 L697 I701 F715 K741 L742 F747 V748 M749 V786	M649-V745 HydrophobicContact CE-CG2 3.73Å; M649-V745 HydrophobicContact SD-CB 4.48Å; M649-V745 HydrophobicContact SD-CG2 3.83Å; L652-V745 HydrophobicContact CB-CG1 4.02Å; L652-V745 HydrophobicContact CD1-CB 4.12Å; L652-V745 HydrophobicContact CD1-CG1 4.16Å; F653-V745 HydrophobicContact CD1-CG1 4.24Å; F653-V745 HydrophobicContact CE1-CG1 3.75Å; F653-V745 HydrophobicContact CE1-CG2 4.38Å; L697-V745 HydrophobicContact CD2-CG1 4.26Å; I701-V745 HydrophobicContact CD1-CB 4.37Å; I701-V745 HydrophobicContact CD1-CG1 4.15Å; I701-V745 HydrophobicContact CD1-CG2 4.01Å; F715-V745 HydrophobicContact CD1-CG2 4.48Å; K741-V745 PolarHBondContact O-N 2.85Å; K741-V745 VanDerWaalsContact O-N 3.11Å; L742-V745 PolarHBondContact O-N 3.48Å; V745-F747 PolarHBondContact O-N 3.19Å; V745-V748 PolarHBondContact O-N 3.45Å; V745-M749 PolarHBondContact O-N 2.94Å; V745-V786 HydrophobicContact CG2-CG2 3.8Å
746	G	88.7	Confident	86.5	Confident	26 Å²	26	26.8 Å²	26.8	27%	0.268	15%	0.151	S	C	.	.	H	α-helix	trans	-59.9	-40.8	174.4	0	0	0	0	0	113.5	L742 A743 G744 N750	L742-G746 PolarHBondContact O-N 3.31Å; A743-G746 CarbonylContact O-C 3.6Å; A743-G746 WeakPolarHBondContact O-CA 3.5Å; A743-G746 PolarHBondContact O-N 3.29Å; A743-G746 VanDerWaalsContact O-N 3.17Å; G744-G746 VanDerWaalsContact C-N 3.31Å; G744-G746 PolarHBondContact O-N 3.46Å; G746-N750 VanDerWaalsContact O-CB 3.29Å; G746-N750 WeakPolarHBondContact O-CB 3.45Å; G746-N750 PolarHBondContact O-N 3.23Å
747	F	88.8	Confident	86.6	Confident	36 Å²	36	27.1 Å²	27.1	16%	0.158	15%	0.148	C	C	.	.	H	α-helix	trans	-65.2	-41.2	174.5	-91.1	-76	0	0	0	112.6	L12 A743 G744 V745 N750 G751 K778 L785	L12-F747 HydrophobicContact CB-CZ 4.48Å; A743-F747 WeakPolarHBondContact O-CD2 3.4Å; A743-F747 PolarHBondContact O-N 3.45Å; G744-F747 PolarHBondContact O-N 3.46Å; V745-F747 PolarHBondContact O-N 3.19Å; F747-N750 PolarHBondContact O-N 3.26Å; F747-G751 PolarHBondContact O-N 3.43Å; F747-K778 CarbonylContact C-O 3.58Å; F747-K778 HydrophobicContact CD1-CB 4.29Å; F747-K778 HydrophobicContact CD1-CD 4.46Å; F747-K778 HydrophobicContact CD1-CG 4.21Å; F747-L785 HydrophobicContact CD2-CD1 3.79Å; F747-L785 HydrophobicContact CE2-CD1 4.18Å
748	V	91.6	Very high	86.1	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.1	-48.5	174.7	173.3	0	0	0	0	111.3	L697 I701 G744 V745 N750 G751 I752 F779 V783	L697-V748 HydrophobicContact CD2-CG1 4.01Å; I701-V748 HydrophobicContact CD1-CB 4.37Å; I701-V748 HydrophobicContact CD1-CG1 4.35Å; I701-V748 HydrophobicContact CG1-CB 4.15Å; I701-V748 HydrophobicContact CG1-CG1 3.78Å; I701-V748 HydrophobicContact CG1-CG2 4.08Å; G744-V748 PolarHBondContact O-N 2.92Å; V745-V748 PolarHBondContact O-N 3.45Å; V748-N750 VanDerWaalsContact C-N 3.3Å; V748-N750 PolarHBondContact O-N 3.49Å; V748-G751 PolarHBondContact O-N 2.94Å; V748-G751 VanDerWaalsContact O-N 3.16Å; V748-I752 HydrophobicContact CG1-CD1 3.71Å; V748-I752 HydrophobicContact CG1-CG1 4.34Å; V748-I752 WeakPolarHBondContact O-CG1 3.14Å; V748-I752 PolarHBondContact O-N 3.16Å; V748-F779 HydrophobicContact CG1-CD2 3.79Å; V748-F779 HydrophobicContact CG1-CE2 3.81Å; V748-V783 HydrophobicContact CG2-CG2 3.94Å
749	M	90.6	Very high	85.3	Confident	15 Å²	15	28.6 Å²	28.6	7%	0.074	16%	0.155	C	C	.	.	H	α-helix	trans	-57.4	-44.3	176.3	-170.3	-163	-66.9	0	0	111.5	L652 W655 L659 L694 L697 V745 I752 S753	L652-M749 HydrophobicContact CB-CE 4.1Å; L652-M749 HydrophobicContact CD2-CE 3.66Å; L652-M749 WeakPolarHBondContact O-CE 3.19Å; W655-M749 HydrophobicContact CB-CE 4.45Å; L659-M749 HydrophobicContact CD1-SD 4.08Å; L694-M749 HydrophobicContact CD2-CG 4.16Å; L697-M749 HydrophobicContact CD1-CB 4.09Å; L697-M749 HydrophobicContact CD1-CE 4Å; L697-M749 HydrophobicContact CD1-CG 4.11Å; V745-M749 PolarHBondContact O-N 2.94Å; M749-I752 PolarHBondContact O-N 3.39Å; M749-S753 VanDerWaalsContact O-CB 3.32Å; M749-S753 WeakPolarHBondContact O-CB 3.4Å; M749-S753 PolarHBondContact O-N 3.35Å
750	N	88.2	Confident	84.3	Confident	43 Å²	43	27.5 Å²	27.5	23%	0.23	15%	0.15	C	C	.	.	H	α-helix	trans	-60.5	-46.7	176.6	-162.2	-53.9	0	0	0	110.8	G746 F747 V748 S753 I754 K778	G746-N750 VanDerWaalsContact O-CB 3.29Å; G746-N750 WeakPolarHBondContact O-CB 3.45Å; G746-N750 PolarHBondContact O-N 3.23Å; F747-N750 PolarHBondContact O-N 3.26Å; V748-N750 VanDerWaalsContact C-N 3.3Å; V748-N750 PolarHBondContact O-N 3.49Å; N750-S753 PolarHBondContact O-N 3.28Å; N750-S753 PolarHBondContact O-OG 2.93Å; N750-I754 WeakPolarHBondContact O-CG1 3.2Å; N750-I754 PolarHBondContact O-N 3.32Å; N750-I754 WeakPolarHBondContact OD1-CD1 3.39Å; N750-K778 HydrophobicContact CB-CD 4.12Å; N750-K778 VanDerWaalsContact OD1-CD 3.25Å; N750-K778 WeakPolarHBondContact OD1-CD 3.19Å; N750-K778 PolarHBondContact OD1-NZ 3.04Å
751	G	86.9	Confident	83.1	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56.6	-51.2	175.8	0	0	0	0	0	113.5	F747 V748 S753 I754 W755 G775	F747-G751 PolarHBondContact O-N 3.43Å; V748-G751 PolarHBondContact O-N 2.94Å; V748-G751 VanDerWaalsContact O-N 3.16Å; G751-S753 VanDerWaalsContact C-N 3.3Å; G751-S753 PolarHBondContact O-N 2.89Å; G751-I754 PolarHBondContact O-N 3.09Å; G751-I754 VanDerWaalsContact O-N 3.15Å; G751-W755 PolarHBondContact O-N 3.27Å; G751-W755 VanDerWaalsContact O-N 3.07Å; G751-G775 WeakPolarHBondContact CA-O 3.45Å
752	I	88.9	Confident	81.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-36.5	177.7	-56.7	165.4	0	0	0	110.8	I690 M693 L694 M700 V748 M749 I754 W755 R756 F779	I690-I752 HydrophobicContact CG2-CG2 3.92Å; M693-I752 HydrophobicContact CB-CD1 4.33Å; M693-I752 HydrophobicContact CB-CG2 4.04Å; L694-I752 HydrophobicContact CD1-CG2 4.48Å; L694-I752 HydrophobicContact CD2-CB 4.21Å; L694-I752 HydrophobicContact CD2-CG2 4.01Å; L694-I752 HydrophobicContact CG-CB 4.5Å; L694-I752 HydrophobicContact CG-CG2 3.76Å; M700-I752 HydrophobicContact CG-CD1 4.29Å; V748-I752 HydrophobicContact CG1-CD1 3.71Å; V748-I752 HydrophobicContact CG1-CG1 4.34Å; V748-I752 WeakPolarHBondContact O-CG1 3.14Å; V748-I752 PolarHBondContact O-N 3.16Å; M749-I752 PolarHBondContact O-N 3.39Å; I752-I754 VanDerWaalsContact C-N 3.3Å; I752-I754 PolarHBondContact O-N 3.19Å; I752-W755 HydrophobicContact CB-CE3 4.21Å; I752-W755 HydrophobicContact CG1-CE3 3.97Å; I752-W755 HydrophobicContact CG1-CZ3 3.85Å; I752-W755 HydrophobicContact CG2-CE3 4.28Å; I752-W755 WeakPolarHBondContact O-CB 3.16Å; I752-W755 PolarHBondContact O-N 2.81Å; I752-R756 PolarHBondContact O-N 2.65Å; I752-F779 HydrophobicContact CD1-CD2 4.42Å; I752-F779 HydrophobicContact CD1-CE2 4.29Å; I752-F779 HydrophobicContact CG1-CD2 4.03Å; I752-F779 HydrophobicContact CG1-CE2 4.3Å
753	S	83.8	Confident	79.9	Confident	24 Å²	24	36 Å²	36	17%	0.168	21%	0.209	C	C	.	.	H	α-helix	trans	-65.4	-31.5	175.8	84	0	0	0	0	113.2	M749 N750 G751 R756 K757	M749-S753 VanDerWaalsContact O-CB 3.32Å; M749-S753 WeakPolarHBondContact O-CB 3.4Å; M749-S753 PolarHBondContact O-N 3.35Å; N750-S753 PolarHBondContact O-N 3.28Å; N750-S753 PolarHBondContact O-OG 2.93Å; G751-S753 VanDerWaalsContact C-N 3.3Å; G751-S753 PolarHBondContact O-N 2.89Å; S753-R756 PolarHBondContact O-N 3.46Å; S753-K757 WeakPolarHBondContact O-CG 3.42Å; S753-K757 PolarHBondContact O-N 3.32Å; S753-K757 VanDerWaalsContact O-N 3.13Å
754	I	84.4	Confident	78.5	Confident	29 Å²	29	39.1 Å²	39.1	15%	0.149	22%	0.223	C	C	.	.	H	α-helix	trans	-73	-42.3	174.3	-66.2	167.1	0	0	0	110.2	N750 G751 I752 R756 K757 S758 S771 K778	N750-I754 WeakPolarHBondContact O-CG1 3.2Å; N750-I754 PolarHBondContact O-N 3.32Å; N750-I754 WeakPolarHBondContact OD1-CD1 3.39Å; G751-I754 PolarHBondContact O-N 3.09Å; G751-I754 VanDerWaalsContact O-N 3.15Å; I752-I754 VanDerWaalsContact C-N 3.3Å; I752-I754 PolarHBondContact O-N 3.19Å; I754-R756 VanDerWaalsContact C-N 3.27Å; I754-R756 PolarHBondContact O-N 2.86Å; I754-K757 PolarHBondContact O-N 2.88Å; I754-S758 VanDerWaalsContact O-CB 3.25Å; I754-S758 WeakPolarHBondContact O-CB 3.26Å; I754-S758 PolarHBondContact O-N 2.85Å; I754-S771 WeakPolarHBondContact CG2-O 3.28Å; I754-K778 HydrophobicContact CD1-CD 3.83Å
755	W	83.7	Confident	77.1	Confident	37 Å²	37	43.2 Å²	43.2	14%	0.14	26%	0.257	C	S	.	.	H	α-helix	trans	-56.1	-44	171	-62.8	-25.9	0	0	0	111.3	I690 M693 G751 I752 K757 S758 L759 I772 N776 F779	I690-W755 HydrophobicContact CD1-CB 4.11Å; M693-W755 HydrophobicContact SD-CE3 4.35Å; M693-W755 HydrophobicContact SD-CZ3 4.02Å; G751-W755 PolarHBondContact O-N 3.27Å; G751-W755 VanDerWaalsContact O-N 3.07Å; I752-W755 HydrophobicContact CB-CE3 4.21Å; I752-W755 HydrophobicContact CG1-CE3 3.97Å; I752-W755 HydrophobicContact CG1-CZ3 3.85Å; I752-W755 HydrophobicContact CG2-CE3 4.28Å; I752-W755 WeakPolarHBondContact O-CB 3.16Å; I752-W755 PolarHBondContact O-N 2.81Å; W755-K757 PolarHBondContact O-N 2.83Å; W755-S758 PolarHBondContact O-N 2.97Å; W755-L759 WeakPolarHBondContact O-CD1 3.37Å; W755-L759 PolarHBondContact O-N 3.42Å; W755-L759 VanDerWaalsContact O-N 3.15Å; W755-I772 PolarHBondContact NE1-O 3.31Å; W755-N776 VanDerWaalsContact CE2-OD1 3.3Å; W755-N776 WeakPolarHBondContact CZ2-OD1 3.25Å; W755-N776 PolarHBondContact NE1-OD1 3.01Å; W755-F779 HydrophobicContact CH2-CB 3.89Å; W755-F779 HydrophobicContact CH2-CD1 4.04Å; W755-F779 AromaticContact CH2-CD2 3.46Å; W755-F779 HydrophobicContact CH2-CD2 3.46Å; W755-F779 VanDerWaalsContact CH2-CD2 3.46Å; W755-F779 HydrophobicContact CH2-CE1 4.47Å; W755-F779 AromaticContact CH2-CE2 3.97Å; W755-F779 HydrophobicContact CH2-CE2 3.97Å; W755-F779 AromaticContact CH2-CG 3.51Å; W755-F779 HydrophobicContact CH2-CG 3.51Å; W755-F779 HydrophobicContact CH2-CZ 4.45Å; W755-F779 HydrophobicContact CZ2-CB 3.84Å; W755-F779 HydrophobicContact CZ2-CD2 4.28Å; W755-F779 AromaticContact CZ2-CG 3.98Å; W755-F779 HydrophobicContact CZ2-CG 3.98Å; W755-F779 AromaticContact CZ3-CD2 3.88Å; W755-F779 HydrophobicContact CZ3-CD2 3.88Å; W755-F779 HydrophobicContact CZ3-CE2 4.2Å; W755-F779 HydrophobicContact CZ3-CG 4.38Å
756	R	80.1	Confident	75.4	Confident	48 Å²	48	50.1 Å²	50.1	18%	0.181	29%	0.293	C	S	.	.	H	α-helix	trans	-57.9	-50.3	178.2	-165.8	-178.2	71.5	179.4	4.9	111.9	L659 I690 I752 S753 I754 L760	L659-R756 PolarHBondContact O-NH1 3.35Å; I690-R756 HydrophobicContact CG2-CB 3.66Å; I690-R756 HydrophobicContact CG2-CG 4.08Å; I752-R756 PolarHBondContact O-N 2.65Å; S753-R756 PolarHBondContact O-N 3.46Å; I754-R756 VanDerWaalsContact C-N 3.27Å; I754-R756 PolarHBondContact O-N 2.86Å; R756-L760 HydrophobicContact CG-CD1 3.82Å; R756-L760 WeakPolarHBondContact O-CB 3.24Å; R756-L760 WeakPolarHBondContact O-CD1 3.34Å; R756-L760 VanDerWaalsContact O-CG 3.22Å; R756-L760 WeakPolarHBondContact O-CG 3.33Å; R756-L760 PolarHBondContact O-N 2.93Å
757	K	77	Confident	74.3	Confident	122 Å²	122	50.9 Å²	50.9	53%	0.53	30%	0.295	S	S	.	.	H	α-helix	trans	-59.6	-53.2	174.6	-70.5	177.4	179.1	-176.2	0	110.8	S753 I754 W755 L759 L760 D761	S753-K757 WeakPolarHBondContact O-CG 3.42Å; S753-K757 PolarHBondContact O-N 3.32Å; S753-K757 VanDerWaalsContact O-N 3.13Å; I754-K757 PolarHBondContact O-N 2.88Å; W755-K757 PolarHBondContact O-N 2.83Å; K757-L759 PolarHBondContact O-N 3.47Å; K757-L760 PolarHBondContact O-N 3.22Å; K757-L760 VanDerWaalsContact O-N 3.12Å; K757-D761 WeakPolarHBondContact CA-OD2 3.34Å; K757-D761 WeakPolarHBondContact CB-OD2 3.27Å; K757-D761 VanDerWaalsContact O-CB 3.31Å; K757-D761 WeakPolarHBondContact O-CB 3.47Å; K757-D761 PolarHBondContact O-N 3.35Å
758	S	72.9	Confident	73.2	Confident	5 Å²	5	50 Å²	50	4%	0.035	29%	0.294	C	S	.	.	H	α-helix	trans	-55.9	-27.2	-175	-176.3	0	0	0	0	115.8	I754 W755 A768 S771 I772	I754-S758 VanDerWaalsContact O-CB 3.25Å; I754-S758 WeakPolarHBondContact O-CB 3.26Å; I754-S758 PolarHBondContact O-N 2.85Å; W755-S758 PolarHBondContact O-N 2.97Å; S758-A768 PolarHBondContact OG-O 3.03Å; S758-S771 VanDerWaalsContact CB-OG 3.32Å; S758-S771 WeakPolarHBondContact CB-OG 3.49Å; S758-S771 PolarHBondContact OG-OG 3.47Å; S758-I772 WeakPolarHBondContact OG-CG1 3.24Å
759	L	68.4	Low	72.3	Confident	51 Å²	51	53.1 Å²	53.1	27%	0.267	32%	0.316	S	S	.	.	H	α-helix	trans	-98.7	-24.5	179.8	-85.6	77.2	0	0	0	113.6	A686 I690 W755 K757 I772	A686-L759 HydrophobicContact CB-CD2 3.63Å; I690-L759 HydrophobicContact CD1-CD1 4.41Å; I690-L759 HydrophobicContact CD1-CD2 3.95Å; W755-L759 WeakPolarHBondContact O-CD1 3.37Å; W755-L759 PolarHBondContact O-N 3.42Å; W755-L759 VanDerWaalsContact O-N 3.15Å; K757-L759 PolarHBondContact O-N 3.47Å; L759-I772 HydrophobicContact CD1-CD1 4.02Å; L759-I772 HydrophobicContact CD1-CG1 4.13Å
760	L	64	Low	71.8	Confident	38 Å²	38	57.3 Å²	57.3	20%	0.199	34%	0.336	C	S	.	.	H	α-helix	trans	-89.3	-36	179.2	-65.5	176.6	0	0	0	112.6	H667 R670 R756 K757	H667-L760 VanDerWaalsContact ND1-CD2 3.35Å; H667-L760 WeakPolarHBondContact ND1-CD2 3.31Å; R670-L760 PolarHBondContact NH1-O 3.02Å; R756-L760 HydrophobicContact CG-CD1 3.82Å; R756-L760 WeakPolarHBondContact O-CB 3.24Å; R756-L760 WeakPolarHBondContact O-CD1 3.34Å; R756-L760 VanDerWaalsContact O-CG 3.22Å; R756-L760 WeakPolarHBondContact O-CG 3.33Å; R756-L760 PolarHBondContact O-N 2.93Å; K757-L760 PolarHBondContact O-N 3.22Å; K757-L760 VanDerWaalsContact O-N 3.12Å
761	D	60.4	Low	71.4	Confident	78 Å²	78	56.3 Å²	56.3	42%	0.417	33%	0.332	S	S	.	.	S	Bend	trans	-84.1	143.2	178.8	-59.5	-41.8	0	0	0	110	K757 H763	K757-D761 WeakPolarHBondContact CA-OD2 3.34Å; K757-D761 WeakPolarHBondContact CB-OD2 3.27Å; K757-D761 VanDerWaalsContact O-CB 3.31Å; K757-D761 WeakPolarHBondContact O-CB 3.47Å; K757-D761 PolarHBondContact O-N 3.35Å; D761-H763 PolarHBondContact O-CD2 3.44Å; D761-H763 PolarHBondContact O-N 2.92Å
762	G	54.9	Low	71.2	Confident	83 Å²	83	59.2 Å²	59.2	86%	0.856	35%	0.347	S	S	*	.			trans	-75	38.2	-166	0	0	0	0	0	116.3
763	H	57.5	Low	70.6	Confident	80 Å²	80	61.9 Å²	61.9	37%	0.37	37%	0.365	S	S	.	.			trans	-58.3	143.6	-175	-68	-83.7	0	0	0	113.4	D761 S767 A768	D761-H763 PolarHBondContact O-CD2 3.44Å; D761-H763 PolarHBondContact O-N 2.92Å; H763-S767 PolarHBondContact ND1-OG 3.46Å; H763-A768 HydrophobicContact CB-CB 3.98Å
764	T	58.4	Low	70.6	Confident	106 Å²	106	65.6 Å²	65.6	65%	0.65	38%	0.379	S	S	*	.			trans	-62.1	151.4	164.8	57.3	0	0	0	0	110	L766 S767 A768	T764-L766 PolarHBondContact O-N 3.07Å; T764-L766 VanDerWaalsContact O-N 3.1Å; T764-S767 PolarHBondContact O-N 3.38Å; T764-A768 PolarHBondContact O-N 3.46Å
765	A	58.9	Low	70.6	Confident	86 Å²	86	64.2 Å²	64.2	71%	0.711	37%	0.371	S	S	*	.	H	α-helix	trans	-55.8	-34.5	-171.9	0	0	0	0	0	114	S769	A765-S769 WeakPolarHBondContact O-CB 3.35Å; A765-S769 PolarHBondContact O-N 2.89Å
766	L	54.8	Low	70.8	Confident	145 Å²	145	66 Å²	66	76%	0.759	38%	0.383	S	S	*	.	H	α-helix	trans	-65.4	-51.4	173	-112.7	73.8	0	0	0	111.9	T764 A768 S769 E770	T764-L766 PolarHBondContact O-N 3.07Å; T764-L766 VanDerWaalsContact O-N 3.1Å; L766-A768 VanDerWaalsContact C-N 3.33Å; L766-A768 PolarHBondContact O-N 3.35Å; L766-S769 PolarHBondContact O-N 2.91Å; L766-S769 PolarHBondContact O-OG 3.31Å; L766-E770 PolarHBondContact O-N 3.01Å
767	S	67.1	Low	71	Confident	43 Å²	43	68.4 Å²	68.4	30%	0.301	40%	0.404	S	S	.	.	H	α-helix	trans	-61	-41.6	179.7	178.3	0	0	0	0	111.6	H763 T764 S769 E770 S771	H763-S767 PolarHBondContact ND1-OG 3.46Å; T764-S767 PolarHBondContact O-N 3.38Å; S767-S769 PolarHBondContact O-N 3.45Å; S767-E770 PolarHBondContact O-N 2.99Å; S767-S771 PolarHBondContact O-N 2.88Å; S767-S771 PolarHBondContact O-OG 2.96Å
768	A	65.1	Low	71.4	Confident	17 Å²	17	64.8 Å²	64.8	14%	0.14	39%	0.388	C	S	.	.	H	α-helix	trans	-61.2	-40	172.1	0	0	0	0	0	112.5	S758 H763 T764 L766 E770 S771 I772	S758-A768 PolarHBondContact OG-O 3.03Å; H763-A768 HydrophobicContact CB-CB 3.98Å; T764-A768 PolarHBondContact O-N 3.46Å; L766-A768 VanDerWaalsContact C-N 3.33Å; L766-A768 PolarHBondContact O-N 3.35Å; A768-E770 VanDerWaalsContact C-N 3.32Å; A768-E770 PolarHBondContact O-N 3.46Å; A768-S771 WeakPolarHBondContact CA-OG 3.42Å; A768-S771 PolarHBondContact O-OG 2.83Å; A768-I772 VanDerWaalsContact O-CB 3.3Å; A768-I772 WeakPolarHBondContact O-CB 3.42Å; A768-I772 WeakPolarHBondContact O-CD1 3.32Å; A768-I772 WeakPolarHBondContact O-CG1 3.48Å; A768-I772 PolarHBondContact O-N 3.33Å
769	S	73.2	Confident	72.2	Confident	66 Å²	66	65.8 Å²	65.8	46%	0.462	39%	0.392	S	S	.	.	H	α-helix	trans	-67.8	-32.1	176.5	76	0	0	0	0	112.7	A765 L766 S767 S773	A765-S769 WeakPolarHBondContact O-CB 3.35Å; A765-S769 PolarHBondContact O-N 2.89Å; L766-S769 PolarHBondContact O-N 2.91Å; L766-S769 PolarHBondContact O-OG 3.31Å; S767-S769 PolarHBondContact O-N 3.45Å; S769-S773 VanDerWaalsContact O-CB 3.32Å; S769-S773 WeakPolarHBondContact O-CB 3.33Å; S769-S773 PolarHBondContact O-N 3.35Å; S769-S773 PolarHBondContact O-OG 3.1Å
770	E	79.5	Confident	73.1	Confident	103 Å²	103	66.5 Å²	66.5	48%	0.481	40%	0.398	S	S	.	.	H	α-helix	trans	-72.5	-43.8	176.2	-161.9	-166.5	142.2	0	0	111.6	L766 S767 A768 S773 K774	L766-E770 PolarHBondContact O-N 3.01Å; S767-E770 PolarHBondContact O-N 2.99Å; A768-E770 VanDerWaalsContact C-N 3.32Å; A768-E770 PolarHBondContact O-N 3.46Å; E770-S773 WeakPolarHBondContact CA-OG 3.28Å; E770-S773 PolarHBondContact O-N 3.45Å; E770-S773 PolarHBondContact O-OG 3.05Å; E770-K774 HydrophobicContact CG-CD 4.38Å; E770-K774 WeakPolarHBondContact O-CB 3.24Å; E770-K774 VanDerWaalsContact O-CG 3.3Å; E770-K774 WeakPolarHBondContact O-CG 3.19Å; E770-K774 PolarHBondContact O-N 3.45Å; E770-K774 WeakPolarHBondContact OE1-CE 3.22Å; E770-K774 IonicContact OE1-NZ 2.8Å; E770-K774 PolarHBondContact OE1-NZ 3.33Å
771	S	79.6	Confident	74	Confident	21 Å²	21	65.8 Å²	65.8	15%	0.147	40%	0.398	C	S	.	.	H	α-helix	trans	-68.5	-40.4	174.6	46.6	0	0	0	0	112.1	I754 S758 S767 A768 S773 K774 G775	I754-S771 WeakPolarHBondContact CG2-O 3.28Å; S758-S771 VanDerWaalsContact CB-OG 3.32Å; S758-S771 WeakPolarHBondContact CB-OG 3.49Å; S758-S771 PolarHBondContact OG-OG 3.47Å; S767-S771 PolarHBondContact O-N 2.88Å; S767-S771 PolarHBondContact O-OG 2.96Å; A768-S771 WeakPolarHBondContact CA-OG 3.42Å; A768-S771 PolarHBondContact O-OG 2.83Å; S771-S773 PolarHBondContact O-N 2.71Å; S771-K774 PolarHBondContact O-N 3.31Å; S771-G775 PolarHBondContact O-N 2.83Å
772	I	81.6	Confident	75.3	Confident	62 Å²	62	62.1 Å²	62.1	32%	0.318	38%	0.378	S	S	.	.	H	α-helix	trans	-59.1	-46.4	171.8	-70.9	163.9	0	0	0	111.1	W755 S758 L759 A768 G775 N776	W755-I772 PolarHBondContact NE1-O 3.31Å; S758-I772 WeakPolarHBondContact OG-CG1 3.24Å; L759-I772 HydrophobicContact CD1-CD1 4.02Å; L759-I772 HydrophobicContact CD1-CG1 4.13Å; A768-I772 VanDerWaalsContact O-CB 3.3Å; A768-I772 WeakPolarHBondContact O-CB 3.42Å; A768-I772 WeakPolarHBondContact O-CD1 3.32Å; A768-I772 WeakPolarHBondContact O-CG1 3.48Å; A768-I772 PolarHBondContact O-N 3.33Å; I772-G775 CarbonylContact O-C 3.57Å; I772-G775 WeakPolarHBondContact O-CA 3.41Å; I772-G775 PolarHBondContact O-N 3.32Å; I772-N776 PolarHBondContact O-N 3.32Å; I772-N776 PolarHBondContact O-OD1 2.81Å; I772-N776 VanDerWaalsContact O-OD1 3.06Å
773	S	77.8	Confident	77	Confident	56 Å²	56	58.1 Å²	58.1	39%	0.392	34%	0.337	S	S	.	.	H	α-helix	trans	-68.3	-39.1	179.8	54.9	0	0	0	0	112.9	S769 E770 S771 G775 N776 V777	S769-S773 VanDerWaalsContact O-CB 3.32Å; S769-S773 WeakPolarHBondContact O-CB 3.33Å; S769-S773 PolarHBondContact O-N 3.35Å; S769-S773 PolarHBondContact O-OG 3.1Å; E770-S773 WeakPolarHBondContact CA-OG 3.28Å; E770-S773 PolarHBondContact O-N 3.45Å; E770-S773 PolarHBondContact O-OG 3.05Å; S771-S773 PolarHBondContact O-N 2.71Å; S773-G775 VanDerWaalsContact C-N 3.31Å; S773-G775 PolarHBondContact O-N 3.38Å; S773-N776 PolarHBondContact O-N 3.44Å; S773-V777 WeakPolarHBondContact O-CG2 3.24Å; S773-V777 PolarHBondContact O-N 3.33Å
774	K	82.9	Confident	78.4	Confident	102 Å²	102	57.5 Å²	57.5	44%	0.443	34%	0.336	S	S	.	.	H	α-helix	trans	-58.5	-42	168.4	-76.5	170.4	170.5	174	0	111.7	E770 S771 V777 K778	E770-K774 HydrophobicContact CG-CD 4.38Å; E770-K774 WeakPolarHBondContact O-CB 3.24Å; E770-K774 VanDerWaalsContact O-CG 3.3Å; E770-K774 WeakPolarHBondContact O-CG 3.19Å; E770-K774 PolarHBondContact O-N 3.45Å; E770-K774 WeakPolarHBondContact OE1-CE 3.22Å; E770-K774 IonicContact OE1-NZ 2.8Å; E770-K774 PolarHBondContact OE1-NZ 3.33Å; S771-K774 PolarHBondContact O-N 3.31Å; K774-V777 PolarHBondContact O-N 2.88Å; K774-K778 WeakPolarHBondContact O-CG 3.47Å; K774-K778 PolarHBondContact O-N 3.41Å; K774-K778 VanDerWaalsContact O-N 3.07Å
775	G	85.7	Confident	79.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-46.5	174	0	0	0	0	0	112.5	G751 S771 I772 S773 V777 K778 F779	G751-G775 WeakPolarHBondContact CA-O 3.45Å; S771-G775 PolarHBondContact O-N 2.83Å; I772-G775 CarbonylContact O-C 3.57Å; I772-G775 WeakPolarHBondContact O-CA 3.41Å; I772-G775 PolarHBondContact O-N 3.32Å; S773-G775 VanDerWaalsContact C-N 3.31Å; S773-G775 PolarHBondContact O-N 3.38Å; G775-V777 PolarHBondContact O-N 3.33Å; G775-K778 PolarHBondContact O-N 2.91Å; G775-F779 WeakPolarHBondContact O-CB 3.37Å; G775-F779 PolarHBondContact O-N 2.99Å
776	N	86.9	Confident	81.1	Confident	73 Å²	73	50.6 Å²	50.6	39%	0.39	28%	0.283	S	S	.	.	H	α-helix	trans	-60.5	-43.6	177.1	-66.8	-0.5	0	0	0	111.7	W755 I772 S773 F779 V780	W755-N776 VanDerWaalsContact CE2-OD1 3.3Å; W755-N776 WeakPolarHBondContact CZ2-OD1 3.25Å; W755-N776 PolarHBondContact NE1-OD1 3.01Å; I772-N776 PolarHBondContact O-N 3.32Å; I772-N776 PolarHBondContact O-OD1 2.81Å; I772-N776 VanDerWaalsContact O-OD1 3.06Å; S773-N776 PolarHBondContact O-N 3.44Å; N776-F779 PolarHBondContact O-N 3.1Å; N776-V780 WeakPolarHBondContact O-CB 3.46Å; N776-V780 WeakPolarHBondContact O-CG2 3.22Å; N776-V780 PolarHBondContact O-N 3.27Å
777	V	84.6	Confident	82.8	Confident	100 Å²	100	43.7 Å²	43.7	61%	0.606	25%	0.247	S	C	*	.	H	α-helix	trans	-63.4	-46.2	177.7	170.5	0	0	0	0	110.8	S773 K774 G775 F779 A781	S773-V777 WeakPolarHBondContact O-CG2 3.24Å; S773-V777 PolarHBondContact O-N 3.33Å; K774-V777 PolarHBondContact O-N 2.88Å; G775-V777 PolarHBondContact O-N 3.33Å; V777-F779 PolarHBondContact O-N 2.91Å; V777-A781 WeakPolarHBondContact O-CB 3.3Å; V777-A781 PolarHBondContact O-N 2.95Å
778	K	85.7	Confident	83.7	Confident	46 Å²	46	42.2 Å²	42.2	20%	0.2	24%	0.235	C	C	.	.	H	α-helix	trans	-65.1	-37.5	176.2	-67.4	-167	-166	-175.2	0	112.4	F747 N750 I754 K774 G775 G782	F747-K778 CarbonylContact C-O 3.58Å; F747-K778 HydrophobicContact CD1-CB 4.29Å; F747-K778 HydrophobicContact CD1-CD 4.46Å; F747-K778 HydrophobicContact CD1-CG 4.21Å; N750-K778 HydrophobicContact CB-CD 4.12Å; N750-K778 VanDerWaalsContact OD1-CD 3.25Å; N750-K778 WeakPolarHBondContact OD1-CD 3.19Å; N750-K778 PolarHBondContact OD1-NZ 3.04Å; I754-K778 HydrophobicContact CD1-CD 3.83Å; K774-K778 WeakPolarHBondContact O-CG 3.47Å; K774-K778 PolarHBondContact O-N 3.41Å; K774-K778 VanDerWaalsContact O-N 3.07Å; G775-K778 PolarHBondContact O-N 2.91Å; K778-G782 PolarHBondContact O-N 2.91Å
779	F	89.5	Confident	84.7	Confident	26 Å²	26	42.5 Å²	42.5	11%	0.114	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-53.5	174.8	-176.4	-90	0	0	0	111.8	M700 V748 I752 W755 G775 N776 V777 G782 V783	M700-F779 HydrophobicContact CG-CE2 4.06Å; M700-F779 HydrophobicContact CG-CZ 4.34Å; V748-F779 HydrophobicContact CG1-CD2 3.79Å; V748-F779 HydrophobicContact CG1-CE2 3.81Å; I752-F779 HydrophobicContact CD1-CD2 4.42Å; I752-F779 HydrophobicContact CD1-CE2 4.29Å; I752-F779 HydrophobicContact CG1-CD2 4.03Å; I752-F779 HydrophobicContact CG1-CE2 4.3Å; W755-F779 HydrophobicContact CH2-CB 3.89Å; W755-F779 HydrophobicContact CH2-CD1 4.04Å; W755-F779 AromaticContact CH2-CD2 3.46Å; W755-F779 HydrophobicContact CH2-CD2 3.46Å; W755-F779 VanDerWaalsContact CH2-CD2 3.46Å; W755-F779 HydrophobicContact CH2-CE1 4.47Å; W755-F779 AromaticContact CH2-CE2 3.97Å; W755-F779 HydrophobicContact CH2-CE2 3.97Å; W755-F779 AromaticContact CH2-CG 3.51Å; W755-F779 HydrophobicContact CH2-CG 3.51Å; W755-F779 HydrophobicContact CH2-CZ 4.45Å; W755-F779 HydrophobicContact CZ2-CB 3.84Å; W755-F779 HydrophobicContact CZ2-CD2 4.28Å; W755-F779 AromaticContact CZ2-CG 3.98Å; W755-F779 HydrophobicContact CZ2-CG 3.98Å; W755-F779 AromaticContact CZ3-CD2 3.88Å; W755-F779 HydrophobicContact CZ3-CD2 3.88Å; W755-F779 HydrophobicContact CZ3-CE2 4.2Å; W755-F779 HydrophobicContact CZ3-CG 4.38Å; G775-F779 WeakPolarHBondContact O-CB 3.37Å; G775-F779 PolarHBondContact O-N 2.99Å; N776-F779 PolarHBondContact O-N 3.1Å; V777-F779 PolarHBondContact O-N 2.91Å; F779-G782 PolarHBondContact O-N 2.99Å; F779-V783 HydrophobicContact CD1-CG2 4.27Å; F779-V783 HydrophobicContact CE1-CG2 3.93Å; F779-V783 HydrophobicContact CZ-CG2 4.13Å; F779-V783 WeakPolarHBondContact O-CG2 3.48Å; F779-V783 PolarHBondContact O-N 2.89Å
780	V	86.8	Confident	85.3	Confident	66 Å²	66	45 Å²	45	40%	0.4	23%	0.234	S	C	.	.	H	α-helix	trans	-64.2	-43.8	-179	171	0	0	0	0	111.5	M708 N776 G782 V783 L784	M708-V780 HydrophobicContact CE-CB 4.45Å; M708-V780 HydrophobicContact CE-CG1 4.01Å; M708-V780 HydrophobicContact CE-CG2 4.36Å; N776-V780 WeakPolarHBondContact O-CB 3.46Å; N776-V780 WeakPolarHBondContact O-CG2 3.22Å; N776-V780 PolarHBondContact O-N 3.27Å; V780-G782 VanDerWaalsContact C-N 3.34Å; V780-G782 PolarHBondContact O-N 3.24Å; V780-V783 PolarHBondContact O-N 3.09Å; V780-L784 HydrophobicContact CG1-CD1 4Å; V780-L784 WeakPolarHBondContact O-CB 3.32Å; V780-L784 VanDerWaalsContact O-CG 3.32Å; V780-L784 WeakPolarHBondContact O-CG 3.08Å; V780-L784 PolarHBondContact O-N 3.44Å
781	A	83	Confident	85.5	Confident	23 Å²	23	41.8 Å²	41.8	19%	0.19	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-39.6	175.5	0	0	0	0	0	112	V777 L784 L785	V777-A781 WeakPolarHBondContact O-CB 3.3Å; V777-A781 PolarHBondContact O-N 2.95Å; A781-L784 PolarHBondContact O-N 2.89Å; A781-L785 WeakPolarHBondContact O-CB 3.43Å; A781-L785 WeakPolarHBondContact O-CG 3.41Å; A781-L785 PolarHBondContact O-N 3.13Å
782	G	88.2	Confident	85.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.5	-43.5	176.8	0	0	0	0	0	113.2	G744 K778 F779 V780 L785 V786	G744-G782 CarbonylContact C-O 3.58Å; G744-G782 WeakPolarHBondContact CA-O 3.49Å; G744-G782 VanDerWaalsContact O-CA 3.26Å; G744-G782 WeakPolarHBondContact O-CA 3.32Å; K778-G782 PolarHBondContact O-N 2.91Å; F779-G782 PolarHBondContact O-N 2.99Å; V780-G782 VanDerWaalsContact C-N 3.34Å; V780-G782 PolarHBondContact O-N 3.24Å; G782-L785 PolarHBondContact O-N 3.01Å; G782-V786 WeakPolarHBondContact O-CG2 3.25Å; G782-V786 PolarHBondContact O-N 3.22Å
783	V	89.6	Confident	85.6	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-47.9	173.2	171.8	0	0	0	0	110.4	M708 V748 F779 V780 L785 V786 F787	M708-V783 HydrophobicContact CE-CB 4.03Å; M708-V783 HydrophobicContact CE-CG1 3.73Å; M708-V783 HydrophobicContact SD-CG1 3.8Å; V748-V783 HydrophobicContact CG2-CG2 3.94Å; F779-V783 HydrophobicContact CD1-CG2 4.27Å; F779-V783 HydrophobicContact CE1-CG2 3.93Å; F779-V783 HydrophobicContact CZ-CG2 4.13Å; F779-V783 WeakPolarHBondContact O-CG2 3.48Å; F779-V783 PolarHBondContact O-N 2.89Å; V780-V783 PolarHBondContact O-N 3.09Å; V783-L785 PolarHBondContact O-N 2.87Å; V783-V786 PolarHBondContact O-N 3.47Å; V783-V786 VanDerWaalsContact O-N 3.16Å; V783-F787 HydrophobicContact CG1-CD2 3.81Å; V783-F787 HydrophobicContact CG1-CE2 4.06Å; V783-F787 VanDerWaalsContact O-CD2 3.29Å; V783-F787 WeakPolarHBondContact O-CD2 3.5Å; V783-F787 PolarHBondContact O-N 3.38Å
784	L	86.7	Confident	85.7	Confident	66 Å²	66	42.3 Å²	42.3	35%	0.346	23%	0.225	S	C	.	.	H	α-helix	trans	-62.2	-29.8	177.1	-70.1	169.5	0	0	0	113.2	M708 F710 V780 A781 F787 N788 V791	M708-L784 HydrophobicContact SD-CD2 3.8Å; M708-L784 HydrophobicContact SD-CG 4.11Å; F710-L784 HydrophobicContact CE2-CD2 4.2Å; V780-L784 HydrophobicContact CG1-CD1 4Å; V780-L784 WeakPolarHBondContact O-CB 3.32Å; V780-L784 VanDerWaalsContact O-CG 3.32Å; V780-L784 WeakPolarHBondContact O-CG 3.08Å; V780-L784 PolarHBondContact O-N 3.44Å; A781-L784 PolarHBondContact O-N 2.89Å; L784-F787 CarbonylContact O-C 3.58Å; L784-N788 WeakPolarHBondContact O-CA 3.39Å; L784-N788 PolarHBondContact O-N 3.27Å; L784-V791 HydrophobicContact CB-CG2 4.37Å; L784-V791 HydrophobicContact CD2-CG2 3.63Å
785	L	86.4	Confident	85.3	Confident	47 Å²	47	40.6 Å²	40.6	25%	0.246	22%	0.223	C	C	.	.	H	α-helix	trans	-75.5	-35.7	173.6	-80.9	169.8	0	0	0	113.2	A740 K741 G744 F747 A781 G782 V783 N788	A740-L785 HydrophobicContact CB-CD2 4.48Å; K741-L785 WeakPolarHBondContact CA-O 3.24Å; G744-L785 VanDerWaalsContact CA-CB 3.48Å; F747-L785 HydrophobicContact CD2-CD1 3.79Å; F747-L785 HydrophobicContact CE2-CD1 4.18Å; A781-L785 WeakPolarHBondContact O-CB 3.43Å; A781-L785 WeakPolarHBondContact O-CG 3.41Å; A781-L785 PolarHBondContact O-N 3.13Å; G782-L785 PolarHBondContact O-N 3.01Å; V783-L785 PolarHBondContact O-N 2.87Å; L785-N788 VanDerWaalsContact O-CB 3.24Å; L785-N788 WeakPolarHBondContact O-CB 3.31Å; L785-N788 PolarHBondContact O-N 3.41Å; L785-N788 PolarHBondContact O-ND2 3.17Å
786	V	89.3	Confident	84.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-45.3	172.7	169.9	0	0	0	0	111	I701 F715 K741 V745 G782 V783 N788	I701-V786 HydrophobicContact CD1-CG2 4.45Å; I701-V786 HydrophobicContact CG2-CB 4.06Å; I701-V786 HydrophobicContact CG2-CG1 3.81Å; I701-V786 HydrophobicContact CG2-CG2 4.11Å; F715-V786 HydrophobicContact CD1-CG1 4.22Å; F715-V786 HydrophobicContact CE1-CG1 3.82Å; K741-V786 WeakPolarHBondContact CE-O 3.3Å; K741-V786 HydrophobicContact CG-CG1 4.28Å; V745-V786 HydrophobicContact CG2-CG2 3.8Å; G782-V786 WeakPolarHBondContact O-CG2 3.25Å; G782-V786 PolarHBondContact O-N 3.22Å; V783-V786 PolarHBondContact O-N 3.47Å; V783-V786 VanDerWaalsContact O-N 3.16Å; V786-N788 PolarHBondContact O-N 3.2Å
787	F	89.2	Confident	84.3	Confident	1 Å²	1	43.9 Å²	43.9	0%	0.004	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	24.2	178.1	-66.3	-76.6	0	0	0	112.8	I701 N702 F710 R711 D713 V783 L784 D789 R790 V791	I701-F787 HydrophobicContact CG2-CE2 3.94Å; N702-F787 WeakPolarHBondContact OD1-CZ 3.38Å; F710-F787 HydrophobicContact CB-CD1 3.88Å; F710-F787 HydrophobicContact CB-CE1 4.22Å; F710-F787 HydrophobicContact CB-CG 4.17Å; F710-F787 HydrophobicContact CD2-CB 3.91Å; F710-F787 HydrophobicContact CD2-CD2 4.32Å; F710-F787 HydrophobicContact CD2-CG 4.01Å; F710-F787 HydrophobicContact CE2-CB 4.29Å; F710-F787 HydrophobicContact CG-CB 4.22Å; F710-F787 HydrophobicContact CG-CD1 4.36Å; F710-F787 HydrophobicContact CG-CG 4.24Å; R711-F787 VanDerWaalsContact O-CE1 3.29Å; R711-F787 WeakPolarHBondContact O-CE1 3.26Å; D713-F787 HydrophobicContact CB-CD1 4.42Å; D713-F787 HydrophobicContact CB-CE1 3.73Å; D713-F787 HydrophobicContact CB-CZ 4.3Å; V783-F787 HydrophobicContact CG1-CD2 3.81Å; V783-F787 HydrophobicContact CG1-CE2 4.06Å; V783-F787 VanDerWaalsContact O-CD2 3.29Å; V783-F787 WeakPolarHBondContact O-CD2 3.5Å; V783-F787 PolarHBondContact O-N 3.38Å; L784-F787 CarbonylContact O-C 3.58Å; F787-D789 VanDerWaalsContact C-N 3.31Å; F787-D789 PolarHBondContact O-N 3.45Å; F787-R790 HydrophobicContact CB-CB 4.43Å; F787-R790 HydrophobicContact CD1-CG 4.45Å; F787-R790 CarbonylContact O-C 3.58Å; F787-R790 WeakPolarHBondContact O-CA 3.37Å; F787-R790 WeakPolarHBondContact O-CB 3.16Å; F787-R790 PolarHBondContact O-N 2.83Å; F787-V791 WeakPolarHBondContact O-CG2 3.43Å; F787-V791 PolarHBondContact O-N 2.67Å
788	N	86.9	Confident	83.7	Confident	12 Å²	12	41.5 Å²	41.5	6%	0.064	24%	0.237	C	C	.	.	H	α-helix	trans	-54.2	-40.4	-172.8	59.1	4.8	0	0	0	114.1	I718 L737 A740 L784 L785 V786 R790 V791 I792	I718-N788 WeakPolarHBondContact CD1-OD1 3.4Å; L737-N788 PolarHBondContact O-ND2 2.97Å; A740-N788 WeakPolarHBondContact CB-ND2 3.34Å; L784-N788 WeakPolarHBondContact O-CA 3.39Å; L784-N788 PolarHBondContact O-N 3.27Å; L785-N788 VanDerWaalsContact O-CB 3.24Å; L785-N788 WeakPolarHBondContact O-CB 3.31Å; L785-N788 PolarHBondContact O-N 3.41Å; L785-N788 PolarHBondContact O-ND2 3.17Å; V786-N788 PolarHBondContact O-N 3.2Å; N788-R790 PolarHBondContact O-N 3.46Å; N788-V791 PolarHBondContact O-N 2.75Å; N788-I792 WeakPolarHBondContact O-CB 3.37Å; N788-I792 WeakPolarHBondContact O-CD1 3.44Å; N788-I792 WeakPolarHBondContact O-CG1 3.18Å; N788-I792 PolarHBondContact O-N 2.9Å
789	D	85.4	Confident	82.9	Confident	23 Å²	23	42.2 Å²	42.2	12%	0.123	24%	0.242	C	C	.	.	H	α-helix	trans	-49.2	-55.1	169	176	-62.5	0	0	0	111.3	I718 Y720 F787 V791 I792 D793	I718-D789 HydrophobicContact CG2-CB 4.2Å; Y720-D789 HydrophobicContact CD2-CB 4.46Å; Y720-D789 WeakPolarHBondContact CD2-OD2 3.48Å; F787-D789 VanDerWaalsContact C-N 3.31Å; F787-D789 PolarHBondContact O-N 3.45Å; D789-V791 PolarHBondContact O-N 2.92Å; D789-I792 PolarHBondContact O-N 2.99Å; D789-D793 PolarHBondContact O-N 3.3Å
790	R	86.1	Confident	82.1	Confident	117 Å²	117	43 Å²	43	44%	0.442	26%	0.258	S	S	.	.	H	α-helix	trans	-69.8	-31.8	179.9	-52.1	-53.8	-176	-154.2	7	113.1	F710 F787 N788 A794	F710-R790 HydrophobicContact CD1-CB 3.45Å; F710-R790 VanDerWaalsContact CD1-CB 3.45Å; F710-R790 HydrophobicContact CD1-CG 4.33Å; F710-R790 HydrophobicContact CE1-CB 3.75Å; F710-R790 HydrophobicContact CG-CB 4.18Å; F787-R790 HydrophobicContact CB-CB 4.43Å; F787-R790 HydrophobicContact CD1-CG 4.45Å; F787-R790 CarbonylContact O-C 3.58Å; F787-R790 WeakPolarHBondContact O-CA 3.37Å; F787-R790 WeakPolarHBondContact O-CB 3.16Å; F787-R790 PolarHBondContact O-N 2.83Å; N788-R790 PolarHBondContact O-N 3.46Å; R790-A794 VanDerWaalsContact O-CB 3.23Å; R790-A794 WeakPolarHBondContact O-CB 3.29Å; R790-A794 PolarHBondContact O-N 2.86Å
791	V	84.2	Confident	81.5	Confident	37 Å²	37	42.3 Å²	42.3	22%	0.224	25%	0.252	C	S	.	.	H	α-helix	trans	-69.9	-39.6	174.2	173	0	0	0	0	110.3	F710 L784 F787 N788 D789 T795	F710-V791 HydrophobicContact CE1-CG2 4.38Å; F710-V791 HydrophobicContact CE2-CG2 3.97Å; F710-V791 HydrophobicContact CZ-CG2 3.6Å; L784-V791 HydrophobicContact CB-CG2 4.37Å; L784-V791 HydrophobicContact CD2-CG2 3.63Å; F787-V791 WeakPolarHBondContact O-CG2 3.43Å; F787-V791 PolarHBondContact O-N 2.67Å; N788-V791 PolarHBondContact O-N 2.75Å; D789-V791 PolarHBondContact O-N 2.92Å; V791-T795 WeakPolarHBondContact O-CB 3.04Å; V791-T795 PolarHBondContact O-N 3.43Å; V791-T795 PolarHBondContact O-OG1 2.83Å
792	I	80.7	Confident	80.6	Confident	34 Å²	34	43.7 Å²	43.7	17%	0.174	26%	0.258	C	S	.	.	H	α-helix	trans	-64.1	-48.5	173.6	-69.3	161.4	0	0	0	109.3	I5 Y720 L737 N788 D789 A794 T795 L796	I5-I792 HydrophobicContact CD1-CD1 4.27Å; I5-I792 HydrophobicContact CD1-CG1 4.28Å; Y720-I792 HydrophobicContact CE1-CG2 4.02Å; Y720-I792 WeakPolarHBondContact OH-CG2 3.47Å; L737-I792 HydrophobicContact CD2-CD1 3.61Å; N788-I792 WeakPolarHBondContact O-CB 3.37Å; N788-I792 WeakPolarHBondContact O-CD1 3.44Å; N788-I792 WeakPolarHBondContact O-CG1 3.18Å; N788-I792 PolarHBondContact O-N 2.9Å; D789-I792 PolarHBondContact O-N 2.99Å; I792-A794 PolarHBondContact O-N 3.1Å; I792-T795 CarbonylContact O-C 3.57Å; I792-T795 PolarHBondContact O-N 3.01Å; I792-L796 HydrophobicContact CG2-CD1 3.75Å; I792-L796 HydrophobicContact CG2-CG 4.18Å; I792-L796 WeakPolarHBondContact O-CB 3.19Å; I792-L796 VanDerWaalsContact O-CG 3.3Å; I792-L796 WeakPolarHBondContact O-CG 3.38Å; I792-L796 PolarHBondContact O-N 3.46Å
793	D	82.1	Confident	79.1	Confident	67 Å²	67	48.6 Å²	48.6	36%	0.358	28%	0.282	S	S	.	.	H	α-helix	trans	-60.2	-46.4	176.5	-84.2	-4.4	0	0	0	112.8	Y720 D789 T795 L796 A797	Y720-D793 VanDerWaalsContact CE2-OD1 3.23Å; Y720-D793 WeakPolarHBondContact CE2-OD1 3.26Å; Y720-D793 PolarHBondContact OH-OD1 3.25Å; D789-D793 PolarHBondContact O-N 3.3Å; D793-T795 VanDerWaalsContact C-N 3.29Å; D793-T795 PolarHBondContact O-N 3.31Å; D793-L796 PolarHBondContact O-N 2.95Å; D793-A797 VanDerWaalsContact O-CB 3.26Å; D793-A797 WeakPolarHBondContact O-CB 3.49Å; D793-A797 PolarHBondContact O-N 3.43Å
794	A	78.9	Confident	78.1	Confident	49 Å²	49	51.4 Å²	51.4	41%	0.405	30%	0.302	S	S	.	.	H	α-helix	trans	-64.6	-33.6	176.6	0	0	0	0	0	112.5	F710 R790 I792 S798	F710-A794 HydrophobicContact CE1-CB 4.46Å; R790-A794 VanDerWaalsContact O-CB 3.23Å; R790-A794 WeakPolarHBondContact O-CB 3.29Å; R790-A794 PolarHBondContact O-N 2.86Å; I792-A794 PolarHBondContact O-N 3.1Å; A794-S798 PolarHBondContact O-N 3Å; A794-S798 PolarHBondContact O-OG 2.88Å
795	T	75.1	Confident	76.6	Confident	65 Å²	65	52.1 Å²	52.1	40%	0.399	30%	0.3	S	S	.	.	H	α-helix	trans	-73.4	-42	175.7	-59.4	0	0	0	0	111.1	V791 I792 D793 A797 S798 L799	V791-T795 WeakPolarHBondContact O-CB 3.04Å; V791-T795 PolarHBondContact O-N 3.43Å; V791-T795 PolarHBondContact O-OG1 2.83Å; I792-T795 CarbonylContact O-C 3.57Å; I792-T795 PolarHBondContact O-N 3.01Å; D793-T795 VanDerWaalsContact C-N 3.29Å; D793-T795 PolarHBondContact O-N 3.31Å; T795-A797 VanDerWaalsContact C-N 3.35Å; T795-S798 PolarHBondContact O-N 3.12Å; T795-S798 PolarHBondContact O-OG 3.24Å; T795-S798 VanDerWaalsContact O-OG 3.06Å; T795-L799 HydrophobicContact CG2-CD1 3.75Å; T795-L799 HydrophobicContact CG2-CG 4.43Å; T795-L799 VanDerWaalsContact O-CB 3.28Å; T795-L799 WeakPolarHBondContact O-CB 3.41Å; T795-L799 WeakPolarHBondContact O-CD1 3.44Å; T795-L799 WeakPolarHBondContact O-CG 3.48Å; T795-L799 PolarHBondContact O-N 3.24Å
796	L	74.6	Confident	75.1	Confident	80 Å²	80	54.8 Å²	54.8	42%	0.419	31%	0.314	S	S	.	.	H	α-helix	trans	-67.1	-35.3	174.4	-72.3	176	0	0	0	111.8	I792 D793 G800	I792-L796 HydrophobicContact CG2-CD1 3.75Å; I792-L796 HydrophobicContact CG2-CG 4.18Å; I792-L796 WeakPolarHBondContact O-CB 3.19Å; I792-L796 VanDerWaalsContact O-CG 3.3Å; I792-L796 WeakPolarHBondContact O-CG 3.38Å; I792-L796 PolarHBondContact O-N 3.46Å; D793-L796 PolarHBondContact O-N 2.95Å; L796-G800 WeakPolarHBondContact O-CA 3.29Å; L796-G800 PolarHBondContact O-N 3.01Å
797	A	76.6	Confident	73.8	Confident	62 Å²	62	63.6 Å²	63.6	51%	0.512	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-47.9	172.1	0	0	0	0	0	111.1	D793 T795 L799 G800 D801	D793-A797 VanDerWaalsContact O-CB 3.26Å; D793-A797 WeakPolarHBondContact O-CB 3.49Å; D793-A797 PolarHBondContact O-N 3.43Å; T795-A797 VanDerWaalsContact C-N 3.35Å; A797-L799 PolarHBondContact O-N 3.46Å; A797-G800 PolarHBondContact O-N 3.31Å; A797-D801 WeakPolarHBondContact O-CB 3.24Å; A797-D801 PolarHBondContact O-N 2.85Å
798	S	72.9	Confident	72.5	Confident	50 Å²	50	65.9 Å²	65.9	35%	0.35	37%	0.366	S	S	.	.	H	α-helix	trans	-67.6	-34	178.2	68.6	0	0	0	0	112.9	A794 T795 T802	A794-S798 PolarHBondContact O-N 3Å; A794-S798 PolarHBondContact O-OG 2.88Å; T795-S798 PolarHBondContact O-N 3.12Å; T795-S798 PolarHBondContact O-OG 3.24Å; T795-S798 VanDerWaalsContact O-OG 3.06Å; S798-T802 WeakPolarHBondContact O-CB 3.45Å; S798-T802 VanDerWaalsContact O-CG2 3.3Å; S798-T802 WeakPolarHBondContact O-CG2 3.37Å; S798-T802 PolarHBondContact O-N 2.79Å; S798-T802 PolarHBondContact O-OG1 3.2Å
799	L	69.6	Low	71	Confident	61 Å²	61	70.7 Å²	70.7	32%	0.319	39%	0.39	S	S	.	.	H	α-helix	trans	-71.9	-39.9	172.9	-72.8	165.6	0	0	0	112.7	M1 T795 A797 T802 M803	M1-L799 HydrophobicContact CE-CD1 3.68Å; M1-L799 HydrophobicContact SD-CD1 4.03Å; T795-L799 HydrophobicContact CG2-CD1 3.75Å; T795-L799 HydrophobicContact CG2-CG 4.43Å; T795-L799 VanDerWaalsContact O-CB 3.28Å; T795-L799 WeakPolarHBondContact O-CB 3.41Å; T795-L799 WeakPolarHBondContact O-CD1 3.44Å; T795-L799 WeakPolarHBondContact O-CG 3.48Å; T795-L799 PolarHBondContact O-N 3.24Å; A797-L799 PolarHBondContact O-N 3.46Å; L799-T802 WeakPolarHBondContact CA-OG1 3.3Å; L799-T802 PolarHBondContact O-OG1 2.88Å; L799-M803 VanDerWaalsContact O-CB 3.22Å; L799-M803 WeakPolarHBondContact O-CB 3.46Å; L799-M803 WeakPolarHBondContact O-CG 3.35Å; L799-M803 PolarHBondContact O-N 2.84Å
800	G	72.3	Confident	69.5	Low	42 Å²	42	72 Å²	72	43%	0.433	40%	0.404	S	S	.	.	H	α-helix	trans	-67	-42.5	176.7	0	0	0	0	0	111.9	L796 A797 M803 S804	L796-G800 WeakPolarHBondContact O-CA 3.29Å; L796-G800 PolarHBondContact O-N 3.01Å; A797-G800 PolarHBondContact O-N 3.31Å; G800-M803 PolarHBondContact O-N 2.91Å; G800-S804 WeakPolarHBondContact O-CB 3.42Å; G800-S804 PolarHBondContact O-N 3.2Å; G800-S804 PolarHBondContact O-OG 3.46Å
801	D	73.5	Confident	68.5	Low	52 Å²	52	69.3 Å²	69.3	28%	0.278	41%	0.406	S	S	.	.	H	α-helix	trans	-71	-38.6	176.5	-171.4	32.5	0	0	0	112	A797 S804 R805	A797-D801 WeakPolarHBondContact O-CB 3.24Å; A797-D801 PolarHBondContact O-N 2.85Å; D801-S804 PolarHBondContact O-OG 3.27Å; D801-R805 WeakPolarHBondContact O-CB 3.35Å; D801-R805 WeakPolarHBondContact O-CD 3.23Å; D801-R805 WeakPolarHBondContact O-CG 3.23Å; D801-R805 PolarHBondContact O-N 3.5Å; D801-R805 IonicContact OD1-CZ 2.62Å; D801-R805 IonicContact OD1-NE 3.95Å; D801-R805 PolarHBondContact OD1-NE 2.75Å; D801-R805 IonicContact OD1-NH2 2.65Å; D801-R805 PolarHBondContact OD1-NH2 3.06Å; D801-R805 IonicContact OD2-CZ 3.87Å; D801-R805 IonicContact OD2-NE 3.2Å; D801-R805 PolarHBondContact OD2-NE 2.93Å; D801-R805 IonicContact OD2-NH1 2.74Å; D801-R805 IonicContact OD2-NH2 3.36Å; D801-R805 PolarHBondContact OD2-NH2 3.25Å
802	T	65.4	Low	67.5	Low	53 Å²	53	76.9 Å²	76.9	33%	0.325	43%	0.431	S	S	.	.	H	α-helix	trans	-67.9	-37.2	170.5	48.8	0	0	0	0	112.5	S798 L799 L806	S798-T802 WeakPolarHBondContact O-CB 3.45Å; S798-T802 VanDerWaalsContact O-CG2 3.3Å; S798-T802 WeakPolarHBondContact O-CG2 3.37Å; S798-T802 PolarHBondContact O-N 2.79Å; S798-T802 PolarHBondContact O-OG1 3.2Å; L799-T802 WeakPolarHBondContact CA-OG1 3.3Å; L799-T802 PolarHBondContact O-OG1 2.88Å; T802-L806 VanDerWaalsContact O-CB 3.24Å; T802-L806 WeakPolarHBondContact O-CB 3.13Å; T802-L806 WeakPolarHBondContact O-CD1 3.32Å; T802-L806 VanDerWaalsContact O-CG 3.24Å; T802-L806 WeakPolarHBondContact O-CG 3.33Å; T802-L806 PolarHBondContact O-N 3.31Å
803	M	56.1	Low	66.5	Low	102 Å²	102	80.5 Å²	80.5	50%	0.502	45%	0.45	S	S	.	.	H	α-helix	trans	-70.6	-35.2	175.1	-74.8	-75.4	-84.9	0	0	113	L799 G800 L806 R807	L799-M803 VanDerWaalsContact O-CB 3.22Å; L799-M803 WeakPolarHBondContact O-CB 3.46Å; L799-M803 WeakPolarHBondContact O-CG 3.35Å; L799-M803 PolarHBondContact O-N 2.84Å; G800-M803 PolarHBondContact O-N 2.91Å; M803-L806 HydrophobicContact SD-CD1 4.45Å; M803-R807 WeakPolarHBondContact O-CG 3.46Å; M803-R807 PolarHBondContact O-N 3.39Å
804	S	69	Low	65.2	Low	60 Å²	60	86.6 Å²	86.6	42%	0.42	47%	0.468	S	S	.	.	H	α-helix	trans	-70.1	-43.7	173.6	76	0	0	0	0	110.8	G800 D801 L806 R807 A808	G800-S804 WeakPolarHBondContact O-CB 3.42Å; G800-S804 PolarHBondContact O-N 3.2Å; G800-S804 PolarHBondContact O-OG 3.46Å; D801-S804 PolarHBondContact O-OG 3.27Å; S804-L806 VanDerWaalsContact C-N 3.34Å; S804-L806 PolarHBondContact O-N 3.37Å; S804-R807 PolarHBondContact O-N 3.49Å; S804-A808 WeakPolarHBondContact O-CB 3.3Å; S804-A808 PolarHBondContact O-N 2.88Å
805	R	55	Low	64.4	Low	81 Å²	81	86.5 Å²	86.5	31%	0.306	47%	0.467	S	S	.	.	H	α-helix	trans	-62.9	-36.9	172.9	-70.4	169.8	-165.7	-147.9	0.1	112	L461 D801 A808 M809	L461-R805 PolarHBondContact O-NH1 2.63Å; D801-R805 WeakPolarHBondContact O-CB 3.35Å; D801-R805 WeakPolarHBondContact O-CD 3.23Å; D801-R805 WeakPolarHBondContact O-CG 3.23Å; D801-R805 PolarHBondContact O-N 3.5Å; D801-R805 IonicContact OD1-CZ 2.62Å; D801-R805 IonicContact OD1-NE 3.95Å; D801-R805 PolarHBondContact OD1-NE 2.75Å; D801-R805 IonicContact OD1-NH2 2.65Å; D801-R805 PolarHBondContact OD1-NH2 3.06Å; D801-R805 IonicContact OD2-CZ 3.87Å; D801-R805 IonicContact OD2-NE 3.2Å; D801-R805 PolarHBondContact OD2-NE 2.93Å; D801-R805 IonicContact OD2-NH1 2.74Å; D801-R805 IonicContact OD2-NH2 3.36Å; D801-R805 PolarHBondContact OD2-NH2 3.25Å; R805-A808 PolarHBondContact O-N 2.71Å; R805-M809 WeakPolarHBondContact O-CB 3.19Å; R805-M809 PolarHBondContact O-N 3.15Å
806	L	55.2	Low	63.4	Low	103 Å²	103	85.9 Å²	85.9	54%	0.539	47%	0.469	S	S	.	.	H	α-helix	trans	-66	-42.4	172.8	-83.2	164.9	0	0	0	112	T802 M803 S804 M809 A810	T802-L806 VanDerWaalsContact O-CB 3.24Å; T802-L806 WeakPolarHBondContact O-CB 3.13Å; T802-L806 WeakPolarHBondContact O-CD1 3.32Å; T802-L806 VanDerWaalsContact O-CG 3.24Å; T802-L806 WeakPolarHBondContact O-CG 3.33Å; T802-L806 PolarHBondContact O-N 3.31Å; M803-L806 HydrophobicContact SD-CD1 4.45Å; S804-L806 VanDerWaalsContact C-N 3.34Å; S804-L806 PolarHBondContact O-N 3.37Å; L806-M809 PolarHBondContact O-N 2.91Å; L806-A810 VanDerWaalsContact O-CB 3.25Å; L806-A810 WeakPolarHBondContact O-CB 3.22Å; L806-A810 PolarHBondContact O-N 3Å
807	R	62	Low	62.2	Low	184 Å²	184	84.9 Å²	84.9	69%	0.694	47%	0.468	S	S	*	.	H	α-helix	trans	-63.6	-44.1	173.4	-75.5	172.7	175.8	161.4	-1.5	111.8	M803 S804 A810 A811	M803-R807 WeakPolarHBondContact O-CG 3.46Å; M803-R807 PolarHBondContact O-N 3.39Å; S804-R807 PolarHBondContact O-N 3.49Å; R807-A810 PolarHBondContact O-N 2.87Å; R807-A811 WeakPolarHBondContact O-CB 3.43Å; R807-A811 PolarHBondContact O-N 2.76Å
808	A	61.3	Low	61.6	Low	49 Å²	49	85.4 Å²	85.4	41%	0.405	47%	0.465	S	S	.	.	H	α-helix	trans	-66	-39.6	176.3	0	0	0	0	0	112.3	S804 R805 A811 R812	S804-A808 WeakPolarHBondContact O-CB 3.3Å; S804-A808 PolarHBondContact O-N 2.88Å; R805-A808 PolarHBondContact O-N 2.71Å; A808-A811 PolarHBondContact O-N 3.37Å; A808-R812 WeakPolarHBondContact O-CB 3.37Å; A808-R812 VanDerWaalsContact O-CG 3.29Å; A808-R812 WeakPolarHBondContact O-CG 3.14Å; A808-R812 PolarHBondContact O-N 3.43Å
809	M	56.2	Low	60.7	Low	114 Å²	114	91.4 Å²	91.4	56%	0.562	48%	0.482	S	S	*	.	H	α-helix	trans	-66.2	-42.9	174	179.1	177.5	-80.9	0	0	111.1	R805 L806 A811 R812 L813	R805-M809 WeakPolarHBondContact O-CB 3.19Å; R805-M809 PolarHBondContact O-N 3.15Å; L806-M809 PolarHBondContact O-N 2.91Å; M809-A811 PolarHBondContact O-N 3.47Å; M809-R812 CarbonylContact O-C 3.45Å; M809-R812 PolarHBondContact O-N 2.88Å; M809-L813 HydrophobicContact CG-CD1 3.6Å; M809-L813 WeakPolarHBondContact O-CB 3.44Å; M809-L813 VanDerWaalsContact O-CD1 3.31Å; M809-L813 WeakPolarHBondContact O-CD1 3.25Å; M809-L813 PolarHBondContact O-N 3.35Å
810	A	53.2	Low	60	Low	51 Å²	51	92.6 Å²	92.6	42%	0.421	49%	0.491	S	S	.	.	H	α-helix	trans	-64.5	-38.2	175.3	0	0	0	0	0	112.2	L806 R807 L813 R814	L806-A810 VanDerWaalsContact O-CB 3.25Å; L806-A810 WeakPolarHBondContact O-CB 3.22Å; L806-A810 PolarHBondContact O-N 3Å; R807-A810 PolarHBondContact O-N 2.87Å; A810-L813 PolarHBondContact O-N 2.87Å; A810-R814 WeakPolarHBondContact O-CB 3.39Å; A810-R814 WeakPolarHBondContact O-CG 3.41Å; A810-R814 PolarHBondContact O-N 2.86Å
811	A	65.2	Low	59.1	Low	59 Å²	59	96.5 Å²	96.5	49%	0.488	50%	0.498	S	S	.	.	H	α-helix	trans	-64.4	-44.6	172	0	0	0	0	0	111.7	R807 A808 M809 R814 A815	R807-A811 WeakPolarHBondContact O-CB 3.43Å; R807-A811 PolarHBondContact O-N 2.76Å; A808-A811 PolarHBondContact O-N 3.37Å; M809-A811 PolarHBondContact O-N 3.47Å; A811-R814 PolarHBondContact O-N 3.4Å; A811-A815 WeakPolarHBondContact O-CB 3.08Å; A811-A815 PolarHBondContact O-N 2.81Å
812	R	62.3	Low	58.5	Low	196 Å²	196	99.2 Å²	99.2	74%	0.74	51%	0.512	S	S	*	.	H	α-helix	trans	-64.8	-38.3	175.1	-73.9	174.7	179.2	-172.1	0	112.6	A808 M809 A816	A808-R812 WeakPolarHBondContact O-CB 3.37Å; A808-R812 VanDerWaalsContact O-CG 3.29Å; A808-R812 WeakPolarHBondContact O-CG 3.14Å; A808-R812 PolarHBondContact O-N 3.43Å; M809-R812 CarbonylContact O-C 3.45Å; M809-R812 PolarHBondContact O-N 2.88Å; R812-A816 VanDerWaalsContact O-CB 3.24Å; R812-A816 WeakPolarHBondContact O-CB 3.46Å; R812-A816 PolarHBondContact O-N 3.03Å
813	L	61.3	Low	57.8	Low	111 Å²	111	100.2 Å²	100.2	58%	0.581	52%	0.52	S	S	*	.	H	α-helix	trans	-67.1	-40.6	172.9	-99.7	98.2	0	0	0	111.8	M809 A810 A816 S817	M809-L813 HydrophobicContact CG-CD1 3.6Å; M809-L813 WeakPolarHBondContact O-CB 3.44Å; M809-L813 VanDerWaalsContact O-CD1 3.31Å; M809-L813 WeakPolarHBondContact O-CD1 3.25Å; M809-L813 PolarHBondContact O-N 3.35Å; A810-L813 PolarHBondContact O-N 2.87Å; L813-A816 PolarHBondContact O-N 2.89Å; L813-S817 VanDerWaalsContact O-CB 3.31Å; L813-S817 WeakPolarHBondContact O-CB 3.11Å; L813-S817 PolarHBondContact O-N 3.45Å; L813-S817 PolarHBondContact O-OG 2.76Å
814	R	53.4	Low	57	Low	195 Å²	195	100.8 Å²	100.8	74%	0.736	53%	0.525	S	S	*	.	H	α-helix	trans	-61.1	-50.2	173.5	-78.8	-177.8	176.7	-169.4	-0.8	110.7	A810 A811 A816 S817 V818	A810-R814 WeakPolarHBondContact O-CB 3.39Å; A810-R814 WeakPolarHBondContact O-CG 3.41Å; A810-R814 PolarHBondContact O-N 2.86Å; A811-R814 PolarHBondContact O-N 3.4Å; R814-A816 PolarHBondContact O-N 2.8Å; R814-S817 PolarHBondContact O-N 3.38Å; R814-S817 PolarHBondContact O-OG 3.47Å; R814-V818 WeakPolarHBondContact O-CG2 3.42Å; R814-V818 PolarHBondContact O-N 2.91Å
815	A	62.1	Low	56.3	Low	47 Å²	47	103.8 Å²	103.8	39%	0.388	53%	0.534	S	S	.	.	H	α-helix	trans	-56.9	-48	175.1	0	0	0	0	0	112	A811 S817 V818 Y819	A811-A815 WeakPolarHBondContact O-CB 3.08Å; A811-A815 PolarHBondContact O-N 2.81Å; A815-S817 VanDerWaalsContact C-N 3.34Å; A815-S817 PolarHBondContact O-N 2.81Å; A815-V818 PolarHBondContact O-N 2.81Å; A815-Y819 VanDerWaalsContact O-CD2 3.28Å; A815-Y819 WeakPolarHBondContact O-CD2 3.4Å; A815-Y819 PolarHBondContact O-N 2.76Å
816	A	53.6	Low	56.5	Low	52 Å²	52	102.4 Å²	102.4	43%	0.43	54%	0.539	S	S	.	.	H	α-helix	trans	-61	-40.1	176.5	0	0	0	0	0	112.4	R812 L813 R814 V818 Y819 V820	R812-A816 VanDerWaalsContact O-CB 3.24Å; R812-A816 WeakPolarHBondContact O-CB 3.46Å; R812-A816 PolarHBondContact O-N 3.03Å; L813-A816 PolarHBondContact O-N 2.89Å; R814-A816 PolarHBondContact O-N 2.8Å; A816-V818 VanDerWaalsContact C-N 3.34Å; A816-V818 PolarHBondContact O-N 3.47Å; A816-Y819 PolarHBondContact O-N 2.99Å; A816-V820 WeakPolarHBondContact O-CB 3.49Å; A816-V820 WeakPolarHBondContact O-CG2 3.39Å; A816-V820 PolarHBondContact O-N 2.89Å
817	S	49.8	Very low	56	Low	58 Å²	58	100.4 Å²	100.4	41%	0.406	53%	0.534	S	S	.	.	H	α-helix	trans	-65.2	-36.4	176.7	72.5	0	0	0	0	112.3	L813 R814 A815 V820 Q821	L813-S817 VanDerWaalsContact O-CB 3.31Å; L813-S817 WeakPolarHBondContact O-CB 3.11Å; L813-S817 PolarHBondContact O-N 3.45Å; L813-S817 PolarHBondContact O-OG 2.76Å; R814-S817 PolarHBondContact O-N 3.38Å; R814-S817 PolarHBondContact O-OG 3.47Å; A815-S817 VanDerWaalsContact C-N 3.34Å; A815-S817 PolarHBondContact O-N 2.81Å; S817-V820 PolarHBondContact O-N 3.49Å; S817-Q821 WeakPolarHBondContact O-CB 3.45Å; S817-Q821 WeakPolarHBondContact O-CG 3.41Å; S817-Q821 PolarHBondContact O-N 3.45Å
818	V	63.6	Low	55.7	Low	74 Å²	74	99.7 Å²	99.7	45%	0.448	53%	0.531	S	S	.	.	H	α-helix	trans	-67.5	-44.5	172.2	171.7	0	0	0	0	110.9	R814 A815 A816 V820 Q821 L822	R814-V818 WeakPolarHBondContact O-CG2 3.42Å; R814-V818 PolarHBondContact O-N 2.91Å; A815-V818 PolarHBondContact O-N 2.81Å; A816-V818 VanDerWaalsContact C-N 3.34Å; A816-V818 PolarHBondContact O-N 3.47Å; V818-V820 VanDerWaalsContact C-N 3.33Å; V818-V820 PolarHBondContact O-N 2.9Å; V818-Q821 PolarHBondContact O-N 2.9Å; V818-L822 HydrophobicContact CG1-CD1 3.89Å; V818-L822 VanDerWaalsContact O-CD1 3.31Å; V818-L822 WeakPolarHBondContact O-CD1 3.38Å; V818-L822 PolarHBondContact O-N 3.39Å
819	Y	55.7	Low	55.9	Low	176 Å²	176	101 Å²	101	69%	0.69	53%	0.531	S	S	*	.	H	α-helix	trans	-60.7	-39.3	173.5	-85.3	-70.5	0	0	0	112.6	A815 A816 L822 C823	A815-Y819 VanDerWaalsContact O-CD2 3.28Å; A815-Y819 WeakPolarHBondContact O-CD2 3.4Å; A815-Y819 PolarHBondContact O-N 2.76Å; A816-Y819 PolarHBondContact O-N 2.99Å; Y819-L822 PolarHBondContact O-N 3.49Å; Y819-C823 WeakPolarHBondContact O-CB 3.31Å; Y819-C823 PolarHBondContact O-N 3.26Å
820	V	54.3	Low	55.7	Low	86 Å²	86	104.1 Å²	104.1	52%	0.521	54%	0.537	S	S	.	.	H	α-helix	trans	-67.8	-39.3	174.8	169.6	0	0	0	0	111.2	A816 S817 V818 C823 L824	A816-V820 WeakPolarHBondContact O-CB 3.49Å; A816-V820 WeakPolarHBondContact O-CG2 3.39Å; A816-V820 PolarHBondContact O-N 2.89Å; S817-V820 PolarHBondContact O-N 3.49Å; V818-V820 VanDerWaalsContact C-N 3.33Å; V818-V820 PolarHBondContact O-N 2.9Å; V820-C823 PolarHBondContact O-N 3.32Å; V820-L824 HydrophobicContact CG1-CD1 3.99Å; V820-L824 HydrophobicContact CG1-CG 4.41Å; V820-L824 WeakPolarHBondContact O-CB 3.19Å; V820-L824 VanDerWaalsContact O-CG 3.32Å; V820-L824 WeakPolarHBondContact O-CG 3.33Å; V820-L824 PolarHBondContact O-N 3.44Å
821	Q	54.1	Low	55.4	Low	124 Å²	124	107.3 Å²	107.3	58%	0.579	55%	0.546	S	S	*	.	H	α-helix	trans	-64.4	-43.6	173.5	-76.8	177.2	-4.7	0	0	112	S817 V818 C823 L824 M825	S817-Q821 WeakPolarHBondContact O-CB 3.45Å; S817-Q821 WeakPolarHBondContact O-CG 3.41Å; S817-Q821 PolarHBondContact O-N 3.45Å; V818-Q821 PolarHBondContact O-N 2.9Å; Q821-C823 VanDerWaalsContact C-N 3.34Å; Q821-C823 PolarHBondContact O-N 3.3Å; Q821-L824 PolarHBondContact O-N 2.9Å; Q821-M825 WeakPolarHBondContact O-CB 3.45Å; Q821-M825 VanDerWaalsContact O-CG 3.25Å; Q821-M825 WeakPolarHBondContact O-CG 3.24Å; Q821-M825 PolarHBondContact O-N 2.96Å
822	L	59.1	Low	55.4	Low	108 Å²	108	108 Å²	108	57%	0.565	54%	0.544	S	S	*	.	H	α-helix	trans	-61.9	-41.2	172.1	-94.7	74.1	0	0	0	111.7	V818 Y819 M825 A826	V818-L822 HydrophobicContact CG1-CD1 3.89Å; V818-L822 VanDerWaalsContact O-CD1 3.31Å; V818-L822 WeakPolarHBondContact O-CD1 3.38Å; V818-L822 PolarHBondContact O-N 3.39Å; Y819-L822 PolarHBondContact O-N 3.49Å; L822-M825 PolarHBondContact O-N 2.97Å; L822-A826 WeakPolarHBondContact O-CB 3.43Å; L822-A826 PolarHBondContact O-N 3Å
823	C	50.5	Low	55.2	Low	75 Å²	75	106.2 Å²	106.2	51%	0.507	54%	0.537	S	S	.	.	H	α-helix	trans	-65.5	-40.3	177.9	-169.1	0	0	0	0	111.7	Y819 V820 Q821 A826 C827	Y819-C823 WeakPolarHBondContact O-CB 3.31Å; Y819-C823 PolarHBondContact O-N 3.26Å; V820-C823 PolarHBondContact O-N 3.32Å; Q821-C823 VanDerWaalsContact C-N 3.34Å; Q821-C823 PolarHBondContact O-N 3.3Å; C823-A826 PolarHBondContact O-N 2.89Å; C823-C827 VanDerWaalsContact O-CB 3.3Å; C823-C827 WeakPolarHBondContact O-CB 3.35Å; C823-C827 PolarHBondContact O-N 2.93Å; C823-C827 PolarHBondContact O-SG 3.13Å
824	L	39.8	Very low	54.8	Low	114 Å²	114	106.4 Å²	106.4	60%	0.597	54%	0.538	S	S	*	.	H	α-helix	trans	-67.5	-39.2	173.8	-74.2	169.7	0	0	0	112.1	V820 Q821 C827 R828	V820-L824 HydrophobicContact CG1-CD1 3.99Å; V820-L824 HydrophobicContact CG1-CG 4.41Å; V820-L824 WeakPolarHBondContact O-CB 3.19Å; V820-L824 VanDerWaalsContact O-CG 3.32Å; V820-L824 WeakPolarHBondContact O-CG 3.33Å; V820-L824 PolarHBondContact O-N 3.44Å; Q821-L824 PolarHBondContact O-N 2.9Å; L824-C827 PolarHBondContact O-N 3.27Å; L824-R828 WeakPolarHBondContact O-CB 3.44Å; L824-R828 PolarHBondContact O-N 3.11Å
825	M	54.1	Low	54.5	Low	122 Å²	122	103 Å²	103	60%	0.601	53%	0.534	S	S	*	.	H	α-helix	trans	-61.6	-45.9	172.1	-72.4	-73.8	-171.6	0	0	111.3	Q821 L822 R828 D829	Q821-M825 WeakPolarHBondContact O-CB 3.45Å; Q821-M825 VanDerWaalsContact O-CG 3.25Å; Q821-M825 WeakPolarHBondContact O-CG 3.24Å; Q821-M825 PolarHBondContact O-N 2.96Å; L822-M825 PolarHBondContact O-N 2.97Å; M825-R828 PolarHBondContact O-N 3.49Å; M825-D829 PolarHBondContact O-N 3.45Å
826	A	59.4	Low	54.3	Low	52 Å²	52	106.7 Å²	106.7	43%	0.43	55%	0.546	S	S	.	.	H	α-helix	trans	-68.1	-37.5	177.9	0	0	0	0	0	112.6	L822 C823 D829 R830	L822-A826 WeakPolarHBondContact O-CB 3.43Å; L822-A826 PolarHBondContact O-N 3Å; C823-A826 PolarHBondContact O-N 2.89Å; A826-D829 PolarHBondContact O-N 3.37Å; A826-R830 WeakPolarHBondContact O-CB 3.49Å; A826-R830 WeakPolarHBondContact O-CG 3.31Å; A826-R830 PolarHBondContact O-N 3.42Å
827	C	45.1	Very low	54.4	Low	62 Å²	62	108 Å²	108	42%	0.419	55%	0.546	S	S	.	.	H	α-helix	trans	-65.9	-38.1	171.4	-73.5	0	0	0	0	111.4	C823 L824 L831	C823-C827 VanDerWaalsContact O-CB 3.3Å; C823-C827 WeakPolarHBondContact O-CB 3.35Å; C823-C827 PolarHBondContact O-N 2.93Å; C823-C827 PolarHBondContact O-SG 3.13Å; L824-C827 PolarHBondContact O-N 3.27Å; C827-L831 VanDerWaalsContact O-CB 3.27Å; C827-L831 WeakPolarHBondContact O-CB 3.49Å; C827-L831 PolarHBondContact O-N 3.38Å
828	R	55	Low	54.2	Low	169 Å²	169	109.8 Å²	109.8	64%	0.638	55%	0.55	S	S	*	*	H	α-helix	trans	-64.3	-45.8	174.5	-165	-176.6	79	171	5.1	111.2	L824 M825 L831 V832	L824-R828 WeakPolarHBondContact O-CB 3.44Å; L824-R828 PolarHBondContact O-N 3.11Å; M825-R828 PolarHBondContact O-N 3.49Å; R828-L831 PolarHBondContact O-N 3.3Å; R828-V832 WeakPolarHBondContact O-CB 3.38Å; R828-V832 VanDerWaalsContact O-CG2 3.28Å; R828-V832 WeakPolarHBondContact O-CG2 3.33Å; R828-V832 PolarHBondContact O-N 3.22Å
829	D	65.2	Low	53.4	Low	75 Å²	75	109.8 Å²	109.8	40%	0.401	55%	0.552	S	S	.	*	H	α-helix	trans	-66.2	-39.9	178.2	-167.1	54.8	0	0	0	112	M825 A826 V832 R833	M825-D829 PolarHBondContact O-N 3.45Å; A826-D829 PolarHBondContact O-N 3.37Å; D829-V832 PolarHBondContact O-N 2.98Å; D829-R833 WeakPolarHBondContact O-CB 3.46Å; D829-R833 VanDerWaalsContact O-CG 3.29Å; D829-R833 WeakPolarHBondContact O-CG 3.28Å; D829-R833 PolarHBondContact O-N 3.19Å; D829-R833 IonicContact OD1-NE 2.71Å; D829-R833 IonicContact OD2-CZ 2.78Å; D829-R833 IonicContact OD2-NE 2.73Å; D829-R833 PolarHBondContact OD2-NE 3.44Å; D829-R833 IonicContact OD2-NH2 2.99Å; D829-R833 PolarHBondContact OD2-NH2 3.46Å
830	R	52.7	Low	53.4	Low	181 Å²	181	105.8 Å²	105.8	68%	0.683	55%	0.545	S	S	*	.	H	α-helix	trans	-64.6	-41.7	171.9	-74.5	-174.1	179.8	-153.1	1.2	112.7	A826 R833 L834	A826-R830 WeakPolarHBondContact O-CB 3.49Å; A826-R830 WeakPolarHBondContact O-CG 3.31Å; A826-R830 PolarHBondContact O-N 3.42Å; R830-R833 PolarHBondContact O-N 2.83Å; R830-L834 VanDerWaalsContact O-CB 3.24Å; R830-L834 WeakPolarHBondContact O-CB 3.22Å; R830-L834 PolarHBondContact O-N 2.91Å
831	L	46.7	Very low	52.9	Low	117 Å²	117	109.1 Å²	109.1	61%	0.613	56%	0.557	S	S	*	*	H	α-helix	trans	-65.2	-42	175.4	-90.9	167.3	0	0	0	111.8	C827 R828 L834 L835	C827-L831 VanDerWaalsContact O-CB 3.27Å; C827-L831 WeakPolarHBondContact O-CB 3.49Å; C827-L831 PolarHBondContact O-N 3.38Å; R828-L831 PolarHBondContact O-N 3.3Å; L831-L834 PolarHBondContact O-N 3.44Å; L831-L835 VanDerWaalsContact O-CB 3.24Å; L831-L835 WeakPolarHBondContact O-CB 3.33Å; L831-L835 PolarHBondContact O-N 2.81Å
832	V	65.6	Low	52.5	Low	73 Å²	73	109.4 Å²	109.4	44%	0.442	56%	0.562	S	S	.	*	H	α-helix	trans	-61.3	-49	174.8	167.8	0	0	0	0	110.2	R828 D829 L834 L835 L836	R828-V832 WeakPolarHBondContact O-CB 3.38Å; R828-V832 VanDerWaalsContact O-CG2 3.28Å; R828-V832 WeakPolarHBondContact O-CG2 3.33Å; R828-V832 PolarHBondContact O-N 3.22Å; D829-V832 PolarHBondContact O-N 2.98Å; V832-L834 VanDerWaalsContact C-N 3.32Å; V832-L834 PolarHBondContact O-N 2.83Å; V832-L835 PolarHBondContact O-N 3.42Å; V832-L836 VanDerWaalsContact O-CB 3.24Å; V832-L836 WeakPolarHBondContact O-CB 3.25Å; V832-L836 PolarHBondContact O-N 3.47Å
833	R	58.6	Low	51.8	Low	160 Å²	160	110.7 Å²	110.7	60%	0.604	57%	0.569	S	S	*	*	H	α-helix	trans	-59.9	-39.5	175.7	-69.3	177.1	-160.1	-141.7	5.5	112.5	D829 R830 L836 L837	D829-R833 WeakPolarHBondContact O-CB 3.46Å; D829-R833 VanDerWaalsContact O-CG 3.29Å; D829-R833 WeakPolarHBondContact O-CG 3.28Å; D829-R833 PolarHBondContact O-N 3.19Å; D829-R833 IonicContact OD1-NE 2.71Å; D829-R833 IonicContact OD2-CZ 2.78Å; D829-R833 IonicContact OD2-NE 2.73Å; D829-R833 PolarHBondContact OD2-NE 3.44Å; D829-R833 IonicContact OD2-NH2 2.99Å; D829-R833 PolarHBondContact OD2-NH2 3.46Å; R830-R833 PolarHBondContact O-N 2.83Å; R833-L836 PolarHBondContact O-N 2.89Å; R833-L837 WeakPolarHBondContact O-CB 3.3Å; R833-L837 VanDerWaalsContact O-CG 3.28Å; R833-L837 WeakPolarHBondContact O-CG 3.4Å; R833-L837 PolarHBondContact O-N 2.85Å
834	L	51.6	Low	51.1	Low	115 Å²	115	111.9 Å²	111.9	60%	0.602	58%	0.575	S	S	*	*	H	α-helix	trans	-73.4	-35.4	-179.6	-165.1	144.5	0	0	0	112.2	R830 L831 V832 L837 L838	R830-L834 VanDerWaalsContact O-CB 3.24Å; R830-L834 WeakPolarHBondContact O-CB 3.22Å; R830-L834 PolarHBondContact O-N 2.91Å; L831-L834 PolarHBondContact O-N 3.44Å; V832-L834 VanDerWaalsContact C-N 3.32Å; V832-L834 PolarHBondContact O-N 2.83Å; L834-L837 PolarHBondContact O-N 3.42Å; L834-L838 PolarHBondContact O-N 3.45Å
835	L	48.2	Very low	50.8	Low	123 Å²	123	114.2 Å²	114.2	64%	0.644	58%	0.583	S	S	*	*	H	α-helix	trans	-67.9	-35.4	171.5	-165.2	78.2	0	0	0	111.8	L831 V832 L838 P839	L831-L835 VanDerWaalsContact O-CB 3.24Å; L831-L835 WeakPolarHBondContact O-CB 3.33Å; L831-L835 PolarHBondContact O-N 2.81Å; V832-L835 PolarHBondContact O-N 3.42Å; L835-L838 VanDerWaalsContact O-CB 3.22Å; L835-L838 WeakPolarHBondContact O-CB 3.4Å; L835-L838 PolarHBondContact O-N 3.28Å; L835-P839 WeakPolarHBondContact O-CD 3.47Å
836	L	57.2	Low	49.9	Very low	125 Å²	125	114.7 Å²	114.7	65%	0.654	59%	0.593	S	S	*	*	H	α-helix	trans	-79.6	-21.1	178.3	-148.1	148.8	0	0	0	112.2	V832 R833 P839	V832-L836 VanDerWaalsContact O-CB 3.24Å; V832-L836 WeakPolarHBondContact O-CB 3.25Å; V832-L836 PolarHBondContact O-N 3.47Å; R833-L836 PolarHBondContact O-N 2.89Å; L836-P839 WeakPolarHBondContact O-CD 3.29Å; L836-P839 WeakPolarHBondContact O-CG 3.24Å
837	L	55.1	Low	48.7	Very low	79 Å²	79	116.6 Å²	116.6	41%	0.414	61%	0.608	S	S	.	*	H	α-helix	trans	-81.5	-20.4	166.1	-76.3	166.6	0	0	0	113.4	R833 L834 V840 M841	R833-L837 WeakPolarHBondContact O-CB 3.3Å; R833-L837 VanDerWaalsContact O-CG 3.28Å; R833-L837 WeakPolarHBondContact O-CG 3.4Å; R833-L837 PolarHBondContact O-N 2.85Å; L834-L837 PolarHBondContact O-N 3.42Å; L837-V840 WeakPolarHBondContact O-CA 3.33Å; L837-V840 WeakPolarHBondContact O-CB 3.38Å; L837-V840 PolarHBondContact O-N 2.83Å; L837-M841 PolarHBondContact O-N 3.3Å
838	L	46.1	Very low	48.3	Very low	96 Å²	96	120.6 Å²	120.6	50%	0.503	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-54.9	-46	176.8	-158.2	102.8	0	0	0	113.7	L834 L835 V840 M841 L842	L834-L838 PolarHBondContact O-N 3.45Å; L835-L838 VanDerWaalsContact O-CB 3.22Å; L835-L838 WeakPolarHBondContact O-CB 3.4Å; L835-L838 PolarHBondContact O-N 3.28Å; L838-V840 VanDerWaalsContact C-N 3.26Å; L838-V840 PolarHBondContact O-N 3.22Å; L838-M841 PolarHBondContact O-N 3.21Å; L838-L842 PolarHBondContact O-N 2.89Å
839	P	47.2	Very low	47.6	Very low	74 Å²	74	116.5 Å²	116.5	48%	0.481	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.4	-23.7	173.7	26.9	-35.9	0	0	0	113.5	L835 L836 L842 L843	L835-P839 WeakPolarHBondContact O-CD 3.47Å; L836-P839 WeakPolarHBondContact O-CD 3.29Å; L836-P839 WeakPolarHBondContact O-CG 3.24Å; P839-L842 PolarHBondContact O-N 2.83Å; P839-L843 VanDerWaalsContact O-CD1 3.22Å; P839-L843 WeakPolarHBondContact O-CD1 3.27Å
840	V	56	Low	46.6	Very low	91 Å²	91	119.2 Å²	119.2	55%	0.552	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-38.3	175	-173.5	0	0	0	0	110.7	L837 L838 L842 L843	L837-V840 WeakPolarHBondContact O-CA 3.33Å; L837-V840 WeakPolarHBondContact O-CB 3.38Å; L837-V840 PolarHBondContact O-N 2.83Å; L838-V840 VanDerWaalsContact C-N 3.26Å; L838-V840 PolarHBondContact O-N 3.22Å; V840-L842 PolarHBondContact O-N 3.47Å; V840-L843 PolarHBondContact O-N 3.5Å
841	M	43.7	Very low	46.5	Very low	156 Å²	156	115.2 Å²	115.2	77%	0.768	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-7.5	174	-69.3	-70	175.6	0	0	114	L837 L838	L837-M841 PolarHBondContact O-N 3.3Å; L838-M841 PolarHBondContact O-N 3.21Å
842	L	45.4	Very low	46	Very low	131 Å²	131	114.9 Å²	114.9	69%	0.686	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-3.8	176.2	-98.1	154.9	0	0	0	113.5	L838 P839 V840 P844	L838-L842 PolarHBondContact O-N 2.89Å; P839-L842 PolarHBondContact O-N 2.83Å; V840-L842 PolarHBondContact O-N 3.47Å; L842-P844 WeakPolarHBondContact O-CD 3.48Å
843	L	44.2	Very low	44.8	Very low	135 Å²	135	118.7 Å²	118.7	71%	0.707	65%	0.645	S	S	*	*	S	Bend	trans	-80.8	120.6	166.5	-84.7	73.2	0	0	0	109.2	P839 V840	P839-L843 VanDerWaalsContact O-CD1 3.22Å; P839-L843 WeakPolarHBondContact O-CD1 3.27Å; V840-L843 PolarHBondContact O-N 3.5Å
844	P	36.6	Very low	44.3	Very low	99 Å²	99	116 Å²	116	64%	0.643	64%	0.642	S	S	*	*			trans	-79.6	157.3	178.4	33.1	-35.1	0	0	0	112.4	L842	L842-P844 WeakPolarHBondContact O-CD 3.48Å
845	H	33	Very low	43.9	Very low	163 Å²	163	116.2 Å²	116.2	76%	0.755	64%	0.642	S	S	*	*			trans	93.4	127.5	164.4	-53.3	-67.8	0	0	0	120
846	T	35.1	Very low	43.5	Very low	132 Å²	132	115 Å²	115	81%	0.81	63%	0.634	S	S	*	*			trans	65.4	111.8	149.1	52	0	0	0	0	119.9
847	A	34.8	Very low	42.9	Very low	92 Å²	92	115.5 Å²	115.5	76%	0.76	63%	0.631	S	S	*	*			trans	63.1	146.7	175.5	0	0	0	0	0	114.3
848	M	36.2	Very low	42.5	Very low	147 Å²	147	116.8 Å²	116.8	72%	0.724	64%	0.643	S	S	*	*			cis	-132.6	131.7	18.6	-64.6	-82.3	-166.3	0	0	110.5	N850	M848-N850 VanDerWaalsContact C-N 3.3Å; M848-N850 PolarHBondContact O-N 2.89Å
849	A	39.9	Very low	42	Very low	82 Å²	82	116.7 Å²	116.7	68%	0.678	65%	0.646	S	S	*	*	S	Bend	trans	-72.9	-22.5	176	0	0	0	0	0	113.5
850	N	44.9	Very low	41.6	Very low	132 Å²	132	115.1 Å²	115.1	71%	0.706	64%	0.644	S	S	*	*	H	α-helix	trans	-83	-31.8	-164.9	-60.5	-0.6	0	0	0	113.4	M848 L852 F853	M848-N850 VanDerWaalsContact C-N 3.3Å; M848-N850 PolarHBondContact O-N 2.89Å; N850-L852 VanDerWaalsContact C-N 3.3Å; N850-L852 PolarHBondContact O-N 3.38Å; N850-F853 PolarHBondContact O-N 3.21Å
851	T	49.8	Very low	40.7	Very low	98 Å²	98	115.1 Å²	115.1	60%	0.601	64%	0.64	S	S	*	*	H	α-helix	trans	-67.8	-26.8	180	23.8	0	0	0	0	113.3	F853 M855	T851-F853 VanDerWaalsContact C-N 3.34Å; T851-F853 PolarHBondContact O-N 2.79Å; T851-M855 WeakPolarHBondContact O-CB 3.39Å; T851-M855 PolarHBondContact O-N 3.42Å; T851-M855 VanDerWaalsContact O-N 3.15Å
852	L	36.1	Very low	40.4	Very low	109 Å²	109	110.5 Å²	110.5	57%	0.571	63%	0.633	S	S	*	*	H	α-helix	trans	-65.2	-38.8	178.1	-161	79.3	0	0	0	111.6	N850 M855 I856	N850-L852 VanDerWaalsContact C-N 3.3Å; N850-L852 PolarHBondContact O-N 3.38Å; L852-M855 PolarHBondContact O-N 2.86Å; L852-I856 HydrophobicContact CD2-CD1 4.38Å; L852-I856 HydrophobicContact CG-CD1 4.16Å; L852-I856 WeakPolarHBondContact O-CD1 3.46Å; L852-I856 VanDerWaalsContact O-CG1 3.25Å; L852-I856 WeakPolarHBondContact O-CG1 3.28Å; L852-I856 PolarHBondContact O-N 3.26Å
853	F	41.3	Very low	40	Very low	154 Å²	154	107.5 Å²	107.5	68%	0.675	63%	0.627	S	S	*	*	H	α-helix	trans	-71.7	-39.4	-176.4	-111.4	-86.4	0	0	0	113.2	N850 T851 I856 K857	N850-F853 PolarHBondContact O-N 3.21Å; T851-F853 VanDerWaalsContact C-N 3.34Å; T851-F853 PolarHBondContact O-N 2.79Å; F853-I856 PolarHBondContact O-N 3.35Å; F853-K857 PolarHBondContact O-N 2.92Å
854	D	48	Very low	39.6	Very low	102 Å²	102	110.6 Å²	110.6	55%	0.545	63%	0.629	S	S	.	*	H	α-helix	trans	-71.9	-31.6	173.9	-82.9	-18.5	0	0	0	112.3	I856 K857 T858	D854-I856 VanDerWaalsContact C-N 3.34Å; D854-K857 PolarHBondContact O-N 2.86Å; D854-T858 WeakPolarHBondContact O-CB 3.37Å; D854-T858 PolarHBondContact O-N 2.71Å; D854-T858 PolarHBondContact O-OG1 2.89Å
855	M	42.4	Very low	39.8	Very low	121 Å²	121	109.6 Å²	109.6	60%	0.596	64%	0.636	S	S	*	*	H	α-helix	trans	-65.3	-38.9	170.9	-164	170.3	-173.2	0	0	111.4	T851 L852 T858 V859	T851-M855 WeakPolarHBondContact O-CB 3.39Å; T851-M855 PolarHBondContact O-N 3.42Å; T851-M855 VanDerWaalsContact O-N 3.15Å; L852-M855 PolarHBondContact O-N 2.86Å; M855-T858 PolarHBondContact O-N 2.91Å; M855-V859 WeakPolarHBondContact O-CG2 3.34Å; M855-V859 PolarHBondContact O-N 3.37Å; M855-V859 VanDerWaalsContact O-N 3.09Å
856	I	41.4	Very low	40.1	Very low	96 Å²	96	105 Å²	105	49%	0.492	62%	0.623	S	S	.	*	H	α-helix	trans	-64.9	-44	172.8	-72.3	163.8	0	0	0	111.5	L852 F853 D854 T858 V859 G860	L852-I856 HydrophobicContact CD2-CD1 4.38Å; L852-I856 HydrophobicContact CG-CD1 4.16Å; L852-I856 WeakPolarHBondContact O-CD1 3.46Å; L852-I856 VanDerWaalsContact O-CG1 3.25Å; L852-I856 WeakPolarHBondContact O-CG1 3.28Å; L852-I856 PolarHBondContact O-N 3.26Å; F853-I856 PolarHBondContact O-N 3.35Å; D854-I856 VanDerWaalsContact C-N 3.34Å; I856-T858 PolarHBondContact O-N 2.81Å; I856-V859 PolarHBondContact O-N 3.46Å; I856-G860 PolarHBondContact O-N 2.95Å
857	K	42.6	Very low	40.4	Very low	136 Å²	136	103.4 Å²	103.4	59%	0.591	62%	0.617	S	S	*	*	H	α-helix	trans	-58.2	-47.6	173.3	-98.4	179	176	173.1	0	112.2	F853 D854 V859 G860 D861	F853-K857 PolarHBondContact O-N 2.92Å; D854-K857 PolarHBondContact O-N 2.86Å; K857-V859 PolarHBondContact O-N 2.92Å; K857-G860 WeakPolarHBondContact O-CA 3.41Å; K857-G860 PolarHBondContact O-N 3Å; K857-D861 PolarHBondContact O-N 3.2Å
858	T	48.3	Very low	40.7	Very low	107 Å²	107	103.8 Å²	103.8	66%	0.656	61%	0.614	S	S	*	*	H	α-helix	trans	-60.3	-34.7	179.4	-54.2	0	0	0	0	111.9	D854 M855 I856 G862	D854-T858 WeakPolarHBondContact O-CB 3.37Å; D854-T858 PolarHBondContact O-N 2.71Å; D854-T858 PolarHBondContact O-OG1 2.89Å; M855-T858 PolarHBondContact O-N 2.91Å; I856-T858 PolarHBondContact O-N 2.81Å; T858-G862 PolarHBondContact O-N 3.48Å
859	V	35.7	Very low	41	Very low	93 Å²	93	100 Å²	100	56%	0.564	60%	0.602	S	S	*	*	H	α-helix	trans	-72.4	-37.9	171.9	170.3	0	0	0	0	111.9	M855 I856 K857 G862 A863	M855-V859 WeakPolarHBondContact O-CG2 3.34Å; M855-V859 PolarHBondContact O-N 3.37Å; M855-V859 VanDerWaalsContact O-N 3.09Å; I856-V859 PolarHBondContact O-N 3.46Å; K857-V859 PolarHBondContact O-N 2.92Å; V859-G862 PolarHBondContact O-N 2.9Å; V859-A863 PolarHBondContact O-N 2.85Å
860	G	37.1	Very low	41.2	Very low	42 Å²	42	104 Å²	104	43%	0.433	60%	0.604	S	S	.	*	H	α-helix	trans	-64.7	-47.7	177.7	0	0	0	0	0	113.9	I856 K857 G862 A863	I856-G860 PolarHBondContact O-N 2.95Å; K857-G860 WeakPolarHBondContact O-CA 3.41Å; K857-G860 PolarHBondContact O-N 3Å; G860-G862 VanDerWaalsContact C-N 3.3Å; G860-G862 PolarHBondContact O-N 3.3Å; G860-A863 VanDerWaalsContact O-CB 3.32Å; G860-A863 WeakPolarHBondContact O-CB 3.48Å; G860-A863 PolarHBondContact O-N 3.39Å; G860-A863 VanDerWaalsContact O-N 3.1Å
861	D	37.1	Very low	41.6	Very low	90 Å²	90	101 Å²	101	48%	0.481	59%	0.591	S	S	.	*	H	α-helix	trans	-67.9	-31.3	177.6	-78.4	-52.6	0	0	0	112.2	K857 A863 R864	K857-D861 PolarHBondContact O-N 3.2Å; D861-A863 PolarHBondContact O-N 2.99Å; D861-R864 PolarHBondContact O-N 3.07Å; D861-R864 IonicContact OD1-CZ 3.76Å; D861-R864 IonicContact OD1-NH1 2.69Å; D861-R864 PolarHBondContact OD1-NH1 2.85Å
862	G	38.8	Very low	41.7	Very low	60 Å²	60	98.8 Å²	98.8	62%	0.619	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-61	-19.9	170.7	0	0	0	0	0	114.7	T858 V859 G860	T858-G862 PolarHBondContact O-N 3.48Å; V859-G862 PolarHBondContact O-N 2.9Å; G860-G862 VanDerWaalsContact C-N 3.3Å; G860-G862 PolarHBondContact O-N 3.3Å
863	A	35.8	Very low	42.6	Very low	67 Å²	67	98.3 Å²	98.3	55%	0.554	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-77	-21.3	178.3	0	0	0	0	0	113.5	V859 G860 D861 G865 S866	V859-A863 PolarHBondContact O-N 2.85Å; G860-A863 VanDerWaalsContact O-CB 3.32Å; G860-A863 WeakPolarHBondContact O-CB 3.48Å; G860-A863 PolarHBondContact O-N 3.39Å; G860-A863 VanDerWaalsContact O-N 3.1Å; D861-A863 PolarHBondContact O-N 2.99Å; A863-G865 PolarHBondContact O-N 2.91Å; A863-S866 PolarHBondContact O-N 2.75Å
864	R	36.8	Very low	43.4	Very low	201 Å²	201	91.8 Å²	91.8	76%	0.758	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-66	-19.2	-176.4	-74.7	174	154.9	150.9	-10.2	113.9	D861 S866	D861-R864 PolarHBondContact O-N 3.07Å; D861-R864 IonicContact OD1-CZ 3.76Å; D861-R864 IonicContact OD1-NH1 2.69Å; D861-R864 PolarHBondContact OD1-NH1 2.85Å; R864-S866 PolarHBondContact O-N 2.78Å
865	G	40.6	Very low	44	Very low	77 Å²	77	89.6 Å²	89.6	79%	0.794	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-79.7	-1.3	179.6	0	0	0	0	0	116.6	A863	A863-G865 PolarHBondContact O-N 2.91Å
866	S	39.1	Very low	44.8	Very low	68 Å²	68	88.4 Å²	88.4	48%	0.476	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-107	7.4	-166.9	-155	0	0	0	0	115.4	A863 R864 S868 S869	A863-S866 PolarHBondContact O-N 2.75Å; R864-S866 PolarHBondContact O-N 2.78Å; S866-S868 VanDerWaalsContact C-N 3.31Å; S866-S868 PolarHBondContact O-N 3.45Å; S866-S868 VanDerWaalsContact O-N 3.09Å; S866-S869 PolarHBondContact O-N 3.04Å
867	S	41.1	Very low	46.1	Very low	98 Å²	98	87.9 Å²	87.9	69%	0.685	54%	0.539	S	S	*	.	H	α-helix	trans	-61.3	-27.4	-159.9	-154.1	0	0	0	0	116
868	S	42.3	Very low	47.4	Very low	99 Å²	99	81.4 Å²	81.4	69%	0.692	51%	0.511	S	S	*	.	H	α-helix	trans	-75	-31.3	-176.5	52.1	0	0	0	0	114.7	S866	S866-S868 VanDerWaalsContact C-N 3.31Å; S866-S868 PolarHBondContact O-N 3.45Å; S866-S868 VanDerWaalsContact O-N 3.09Å
869	S	41.1	Very low	48.4	Very low	67 Å²	67	79.1 Å²	79.1	47%	0.469	49%	0.494	S	S	.	.	H	α-helix	trans	-76.9	-36.6	-171.7	-63.2	0	0	0	0	113.3	S866 V871 I873	S866-S869 PolarHBondContact O-N 3.04Å; S869-V871 VanDerWaalsContact C-N 3.34Å; S869-V871 PolarHBondContact O-N 2.83Å; S869-I873 WeakPolarHBondContact O-CD1 3.46Å; S869-I873 WeakPolarHBondContact O-CG1 3.43Å; S869-I873 PolarHBondContact O-N 3.24Å
870	F	44.4	Very low	50.2	Low	167 Å²	167	79.3 Å²	79.3	73%	0.732	50%	0.495	S	S	*	.	H	α-helix	trans	-65.8	-36.2	-177	-114.8	-92.4	0	0	0	112.6	I873 G874	F870-I873 PolarHBondContact O-N 2.73Å; F870-G874 PolarHBondContact O-N 3.28Å
871	V	53.1	Low	52	Low	70 Å²	70	80.4 Å²	80.4	42%	0.424	49%	0.491	S	S	.	.	H	α-helix	trans	-64	-46.3	-179.4	-177.6	0	0	0	0	111.2	S869 I873 G874 Q875 P916	S869-V871 VanDerWaalsContact C-N 3.34Å; S869-V871 PolarHBondContact O-N 2.83Å; V871-I873 VanDerWaalsContact C-N 3.35Å; V871-I873 PolarHBondContact O-N 2.96Å; V871-G874 PolarHBondContact O-N 3.29Å; V871-Q875 PolarHBondContact O-N 3.09Å; V871-Q875 VanDerWaalsContact O-N 3.1Å; V871-P916 HydrophobicContact CG1-CB 3.86Å; V871-P916 HydrophobicContact CG1-CG 3.71Å
872	A	53.3	Low	53.8	Low	51 Å²	51	79.6 Å²	79.6	42%	0.421	48%	0.483	S	S	.	.	H	α-helix	trans	-64.4	-38.2	178.3	0	0	0	0	0	112.5	Q875 V876	A872-Q875 PolarHBondContact O-N 3.3Å; A872-V876 WeakPolarHBondContact O-CG2 3.44Å; A872-V876 PolarHBondContact O-N 2.89Å
873	I	53.6	Low	55.5	Low	98 Å²	98	79.9 Å²	79.9	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-64.8	-42.5	176.1	-66.8	165.9	0	0	0	110.5	S869 F870 V871 Q875 V876 I877	S869-I873 WeakPolarHBondContact O-CD1 3.46Å; S869-I873 WeakPolarHBondContact O-CG1 3.43Å; S869-I873 PolarHBondContact O-N 3.24Å; F870-I873 PolarHBondContact O-N 2.73Å; V871-I873 VanDerWaalsContact C-N 3.35Å; V871-I873 PolarHBondContact O-N 2.96Å; I873-Q875 PolarHBondContact O-N 3.22Å; I873-V876 PolarHBondContact O-N 3.38Å; I873-I877 HydrophobicContact CG2-CD1 3.87Å; I873-I877 WeakPolarHBondContact O-CG1 3.48Å; I873-I877 PolarHBondContact O-N 3.23Å; I873-I877 VanDerWaalsContact O-N 3.13Å
874	G	59.8	Low	57.2	Low	18 Å²	18	78.7 Å²	78.7	19%	0.186	47%	0.465	C	S	.	.	H	α-helix	trans	-58.9	-45.8	175.3	0	0	0	0	0	113.3	F870 V871 V876 I877 G878	F870-G874 PolarHBondContact O-N 3.28Å; V871-G874 PolarHBondContact O-N 3.29Å; G874-V876 PolarHBondContact O-N 3.03Å; G874-I877 PolarHBondContact O-N 3.46Å; G874-G878 PolarHBondContact O-N 3.23Å
875	Q	59.9	Low	59	Low	55 Å²	55	69.1 Å²	69.1	26%	0.257	43%	0.428	S	S	.	.	H	α-helix	trans	-60.5	-42.1	177.8	-72.9	179	-42.8	0	0	112.8	V871 A872 I873 G878 L879 P916	V871-Q875 PolarHBondContact O-N 3.09Å; V871-Q875 VanDerWaalsContact O-N 3.1Å; A872-Q875 PolarHBondContact O-N 3.3Å; I873-Q875 PolarHBondContact O-N 3.22Å; Q875-G878 PolarHBondContact O-N 3.01Å; Q875-L879 PolarHBondContact O-N 2.9Å; Q875-P916 HydrophobicContact CG-CG 3.84Å
876	V	58.4	Low	60.6	Low	96 Å²	96	69.9 Å²	69.9	58%	0.582	41%	0.414	S	S	*	.	H	α-helix	trans	-65.1	-42.4	178.1	173.2	0	0	0	0	111.2	A872 I873 G874 L879 V880	A872-V876 WeakPolarHBondContact O-CG2 3.44Å; A872-V876 PolarHBondContact O-N 2.89Å; I873-V876 PolarHBondContact O-N 3.38Å; G874-V876 PolarHBondContact O-N 3.03Å; V876-L879 PolarHBondContact O-N 3.16Å; V876-V880 WeakPolarHBondContact O-CG2 3.37Å; V876-V880 PolarHBondContact O-N 3.4Å; V876-V880 VanDerWaalsContact O-N 3.1Å
877	I	69.7	Low	62.1	Low	86 Å²	86	71.9 Å²	71.9	44%	0.441	42%	0.418	S	S	.	.	H	α-helix	trans	-64	-43.3	176.5	-64.7	166.6	0	0	0	110.6	I873 G874 L879 V880 L881 L912	I873-I877 HydrophobicContact CG2-CD1 3.87Å; I873-I877 WeakPolarHBondContact O-CG1 3.48Å; I873-I877 PolarHBondContact O-N 3.23Å; I873-I877 VanDerWaalsContact O-N 3.13Å; G874-I877 PolarHBondContact O-N 3.46Å; I877-L879 PolarHBondContact O-N 2.79Å; I877-V880 PolarHBondContact O-N 2.71Å; I877-L881 HydrophobicContact CG2-CD1 4Å; I877-L881 HydrophobicContact CG2-CG 4.49Å; I877-L881 WeakPolarHBondContact O-CG 3.39Å; I877-L881 PolarHBondContact O-N 3.4Å; I877-L912 HydrophobicContact CG2-CD1 3.95Å
878	G	69.2	Low	63.2	Low	0 Å²	0	68.1 Å²	68.1	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-58.8	-46.9	176.4	0	0	0	0	0	113.2	G874 Q875 V880 L881 F882 G909	G874-G878 PolarHBondContact O-N 3.23Å; Q875-G878 PolarHBondContact O-N 3.01Å; G878-V880 PolarHBondContact O-N 3.06Å; G878-L881 PolarHBondContact O-N 3.09Å; G878-F882 WeakPolarHBondContact O-CB 3.45Å; G878-F882 PolarHBondContact O-N 3.01Å; G878-G909 WeakPolarHBondContact CA-O 3.42Å; G878-G909 WeakPolarHBondContact O-CA 3.32Å
879	L	69.9	Low	64.3	Low	58 Å²	58	67.4 Å²	67.4	30%	0.304	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-41.7	177.9	-176.8	62.8	0	0	0	112.4	Q875 V876 I877 F882 I883	Q875-L879 PolarHBondContact O-N 2.9Å; V876-L879 PolarHBondContact O-N 3.16Å; I877-L879 PolarHBondContact O-N 2.79Å; L879-F882 PolarHBondContact O-N 3.33Å; L879-I883 HydrophobicContact CD1-CD1 3.93Å; L879-I883 HydrophobicContact CD1-CG1 4.35Å; L879-I883 HydrophobicContact CG-CD1 3.95Å; L879-I883 WeakPolarHBondContact O-CG1 3.29Å; L879-I883 PolarHBondContact O-N 2.74Å
880	V	72.6	Confident	65.1	Low	98 Å²	98	70 Å²	70	59%	0.594	39%	0.386	S	S	*	.	H	α-helix	trans	-65.1	-42.6	177.8	169.9	0	0	0	0	111.5	V876 I877 G878 G884	V876-V880 WeakPolarHBondContact O-CG2 3.37Å; V876-V880 PolarHBondContact O-N 3.4Å; V876-V880 VanDerWaalsContact O-N 3.1Å; I877-V880 PolarHBondContact O-N 2.71Å; G878-V880 PolarHBondContact O-N 3.06Å; V880-G884 PolarHBondContact O-N 3.01Å
881	L	75.6	Confident	65.6	Low	65 Å²	65	66 Å²	66	34%	0.34	37%	0.37	S	S	.	.	H	α-helix	trans	-65.6	-41	176.6	-70.1	172.4	0	0	0	112.1	I877 G878 G884 G885 S905 V908 L912	I877-L881 HydrophobicContact CG2-CD1 4Å; I877-L881 HydrophobicContact CG2-CG 4.49Å; I877-L881 WeakPolarHBondContact O-CG 3.39Å; I877-L881 PolarHBondContact O-N 3.4Å; G878-L881 PolarHBondContact O-N 3.09Å; L881-G884 PolarHBondContact O-N 3.44Å; L881-G885 PolarHBondContact O-N 3Å; L881-S905 CarbonylContact C-O 3.58Å; L881-V908 HydrophobicContact CD1-CG1 3.8Å; L881-L912 HydrophobicContact CD1-CD1 4.06Å
882	F	75.3	Confident	65.6	Low	73 Å²	73	67.2 Å²	67.2	32%	0.32	37%	0.373	S	S	.	.	H	α-helix	trans	-63.1	-45.5	176.8	-178.3	-106.7	0	0	0	112.6	G878 L879 G885 L886 I906 V910	G878-F882 WeakPolarHBondContact O-CB 3.45Å; G878-F882 PolarHBondContact O-N 3.01Å; L879-F882 PolarHBondContact O-N 3.33Å; F882-G885 PolarHBondContact O-N 3.2Å; F882-L886 HydrophobicContact CD1-CD1 3.93Å; F882-L886 HydrophobicContact CE1-CD1 3.44Å; F882-L886 VanDerWaalsContact CE1-CD1 3.44Å; F882-L886 HydrophobicContact CE1-CG 4.48Å; F882-L886 HydrophobicContact CE2-CD1 4.46Å; F882-L886 HydrophobicContact CZ-CD1 3.75Å; F882-L886 HydrophobicContact CZ-CG 4.47Å; F882-L886 PolarHBondContact O-N 3.4Å; F882-I906 HydrophobicContact CD2-CG2 4.16Å; F882-I906 HydrophobicContact CE2-CG2 4.12Å; F882-V910 HydrophobicContact CD2-CG2 3.79Å; F882-V910 HydrophobicContact CE2-CG2 3.82Å
883	I	74.4	Confident	65.3	Low	65 Å²	65	68.5 Å²	68.5	33%	0.333	39%	0.392	S	S	.	.	H	α-helix	trans	-67.3	-41.2	176.9	-67.1	170	0	0	0	111	L879 G885 L886 L887	L879-I883 HydrophobicContact CD1-CD1 3.93Å; L879-I883 HydrophobicContact CD1-CG1 4.35Å; L879-I883 HydrophobicContact CG-CD1 3.95Å; L879-I883 WeakPolarHBondContact O-CG1 3.29Å; L879-I883 PolarHBondContact O-N 2.74Å; I883-G885 VanDerWaalsContact C-N 3.3Å; I883-G885 PolarHBondContact O-N 2.84Å; I883-L886 PolarHBondContact O-N 3.23Å; I883-L887 HydrophobicContact CG2-CD1 3.97Å; I883-L887 HydrophobicContact CG2-CG 4.47Å; I883-L887 WeakPolarHBondContact O-CG 3.42Å; I883-L887 PolarHBondContact O-N 3.35Å
884	G	70.8	Confident	65.2	Low	43 Å²	43	71.9 Å²	71.9	44%	0.443	40%	0.403	S	S	.	.	H	α-helix	trans	-59.2	-41.5	173.8	0	0	0	0	0	112.4	V880 L881 G888	V880-G884 PolarHBondContact O-N 3.01Å; L881-G884 PolarHBondContact O-N 3.44Å; G884-G888 PolarHBondContact O-N 3.03Å
885	G	74.2	Confident	64.7	Low	0 Å²	0	78 Å²	78	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-61.4	-51.7	173.3	0	0	0	0	0	112.8	L881 F882 I883 L887 G888 L889 C902 S905	L881-G885 PolarHBondContact O-N 3Å; F882-G885 PolarHBondContact O-N 3.2Å; I883-G885 VanDerWaalsContact C-N 3.3Å; I883-G885 PolarHBondContact O-N 2.84Å; G885-L887 VanDerWaalsContact C-N 3.35Å; G885-L887 PolarHBondContact O-N 3.29Å; G885-G888 VanDerWaalsContact O-CA 3.28Å; G885-G888 WeakPolarHBondContact O-CA 3.3Å; G885-G888 PolarHBondContact O-N 3.18Å; G885-L889 PolarHBondContact O-N 3.5Å; G885-C902 PolarHBondContact O-SG 3.36Å; G885-S905 VanDerWaalsContact CA-OG 3.27Å; G885-S905 WeakPolarHBondContact CA-OG 3.39Å
886	L	74.3	Confident	63.9	Low	93 Å²	93	81.9 Å²	81.9	49%	0.487	45%	0.454	S	S	.	.	H	α-helix	trans	-57.7	-42.6	177.7	-82.7	168.8	0	0	0	113.2	F882 I883 G888 L889	F882-L886 HydrophobicContact CD1-CD1 3.93Å; F882-L886 HydrophobicContact CE1-CD1 3.44Å; F882-L886 VanDerWaalsContact CE1-CD1 3.44Å; F882-L886 HydrophobicContact CE1-CG 4.48Å; F882-L886 HydrophobicContact CE2-CD1 4.46Å; F882-L886 HydrophobicContact CZ-CD1 3.75Å; F882-L886 HydrophobicContact CZ-CG 4.47Å; F882-L886 PolarHBondContact O-N 3.4Å; I883-L886 PolarHBondContact O-N 3.23Å; L886-G888 VanDerWaalsContact C-N 3.26Å; L886-G888 PolarHBondContact O-N 3.1Å; L886-L889 HydrophobicContact CD2-CD1 4.3Å; L886-L889 PolarHBondContact O-N 3.28Å
887	L	70.1	Confident	64	Low	109 Å²	109	80.2 Å²	80.2	57%	0.571	46%	0.456	S	S	*	.	H	α-helix	trans	-68	-28.5	174.1	-67	171.2	0	0	0	112.1	I883 G885 K890	I883-L887 HydrophobicContact CG2-CD1 3.97Å; I883-L887 HydrophobicContact CG2-CG 4.47Å; I883-L887 WeakPolarHBondContact O-CG 3.42Å; I883-L887 PolarHBondContact O-N 3.35Å; G885-L887 VanDerWaalsContact C-N 3.35Å; G885-L887 PolarHBondContact O-N 3.29Å; L887-K890 PolarHBondContact O-N 3.02Å
888	G	65.3	Low	63.5	Low	20 Å²	20	77.3 Å²	77.3	21%	0.206	45%	0.445	C	S	.	.	H	α-helix	trans	-64.8	-29.2	174	0	0	0	0	0	114.7	G884 G885 L886 K890 Q891	G884-G888 PolarHBondContact O-N 3.03Å; G885-G888 VanDerWaalsContact O-CA 3.28Å; G885-G888 WeakPolarHBondContact O-CA 3.3Å; G885-G888 PolarHBondContact O-N 3.18Å; L886-G888 VanDerWaalsContact C-N 3.26Å; L886-G888 PolarHBondContact O-N 3.1Å; G888-K890 PolarHBondContact O-N 3.46Å; G888-K890 VanDerWaalsContact O-N 3.12Å; G888-Q891 WeakPolarHBondContact O-CB 3.29Å; G888-Q891 PolarHBondContact O-N 3.39Å
889	L	65.2	Low	63.4	Low	84 Å²	84	78.5 Å²	78.5	44%	0.44	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-57.4	-30.6	177.6	-86.4	109.1	0	0	0	112.5	G885 L886 Q891 I892 I906	G885-L889 PolarHBondContact O-N 3.5Å; L886-L889 HydrophobicContact CD2-CD1 4.3Å; L886-L889 PolarHBondContact O-N 3.28Å; L889-Q891 PolarHBondContact O-N 3.32Å; L889-I892 HydrophobicContact CB-CD1 4.28Å; L889-I892 HydrophobicContact CD2-CD1 4.21Å; L889-I892 HydrophobicContact CG-CD1 4.02Å; L889-I892 VanDerWaalsContact O-CB 3.29Å; L889-I892 WeakPolarHBondContact O-CB 3.44Å; L889-I892 WeakPolarHBondContact O-CG1 3.44Å; L889-I892 PolarHBondContact O-N 3.44Å; L889-I906 HydrophobicContact CD1-CD1 3.73Å
890	K	58.9	Low	63.4	Low	121 Å²	121	81.5 Å²	81.5	53%	0.526	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-74.1	-0.7	178.1	-159.9	170.7	173	-170.5	0	113.9	M438 L887 G888	M438-K890 HydrophobicContact CE-CB 4.12Å; M438-K890 HydrophobicContact CE-CD 3.73Å; M438-K890 HydrophobicContact CE-CG 3.84Å; M438-K890 HydrophobicContact SD-CD 3.81Å; L887-K890 PolarHBondContact O-N 3.02Å; G888-K890 PolarHBondContact O-N 3.46Å; G888-K890 VanDerWaalsContact O-N 3.12Å
891	Q	54.5	Low	63.1	Low	82 Å²	82	79.8 Å²	79.8	38%	0.383	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-97.6	-11	169.1	-61.5	-78.5	-8.6	0	0	112.7	G888 L889 G893 K894 A898	G888-Q891 WeakPolarHBondContact O-CB 3.29Å; G888-Q891 PolarHBondContact O-N 3.39Å; L889-Q891 PolarHBondContact O-N 3.32Å; Q891-G893 PolarHBondContact O-N 3.35Å; Q891-K894 PolarHBondContact O-N 3.36Å; Q891-A898 HydrophobicContact CB-CB 4.46Å
892	I	52.4	Low	63	Low	96 Å²	96	77 Å²	77	49%	0.492	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	124.5	175.4	-61.2	174.6	0	0	0	107.7	L889	L889-I892 HydrophobicContact CB-CD1 4.28Å; L889-I892 HydrophobicContact CD2-CD1 4.21Å; L889-I892 HydrophobicContact CG-CD1 4.02Å; L889-I892 VanDerWaalsContact O-CB 3.29Å; L889-I892 WeakPolarHBondContact O-CB 3.44Å; L889-I892 WeakPolarHBondContact O-CG1 3.44Å; L889-I892 PolarHBondContact O-N 3.44Å
893	G	47.6	Very low	63	Low	79 Å²	79	79.3 Å²	79.3	81%	0.814	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	97	-3.2	-169.7	0	0	0	0	0	115.7	Q891	Q891-G893 PolarHBondContact O-N 3.35Å
894	K	51.9	Low	63	Low	169 Å²	169	80.9 Å²	80.9	74%	0.735	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	-17.4	176	-67.9	-168.2	177.1	-173.2	0	115.9	Q891	Q891-K894 PolarHBondContact O-N 3.36Å
895	K	48.6	Very low	63.3	Low	145 Å²	145	80.1 Å²	80.1	63%	0.63	47%	0.466	S	S	*	.	S	Bend	trans	-145.3	132.1	173.7	-65.6	-174.3	179.6	-175.4	0	110.7	A898	K895-A898 HydrophobicContact CB-CB 4.17Å; K895-A898 WeakPolarHBondContact O-CB 3.49Å; K895-A898 PolarHBondContact O-N 3.14Å
896	P	42.6	Very low	63.5	Low	138 Å²	138	82 Å²	82	90%	0.896	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	146.6	167	28.1	-33.5	0	0	0	109.8	A898	P896-A898 VanDerWaalsContact C-N 3.27Å; P896-A898 PolarHBondContact O-N 3.21Å
897	G	61.9	Low	63.6	Low	60 Å²	60	83.3 Å²	83.3	62%	0.619	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	-20.1	-177.2	0	0	0	0	0	116.2	G899 L900	G897-G899 VanDerWaalsContact C-N 3.27Å; G897-G899 PolarHBondContact O-N 3.13Å; G897-L900 PolarHBondContact O-N 3.09Å; G897-L900 VanDerWaalsContact O-N 3.15Å
898	A	59.1	Low	64	Low	26 Å²	26	81.2 Å²	81.2	22%	0.215	47%	0.474	C	S	.	.	H	α-helix	trans	-59.9	-33.5	-177.6	0	0	0	0	0	113.8	Q891 K895 P896 L900 C902	Q891-A898 HydrophobicContact CB-CB 4.46Å; K895-A898 HydrophobicContact CB-CB 4.17Å; K895-A898 WeakPolarHBondContact O-CB 3.49Å; K895-A898 PolarHBondContact O-N 3.14Å; P896-A898 VanDerWaalsContact C-N 3.27Å; P896-A898 PolarHBondContact O-N 3.21Å; A898-L900 PolarHBondContact O-N 3.44Å; A898-C902 VanDerWaalsContact O-CB 3.25Å; A898-C902 WeakPolarHBondContact O-CB 3.49Å; A898-C902 PolarHBondContact O-N 3.47Å
899	G	65.5	Low	64.3	Low	24 Å²	24	80.2 Å²	80.2	25%	0.247	46%	0.464	C	S	.	.	H	α-helix	trans	-64	-36.4	177.3	0	0	0	0	0	113.8	G897 C902 L903	G897-G899 VanDerWaalsContact C-N 3.27Å; G897-G899 PolarHBondContact O-N 3.13Å; G899-C902 WeakPolarHBondContact O-CB 3.36Å; G899-C902 PolarHBondContact O-N 3.41Å; G899-L903 WeakPolarHBondContact O-CG 3.4Å; G899-L903 PolarHBondContact O-N 3.2Å
900	L	70.8	Confident	64.8	Low	122 Å²	122	79.5 Å²	79.5	64%	0.639	46%	0.463	S	S	*	.	H	α-helix	trans	-74.7	-39.5	-176.8	-168.8	146.3	0	0	0	111.6	G897 A898 C902 L903 L904	G897-L900 PolarHBondContact O-N 3.09Å; G897-L900 VanDerWaalsContact O-N 3.15Å; A898-L900 PolarHBondContact O-N 3.44Å; L900-C902 VanDerWaalsContact C-N 3.35Å; L900-L903 PolarHBondContact O-N 3.18Å; L900-L904 HydrophobicContact CD2-CD1 3.69Å; L900-L904 HydrophobicContact CD2-CG 4.37Å; L900-L904 WeakPolarHBondContact O-CB 3.26Å; L900-L904 WeakPolarHBondContact O-CG 3.29Å; L900-L904 PolarHBondContact O-N 3.47Å
901	A	66.9	Low	65.5	Low	62 Å²	62	77.2 Å²	77.2	51%	0.512	46%	0.462	S	S	.	.	H	α-helix	trans	-65.4	-37.5	171.3	0	0	0	0	0	112.4	S905	A901-S905 PolarHBondContact O-N 2.97Å; A901-S905 PolarHBondContact O-OG 3.49Å
902	C	73.6	Confident	66.3	Low	7 Å²	7	76.4 Å²	76.4	5%	0.047	46%	0.46	C	S	.	.	H	α-helix	trans	-61.3	-50.6	173.3	173.5	0	0	0	0	111.5	G885 A898 G899 L900 L904 S905 I906	G885-C902 PolarHBondContact O-SG 3.36Å; A898-C902 VanDerWaalsContact O-CB 3.25Å; A898-C902 WeakPolarHBondContact O-CB 3.49Å; A898-C902 PolarHBondContact O-N 3.47Å; G899-C902 WeakPolarHBondContact O-CB 3.36Å; G899-C902 PolarHBondContact O-N 3.41Å; L900-C902 VanDerWaalsContact C-N 3.35Å; C902-L904 PolarHBondContact O-N 3.1Å; C902-S905 PolarHBondContact O-N 2.9Å; C902-S905 PolarHBondContact O-OG 3.38Å; C902-I906 WeakPolarHBondContact O-CG1 3.41Å; C902-I906 PolarHBondContact O-N 3.27Å; C902-I906 VanDerWaalsContact O-N 3.07Å
903	L	73.7	Confident	66.9	Low	120 Å²	120	73.8 Å²	73.8	63%	0.628	45%	0.452	S	S	*	.	H	α-helix	trans	-62.6	-41.3	177.7	-70.8	170.3	0	0	0	112.7	G899 L900 I906 L907	G899-L903 WeakPolarHBondContact O-CG 3.4Å; G899-L903 PolarHBondContact O-N 3.2Å; L900-L903 PolarHBondContact O-N 3.18Å; L903-I906 PolarHBondContact O-N 3.09Å; L903-L907 WeakPolarHBondContact O-CB 3.38Å; L903-L907 PolarHBondContact O-N 2.94Å
904	L	76.1	Confident	67.7	Low	99 Å²	99	73 Å²	73	52%	0.518	43%	0.431	S	S	.	.	H	α-helix	trans	-61.9	-44.1	175.3	-77.9	172.7	0	0	0	112.5	L900 C902 I906 L907 V908	L900-L904 HydrophobicContact CD2-CD1 3.69Å; L900-L904 HydrophobicContact CD2-CG 4.37Å; L900-L904 WeakPolarHBondContact O-CB 3.26Å; L900-L904 WeakPolarHBondContact O-CG 3.29Å; L900-L904 PolarHBondContact O-N 3.47Å; C902-L904 PolarHBondContact O-N 3.1Å; L904-I906 VanDerWaalsContact C-N 3.33Å; L904-I906 PolarHBondContact O-N 3.28Å; L904-L907 PolarHBondContact O-N 3.33Å; L904-V908 WeakPolarHBondContact O-CB 3.36Å; L904-V908 WeakPolarHBondContact O-CG2 3.29Å; L904-V908 PolarHBondContact O-N 3.15Å
905	S	77.1	Confident	68.1	Low	27 Å²	27	68.4 Å²	68.4	19%	0.189	42%	0.418	C	S	.	.	H	α-helix	trans	-66.5	-33.3	178.6	50.5	0	0	0	0	113	L881 G885 A901 C902 G909	L881-S905 CarbonylContact C-O 3.58Å; G885-S905 VanDerWaalsContact CA-OG 3.27Å; G885-S905 WeakPolarHBondContact CA-OG 3.39Å; A901-S905 PolarHBondContact O-N 2.97Å; A901-S905 PolarHBondContact O-OG 3.49Å; C902-S905 PolarHBondContact O-N 2.9Å; C902-S905 PolarHBondContact O-OG 3.38Å; S905-G909 PolarHBondContact O-N 3.49Å
906	I	77.6	Confident	68.2	Low	39 Å²	39	62.8 Å²	62.8	20%	0.2	40%	0.396	C	S	.	.	H	α-helix	trans	-65.6	-49.9	170.9	-66	166.4	0	0	0	110.6	F882 L889 C902 L903 L904 G909 V910	F882-I906 HydrophobicContact CD2-CG2 4.16Å; F882-I906 HydrophobicContact CE2-CG2 4.12Å; L889-I906 HydrophobicContact CD1-CD1 3.73Å; C902-I906 WeakPolarHBondContact O-CG1 3.41Å; C902-I906 PolarHBondContact O-N 3.27Å; C902-I906 VanDerWaalsContact O-N 3.07Å; L903-I906 PolarHBondContact O-N 3.09Å; L904-I906 VanDerWaalsContact C-N 3.33Å; L904-I906 PolarHBondContact O-N 3.28Å; I906-G909 PolarHBondContact O-N 3.5Å; I906-V910 WeakPolarHBondContact O-CG2 3.25Å; I906-V910 PolarHBondContact O-N 3.46Å
907	L	76.8	Confident	68.6	Low	120 Å²	120	62.4 Å²	62.4	63%	0.628	38%	0.382	S	S	*	.	H	α-helix	trans	-64.6	-45.9	-175.8	-165.1	158.8	0	0	0	111.9	L903 L904 C911	L903-L907 WeakPolarHBondContact O-CB 3.38Å; L903-L907 PolarHBondContact O-N 2.94Å; L904-L907 PolarHBondContact O-N 3.33Å; L907-C911 WeakPolarHBondContact O-CB 3.43Å; L907-C911 PolarHBondContact O-N 3.42Å
908	V	77.2	Confident	67.9	Low	65 Å²	65	65 Å²	65	39%	0.394	38%	0.381	S	S	.	.	H	α-helix	trans	-66.1	-38.8	174.9	176.3	0	0	0	0	111.2	L881 L904 C911 L912	L881-V908 HydrophobicContact CD1-CG1 3.8Å; L904-V908 WeakPolarHBondContact O-CB 3.36Å; L904-V908 WeakPolarHBondContact O-CG2 3.29Å; L904-V908 PolarHBondContact O-N 3.15Å; V908-C911 PolarHBondContact O-N 3.49Å; V908-L912 HydrophobicContact CG1-CD1 3.99Å; V908-L912 PolarHBondContact O-N 3.43Å
909	G	72.7	Confident	67.2	Low	0 Å²	0	69.7 Å²	69.7	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-62.1	-45.8	176.9	0	0	0	0	0	113.3	G878 S905 I906 A913	G878-G909 WeakPolarHBondContact CA-O 3.42Å; G878-G909 WeakPolarHBondContact O-CA 3.32Å; S905-G909 PolarHBondContact O-N 3.49Å; I906-G909 PolarHBondContact O-N 3.5Å; G909-A913 WeakPolarHBondContact O-CB 3.37Å; G909-A913 PolarHBondContact O-N 3.39Å; G909-A913 VanDerWaalsContact O-N 3.11Å
910	V	74.6	Confident	66.2	Low	68 Å²	68	70.3 Å²	70.3	41%	0.412	41%	0.407	S	S	.	.	H	α-helix	trans	-62.2	-46.2	173.5	170.7	0	0	0	0	110.8	F882 I906 L912 A913 V914	F882-V910 HydrophobicContact CD2-CG2 3.79Å; F882-V910 HydrophobicContact CE2-CG2 3.82Å; I906-V910 WeakPolarHBondContact O-CG2 3.25Å; I906-V910 PolarHBondContact O-N 3.46Å; V910-L912 PolarHBondContact O-N 2.93Å; V910-A913 PolarHBondContact O-N 3.38Å; V910-V914 HydrophobicContact CG1-CG2 4.14Å; V910-V914 WeakPolarHBondContact O-CB 3.47Å; V910-V914 VanDerWaalsContact O-CG2 3.29Å; V910-V914 WeakPolarHBondContact O-CG2 3.4Å; V910-V914 PolarHBondContact O-N 3.46Å
911	C	73.4	Confident	64.8	Low	74 Å²	74	67.5 Å²	67.5	50%	0.5	40%	0.397	S	S	.	.	H	α-helix	trans	-59.9	-47.2	-178.7	-164.8	0	0	0	0	112	L907 V908 A913 V914 V915	L907-C911 WeakPolarHBondContact O-CB 3.43Å; L907-C911 PolarHBondContact O-N 3.42Å; V908-C911 PolarHBondContact O-N 3.49Å; C911-A913 VanDerWaalsContact C-N 3.3Å; C911-A913 PolarHBondContact O-N 2.77Å; C911-V914 PolarHBondContact O-N 3.33Å; C911-V915 WeakPolarHBondContact O-CG2 3.38Å; C911-V915 PolarHBondContact O-N 2.89Å
912	L	72	Confident	63.6	Low	64 Å²	64	65.8 Å²	65.8	34%	0.335	39%	0.386	S	S	.	.	H	α-helix	trans	-66.5	-28.1	177.4	-79	168.7	0	0	0	113.7	I877 L881 V908 V910	I877-L912 HydrophobicContact CG2-CD1 3.95Å; L881-L912 HydrophobicContact CD1-CD1 4.06Å; V908-L912 HydrophobicContact CG1-CD1 3.99Å; V908-L912 PolarHBondContact O-N 3.43Å; V910-L912 PolarHBondContact O-N 2.93Å
913	A	65.7	Low	62.1	Low	41 Å²	41	72 Å²	72	34%	0.339	41%	0.414	S	S	.	.	H	α-helix	trans	-77.6	-31	176.5	0	0	0	0	0	113.4	G909 V910 C911	G909-A913 WeakPolarHBondContact O-CB 3.37Å; G909-A913 PolarHBondContact O-N 3.39Å; G909-A913 VanDerWaalsContact O-N 3.11Å; V910-A913 PolarHBondContact O-N 3.38Å; C911-A913 VanDerWaalsContact C-N 3.3Å; C911-A913 PolarHBondContact O-N 2.77Å
914	V	65	Low	60.6	Low	62 Å²	62	75.4 Å²	75.4	38%	0.376	42%	0.424	S	S	.	.	H	α-helix	trans	-95.7	-23.2	-169	173.4	0	0	0	0	114	V910 C911 P916 E917 L918	V910-V914 HydrophobicContact CG1-CG2 4.14Å; V910-V914 WeakPolarHBondContact O-CB 3.47Å; V910-V914 VanDerWaalsContact O-CG2 3.29Å; V910-V914 WeakPolarHBondContact O-CG2 3.4Å; V910-V914 PolarHBondContact O-N 3.46Å; C911-V914 PolarHBondContact O-N 3.33Å; V914-P916 VanDerWaalsContact C-CD 3.41Å; V914-P916 VanDerWaalsContact C-N 3.33Å; V914-E917 PolarHBondContact O-N 3.43Å; V914-E917 VanDerWaalsContact O-N 3.14Å; V914-L918 HydrophobicContact CG1-CD1 3.86Å; V914-L918 HydrophobicContact CG1-CG 3.95Å; V914-L918 PolarHBondContact O-N 3.47Å; V914-L918 VanDerWaalsContact O-N 3.13Å
915	V	58.6	Low	59	Low	74 Å²	74	76.5 Å²	76.5	45%	0.448	44%	0.435	S	S	.	.	H	α-helix	trans	-47.7	-43.1	177.1	161	0	0	0	0	114.4	C911 L918 M919	C911-V915 WeakPolarHBondContact O-CG2 3.38Å; C911-V915 PolarHBondContact O-N 2.89Å; V915-L918 PolarHBondContact O-N 3.01Å; V915-M919 PolarHBondContact O-N 3.21Å
916	P	52.2	Low	57.2	Low	27 Å²	27	81.3 Å²	81.3	18%	0.175	46%	0.457	C	S	.	.	H	α-helix	trans	-69.4	-38.1	-179.3	-20.4	35.2	0	0	0	113.5	V871 Q875 V914 L918 M919 G920	V871-P916 HydrophobicContact CG1-CB 3.86Å; V871-P916 HydrophobicContact CG1-CG 3.71Å; Q875-P916 HydrophobicContact CG-CG 3.84Å; V914-P916 VanDerWaalsContact C-CD 3.41Å; V914-P916 VanDerWaalsContact C-N 3.33Å; P916-L918 VanDerWaalsContact C-N 3.33Å; P916-M919 PolarHBondContact O-N 2.92Å; P916-G920 PolarHBondContact O-N 2.74Å
917	E	51.1	Low	55.3	Low	130 Å²	130	82.6 Å²	82.6	61%	0.607	48%	0.481	S	S	*	.	H	α-helix	trans	-65.6	-37.2	177.5	-66.4	-65.7	147	0	0	111.4	V914 G920 S921	V914-E917 PolarHBondContact O-N 3.43Å; V914-E917 VanDerWaalsContact O-N 3.14Å; E917-G920 PolarHBondContact O-N 2.69Å; E917-S921 VanDerWaalsContact O-CB 3.31Å; E917-S921 WeakPolarHBondContact O-CB 3.49Å; E917-S921 PolarHBondContact O-N 2.89Å; E917-S921 PolarHBondContact O-OG 3.33Å
918	L	46.3	Very low	53.3	Low	114 Å²	114	83.9 Å²	83.9	60%	0.597	49%	0.488	S	S	*	.	H	α-helix	trans	-66.3	-40.2	174.9	-75.5	170.7	0	0	0	112.3	V914 V915 P916 S921 G922	V914-L918 HydrophobicContact CG1-CD1 3.86Å; V914-L918 HydrophobicContact CG1-CG 3.95Å; V914-L918 PolarHBondContact O-N 3.47Å; V914-L918 VanDerWaalsContact O-N 3.13Å; V915-L918 PolarHBondContact O-N 3.01Å; P916-L918 VanDerWaalsContact C-N 3.33Å; L918-S921 PolarHBondContact O-N 2.9Å; L918-G922 PolarHBondContact O-N 3.38Å
919	M	45	Very low	51.5	Low	124 Å²	124	85.8 Å²	85.8	61%	0.611	50%	0.503	S	S	*	.	H	α-helix	trans	-66.7	-42.1	174.9	-73.8	179.5	64.3	0	0	112.1	V915 P916 S921 Q923	V915-M919 PolarHBondContact O-N 3.21Å; P916-M919 PolarHBondContact O-N 2.92Å; M919-S921 VanDerWaalsContact C-N 3.3Å; M919-S921 PolarHBondContact O-N 3.5Å; M919-Q923 WeakPolarHBondContact O-CG 3.31Å; M919-Q923 PolarHBondContact O-N 3.06Å
920	G	43	Very low	50	Low	37 Å²	37	91.9 Å²	91.9	38%	0.381	54%	0.543	S	S	.	.	H	α-helix	trans	-66.7	-29.3	175.9	0	0	0	0	0	113.9	P916 E917	P916-G920 PolarHBondContact O-N 2.74Å; E917-G920 PolarHBondContact O-N 2.69Å
921	S	41.2	Very low	48.2	Very low	63 Å²	63	94.8 Å²	94.8	44%	0.441	56%	0.561	S	S	.	*	H	α-helix	trans	-78.2	-48.4	175.2	-59	0	0	0	0	111.8	E917 L918 M919 Q923 K924 T925	E917-S921 VanDerWaalsContact O-CB 3.31Å; E917-S921 WeakPolarHBondContact O-CB 3.49Å; E917-S921 PolarHBondContact O-N 2.89Å; E917-S921 PolarHBondContact O-OG 3.33Å; L918-S921 PolarHBondContact O-N 2.9Å; M919-S921 VanDerWaalsContact C-N 3.3Å; M919-S921 PolarHBondContact O-N 3.5Å; S921-Q923 VanDerWaalsContact C-N 3.33Å; S921-Q923 PolarHBondContact O-N 3.45Å; S921-K924 WeakPolarHBondContact O-CB 3.45Å; S921-K924 PolarHBondContact O-N 3.32Å; S921-T925 PolarHBondContact O-N 3.28Å; S921-T925 PolarHBondContact O-OG1 3.17Å
922	G	42.2	Very low	46.2	Very low	26 Å²	26	96.8 Å²	96.8	27%	0.268	58%	0.576	S	S	.	*	H	α-helix	trans	-61.3	-36.4	-176.9	0	0	0	0	0	113.8	L918 K924 T925 L926	L918-G922 PolarHBondContact O-N 3.38Å; G922-K924 VanDerWaalsContact C-N 3.29Å; G922-K924 PolarHBondContact O-N 3.27Å; G922-T925 PolarHBondContact O-N 3.08Å; G922-T925 VanDerWaalsContact O-N 3.17Å; G922-L926 WeakPolarHBondContact O-CB 3.47Å; G922-L926 VanDerWaalsContact O-CG 3.31Å; G922-L926 WeakPolarHBondContact O-CG 3.31Å; G922-L926 PolarHBondContact O-N 3.38Å; G922-L926 VanDerWaalsContact O-N 3.08Å
923	Q	41.8	Very low	44.7	Very low	137 Å²	137	101.3 Å²	101.3	64%	0.64	60%	0.598	S	S	*	*	H	α-helix	trans	-63.6	-33.1	175.4	-73.3	-178	-11.5	0	0	112.8	M919 S921 T925	M919-Q923 WeakPolarHBondContact O-CG 3.31Å; M919-Q923 PolarHBondContact O-N 3.06Å; S921-Q923 VanDerWaalsContact C-N 3.33Å; S921-Q923 PolarHBondContact O-N 3.45Å; Q923-T925 VanDerWaalsContact C-N 3.33Å
924	K	42.7	Very low	43.3	Very low	192 Å²	192	108 Å²	108	84%	0.835	64%	0.643	S	S	*	*	H	α-helix	trans	-73	-25	176	-65.3	179.7	179.2	-175	0	112.8	S921 G922	S921-K924 WeakPolarHBondContact O-CB 3.45Å; S921-K924 PolarHBondContact O-N 3.32Å; G922-K924 VanDerWaalsContact C-N 3.29Å; G922-K924 PolarHBondContact O-N 3.27Å
925	T	42.5	Very low	42.2	Very low	122 Å²	122	110.4 Å²	110.4	75%	0.748	66%	0.657	S	S	*	*	H	α-helix	trans	-86.5	-21.4	176.4	-37.4	0	0	0	0	113.2	S921 G922 Q923	S921-T925 PolarHBondContact O-N 3.28Å; S921-T925 PolarHBondContact O-OG1 3.17Å; G922-T925 PolarHBondContact O-N 3.08Å; G922-T925 VanDerWaalsContact O-N 3.17Å; Q923-T925 VanDerWaalsContact C-N 3.33Å
926	L	39.5	Very low	41.3	Very low	128 Å²	128	112.3 Å²	112.3	67%	0.67	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	0	-173.1	-73	169.8	0	0	0	115.3	G922 L928	G922-L926 WeakPolarHBondContact O-CB 3.47Å; G922-L926 VanDerWaalsContact O-CG 3.31Å; G922-L926 WeakPolarHBondContact O-CG 3.31Å; G922-L926 PolarHBondContact O-N 3.38Å; G922-L926 VanDerWaalsContact O-N 3.08Å; L926-L928 PolarHBondContact O-N 3.31Å; L926-L928 VanDerWaalsContact O-N 3.09Å
927	G	38.1	Very low	40.7	Very low	67 Å²	67	117 Å²	117	69%	0.691	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.1	12.7	169.1	0	0	0	0	0	116.4	S929	G927-S929 PolarHBondContact O-N 3.2Å
928	L	35	Very low	40.1	Very low	147 Å²	147	116.2 Å²	116.2	77%	0.77	70%	0.7	S	S	*	*			trans	-82.2	103.2	179.6	-67.5	173.9	0	0	0	110.5	L926	L926-L928 PolarHBondContact O-N 3.31Å; L926-L928 VanDerWaalsContact O-N 3.09Å
929	S	38.6	Very low	39.7	Very low	104 Å²	104	116.4 Å²	116.4	73%	0.727	71%	0.706	S	S	*	*			trans	-54.4	133.5	177.4	-57.7	0	0	0	0	112.2	G927 V931	G927-S929 PolarHBondContact O-N 3.2Å; S929-V931 PolarHBondContact O-N 3.09Å
930	P	41.9	Very low	39.4	Very low	129 Å²	129	115.9 Å²	115.9	84%	0.838	71%	0.713	S	S	*	*			trans	-68.1	116	175	27.9	-33.2	0	0	0	109.9	S932	P930-S932 PolarHBondContact O-N 3.18Å
931	V	35.3	Very low	39.1	Very low	128 Å²	128	121.5 Å²	121.5	78%	0.776	74%	0.737	S	S	*	*			trans	-68.8	113.4	175.1	178.7	0	0	0	0	109	S929 I933	S929-V931 PolarHBondContact O-N 3.09Å; V931-I933 HydrophobicContact CG1-CG1 4.34Å; V931-I933 PolarHBondContact O-N 3.3Å
932	S	33.2	Very low	39	Very low	117 Å²	117	126 Å²	126	82%	0.818	76%	0.759	S	S	*	*			trans	-70.2	114.7	171.1	55.1	0	0	0	0	110.2	P930	P930-S932 PolarHBondContact O-N 3.18Å
933	I	39.4	Very low	38.7	Very low	158 Å²	158	134.3 Å²	134.3	81%	0.81	80%	0.8	S	S	*	*			trans	-105.4	136.8	162.9	-58.4	178.2	0	0	0	106.5	V931	V931-I933 HydrophobicContact CG1-CG1 4.34Å; V931-I933 PolarHBondContact O-N 3.3Å
934	S	36.5	Very low	38.4	Very low	183 Å²	183	134.1 Å²	134.1	100%	1.28	82%	0.815	S	S	*	*			trans	-78.1	0	-177.1	-173.3	0	0	0	0	113.8

Retrieved 934 of 934 residues in 1701.3 ms (Link to these results)

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