A0A2J8NQD9_PANTR Loading...

Serine/threonine-protein kinase receptor

AlphaFold DB , UniProt , Accession A0A2J8NQD9, Species PANTR (Pan troglodytes, Chimpanzee), Gene n/a, Length 518 aa.

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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	31.1	Very low	33.9	Very low	248 Å²	248	126.7 Å²	126.7	100%	1.222	76%	0.756	S	S	*	*				0	108.4	0	-76.5	172.8	176.6	0	0	106.7
2	G	30.5	Very low	33.9	Very low	88 Å²	88	124.2 Å²	124.2	91%	0.907	74%	0.741	S	S	*	*			trans	-72	127.3	-174.2	0	0	0	0	0	111.8
3	A	27.5	Very low	33.5	Very low	104 Å²	104	133.8 Å²	133.8	86%	0.86	76%	0.757	S	S	*	*			trans	-94.8	105.1	167.4	0	0	0	0	0	107.7
4	G	25.6	Very low	33.5	Very low	71 Å²	71	129.7 Å²	129.7	73%	0.732	75%	0.748	S	S	*	*			trans	-67.8	131	179.7	0	0	0	0	0	112	R6	G4-R6 PolarHBondContact O-N 3.25Å
5	T	30.1	Very low	33.2	Very low	145 Å²	145	130.7 Å²	130.7	89%	0.89	76%	0.757	S	S	*	*			trans	-57.4	111.9	165.1	7.5	0	0	0	0	108.9	S7	T5-S7 PolarHBondContact O-N 3.03Å
6	R	32.5	Very low	32.9	Very low	233 Å²	233	138.1 Å²	138.1	88%	0.879	77%	0.768	S	S	*	*			trans	-73.1	96.6	176.3	-88.4	-175.9	173	-173.3	-1.1	109.7	G4 L8	G4-R6 PolarHBondContact O-N 3.25Å; R6-L8 PolarHBondContact O-N 3.43Å
7	S	35.7	Very low	32.7	Very low	73 Å²	73	135.6 Å²	135.6	51%	0.51	77%	0.77	S	S	.	*			trans	-67.5	103.4	160.5	-174.7	0	0	0	0	108.6	T5 R9	T5-S7 PolarHBondContact O-N 3.03Å; S7-R9 PolarHBondContact O-N 3.4Å
8	L	40	Very low	32.9	Very low	116 Å²	116	142.4 Å²	142.4	61%	0.607	78%	0.781	S	S	*	*			trans	-82.2	97.3	173.4	-90.4	148.3	0	0	0	108.7	R6 I76	R6-L8 PolarHBondContact O-N 3.43Å; L8-I76 HydrophobicContact CB-CD1 4.47Å
9	R	39.5	Very low	32.6	Very low	194 Å²	194	138.7 Å²	138.7	73%	0.732	78%	0.779	S	S	*	*			trans	-86.7	112.3	175.1	-68	180	-177.6	-178.9	-1.4	109.7	S7	S7-R9 PolarHBondContact O-N 3.4Å
10	V	43	Very low	32.4	Very low	67 Å²	67	139 Å²	139	41%	0.406	78%	0.784	S	S	.	*			trans	-106.7	110.7	168.1	-175.1	0	0	0	0	108.1	I76	V10-I76 HydrophobicContact CG2-CD1 4.03Å
11	G	36.9	Very low	32.4	Very low	55 Å²	55	142.1 Å²	142.1	57%	0.567	79%	0.793	S	S	*	*			trans	-111.8	129.4	174.7	0	0	0	0	0	110.2
12	V	34.8	Very low	32.3	Very low	96 Å²	96	134.1 Å²	134.1	58%	0.582	77%	0.773	S	S	*	*			trans	-84.9	122.6	167.8	179.7	0	0	0	0	107.4	A14	V12-A14 PolarHBondContact O-N 2.63Å
13	R	28.9	Very low	32.5	Very low	250 Å²	250	139.9 Å²	139.9	94%	0.943	77%	0.773	S	S	*	*			trans	-75.7	102.7	173.7	-107.5	-178.1	177.1	178.7	0.1	109
14	A	33	Very low	32.5	Very low	76 Å²	76	140.5 Å²	140.5	63%	0.628	77%	0.772	S	S	*	*			trans	-87.5	125.3	163.7	0	0	0	0	0	110	V12 R16	V12-A14 PolarHBondContact O-N 2.63Å; A14-R16 PolarHBondContact O-N 3.48Å
15	T	28.5	Very low	32.7	Very low	145 Å²	145	142.8 Å²	142.8	89%	0.89	78%	0.776	S	S	*	*			trans	-67.8	122.6	173.8	30.1	0	0	0	0	110.9	A17	T15-A17 PolarHBondContact O-N 2.93Å
16	R	29.3	Very low	33.1	Very low	249 Å²	249	139.5 Å²	139.5	94%	0.94	77%	0.771	S	S	*	*			trans	-74	111.6	-177.1	-152.1	179.5	-167.5	-175.2	4.2	110.9	A14	A14-R16 PolarHBondContact O-N 3.48Å
17	A	29.2	Very low	33.1	Very low	96 Å²	96	139.7 Å²	139.7	79%	0.793	77%	0.772	S	S	*	*			trans	-81	128	164.6	0	0	0	0	0	109.6	T15	T15-A17 PolarHBondContact O-N 2.93Å
18	R	35.9	Very low	33.4	Very low	258 Å²	258	140.5 Å²	140.5	97%	0.974	79%	0.792	S	S	*	*			trans	-74.4	122.6	174.6	-84.1	178.8	174.3	174.3	-1.7	109.5
19	G	28	Very low	33.6	Very low	72 Å²	72	143.6 Å²	143.6	74%	0.742	80%	0.803	S	S	*	*			trans	-134.2	120.1	170.3	0	0	0	0	0	110.7
20	T	28.2	Very low	34.1	Very low	144 Å²	144	137.8 Å²	137.8	88%	0.883	80%	0.797	S	S	*	*			trans	-33.2	139.5	179.3	38.9	0	0	0	0	119.5
21	Q	33.1	Very low	35	Very low	205 Å²	205	142.2 Å²	142.2	96%	0.958	81%	0.813	S	S	*	*			trans	-64.3	128.6	161.7	-79.2	176.4	-16.2	0	0	111.2
22	G	27.5	Very low	36.5	Very low	79 Å²	79	144.5 Å²	144.5	81%	0.814	82%	0.816	S	S	*	*			trans	-130	129.3	164.4	0	0	0	0	0	110.2
23	K	34.4	Very low	38.9	Very low	209 Å²	209	141.3 Å²	141.3	91%	0.909	79%	0.794	S	S	*	*			trans	-92.9	131.1	171.4	-87.1	-179.9	171.7	179	0	110
24	S	28.1	Very low	41.8	Very low	118 Å²	118	131.6 Å²	131.6	83%	0.825	76%	0.759	S	S	*	*			trans	170.6	122.7	142.5	50.4	0	0	0	0	108.2
25	S	29.3	Very low	44.7	Very low	119 Å²	119	128 Å²	128	83%	0.832	73%	0.729	S	S	*	*				98	97.8	78.3	-172	0	0	0	0	113.1
26	G	40.2	Very low	47.8	Very low	76 Å²	76	122.7 Å²	122.7	78%	0.784	70%	0.695	S	S	*	*			trans	23.6	103.2	151.5	0	0	0	0	0	121.5
27	R	31.7	Very low	50.7	Low	236 Å²	236	112.3 Å²	112.3	89%	0.891	66%	0.656	S	S	*	*	S	Bend	trans	-164.6	141.4	136.1	-111.4	172.1	176	177.4	-2.4	106.8	E29	R27-E29 PolarHBondContact O-N 3.38Å
28	G	42.8	Very low	53.7	Low	91 Å²	91	110.6 Å²	110.6	94%	0.938	63%	0.63	S	S	*	*			trans	-55.9	99.7	-171.1	0	0	0	0	0	112.8
29	E	42.3	Very low	56.2	Low	180 Å²	180	98.4 Å²	98.4	84%	0.841	58%	0.584	S	S	*	*			trans	-87	132.8	172.1	-77.8	175.7	154.2	0	0	108	R27 E31	R27-E29 PolarHBondContact O-N 3.38Å; E29-E31 PolarHBondContact O-N 3Å
30	A	51.6	Low	59	Low	72 Å²	72	96.9 Å²	96.9	60%	0.595	56%	0.564	S	S	*	*			trans	-52.7	128.6	166.6	0	0	0	0	0	108.3	T32	A30-T32 PolarHBondContact O-N 3.3Å
31	E	62.2	Low	61.8	Low	161 Å²	161	94.6 Å²	94.6	75%	0.752	55%	0.546	S	S	*	.			trans	-60.5	107.9	178.8	-78.6	-170.7	163.4	0	0	108.9	E29 L63	E29-E31 PolarHBondContact O-N 3Å; E31-L63 WeakPolarHBondContact O-CD1 3.49Å
32	T	67.3	Low	64.2	Low	103 Å²	103	88.6 Å²	88.6	63%	0.632	52%	0.515	S	S	*	.			trans	-86	134.4	174.1	48.4	0	0	0	0	108.9	A30	A30-T32 PolarHBondContact O-N 3.3Å
33	R	84.3	Confident	66.8	Low	29 Å²	29	91.8 Å²	91.8	11%	0.109	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134	-175.5	176.3	61.1	58.7	84.7	-1.3	109.7	R54 C55 L63 G112 N113	R33-R54 CarbonylContact O-C 3.6Å; R33-C55 HydrophobicContact CB-CB 4.06Å; R33-C55 PolarHBondContact N-O 3.35Å; R33-C55 PolarHBondContact O-N 2.92Å; R33-C55 PolarHBondContact O-SG 2.99Å; R33-L63 HydrophobicContact CB-CB 3.85Å; R33-L63 HydrophobicContact CB-CD1 4.08Å; R33-L63 HydrophobicContact CG-CB 4.21Å; R33-L63 PolarHBondContact NH1-O 3.46Å; R33-G112 VanDerWaalsContact CD-C 3.45Å; R33-G112 WeakPolarHBondContact CD-O 3.07Å; R33-N113 WeakPolarHBondContact CA-OD1 3.32Å; R33-N113 VanDerWaalsContact CD-OD1 3.28Å; R33-N113 WeakPolarHBondContact CD-OD1 3.24Å
34	E	91.3	Very high	69.1	Low	46 Å²	46	89.3 Å²	89.3	22%	0.215	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.3	178	-59.9	-165.7	128.4	0	0	110.2	L52 R54 N113 F114	E34-L52 HydrophobicContact CB-CD1 4.15Å; E34-L52 HydrophobicContact CB-CD2 4.24Å; E34-L52 HydrophobicContact CB-CG 4.36Å; E34-L52 HydrophobicContact CG-CD2 4.47Å; E34-R54 HydrophobicContact CG-CG 4.17Å; E34-R54 IonicContact OE1-CZ 2.66Å; E34-R54 IonicContact OE1-NE 3.68Å; E34-R54 PolarHBondContact OE1-NE 3.49Å; E34-R54 IonicContact OE1-NH2 3.52Å; E34-R54 PolarHBondContact OE1-NH2 3.07Å; E34-N113 PolarHBondContact N-OD1 3.47Å; E34-N113 CarbonylContact O-C 3.58Å; E34-N113 WeakPolarHBondContact O-CA 3.37Å; E34-F114 HydrophobicContact CB-CE1 4.24Å; E34-F114 HydrophobicContact CB-CE2 4.14Å; E34-F114 HydrophobicContact CB-CZ 3.83Å; E34-F114 PolarHBondContact O-N 3.31Å; E34-F114 WeakPolarHBondContact OE2-CZ 3.5Å
35	C	92.5	Very high	71.4	Confident	0 Å²	0	87.9 Å²	87.9	0%	0	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	144.6	-177.7	-63.7	0	0	0	0	111.6	Y37 L52 E53 C55 C65	C35-Y37 PolarHBondContact O-N 3.13Å; C35-L52 WeakPolarHBondContact O-CD1 3.25Å; C35-E53 PolarHBondContact N-O 3.2Å; C35-E53 PolarHBondContact O-N 2.87Å; C35-C55 PolarHBondContact SG-SG 3.38Å; C35-C65 VanDerWaalsContact CA-SG 3.55Å; C35-C65 HydrophobicContact CB-CB 3.7Å; C35-C65 WeakPolarHBondContact CB-SG 3.3Å; C35-C65 WeakPolarHBondContact SG-CA 3.27Å; C35-C65 WeakPolarHBondContact SG-CB 3.47Å; C35-C65 CovalentContact SG-SG 2.02Å; C35-C65 PolarHBondContact SG-SG 3.48Å
36	I	93.4	Very high	74.1	Confident	33 Å²	33	93.4 Å²	93.4	17%	0.169	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	127.7	173.8	-59.3	-60.8	0	0	0	108.7	L52 K81 G82 F114 N116 E117	I36-L52 HydrophobicContact CD1-CD1 4.41Å; I36-K81 HydrophobicContact CB-CD 4.4Å; I36-K81 HydrophobicContact CG2-CD 4.01Å; I36-K81 CarbonylContact O-C 3.52Å; I36-K81 WeakPolarHBondContact O-CB 3.3Å; I36-G82 PolarHBondContact O-N 2.87Å; I36-F114 HydrophobicContact CD1-CD1 3.86Å; I36-N116 WeakPolarHBondContact CB-OD1 3.25Å; I36-N116 PolarHBondContact N-OD1 2.8Å; I36-N116 PolarHBondContact O-ND2 3.41Å; I36-E117 HydrophobicContact CG1-CB 4.04Å; I36-E117 HydrophobicContact CG1-CG 4.5Å
37	Y	91.6	Very high	76.1	Confident	32 Å²	32	92.1 Å²	92.1	13%	0.125	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	136.1	177	-177.2	-107.4	0	0	0	110.5	C35 N39 T47 N48 S50 G51 E53 K81	C35-Y37 PolarHBondContact O-N 3.13Å; Y37-N39 HydrophobicContact CE1-CB 4.27Å; Y37-T47 VanDerWaalsContact OH-CB 3.32Å; Y37-T47 WeakPolarHBondContact OH-CB 3.43Å; Y37-T47 PolarHBondContact OH-OG1 3.41Å; Y37-N48 HydrophobicContact CE1-CB 4.35Å; Y37-N48 WeakPolarHBondContact CE1-O 3.22Å; Y37-S50 CarbonylContact O-C 3.51Å; Y37-S50 VanDerWaalsContact O-CA 3.3Å; Y37-S50 WeakPolarHBondContact O-CA 3.47Å; Y37-G51 PolarHBondContact N-O 3.25Å; Y37-G51 PolarHBondContact O-N 2.95Å; Y37-E53 HydrophobicContact CD2-CB 4.26Å; Y37-E53 HydrophobicContact CG-CB 4.34Å; Y37-K81 WeakPolarHBondContact CA-O 3.23Å; Y37-K81 VanDerWaalsContact CD2-O 3.3Å; Y37-K81 WeakPolarHBondContact CD2-O 3.37Å
38	Y	91.9	Very high	78.6	Confident	59 Å²	59	86.7 Å²	86.7	23%	0.231	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	139	171	-178.1	-92.5	0	0	0	109.4	A40 Q49 L78 K80 K81	Y38-A40 HydrophobicContact CE1-CB 4.11Å; Y38-Q49 CarbonylContact C-O 3.46Å; Y38-Q49 WeakPolarHBondContact CA-O 3.47Å; Y38-Q49 VanDerWaalsContact CD2-O 3.26Å; Y38-Q49 WeakPolarHBondContact CD2-O 3.36Å; Y38-Q49 HydrophobicContact CE2-CG 4.23Å; Y38-L78 HydrophobicContact CD1-CB 4.17Å; Y38-L78 HydrophobicContact CD1-CD2 3.38Å; Y38-L78 HydrophobicContact CD1-CG 3.55Å; Y38-L78 HydrophobicContact CD2-CD2 3.96Å; Y38-L78 HydrophobicContact CE1-CB 3.94Å; Y38-L78 HydrophobicContact CE1-CD2 3.86Å; Y38-L78 HydrophobicContact CE1-CG 3.86Å; Y38-L78 WeakPolarHBondContact CE1-O 3.11Å; Y38-L78 HydrophobicContact CE2-CD2 4.4Å; Y38-L78 HydrophobicContact CG-CD2 3.43Å; Y38-L78 VanDerWaalsContact CG-CD2 3.43Å; Y38-L78 HydrophobicContact CG-CG 4.13Å; Y38-K80 CarbonylContact O-C 3.55Å; Y38-K80 VanDerWaalsContact O-CA 3.27Å; Y38-K80 WeakPolarHBondContact O-CA 3.33Å; Y38-K80 WeakPolarHBondContact O-CG 3.44Å; Y38-K81 PolarHBondContact N-O 2.89Å; Y38-K81 PolarHBondContact O-N 3.42Å
39	N	87.6	Confident	80.6	Confident	3 Å²	3	86.8 Å²	86.8	2%	0.016	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	116	175	-170.6	2.8	0	0	0	110.6	Y37 N41 W42 E45 T47 Q49	Y37-N39 HydrophobicContact CE1-CB 4.27Å; N39-N41 VanDerWaalsContact C-N 3.27Å; N39-N41 PolarHBondContact O-N 3.21Å; N39-N41 PolarHBondContact OD1-N 2.75Å; N39-N41 VanDerWaalsContact OD1-N 3.08Å; N39-W42 HydrophobicContact CB-CB 4.25Å; N39-W42 WeakPolarHBondContact O-CB 3.38Å; N39-E45 PolarHBondContact ND2-OE2 3.48Å; N39-T47 PolarHBondContact ND2-OG1 3.2Å; N39-Q49 PolarHBondContact N-O 3.5Å
40	A	87	Confident	82.9	Confident	40 Å²	40	81.9 Å²	81.9	33%	0.331	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-30.3	176	0	0	0	0	0	112.5	Y38 V79	Y38-A40 HydrophobicContact CE1-CB 4.11Å; A40-V79 WeakPolarHBondContact CB-O 3.13Å; A40-V79 PolarHBondContact N-O 3.33Å; A40-V79 VanDerWaalsContact N-O 3.11Å
41	N	87.3	Confident	84.7	Confident	95 Å²	95	80.3 Å²	80.3	51%	0.508	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	26	-176.7	-70.6	-15.1	0	0	0	113.3	N39 E43 L44 E45	N39-N41 VanDerWaalsContact C-N 3.27Å; N39-N41 PolarHBondContact O-N 3.21Å; N39-N41 PolarHBondContact OD1-N 2.75Å; N39-N41 VanDerWaalsContact OD1-N 3.08Å; N41-E43 VanDerWaalsContact C-N 3.28Å; N41-E43 PolarHBondContact O-N 3.3Å; N41-L44 PolarHBondContact O-N 3.43Å; N41-E45 HydrophobicContact CB-CG 4.32Å; N41-E45 PolarHBondContact O-N 2.97Å
42	W	84.5	Confident	86	Confident	80 Å²	80	76.7 Å²	76.7	30%	0.303	39%	0.391	S	S	.	.	H	α-helix	trans	-58.6	-32.2	-171.2	68.2	-84.1	0	0	0	114.9	N39 R46 T47 Q49	N39-W42 HydrophobicContact CB-CB 4.25Å; N39-W42 WeakPolarHBondContact O-CB 3.38Å; W42-R46 CarbonylContact O-C 3.53Å; W42-R46 VanDerWaalsContact O-CA 3.27Å; W42-R46 WeakPolarHBondContact O-CA 3.22Å; W42-R46 PolarHBondContact O-N 3.35Å; W42-T47 WeakPolarHBondContact CB-O 3.46Å; W42-T47 PolarHBondContact O-N 3.35Å; W42-Q49 HydrophobicContact CB-CB 4.26Å; W42-Q49 VanDerWaalsContact CD1-CG 3.42Å; W42-Q49 HydrophobicContact CD2-CB 3.78Å; W42-Q49 HydrophobicContact CD2-CG 4.44Å; W42-Q49 HydrophobicContact CG-CB 3.57Å; W42-Q49 HydrophobicContact CG-CG 4.01Å
43	E	81.2	Confident	87	Confident	145 Å²	145	75.1 Å²	75.1	68%	0.678	38%	0.376	S	S	*	.	H	α-helix	trans	-67.2	-41.2	175.8	-65.5	-176.4	167	0	0	112.1	N41	N41-E43 VanDerWaalsContact C-N 3.28Å; N41-E43 PolarHBondContact O-N 3.3Å
44	L	82.3	Confident	87.2	Confident	158 Å²	158	82.2 Å²	82.2	83%	0.827	40%	0.403	S	S	*	.	H	α-helix	trans	-72.2	-43.6	176.4	-102.5	113.5	0	0	0	111.5	N41 R46	N41-L44 PolarHBondContact O-N 3.43Å; L44-R46 VanDerWaalsContact C-N 3.26Å; L44-R46 PolarHBondContact O-N 2.96Å
45	E	78.1	Confident	86.9	Confident	88 Å²	88	80.3 Å²	80.3	41%	0.411	40%	0.395	S	S	.	.	H	α-helix	trans	-81.9	-3.9	-177.8	-66.4	-176.2	-164.1	0	0	112.8	N39 N41 T47 K80	N39-E45 PolarHBondContact ND2-OE2 3.48Å; N41-E45 HydrophobicContact CB-CG 4.32Å; N41-E45 PolarHBondContact O-N 2.97Å; E45-T47 HydrophobicContact CB-CG2 4.29Å; E45-T47 PolarHBondContact O-N 2.79Å; E45-K80 IonicContact OE1-NZ 3.37Å; E45-K80 IonicContact OE2-NZ 2.87Å; E45-K80 PolarHBondContact OE2-NZ 3.34Å
46	R	84.8	Confident	86.3	Confident	235 Å²	235	88.1 Å²	88.1	89%	0.887	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	39.9	-174.7	-59.9	-175.6	174.6	-178.1	-0.4	113.4	W42 L44	W42-R46 CarbonylContact O-C 3.53Å; W42-R46 VanDerWaalsContact O-CA 3.27Å; W42-R46 WeakPolarHBondContact O-CA 3.22Å; W42-R46 PolarHBondContact O-N 3.35Å; L44-R46 VanDerWaalsContact C-N 3.26Å; L44-R46 PolarHBondContact O-N 2.96Å
47	T	81.6	Confident	85	Confident	48 Å²	48	88 Å²	88	29%	0.294	44%	0.437	S	S	.	.	S	Bend	trans	-111.1	175	179.1	49.8	0	0	0	0	110.9	Y37 N39 W42 E45	Y37-T47 VanDerWaalsContact OH-CB 3.32Å; Y37-T47 WeakPolarHBondContact OH-CB 3.43Å; Y37-T47 PolarHBondContact OH-OG1 3.41Å; N39-T47 PolarHBondContact ND2-OG1 3.2Å; W42-T47 WeakPolarHBondContact CB-O 3.46Å; W42-T47 PolarHBondContact O-N 3.35Å; E45-T47 HydrophobicContact CB-CG2 4.29Å; E45-T47 PolarHBondContact O-N 2.79Å
48	N	84.3	Confident	84.1	Confident	123 Å²	123	92.5 Å²	92.5	66%	0.658	46%	0.46	S	S	*	.			trans	-72.1	141.7	172.1	-72.4	-40.6	0	0	0	110.2	Y37 S50	Y37-N48 HydrophobicContact CE1-CB 4.35Å; Y37-N48 WeakPolarHBondContact CE1-O 3.22Å; N48-S50 VanDerWaalsContact C-N 3.34Å; N48-S50 PolarHBondContact O-N 3.4Å
49	Q	85.1	Confident	82.7	Confident	93 Å²	93	98.2 Å²	98.2	44%	0.435	49%	0.489	S	S	.	.	S	Bend	trans	-64.5	-41.1	175.9	-175.8	173.7	37.2	0	0	112.5	Y38 N39 W42	Y38-Q49 CarbonylContact C-O 3.46Å; Y38-Q49 WeakPolarHBondContact CA-O 3.47Å; Y38-Q49 VanDerWaalsContact CD2-O 3.26Å; Y38-Q49 WeakPolarHBondContact CD2-O 3.36Å; Y38-Q49 HydrophobicContact CE2-CG 4.23Å; N39-Q49 PolarHBondContact N-O 3.5Å; W42-Q49 HydrophobicContact CB-CB 4.26Å; W42-Q49 VanDerWaalsContact CD1-CG 3.42Å; W42-Q49 HydrophobicContact CD2-CB 3.78Å; W42-Q49 HydrophobicContact CD2-CG 4.44Å; W42-Q49 HydrophobicContact CG-CB 3.57Å; W42-Q49 HydrophobicContact CG-CG 4.01Å
50	S	90.3	Very high	81.7	Confident	77 Å²	77	106.2 Å²	106.2	54%	0.538	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	148.5	-178.4	63.6	0	0	0	0	110.1	Y37 N48	Y37-S50 CarbonylContact O-C 3.51Å; Y37-S50 VanDerWaalsContact O-CA 3.3Å; Y37-S50 WeakPolarHBondContact O-CA 3.47Å; N48-S50 VanDerWaalsContact C-N 3.34Å; N48-S50 PolarHBondContact O-N 3.4Å
51	G	90	Very high	81.2	Confident	38 Å²	38	108.9 Å²	108.9	39%	0.392	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	175.9	-154.4	177.1	0	0	0	0	0	112.8	Y37	Y37-G51 PolarHBondContact N-O 3.25Å; Y37-G51 PolarHBondContact O-N 2.95Å
52	L	89.6	Confident	81	Confident	85 Å²	85	108.7 Å²	108.7	45%	0.445	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.9	171.8	-170.7	65.8	0	0	0	108.8	E34 C35 I36 F114	E34-L52 HydrophobicContact CB-CD1 4.15Å; E34-L52 HydrophobicContact CB-CD2 4.24Å; E34-L52 HydrophobicContact CB-CG 4.36Å; E34-L52 HydrophobicContact CG-CD2 4.47Å; C35-L52 WeakPolarHBondContact O-CD1 3.25Å; I36-L52 HydrophobicContact CD1-CD1 4.41Å; L52-F114 HydrophobicContact CD1-CD1 3.59Å; L52-F114 HydrophobicContact CD1-CE1 3.15Å; L52-F114 HydrophobicContact CD1-CZ 4.08Å; L52-F114 HydrophobicContact CD2-CE1 3.79Å; L52-F114 HydrophobicContact CD2-CZ 4.08Å; L52-F114 HydrophobicContact CG-CE1 4.11Å
53	E	88.9	Confident	81.1	Confident	70 Å²	70	105.6 Å²	105.6	33%	0.327	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.4	173.8	-177.1	176.3	-140.8	0	0	109	C35 Y37 G82 C83	C35-E53 PolarHBondContact N-O 3.2Å; C35-E53 PolarHBondContact O-N 2.87Å; Y37-E53 HydrophobicContact CD2-CB 4.26Å; Y37-E53 HydrophobicContact CG-CB 4.34Å; E53-G82 WeakPolarHBondContact OE2-CA 3.38Å; E53-C83 VanDerWaalsContact CG-SG 3.59Å; E53-C83 PolarHBondContact OE2-N 2.9Å
54	R	88.7	Confident	81.6	Confident	179 Å²	179	98.7 Å²	98.7	68%	0.675	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	114.7	171.4	-74.5	-175.1	172.2	169.8	-0.1	107.9	R33 E34 E56	R33-R54 CarbonylContact O-C 3.6Å; E34-R54 HydrophobicContact CG-CG 4.17Å; E34-R54 IonicContact OE1-CZ 2.66Å; E34-R54 IonicContact OE1-NE 3.68Å; E34-R54 PolarHBondContact OE1-NE 3.49Å; E34-R54 IonicContact OE1-NH2 3.52Å; E34-R54 PolarHBondContact OE1-NH2 3.07Å; R54-E56 PolarHBondContact O-N 3.29Å
55	C	83.7	Confident	82.1	Confident	5 Å²	5	91.1 Å²	91.1	3%	0.034	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	118.6	176.4	-37.3	0	0	0	0	108.9	R33 C35 L63 C83	R33-C55 HydrophobicContact CB-CB 4.06Å; R33-C55 PolarHBondContact N-O 3.35Å; R33-C55 PolarHBondContact O-N 2.92Å; R33-C55 PolarHBondContact O-SG 2.99Å; C35-C55 PolarHBondContact SG-SG 3.38Å; C55-L63 HydrophobicContact CB-CD2 3.72Å; C55-C83 WeakPolarHBondContact CA-SG 3.13Å; C55-C83 HydrophobicContact CB-CB 3.63Å; C55-C83 WeakPolarHBondContact CB-SG 3.26Å; C55-C83 WeakPolarHBondContact SG-CB 3.32Å; C55-C83 CovalentContact SG-SG 2.01Å; C55-C83 PolarHBondContact SG-SG 3.02Å
56	E	80	Confident	82.9	Confident	165 Å²	165	88.3 Å²	88.3	77%	0.771	43%	0.431	S	S	*	.			trans	-95.9	127.4	171.1	-63.4	-177.9	177.2	0	0	108.1	R54	R54-E56 PolarHBondContact O-N 3.29Å
57	G	66.5	Low	83.3	Confident	29 Å²	29	77.1 Å²	77.1	30%	0.299	39%	0.389	S	S	.	.			trans	-110.2	150.8	-179.2	0	0	0	0	0	112.2
58	E	72.9	Confident	83.8	Confident	128 Å²	128	75.4 Å²	75.4	60%	0.598	38%	0.379	S	S	*	.			trans	-74.8	155	166.1	-65.5	174.1	177.8	0	0	110	D60 K61	E58-D60 PolarHBondContact O-N 3.05Å; E58-K61 HydrophobicContact CB-CD 4.31Å; E58-K61 PolarHBondContact O-N 3.46Å; E58-K61 WeakPolarHBondContact OE2-CE 3.37Å; E58-K61 IonicContact OE2-NZ 3.33Å; E58-K61 PolarHBondContact OE2-NZ 3.31Å
59	Q	62.1	Low	84.1	Confident	179 Å²	179	69.9 Å²	69.9	84%	0.836	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	135.5	172.5	-71.9	178.2	-12.9	0	0	109.3
60	D	68	Low	84.2	Confident	171 Å²	171	71.2 Å²	71.2	91%	0.914	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	4.2	-179.4	-51	-36.9	0	0	0	118.3	E58	E58-D60 PolarHBondContact O-N 3.05Å
61	K	76	Confident	83.7	Confident	95 Å²	95	71.3 Å²	71.3	41%	0.413	34%	0.344	S	S	.	.			trans	-109.1	141.4	176.5	-70.3	-173.7	-179.3	164.7	0	113.1	E58 D86	E58-K61 HydrophobicContact CB-CD 4.31Å; E58-K61 PolarHBondContact O-N 3.46Å; E58-K61 WeakPolarHBondContact OE2-CE 3.37Å; E58-K61 IonicContact OE2-NZ 3.33Å; E58-K61 PolarHBondContact OE2-NZ 3.31Å; K61-D86 HydrophobicContact CB-CB 4.02Å; K61-D86 HydrophobicContact CD-CB 4.24Å; K61-D86 HydrophobicContact CG-CB 4.14Å
62	R	82.2	Confident	82.8	Confident	92 Å²	92	72.7 Å²	72.7	35%	0.347	35%	0.348	S	S	.	.			trans	-83.3	144.1	176.1	-65.7	-162.5	-175	-169.4	5.8	112.2	H64 D86 Y91 D92 E111	R62-H64 WeakPolarHBondContact CB-NE2 3.31Å; R62-D86 PolarHBondContact N-OD1 3Å; R62-D86 WeakPolarHBondContact O-CA 3.37Å; R62-D86 PolarHBondContact O-N 2.65Å; R62-Y91 HydrophobicContact CB-CD1 4.5Å; R62-Y91 HydrophobicContact CB-CE1 3.86Å; R62-Y91 HydrophobicContact CG-CE1 4.07Å; R62-D92 IonicContact NH1-OD1 2.95Å; R62-D92 PolarHBondContact NH1-OD1 2.84Å; R62-E111 IonicContact NH1-OE1 3.48Å; R62-E111 IonicContact NH1-OE2 3.6Å; R62-E111 PolarHBondContact NH1-OE2 3.47Å
63	L	87.2	Confident	81.7	Confident	14 Å²	14	75 Å²	75	7%	0.073	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.9	-179.9	-70.2	160.4	0	0	0	111.1	E31 R33 C55 L85	E31-L63 WeakPolarHBondContact O-CD1 3.49Å; R33-L63 HydrophobicContact CB-CB 3.85Å; R33-L63 HydrophobicContact CB-CD1 4.08Å; R33-L63 HydrophobicContact CG-CB 4.21Å; R33-L63 PolarHBondContact NH1-O 3.46Å; C55-L63 HydrophobicContact CB-CD2 3.72Å; L63-L85 HydrophobicContact CD2-CD2 3.36Å; L63-L85 HydrophobicContact CG-CD2 4.46Å
64	H	91.4	Very high	80.6	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	153.1	-178.7	-56.5	-72.4	0	0	0	111.5	R62 W84 C90 Y91 C110 E111	R62-H64 WeakPolarHBondContact CB-NE2 3.31Å; H64-W84 HydrophobicContact CB-CB 4.4Å; H64-W84 PolarHBondContact N-O 2.97Å; H64-W84 PolarHBondContact O-N 3.44Å; H64-C90 HydrophobicContact CB-CB 3.98Å; H64-C90 PolarHBondContact CE1-O 3.17Å; H64-C90 VanDerWaalsContact CG-CB 3.44Å; H64-C90 WeakPolarHBondContact ND1-CB 3.3Å; H64-C90 PolarHBondContact ND1-O 3.03Å; H64-Y91 AromaticContact CE1-CD1 3.61Å; H64-Y91 AromaticContact NE2-CD1 3.39Å; H64-Y91 WeakPolarHBondContact NE2-CD1 3.45Å; H64-Y91 AromaticContact NE2-CE1 3.45Å; H64-Y91 WeakPolarHBondContact NE2-CE1 3.42Å; H64-C110 CarbonylContact C-O 3.48Å; H64-C110 WeakPolarHBondContact CA-O 3.44Å; H64-C110 WeakPolarHBondContact CB-O 3.32Å; H64-E111 IonicContact CE1-OE2 3.34Å
65	C	93.3	Very high	79.9	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	151.2	165.8	-52.4	0	0	0	0	109.5	C35 G82 C109 C110 G112 N116	C35-C65 VanDerWaalsContact CA-SG 3.55Å; C35-C65 HydrophobicContact CB-CB 3.7Å; C35-C65 WeakPolarHBondContact CB-SG 3.3Å; C35-C65 WeakPolarHBondContact SG-CA 3.27Å; C35-C65 WeakPolarHBondContact SG-CB 3.47Å; C35-C65 CovalentContact SG-SG 2.02Å; C35-C65 PolarHBondContact SG-SG 3.48Å; C65-G82 WeakPolarHBondContact CA-O 3.28Å; C65-C109 CarbonylContact O-C 3.58Å; C65-C109 WeakPolarHBondContact O-CA 3.2Å; C65-C110 PolarHBondContact N-O 3.1Å; C65-C110 PolarHBondContact O-N 3.33Å; C65-G112 PolarHBondContact SG-O 3.42Å; C65-G112 VanDerWaalsContact SG-O 3.39Å; C65-N116 HydrophobicContact CB-CB 3.69Å
66	Y	94.6	Very high	79.8	Confident	29 Å²	29	73 Å²	73	11%	0.114	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	163.1	174.7	78.2	-88.2	0	0	0	113.2	K80 K81 G82 C83 W84 F107 C108 N116	Y66-K80 HydrophobicContact CE2-CB 4.25Å; Y66-K80 HydrophobicContact CE2-CG 4.5Å; Y66-K80 WeakPolarHBondContact OH-CG 3.45Å; Y66-K81 WeakPolarHBondContact O-CA 3.42Å; Y66-G82 VanDerWaalsContact CD1-C 3.44Å; Y66-G82 WeakPolarHBondContact CD1-O 3.35Å; Y66-G82 PolarHBondContact N-O 3.37Å; Y66-G82 PolarHBondContact O-N 3.22Å; Y66-C83 VanDerWaalsContact CE1-O 3.28Å; Y66-C83 WeakPolarHBondContact CE1-O 3.39Å; Y66-W84 HydrophobicContact CD1-CB 3.98Å; Y66-W84 HydrophobicContact CD1-CE3 4.16Å; Y66-W84 HydrophobicContact CE1-CE3 4.28Å; Y66-F107 HydrophobicContact CD2-CD2 4.32Å; Y66-F107 AromaticContact CD2-CE2 3.63Å; Y66-F107 HydrophobicContact CD2-CE2 3.63Å; Y66-F107 HydrophobicContact CD2-CZ 4.43Å; Y66-F107 HydrophobicContact CE2-CE2 4.47Å; Y66-F107 AromaticContact CG-CE2 3.94Å; Y66-F107 HydrophobicContact CG-CE2 3.94Å; Y66-F107 HydrophobicContact CG-CZ 4.3Å; Y66-C108 CarbonylContact C-O 3.56Å; Y66-C108 VanDerWaalsContact CA-O 3.22Å; Y66-C108 WeakPolarHBondContact CA-O 3.1Å; Y66-C108 WeakPolarHBondContact CB-O 3.5Å; Y66-N116 PolarHBondContact O-ND2 3.21Å
67	A	93.3	Very high	80	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	141.4	167.6	0	0	0	0	0	111	W69 K81 F107 C108 F119	A67-W69 HydrophobicContact CB-CZ3 4.44Å; A67-K81 HydrophobicContact CB-CD 4.26Å; A67-K81 HydrophobicContact CB-CG 3.89Å; A67-F107 WeakPolarHBondContact O-CA 3.39Å; A67-C108 PolarHBondContact N-O 3.37Å; A67-C108 PolarHBondContact O-N 3.42Å; A67-F119 HydrophobicContact CB-CB 4.17Å; A67-F119 HydrophobicContact CB-CD1 4.21Å; A67-F119 HydrophobicContact CB-CG 4.3Å
68	S	92.9	Very high	81	Confident	12 Å²	12	70.1 Å²	70.1	8%	0.084	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	139.2	173.4	65.5	0	0	0	0	112.4	L78 V79 K80 Y106	S68-L78 WeakPolarHBondContact O-CD1 3.34Å; S68-V79 PolarHBondContact O-N 3.23Å; S68-K80 PolarHBondContact N-O 3.1Å; S68-K80 PolarHBondContact O-N 2.84Å; S68-K80 PolarHBondContact OG-N 2.9Å; S68-K80 PolarHBondContact OG-O 3.18Å; S68-Y106 CarbonylContact C-O 3.54Å; S68-Y106 WeakPolarHBondContact CA-O 3.1Å
69	W	90.6	Very high	81.8	Confident	7 Å²	7	65.9 Å²	65.9	3%	0.027	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	158.5	-177.7	67.6	95.5	0	0	0	112.4	A67 I76 E77 L78 A98 Y106 C108 F119 H121	A67-W69 HydrophobicContact CB-CZ3 4.44Å; W69-I76 HydrophobicContact CB-CG2 4.03Å; W69-I76 HydrophobicContact CG-CG2 4.03Å; W69-E77 CarbonylContact C-O 3.44Å; W69-E77 WeakPolarHBondContact CA-O 3.3Å; W69-E77 WeakPolarHBondContact CB-O 3.39Å; W69-L78 HydrophobicContact CB-CD1 4.41Å; W69-A98 HydrophobicContact CH2-CB 3.61Å; W69-A98 HydrophobicContact CZ2-CB 3.9Å; W69-Y106 HydrophobicContact CD2-CG 4.48Å; W69-Y106 AromaticContact CE2-CG 3.77Å; W69-Y106 VanDerWaalsContact CZ2-CB 3.48Å; W69-Y106 HydrophobicContact CZ2-CD1 4.17Å; W69-Y106 HydrophobicContact CZ2-CG 4.03Å; W69-Y106 PolarHBondContact N-O 2.92Å; W69-Y106 AromaticContact NE1-CD2 3.79Å; W69-Y106 AromaticContact NE1-CG 3.53Å; W69-Y106 PolarHBondContact O-N 2.98Å; W69-C108 HydrophobicContact CH2-CB 4.41Å; W69-C108 HydrophobicContact CZ3-CB 4.39Å; W69-C108 VanDerWaalsContact CZ3-SG 3.58Å; W69-F119 HydrophobicContact CB-CE2 4.12Å; W69-F119 HydrophobicContact CB-CZ 4.38Å; W69-F119 AromaticContact CD2-CD2 3.4Å; W69-F119 HydrophobicContact CD2-CD2 3.4Å; W69-F119 AromaticContact CD2-CE2 3.31Å; W69-F119 HydrophobicContact CD2-CE2 3.31Å; W69-F119 HydrophobicContact CD2-CG 4.42Å; W69-F119 HydrophobicContact CD2-CZ 4.3Å; W69-F119 AromaticContact CE2-CD2 3.58Å; W69-F119 AromaticContact CE2-CE2 3.68Å; W69-F119 HydrophobicContact CE3-CB 4.42Å; W69-F119 AromaticContact CE3-CD2 3.31Å; W69-F119 HydrophobicContact CE3-CD2 3.31Å; W69-F119 AromaticContact CE3-CE2 3.62Å; W69-F119 HydrophobicContact CE3-CE2 3.62Å; W69-F119 AromaticContact CE3-CG 3.93Å; W69-F119 HydrophobicContact CE3-CG 3.93Å; W69-F119 HydrophobicContact CE3-CZ 4.46Å; W69-F119 HydrophobicContact CG-CD2 4.16Å; W69-F119 AromaticContact CG-CE2 3.56Å; W69-F119 HydrophobicContact CG-CE2 3.56Å; W69-F119 HydrophobicContact CG-CZ 4.29Å; W69-F119 HydrophobicContact CH2-CB 4.11Å; W69-F119 AromaticContact CH2-CD2 3.62Å; W69-F119 HydrophobicContact CH2-CD2 3.62Å; W69-F119 HydrophobicContact CH2-CG 4.26Å; W69-F119 AromaticContact CZ2-CD2 3.69Å; W69-F119 HydrophobicContact CZ2-CD2 3.69Å; W69-F119 HydrophobicContact CZ2-CE2 4.26Å; W69-F119 HydrophobicContact CZ3-CB 3.86Å; W69-F119 AromaticContact CZ3-CD2 3.44Å; W69-F119 HydrophobicContact CZ3-CD2 3.44Å; W69-F119 VanDerWaalsContact CZ3-CD2 3.44Å; W69-F119 HydrophobicContact CZ3-CE2 4.23Å; W69-F119 AromaticContact CZ3-CG 3.86Å; W69-F119 HydrophobicContact CZ3-CG 3.86Å; W69-H121 HydrophobicContact CZ2-CB 4.39Å
70	R	86.5	Confident	83.3	Confident	120 Å²	120	60.1 Å²	60.1	45%	0.453	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	150.3	171.6	-67.7	174.5	-176.7	-174.4	-0.3	109.7	I76 E77 V79 V105	R70-I76 WeakPolarHBondContact O-CA 3.46Å; R70-E77 HydrophobicContact CB-CB 4.4Å; R70-E77 PolarHBondContact N-O 3.2Å; R70-E77 PolarHBondContact O-N 3.19Å; R70-V79 HydrophobicContact CG-CG2 3.87Å; R70-V105 HydrophobicContact CG-CG2 4.02Å
71	N	80.1	Confident	84.5	Confident	80 Å²	80	52.1 Å²	52.1	43%	0.428	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	88.3	173.1	-174.1	-0.4	0	0	0	109.2	G74 Y106	N71-G74 VanDerWaalsContact OD1-CA 3.31Å; N71-G74 WeakPolarHBondContact OD1-CA 3.34Å; N71-G74 PolarHBondContact OD1-N 2.84Å; N71-Y106 HydrophobicContact CB-CD2 4.35Å; N71-Y106 HydrophobicContact CB-CE2 3.72Å
72	S	71.6	Confident	85.3	Confident	66 Å²	66	47.6 Å²	47.6	46%	0.462	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	105.5	179.6	-63.3	0	0	0	0	108.7	G74 T75	S72-G74 VanDerWaalsContact C-N 3.28Å; S72-G74 PolarHBondContact O-N 2.87Å; S72-T75 PolarHBondContact N-O 3.5Å; S72-T75 VanDerWaalsContact N-O 3.08Å; S72-T75 PolarHBondContact O-N 3.46Å; S72-T75 VanDerWaalsContact O-N 3.1Å
73	S	66.2	Low	85.7	Confident	135 Å²	135	44.7 Å²	44.7	94%	0.944	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	36.1	175.2	-52.7	0	0	0	0	114.8
74	G	65.8	Low	85.5	Confident	61 Å²	61	49 Å²	49	63%	0.629	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	1.1	178.9	0	0	0	0	0	115	N71 S72	N71-G74 VanDerWaalsContact OD1-CA 3.31Å; N71-G74 WeakPolarHBondContact OD1-CA 3.34Å; N71-G74 PolarHBondContact OD1-N 2.84Å; S72-G74 VanDerWaalsContact C-N 3.28Å; S72-G74 PolarHBondContact O-N 2.87Å
75	T	73.1	Confident	85	Confident	99 Å²	99	53.5 Å²	53.5	61%	0.607	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.3	171.9	-50.1	0	0	0	0	109.8	S72	S72-T75 PolarHBondContact N-O 3.5Å; S72-T75 VanDerWaalsContact N-O 3.08Å; S72-T75 PolarHBondContact O-N 3.46Å; S72-T75 VanDerWaalsContact O-N 3.1Å
76	I	81.6	Confident	84.3	Confident	50 Å²	50	56.4 Å²	56.4	26%	0.256	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	120.1	175.9	-63.8	174.3	0	0	0	108.7	L8 V10 W69 R70 F119	L8-I76 HydrophobicContact CB-CD1 4.47Å; V10-I76 HydrophobicContact CG2-CD1 4.03Å; W69-I76 HydrophobicContact CB-CG2 4.03Å; W69-I76 HydrophobicContact CG-CG2 4.03Å; R70-I76 WeakPolarHBondContact O-CA 3.46Å; I76-F119 HydrophobicContact CG2-CE2 3.95Å; I76-F119 HydrophobicContact CG2-CZ 3.95Å
77	E	85.1	Confident	83.6	Confident	104 Å²	104	56.6 Å²	56.6	49%	0.486	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	111.6	173.8	-174.7	-179.4	-169.7	0	0	108.8	W69 R70 V79	W69-E77 CarbonylContact C-O 3.44Å; W69-E77 WeakPolarHBondContact CA-O 3.3Å; W69-E77 WeakPolarHBondContact CB-O 3.39Å; R70-E77 HydrophobicContact CB-CB 4.4Å; R70-E77 PolarHBondContact N-O 3.2Å; R70-E77 PolarHBondContact O-N 3.19Å; E77-V79 PolarHBondContact O-N 3.46Å
78	L	86.9	Confident	83.1	Confident	30 Å²	30	63.9 Å²	63.9	16%	0.157	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	128.8	178.5	-171.6	67.1	0	0	0	109.4	Y38 S68 W69 K81 F119	Y38-L78 HydrophobicContact CD1-CB 4.17Å; Y38-L78 HydrophobicContact CD1-CD2 3.38Å; Y38-L78 HydrophobicContact CD1-CG 3.55Å; Y38-L78 HydrophobicContact CD2-CD2 3.96Å; Y38-L78 HydrophobicContact CE1-CB 3.94Å; Y38-L78 HydrophobicContact CE1-CD2 3.86Å; Y38-L78 HydrophobicContact CE1-CG 3.86Å; Y38-L78 WeakPolarHBondContact CE1-O 3.11Å; Y38-L78 HydrophobicContact CE2-CD2 4.4Å; Y38-L78 HydrophobicContact CG-CD2 3.43Å; Y38-L78 VanDerWaalsContact CG-CD2 3.43Å; Y38-L78 HydrophobicContact CG-CG 4.13Å; S68-L78 WeakPolarHBondContact O-CD1 3.34Å; W69-L78 HydrophobicContact CB-CD1 4.41Å; L78-K81 HydrophobicContact CD1-CD 4.35Å; L78-K81 HydrophobicContact CD1-CG 4.01Å; L78-K81 HydrophobicContact CD2-CD 4.16Å; L78-K81 HydrophobicContact CD2-CG 4.2Å; L78-K81 HydrophobicContact CG-CG 4.47Å; L78-F119 HydrophobicContact CD1-CE1 3.79Å; L78-F119 HydrophobicContact CD1-CZ 3.97Å
79	V	90	Very high	82.6	Confident	40 Å²	40	67.2 Å²	67.2	24%	0.242	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-57.4	-177.8	177.9	0	0	0	0	109.9	A40 S68 R70 E77	A40-V79 WeakPolarHBondContact CB-O 3.13Å; A40-V79 PolarHBondContact N-O 3.33Å; A40-V79 VanDerWaalsContact N-O 3.11Å; S68-V79 PolarHBondContact O-N 3.23Å; R70-V79 HydrophobicContact CG-CG2 3.87Å; E77-V79 PolarHBondContact O-N 3.46Å
80	K	92.9	Very high	82.2	Confident	57 Å²	57	66.9 Å²	66.9	25%	0.248	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	150.6	-178.8	-150.9	164.3	-174.1	154.4	0	112.2	Y38 E45 Y66 S68	Y38-K80 CarbonylContact O-C 3.55Å; Y38-K80 VanDerWaalsContact O-CA 3.27Å; Y38-K80 WeakPolarHBondContact O-CA 3.33Å; Y38-K80 WeakPolarHBondContact O-CG 3.44Å; E45-K80 IonicContact OE1-NZ 3.37Å; E45-K80 IonicContact OE2-NZ 2.87Å; E45-K80 PolarHBondContact OE2-NZ 3.34Å; Y66-K80 HydrophobicContact CE2-CB 4.25Å; Y66-K80 HydrophobicContact CE2-CG 4.5Å; Y66-K80 WeakPolarHBondContact OH-CG 3.45Å; S68-K80 PolarHBondContact N-O 3.1Å; S68-K80 PolarHBondContact O-N 2.84Å; S68-K80 PolarHBondContact OG-N 2.9Å; S68-K80 PolarHBondContact OG-O 3.18Å
81	K	94.1	Very high	82.1	Confident	3 Å²	3	64.9 Å²	64.9	1%	0.013	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	146.3	167	-62.1	-170.3	174.3	-169.1	0	109	I36 Y37 Y38 Y66 A67 L78 N116 E117	I36-K81 HydrophobicContact CB-CD 4.4Å; I36-K81 HydrophobicContact CG2-CD 4.01Å; I36-K81 CarbonylContact O-C 3.52Å; I36-K81 WeakPolarHBondContact O-CB 3.3Å; Y37-K81 WeakPolarHBondContact CA-O 3.23Å; Y37-K81 VanDerWaalsContact CD2-O 3.3Å; Y37-K81 WeakPolarHBondContact CD2-O 3.37Å; Y38-K81 PolarHBondContact N-O 2.89Å; Y38-K81 PolarHBondContact O-N 3.42Å; Y66-K81 WeakPolarHBondContact O-CA 3.42Å; A67-K81 HydrophobicContact CB-CD 4.26Å; A67-K81 HydrophobicContact CB-CG 3.89Å; L78-K81 HydrophobicContact CD1-CD 4.35Å; L78-K81 HydrophobicContact CD1-CG 4.01Å; L78-K81 HydrophobicContact CD2-CD 4.16Å; L78-K81 HydrophobicContact CD2-CG 4.2Å; L78-K81 HydrophobicContact CG-CG 4.47Å; K81-N116 WeakPolarHBondContact CE-O 3.01Å; K81-N116 PolarHBondContact NZ-O 2.95Å; K81-E117 PolarHBondContact NZ-O 3.39Å; K81-E117 VanDerWaalsContact NZ-O 3.09Å
82	G	92.4	Very high	82.3	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.7	-154.5	175.8	0	0	0	0	0	112.8	I36 E53 C65 Y66	I36-G82 PolarHBondContact O-N 2.87Å; E53-G82 WeakPolarHBondContact OE2-CA 3.38Å; C65-G82 WeakPolarHBondContact CA-O 3.28Å; Y66-G82 VanDerWaalsContact CD1-C 3.44Å; Y66-G82 WeakPolarHBondContact CD1-O 3.35Å; Y66-G82 PolarHBondContact N-O 3.37Å; Y66-G82 PolarHBondContact O-N 3.22Å
83	C	90.6	Very high	83	Confident	31 Å²	31	68.7 Å²	68.7	21%	0.209	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	143.8	178.5	-59.4	0	0	0	0	113.1	E53 C55 Y66	E53-C83 VanDerWaalsContact CG-SG 3.59Å; E53-C83 PolarHBondContact OE2-N 2.9Å; C55-C83 WeakPolarHBondContact CA-SG 3.13Å; C55-C83 HydrophobicContact CB-CB 3.63Å; C55-C83 WeakPolarHBondContact CB-SG 3.26Å; C55-C83 WeakPolarHBondContact SG-CB 3.32Å; C55-C83 CovalentContact SG-SG 2.01Å; C55-C83 PolarHBondContact SG-SG 3.02Å; Y66-C83 VanDerWaalsContact CE1-O 3.28Å; Y66-C83 WeakPolarHBondContact CE1-O 3.39Å
84	W	83.7	Confident	83.9	Confident	105 Å²	105	70.1 Å²	70.1	40%	0.398	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.1	173.5	-162.6	-99	0	0	0	109.4	H64 Y66 D87	H64-W84 HydrophobicContact CB-CB 4.4Å; H64-W84 PolarHBondContact N-O 2.97Å; H64-W84 PolarHBondContact O-N 3.44Å; Y66-W84 HydrophobicContact CD1-CB 3.98Å; Y66-W84 HydrophobicContact CD1-CE3 4.16Å; Y66-W84 HydrophobicContact CE1-CE3 4.28Å; W84-D87 VanDerWaalsContact CD1-CB 3.43Å; W84-D87 VanDerWaalsContact NE1-CB 3.34Å; W84-D87 PolarHBondContact NE1-OD2 2.86Å
85	L	80.1	Confident	84.9	Confident	95 Å²	95	74 Å²	74	50%	0.497	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.3	-175.1	-73.9	163.7	0	0	0	110.7	L63 D87	L63-L85 HydrophobicContact CD2-CD2 3.36Å; L63-L85 HydrophobicContact CG-CD2 4.46Å; L85-D87 PolarHBondContact O-N 3.31Å
86	D	79.4	Confident	85.7	Confident	60 Å²	60	69.3 Å²	69.3	32%	0.321	33%	0.33	S	S	.	.			trans	56.4	44.9	160.5	-152.8	36.6	0	0	0	117.6	K61 R62 Y91	K61-D86 HydrophobicContact CB-CB 4.02Å; K61-D86 HydrophobicContact CD-CB 4.24Å; K61-D86 HydrophobicContact CG-CB 4.14Å; R62-D86 PolarHBondContact N-OD1 3Å; R62-D86 WeakPolarHBondContact O-CA 3.37Å; R62-D86 PolarHBondContact O-N 2.65Å; D86-Y91 PolarHBondContact OD1-OH 2.8Å
87	D	79.4	Confident	86	Confident	34 Å²	34	68 Å²	68	18%	0.182	32%	0.324	C	S	.	.			trans	-97.3	116.2	174.5	-169.9	-38.9	0	0	0	111	W84 L85 N89 C90 Y91	W84-D87 VanDerWaalsContact CD1-CB 3.43Å; W84-D87 VanDerWaalsContact NE1-CB 3.34Å; W84-D87 PolarHBondContact NE1-OD2 2.86Å; L85-D87 PolarHBondContact O-N 3.31Å; D87-N89 PolarHBondContact O-N 3.49Å; D87-N89 VanDerWaalsContact O-N 3.12Å; D87-N89 VanDerWaalsContact OD1-CB 3.26Å; D87-N89 WeakPolarHBondContact OD1-CB 3.46Å; D87-N89 PolarHBondContact OD1-N 3.36Å; D87-N89 PolarHBondContact OD1-ND2 3.08Å; D87-C90 VanDerWaalsContact O-CB 3.3Å; D87-C90 WeakPolarHBondContact O-CB 3.37Å; D87-C90 PolarHBondContact O-N 2.55Å; D87-Y91 WeakPolarHBondContact O-CD1 3.35Å; D87-Y91 WeakPolarHBondContact O-CE1 3.46Å
88	F	82.9	Confident	86	Confident	152 Å²	152	63.3 Å²	63.3	67%	0.667	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-59.4	-24.1	-177.7	67.6	-92.2	0	0	0	113.3	C90 Y91	F88-C90 PolarHBondContact O-N 2.93Å; F88-Y91 PolarHBondContact O-N 3.1Å
89	N	80.8	Confident	85.6	Confident	83 Å²	83	64.6 Å²	64.6	44%	0.444	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-69.8	-19.9	176.7	-61.3	-66.7	0	0	0	112.1	D87 R93	D87-N89 PolarHBondContact O-N 3.49Å; D87-N89 VanDerWaalsContact O-N 3.12Å; D87-N89 VanDerWaalsContact OD1-CB 3.26Å; D87-N89 WeakPolarHBondContact OD1-CB 3.46Å; D87-N89 PolarHBondContact OD1-N 3.36Å; D87-N89 PolarHBondContact OD1-ND2 3.08Å; N89-R93 WeakPolarHBondContact O-CD 3.06Å; N89-R93 PolarHBondContact O-NE 2.93Å
90	C	83	Confident	85	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-94.7	-5	-177	-49	0	0	0	0	113.1	H64 D87 F88 D92 R93 C109	H64-C90 HydrophobicContact CB-CB 3.98Å; H64-C90 PolarHBondContact CE1-O 3.17Å; H64-C90 VanDerWaalsContact CG-CB 3.44Å; H64-C90 WeakPolarHBondContact ND1-CB 3.3Å; H64-C90 PolarHBondContact ND1-O 3.03Å; D87-C90 VanDerWaalsContact O-CB 3.3Å; D87-C90 WeakPolarHBondContact O-CB 3.37Å; D87-C90 PolarHBondContact O-N 2.55Å; F88-C90 PolarHBondContact O-N 2.93Å; C90-D92 PolarHBondContact O-N 2.88Å; C90-R93 PolarHBondContact O-N 2.92Å; C90-C109 WeakPolarHBondContact CA-SG 3.24Å; C90-C109 HydrophobicContact CB-CB 3.78Å; C90-C109 WeakPolarHBondContact CB-SG 3.48Å; C90-C109 WeakPolarHBondContact SG-CB 3.44Å; C90-C109 CovalentContact SG-SG 2Å; C90-C109 PolarHBondContact SG-SG 3.07Å
91	Y	84.4	Confident	83.6	Confident	78 Å²	78	73.7 Å²	73.7	31%	0.306	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	133.5	-176.7	-75.1	18.5	0	0	0	110.5	R62 H64 D86 D87 F88 R93	R62-Y91 HydrophobicContact CB-CD1 4.5Å; R62-Y91 HydrophobicContact CB-CE1 3.86Å; R62-Y91 HydrophobicContact CG-CE1 4.07Å; H64-Y91 AromaticContact CE1-CD1 3.61Å; H64-Y91 AromaticContact NE2-CD1 3.39Å; H64-Y91 WeakPolarHBondContact NE2-CD1 3.45Å; H64-Y91 AromaticContact NE2-CE1 3.45Å; H64-Y91 WeakPolarHBondContact NE2-CE1 3.42Å; D86-Y91 PolarHBondContact OD1-OH 2.8Å; D87-Y91 WeakPolarHBondContact O-CD1 3.35Å; D87-Y91 WeakPolarHBondContact O-CE1 3.46Å; F88-Y91 PolarHBondContact O-N 3.1Å; Y91-R93 PolarHBondContact O-N 3.22Å
92	D	84.1	Confident	82.3	Confident	126 Å²	126	80.3 Å²	80.3	67%	0.674	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	12.4	176.1	-48.1	-39.5	0	0	0	114.6	R62 C90 Q94 E111	R62-D92 IonicContact NH1-OD1 2.95Å; R62-D92 PolarHBondContact NH1-OD1 2.84Å; C90-D92 PolarHBondContact O-N 2.88Å; D92-Q94 PolarHBondContact O-N 2.85Å; D92-E111 PolarHBondContact N-OE2 3.37Å
93	R	85.8	Confident	81.5	Confident	99 Å²	99	81.5 Å²	81.5	37%	0.374	40%	0.396	S	S	.	.			trans	-85.3	108.6	175.9	-69.4	-164.7	-177.7	-132.8	0.3	111.3	N89 C90 Y91 C110 E111	N89-R93 WeakPolarHBondContact O-CD 3.06Å; N89-R93 PolarHBondContact O-NE 2.93Å; C90-R93 PolarHBondContact O-N 2.92Å; Y91-R93 PolarHBondContact O-N 3.22Å; R93-C110 CarbonylContact O-C 3.58Å; R93-C110 WeakPolarHBondContact O-CA 3.17Å; R93-C110 VanDerWaalsContact O-CB 3.29Å; R93-C110 WeakPolarHBondContact O-CB 3.42Å; R93-E111 PolarHBondContact O-N 3.19Å
94	Q	86.6	Confident	81	Confident	165 Å²	165	89 Å²	89	77%	0.771	43%	0.428	S	S	*	.			trans	-80.1	-23.1	-179.9	-63	-174.7	1.7	0	0	114	D92	D92-Q94 PolarHBondContact O-N 2.85Å
95	E	87.2	Confident	81.1	Confident	142 Å²	142	86.6 Å²	86.6	66%	0.664	43%	0.425	S	S	*	.	S	Bend	trans	-117.6	139.3	-177.2	-61.9	-168	157.1	0	0	111.4	V97	E95-V97 HydrophobicContact CB-CG2 3.91Å; E95-V97 PolarHBondContact O-N 3.2Å; E95-V97 VanDerWaalsContact O-N 3.16Å
96	C	89.2	Confident	81.4	Confident	2 Å²	2	82.7 Å²	82.7	1%	0.014	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	93.8	175.5	-157.5	0	0	0	0	109.9	C108 C110 F119 T120	C96-C108 VanDerWaalsContact CA-SG 3.55Å; C96-C108 HydrophobicContact CB-CB 4.08Å; C96-C108 WeakPolarHBondContact CB-SG 3.32Å; C96-C108 PolarHBondContact O-SG 3.07Å; C96-C108 VanDerWaalsContact O-SG 3.4Å; C96-C108 WeakPolarHBondContact SG-CB 3.42Å; C96-C108 PolarHBondContact SG-O 3.44Å; C96-C108 CovalentContact SG-SG 2.04Å; C96-C108 PolarHBondContact SG-SG 2.94Å; C96-C110 HydrophobicContact CB-CB 4.3Å; C96-F119 HydrophobicContact CB-CB 4.33Å; C96-F119 VanDerWaalsContact O-CA 3.27Å; C96-F119 WeakPolarHBondContact O-CA 3.46Å; C96-T120 PolarHBondContact O-N 3.42Å
97	V	88.3	Confident	82	Confident	23 Å²	23	83.7 Å²	83.7	14%	0.139	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.4	-178	-172.7	0	0	0	0	110.6	E95 C108 T120 L122	E95-V97 HydrophobicContact CB-CG2 3.91Å; E95-V97 PolarHBondContact O-N 3.2Å; E95-V97 VanDerWaalsContact O-N 3.16Å; V97-C108 VanDerWaalsContact C-CB 3.49Å; V97-T120 WeakPolarHBondContact CA-O 3.38Å; V97-L122 HydrophobicContact CG1-CB 3.88Å; V97-L122 HydrophobicContact CG1-CD1 4Å; V97-L122 HydrophobicContact CG1-CG 4.15Å
98	A	85.3	Confident	82.7	Confident	4 Å²	4	82.3 Å²	82.3	3%	0.033	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	130.3	169.2	0	0	0	0	0	109.6	W69 Y106 F107 T120 H121 L122	W69-A98 HydrophobicContact CH2-CB 3.61Å; W69-A98 HydrophobicContact CZ2-CB 3.9Å; A98-Y106 HydrophobicContact CB-CD1 4.21Å; A98-F107 WeakPolarHBondContact CB-O 3.19Å; A98-T120 PolarHBondContact N-O 3.3Å; A98-H121 PolarHBondContact O-CD2 3.37Å; A98-H121 VanDerWaalsContact O-CD2 3.25Å; A98-L122 PolarHBondContact O-N 3.15Å; A98-L122 VanDerWaalsContact O-N 3.13Å
99	T	78.3	Confident	83.2	Confident	58 Å²	58	75.5 Å²	75.5	36%	0.356	37%	0.369	S	S	.	.			trans	-109.3	-13.1	-177.9	51.8	0	0	0	0	113.5
100	E	75.7	Confident	83.7	Confident	125 Å²	125	71.6 Å²	71.6	58%	0.584	35%	0.348	S	S	*	.			trans	-66.5	141.4	-178.6	-66.5	-179.1	-178.9	0	0	112.6	N102 P103 H121	E100-N102 PolarHBondContact O-N 3.37Å; E100-P103 HydrophobicContact CB-CG 4.14Å; E100-H121 PolarHBondContact O-NE2 3.44Å
101	E	65.4	Low	84	Confident	163 Å²	163	73.7 Å²	73.7	76%	0.762	36%	0.358	S	S	*	.	S	Bend	trans	-83.5	113.6	175	-70.9	-166.2	157.4	0	0	111
102	N	65.7	Low	84.1	Confident	142 Å²	142	70.9 Å²	70.9	76%	0.759	35%	0.353	S	S	*	.	S	Bend	trans	54.4	48.1	171.8	-156.6	41.9	0	0	0	117.2	E100	E100-N102 PolarHBondContact O-N 3.37Å
103	P	76.3	Confident	84.4	Confident	24 Å²	24	69.2 Å²	69.2	16%	0.156	34%	0.344	C	S	.	.			trans	-69.6	153.7	173.4	32.3	-37.3	0	0	0	111.8	E100 V105 Y106	E100-P103 HydrophobicContact CB-CG 4.14Å; P103-V105 PolarHBondContact O-N 2.89Å; P103-Y106 HydrophobicContact CG-CD1 3.73Å; P103-Y106 HydrophobicContact CG-CD2 4.2Å; P103-Y106 HydrophobicContact CG-CE1 3.87Å; P103-Y106 HydrophobicContact CG-CE2 4.29Å; P103-Y106 HydrophobicContact CG-CG 3.9Å
104	Q	79.1	Confident	84.7	Confident	189 Å²	189	68.4 Å²	68.4	88%	0.883	34%	0.343	S	S	*	.	S	Bend	trans	-62.5	-32.3	174.3	-65.6	-175.1	14.1	0	0	112.1
105	V	85.6	Confident	84.9	Confident	55 Å²	55	61.6 Å²	61.6	33%	0.333	31%	0.314	S	S	.	.	S	Bend	trans	-135.7	124.2	172.2	-177.7	0	0	0	0	107.5	R70 P103	R70-V105 HydrophobicContact CG-CG2 4.02Å; P103-V105 PolarHBondContact O-N 2.89Å
106	Y	87.1	Confident	85.1	Confident	13 Å²	13	54.9 Å²	54.9	5%	0.051	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	141	174.7	-67.1	-99.3	0	0	0	109.7	S68 W69 N71 A98 P103 H121	S68-Y106 CarbonylContact C-O 3.54Å; S68-Y106 WeakPolarHBondContact CA-O 3.1Å; W69-Y106 HydrophobicContact CD2-CG 4.48Å; W69-Y106 AromaticContact CE2-CG 3.77Å; W69-Y106 VanDerWaalsContact CZ2-CB 3.48Å; W69-Y106 HydrophobicContact CZ2-CD1 4.17Å; W69-Y106 HydrophobicContact CZ2-CG 4.03Å; W69-Y106 PolarHBondContact N-O 2.92Å; W69-Y106 AromaticContact NE1-CD2 3.79Å; W69-Y106 AromaticContact NE1-CG 3.53Å; W69-Y106 PolarHBondContact O-N 2.98Å; N71-Y106 HydrophobicContact CB-CD2 4.35Å; N71-Y106 HydrophobicContact CB-CE2 3.72Å; A98-Y106 HydrophobicContact CB-CD1 4.21Å; P103-Y106 HydrophobicContact CG-CD1 3.73Å; P103-Y106 HydrophobicContact CG-CD2 4.2Å; P103-Y106 HydrophobicContact CG-CE1 3.87Å; P103-Y106 HydrophobicContact CG-CE2 4.29Å; P103-Y106 HydrophobicContact CG-CG 3.9Å; Y106-H121 HydrophobicContact CD1-CB 4.44Å; Y106-H121 AromaticContact CD1-CD2 3.75Å; Y106-H121 HydrophobicContact CE1-CB 4.42Å; Y106-H121 AromaticContact CE1-CD2 3.5Å; Y106-H121 VanDerWaalsContact CE1-CD2 3.5Å; Y106-H121 WeakPolarHBondContact CE1-CD2 3.18Å; Y106-H121 AromaticContact CE1-CE1 3.92Å; Y106-H121 AromaticContact CE1-CG 3.74Å; Y106-H121 AromaticContact CE1-NE2 3.62Å
107	F	93	Very high	85.1	Confident	81 Å²	81	58.3 Å²	58.3	36%	0.355	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	141	178.5	-179.4	-92.3	0	0	0	110.6	Y66 A67 A98 C109	Y66-F107 HydrophobicContact CD2-CD2 4.32Å; Y66-F107 AromaticContact CD2-CE2 3.63Å; Y66-F107 HydrophobicContact CD2-CE2 3.63Å; Y66-F107 HydrophobicContact CD2-CZ 4.43Å; Y66-F107 HydrophobicContact CE2-CE2 4.47Å; Y66-F107 AromaticContact CG-CE2 3.94Å; Y66-F107 HydrophobicContact CG-CE2 3.94Å; Y66-F107 HydrophobicContact CG-CZ 4.3Å; A67-F107 WeakPolarHBondContact O-CA 3.39Å; A98-F107 WeakPolarHBondContact CB-O 3.19Å; F107-C109 HydrophobicContact CE1-CB 4.2Å; F107-C109 HydrophobicContact CZ-CB 4.45Å
108	C	92.6	Very high	85.1	Confident	4 Å²	4	64.5 Å²	64.5	3%	0.027	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	156.7	167.4	63.2	0	0	0	0	110.9	Y66 A67 W69 C96 V97	Y66-C108 CarbonylContact C-O 3.56Å; Y66-C108 VanDerWaalsContact CA-O 3.22Å; Y66-C108 WeakPolarHBondContact CA-O 3.1Å; Y66-C108 WeakPolarHBondContact CB-O 3.5Å; A67-C108 PolarHBondContact N-O 3.37Å; A67-C108 PolarHBondContact O-N 3.42Å; W69-C108 HydrophobicContact CH2-CB 4.41Å; W69-C108 HydrophobicContact CZ3-CB 4.39Å; W69-C108 VanDerWaalsContact CZ3-SG 3.58Å; C96-C108 VanDerWaalsContact CA-SG 3.55Å; C96-C108 HydrophobicContact CB-CB 4.08Å; C96-C108 WeakPolarHBondContact CB-SG 3.32Å; C96-C108 PolarHBondContact O-SG 3.07Å; C96-C108 VanDerWaalsContact O-SG 3.4Å; C96-C108 WeakPolarHBondContact SG-CB 3.42Å; C96-C108 PolarHBondContact SG-O 3.44Å; C96-C108 CovalentContact SG-SG 2.04Å; C96-C108 PolarHBondContact SG-SG 2.94Å; V97-C108 VanDerWaalsContact C-CB 3.49Å
109	C	93.4	Very high	85.1	Confident	10 Å²	10	64.8 Å²	64.8	7%	0.068	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	156.4	172.6	60.3	0	0	0	0	111.4	C65 C90 F107	C65-C109 CarbonylContact O-C 3.58Å; C65-C109 WeakPolarHBondContact O-CA 3.2Å; C90-C109 WeakPolarHBondContact CA-SG 3.24Å; C90-C109 HydrophobicContact CB-CB 3.78Å; C90-C109 WeakPolarHBondContact CB-SG 3.48Å; C90-C109 WeakPolarHBondContact SG-CB 3.44Å; C90-C109 CovalentContact SG-SG 2Å; C90-C109 PolarHBondContact SG-SG 3.07Å; F107-C109 HydrophobicContact CE1-CB 4.2Å; F107-C109 HydrophobicContact CZ-CB 4.45Å
110	C	91.3	Very high	85.4	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	161	-176.1	56.3	0	0	0	0	111.9	H64 C65 R93 C96 C115 N116	H64-C110 CarbonylContact C-O 3.48Å; H64-C110 WeakPolarHBondContact CA-O 3.44Å; H64-C110 WeakPolarHBondContact CB-O 3.32Å; C65-C110 PolarHBondContact N-O 3.1Å; C65-C110 PolarHBondContact O-N 3.33Å; R93-C110 CarbonylContact O-C 3.58Å; R93-C110 WeakPolarHBondContact O-CA 3.17Å; R93-C110 VanDerWaalsContact O-CB 3.29Å; R93-C110 WeakPolarHBondContact O-CB 3.42Å; C96-C110 HydrophobicContact CB-CB 4.3Å; C110-C115 HydrophobicContact CB-CB 3.81Å; C110-C115 WeakPolarHBondContact CB-SG 3.48Å; C110-C115 PolarHBondContact O-SG 3.25Å; C110-C115 WeakPolarHBondContact SG-CB 3.39Å; C110-C115 PolarHBondContact SG-O 3.16Å; C110-C115 CovalentContact SG-SG 2.03Å; C110-C115 PolarHBondContact SG-SG 3.01Å; C110-N116 PolarHBondContact SG-N 3.29Å; C110-N116 VanDerWaalsContact SG-N 3.44Å
111	E	89.9	Confident	85.6	Confident	44 Å²	44	60.7 Å²	60.7	21%	0.206	30%	0.298	C	S	.	.	S	Bend	trans	-112.7	101.2	179	-165.4	171.5	176.4	0	0	109.8	R62 H64 D92 R93	R62-E111 IonicContact NH1-OE1 3.48Å; R62-E111 IonicContact NH1-OE2 3.6Å; R62-E111 PolarHBondContact NH1-OE2 3.47Å; H64-E111 IonicContact CE1-OE2 3.34Å; D92-E111 PolarHBondContact N-OE2 3.37Å; R93-E111 PolarHBondContact O-N 3.19Å
112	G	86.6	Confident	85.9	Confident	20 Å²	20	57.5 Å²	57.5	21%	0.206	29%	0.286	C	S	.	.	S	Bend	trans	167.3	158.9	169	0	0	0	0	0	111.1	R33 C65 F114 C115	R33-G112 VanDerWaalsContact CD-C 3.45Å; R33-G112 WeakPolarHBondContact CD-O 3.07Å; C65-G112 PolarHBondContact SG-O 3.42Å; C65-G112 VanDerWaalsContact SG-O 3.39Å; G112-F114 PolarHBondContact O-N 3.46Å; G112-C115 PolarHBondContact O-N 2.91Å; G112-C115 PolarHBondContact O-SG 2.79Å
113	N	90.2	Very high	85.7	Confident	90 Å²	90	53.9 Å²	53.9	48%	0.481	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	130.2	172.1	-73	-45.3	0	0	0	109.8	R33 E34 C115	R33-N113 WeakPolarHBondContact CA-OD1 3.32Å; R33-N113 VanDerWaalsContact CD-OD1 3.28Å; R33-N113 WeakPolarHBondContact CD-OD1 3.24Å; E34-N113 PolarHBondContact N-OD1 3.47Å; E34-N113 CarbonylContact O-C 3.58Å; E34-N113 WeakPolarHBondContact O-CA 3.37Å; N113-C115 PolarHBondContact O-N 3.07Å; N113-C115 VanDerWaalsContact O-N 3.14Å
114	F	91.6	Very high	84.3	Confident	83 Å²	83	60.4 Å²	60.4	36%	0.364	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	18.5	179.6	-44.1	-91.8	0	0	0	114.7	E34 I36 L52 G112 N116 E117	E34-F114 HydrophobicContact CB-CE1 4.24Å; E34-F114 HydrophobicContact CB-CE2 4.14Å; E34-F114 HydrophobicContact CB-CZ 3.83Å; E34-F114 PolarHBondContact O-N 3.31Å; E34-F114 WeakPolarHBondContact OE2-CZ 3.5Å; I36-F114 HydrophobicContact CD1-CD1 3.86Å; L52-F114 HydrophobicContact CD1-CD1 3.59Å; L52-F114 HydrophobicContact CD1-CE1 3.15Å; L52-F114 HydrophobicContact CD1-CZ 4.08Å; L52-F114 HydrophobicContact CD2-CE1 3.79Å; L52-F114 HydrophobicContact CD2-CZ 4.08Å; L52-F114 HydrophobicContact CG-CE1 4.11Å; G112-F114 PolarHBondContact O-N 3.46Å; F114-N116 PolarHBondContact O-N 3.31Å; F114-N116 VanDerWaalsContact O-N 3.11Å; F114-E117 VanDerWaalsContact O-CB 3.24Å; F114-E117 WeakPolarHBondContact O-CB 3.35Å; F114-E117 PolarHBondContact O-N 2.71Å
115	C	90.4	Very high	82.6	Confident	22 Å²	22	56.4 Å²	56.4	15%	0.149	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-64.9	-21.2	-174.1	69.2	0	0	0	0	113.1	C110 G112 N113 E117	C110-C115 HydrophobicContact CB-CB 3.81Å; C110-C115 WeakPolarHBondContact CB-SG 3.48Å; C110-C115 PolarHBondContact O-SG 3.25Å; C110-C115 WeakPolarHBondContact SG-CB 3.39Å; C110-C115 PolarHBondContact SG-O 3.16Å; C110-C115 CovalentContact SG-SG 2.03Å; C110-C115 PolarHBondContact SG-SG 3.01Å; G112-C115 PolarHBondContact O-N 2.91Å; G112-C115 PolarHBondContact O-SG 2.79Å; N113-C115 PolarHBondContact O-N 3.07Å; N113-C115 VanDerWaalsContact O-N 3.14Å; C115-E117 VanDerWaalsContact C-N 3.31Å
116	N	93.1	Very high	80.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-86.3	6.9	175.1	71.3	-23.7	0	0	0	113.8	I36 C65 Y66 K81 C110 F114 R118	I36-N116 WeakPolarHBondContact CB-OD1 3.25Å; I36-N116 PolarHBondContact N-OD1 2.8Å; I36-N116 PolarHBondContact O-ND2 3.41Å; C65-N116 HydrophobicContact CB-CB 3.69Å; Y66-N116 PolarHBondContact O-ND2 3.21Å; K81-N116 WeakPolarHBondContact CE-O 3.01Å; K81-N116 PolarHBondContact NZ-O 2.95Å; C110-N116 PolarHBondContact SG-N 3.29Å; C110-N116 VanDerWaalsContact SG-N 3.44Å; F114-N116 PolarHBondContact O-N 3.31Å; F114-N116 VanDerWaalsContact O-N 3.11Å; N116-R118 PolarHBondContact O-N 2.9Å
117	E	89	Confident	78.2	Confident	75 Å²	75	59.7 Å²	59.7	35%	0.35	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-55.9	-44.2	174.5	-175.1	-172.9	-139.8	0	0	110.4	I36 K81 F114 C115	I36-E117 HydrophobicContact CG1-CB 4.04Å; I36-E117 HydrophobicContact CG1-CG 4.5Å; K81-E117 PolarHBondContact NZ-O 3.39Å; K81-E117 VanDerWaalsContact NZ-O 3.09Å; F114-E117 VanDerWaalsContact O-CB 3.24Å; F114-E117 WeakPolarHBondContact O-CB 3.35Å; F114-E117 PolarHBondContact O-N 2.71Å; C115-E117 VanDerWaalsContact C-N 3.31Å
118	R	86.6	Confident	75.5	Confident	152 Å²	152	61.9 Å²	61.9	57%	0.574	37%	0.369	S	S	*	.	S	Bend	trans	-114.6	138.8	175.5	-59.4	-177.9	-174.6	-172.7	0.5	109.2	N116	N116-R118 PolarHBondContact O-N 2.9Å
119	F	86.9	Confident	72.7	Confident	10 Å²	10	70.7 Å²	70.7	4%	0.044	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	150	173.3	59.6	-88	0	0	0	109.2	A67 W69 I76 L78 C96	A67-F119 HydrophobicContact CB-CB 4.17Å; A67-F119 HydrophobicContact CB-CD1 4.21Å; A67-F119 HydrophobicContact CB-CG 4.3Å; W69-F119 HydrophobicContact CB-CE2 4.12Å; W69-F119 HydrophobicContact CB-CZ 4.38Å; W69-F119 AromaticContact CD2-CD2 3.4Å; W69-F119 HydrophobicContact CD2-CD2 3.4Å; W69-F119 AromaticContact CD2-CE2 3.31Å; W69-F119 HydrophobicContact CD2-CE2 3.31Å; W69-F119 HydrophobicContact CD2-CG 4.42Å; W69-F119 HydrophobicContact CD2-CZ 4.3Å; W69-F119 AromaticContact CE2-CD2 3.58Å; W69-F119 AromaticContact CE2-CE2 3.68Å; W69-F119 HydrophobicContact CE3-CB 4.42Å; W69-F119 AromaticContact CE3-CD2 3.31Å; W69-F119 HydrophobicContact CE3-CD2 3.31Å; W69-F119 AromaticContact CE3-CE2 3.62Å; W69-F119 HydrophobicContact CE3-CE2 3.62Å; W69-F119 AromaticContact CE3-CG 3.93Å; W69-F119 HydrophobicContact CE3-CG 3.93Å; W69-F119 HydrophobicContact CE3-CZ 4.46Å; W69-F119 HydrophobicContact CG-CD2 4.16Å; W69-F119 AromaticContact CG-CE2 3.56Å; W69-F119 HydrophobicContact CG-CE2 3.56Å; W69-F119 HydrophobicContact CG-CZ 4.29Å; W69-F119 HydrophobicContact CH2-CB 4.11Å; W69-F119 AromaticContact CH2-CD2 3.62Å; W69-F119 HydrophobicContact CH2-CD2 3.62Å; W69-F119 HydrophobicContact CH2-CG 4.26Å; W69-F119 AromaticContact CZ2-CD2 3.69Å; W69-F119 HydrophobicContact CZ2-CD2 3.69Å; W69-F119 HydrophobicContact CZ2-CE2 4.26Å; W69-F119 HydrophobicContact CZ3-CB 3.86Å; W69-F119 AromaticContact CZ3-CD2 3.44Å; W69-F119 HydrophobicContact CZ3-CD2 3.44Å; W69-F119 VanDerWaalsContact CZ3-CD2 3.44Å; W69-F119 HydrophobicContact CZ3-CE2 4.23Å; W69-F119 AromaticContact CZ3-CG 3.86Å; W69-F119 HydrophobicContact CZ3-CG 3.86Å; I76-F119 HydrophobicContact CG2-CE2 3.95Å; I76-F119 HydrophobicContact CG2-CZ 3.95Å; L78-F119 HydrophobicContact CD1-CE1 3.79Å; L78-F119 HydrophobicContact CD1-CZ 3.97Å; C96-F119 HydrophobicContact CB-CB 4.33Å; C96-F119 VanDerWaalsContact O-CA 3.27Å; C96-F119 WeakPolarHBondContact O-CA 3.46Å
120	T	83.4	Confident	70	Confident	30 Å²	30	75.9 Å²	75.9	18%	0.184	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	157.9	178.6	59.7	0	0	0	0	111.3	C96 V97 A98	C96-T120 PolarHBondContact O-N 3.42Å; V97-T120 WeakPolarHBondContact CA-O 3.38Å; A98-T120 PolarHBondContact N-O 3.3Å
121	H	79.9	Confident	67.1	Low	68 Å²	68	81.7 Å²	81.7	32%	0.315	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.3	167.1	176.9	-119.7	0	0	0	107.8	W69 A98 E100 Y106	W69-H121 HydrophobicContact CZ2-CB 4.39Å; A98-H121 PolarHBondContact O-CD2 3.37Å; A98-H121 VanDerWaalsContact O-CD2 3.25Å; E100-H121 PolarHBondContact O-NE2 3.44Å; Y106-H121 HydrophobicContact CD1-CB 4.44Å; Y106-H121 AromaticContact CD1-CD2 3.75Å; Y106-H121 HydrophobicContact CE1-CB 4.42Å; Y106-H121 AromaticContact CE1-CD2 3.5Å; Y106-H121 VanDerWaalsContact CE1-CD2 3.5Å; Y106-H121 WeakPolarHBondContact CE1-CD2 3.18Å; Y106-H121 AromaticContact CE1-CE1 3.92Å; Y106-H121 AromaticContact CE1-CG 3.74Å; Y106-H121 AromaticContact CE1-NE2 3.62Å
122	L	72.6	Confident	64.6	Low	96 Å²	96	89.8 Å²	89.8	50%	0.503	51%	0.507	S	S	.	.			trans	-129.7	97.4	173.8	-72.3	169.9	0	0	0	106.2	V97 A98 E124	V97-L122 HydrophobicContact CG1-CB 3.88Å; V97-L122 HydrophobicContact CG1-CD1 4Å; V97-L122 HydrophobicContact CG1-CG 4.15Å; A98-L122 PolarHBondContact O-N 3.15Å; A98-L122 VanDerWaalsContact O-N 3.13Å; L122-E124 PolarHBondContact O-N 3.42Å
123	P	60.3	Low	62.2	Low	65 Å²	65	97.1 Å²	97.1	42%	0.422	54%	0.536	S	S	.	.			trans	-60.3	135.2	171.2	25	-30	0	0	0	108	A125	P123-A125 PolarHBondContact O-N 2.79Å; P123-A125 VanDerWaalsContact O-N 3.1Å
124	E	47.3	Very low	60	Low	161 Å²	161	98.1 Å²	98.1	75%	0.752	55%	0.547	S	S	*	.			trans	-56.2	119.4	179.5	-80	-174.9	155.5	0	0	110	L122 G126	L122-E124 PolarHBondContact O-N 3.42Å; E124-G126 PolarHBondContact O-N 2.7Å; E124-G126 VanDerWaalsContact O-N 3.1Å
125	A	44.8	Very low	57.7	Low	105 Å²	105	100 Å²	100	87%	0.868	57%	0.567	S	S	*	*			trans	-73.4	103.8	179.3	0	0	0	0	0	110.1	P123	P123-A125 PolarHBondContact O-N 2.79Å; P123-A125 VanDerWaalsContact O-N 3.1Å
126	G	39.3	Very low	55.9	Low	70 Å²	70	104.5 Å²	104.5	72%	0.722	60%	0.597	S	S	*	*			trans	45.8	101.9	149	0	0	0	0	0	118.8	E124	E124-G126 PolarHBondContact O-N 2.7Å; E124-G126 VanDerWaalsContact O-N 3.1Å
127	G	39.3	Very low	54.5	Low	67 Å²	67	111.1 Å²	111.1	69%	0.691	64%	0.637	S	S	*	*	S	Bend	trans	-60.5	163	135.1	0	0	0	0	0	110.7
128	P	37.1	Very low	53	Low	128 Å²	128	111.8 Å²	111.8	83%	0.831	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-60.4	140	-157.2	23.6	-32.9	0	0	0	114.5	V130	P128-V130 PolarHBondContact O-N 3.49Å
129	E	34.5	Very low	51.9	Low	189 Å²	189	109.1 Å²	109.1	88%	0.883	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-50	124.2	175	-78.4	-178.8	133.4	0	0	112.5
130	V	36.7	Very low	51.2	Low	118 Å²	118	113 Å²	113	72%	0.715	68%	0.683	S	S	*	*			trans	-90.9	106.4	159.9	178.5	0	0	0	0	107.8	P128 Y132	P128-V130 PolarHBondContact O-N 3.49Å; V130-Y132 PolarHBondContact O-N 3.41Å
131	T	30.8	Very low	50.7	Low	123 Å²	123	118.1 Å²	118.1	76%	0.755	71%	0.708	S	S	*	*			trans	-67.4	119.6	169.6	-34.1	0	0	0	0	108.8	E133	T131-E133 PolarHBondContact O-N 2.9Å
132	Y	36.3	Very low	50.4	Low	214 Å²	214	121.6 Å²	121.6	84%	0.839	73%	0.728	S	S	*	*			trans	-79	104.5	168	-70.7	-88.1	0	0	0	108.9	V130	V130-Y132 PolarHBondContact O-N 3.41Å
133	E	36.2	Very low	50.3	Low	174 Å²	174	119.5 Å²	119.5	81%	0.813	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-72	148.7	155.8	-96.3	-171.1	153.2	0	0	109.7	T131	T131-E133 PolarHBondContact O-N 2.9Å
134	P	43.6	Very low	51	Low	111 Å²	111	120.3 Å²	120.3	72%	0.721	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-60.7	148.8	175.2	27.1	-33.1	0	0	0	110.4
135	P	43.3	Very low	52.3	Low	121 Å²	121	116.5 Å²	116.5	79%	0.786	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-62.1	131.7	-167.4	23.7	-32.5	0	0	0	111.3
136	P	52.6	Low	53.9	Low	118 Å²	118	113.8 Å²	113.8	77%	0.766	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-67.2	146.9	166.2	28.5	-30.9	0	0	0	108.8	A138	P136-A138 PolarHBondContact O-N 2.79Å
137	T	63.4	Low	55.7	Low	139 Å²	139	119.3 Å²	119.3	85%	0.853	69%	0.685	S	S	*	*			trans	-43.5	132.5	175.2	38.6	0	0	0	0	111.6
138	A	58.6	Low	57.6	Low	89 Å²	89	118.4 Å²	118.4	74%	0.736	67%	0.668	S	S	*	*			trans	-43.6	134.6	-173.8	0	0	0	0	0	112.9	P136 T140	P136-A138 PolarHBondContact O-N 2.79Å; A138-T140 PolarHBondContact O-N 3.1Å
139	P	62.6	Low	59.6	Low	96 Å²	96	117.2 Å²	117.2	62%	0.623	66%	0.655	S	S	*	*			trans	-64.2	137.3	178.7	25.8	-31.9	0	0	0	109.9	V144	P139-V144 HydrophobicContact CG-CG2 4.38Å
140	T	72.6	Confident	61.9	Low	92 Å²	92	114.6 Å²	114.6	56%	0.564	65%	0.646	S	S	*	*			trans	-59.4	151.8	178.8	63.2	0	0	0	0	111.2	A138 L142 T143 V144	A138-T140 PolarHBondContact O-N 3.1Å; T140-L142 PolarHBondContact O-N 3.3Å; T140-T143 PolarHBondContact N-OG1 3.49Å; T140-T143 PolarHBondContact O-N 3.13Å; T140-T143 PolarHBondContact O-OG1 3.25Å; T140-T143 PolarHBondContact OG1-OG1 2.88Å; T140-V144 PolarHBondContact O-N 2.8Å
141	L	72.5	Confident	64.2	Low	136 Å²	136	112.3 Å²	112.3	71%	0.712	63%	0.633	S	S	*	*	H	α-helix	trans	-54.7	-29.5	-179.5	-158.2	144.4	0	0	0	112.2	V144 L145	L141-V144 PolarHBondContact O-N 3.29Å; L141-L145 HydrophobicContact CD2-CD1 3.56Å; L141-L145 HydrophobicContact CD2-CG 4.02Å; L141-L145 WeakPolarHBondContact O-CG 3.45Å; L141-L145 PolarHBondContact O-N 3.03Å; L141-L145 VanDerWaalsContact O-N 3.07Å
142	L	73.6	Confident	66.8	Low	142 Å²	142	111.1 Å²	111.1	74%	0.743	62%	0.621	S	S	*	*	H	α-helix	trans	-62.7	-42.3	175.3	-154.8	91.5	0	0	0	112.9	T140 L145 A146	T140-L142 PolarHBondContact O-N 3.3Å; L142-L145 PolarHBondContact O-N 2.67Å; L142-A146 WeakPolarHBondContact O-CB 3.32Å; L142-A146 PolarHBondContact O-N 2.99Å
143	T	71.4	Confident	69.3	Low	52 Å²	52	102.9 Å²	102.9	32%	0.319	60%	0.601	S	S	.	*	H	α-helix	trans	-67.3	-40.1	178.2	28	0	0	0	0	112	T140 A146 Y147	T140-T143 PolarHBondContact N-OG1 3.49Å; T140-T143 PolarHBondContact O-N 3.13Å; T140-T143 PolarHBondContact O-OG1 3.25Å; T140-T143 PolarHBondContact OG1-OG1 2.88Å; T143-A146 PolarHBondContact O-N 3.42Å; T143-Y147 WeakPolarHBondContact O-CD2 3.45Å; T143-Y147 PolarHBondContact O-N 3.08Å; T143-Y147 VanDerWaalsContact O-N 3.13Å
144	V	74.7	Confident	71.9	Confident	82 Å²	82	96.2 Å²	96.2	50%	0.497	58%	0.579	S	S	.	*	H	α-helix	trans	-65.8	-40.4	177	179.1	0	0	0	0	111.4	P139 T140 L141 S148	P139-V144 HydrophobicContact CG-CG2 4.38Å; T140-V144 PolarHBondContact O-N 2.8Å; L141-V144 PolarHBondContact O-N 3.29Å; V144-S148 PolarHBondContact O-N 3.21Å; V144-S148 PolarHBondContact O-OG 3.13Å
145	L	75.5	Confident	74.1	Confident	81 Å²	81	96.3 Å²	96.3	42%	0.424	57%	0.573	S	S	.	*	H	α-helix	trans	-65.4	-39.4	175.3	-71.3	177.4	0	0	0	112	L141 L142 S148 L149	L141-L145 HydrophobicContact CD2-CD1 3.56Å; L141-L145 HydrophobicContact CD2-CG 4.02Å; L141-L145 WeakPolarHBondContact O-CG 3.45Å; L141-L145 PolarHBondContact O-N 3.03Å; L141-L145 VanDerWaalsContact O-N 3.07Å; L142-L145 PolarHBondContact O-N 2.67Å; L145-S148 PolarHBondContact O-N 3.42Å; L145-S148 PolarHBondContact O-OG 3.43Å; L145-L149 HydrophobicContact CB-CD1 4.25Å; L145-L149 HydrophobicContact CD2-CD1 4.38Å; L145-L149 VanDerWaalsContact O-CB 3.25Å; L145-L149 WeakPolarHBondContact O-CB 3.48Å; L145-L149 VanDerWaalsContact O-CG 3.24Å; L145-L149 WeakPolarHBondContact O-CG 3.24Å; L145-L149 PolarHBondContact O-N 3.36Å
146	A	76.9	Confident	76.3	Confident	47 Å²	47	93.4 Å²	93.4	39%	0.388	56%	0.556	S	S	.	*	H	α-helix	trans	-63	-47.1	178	0	0	0	0	0	112.1	L142 T143 S148 L150	L142-A146 WeakPolarHBondContact O-CB 3.32Å; L142-A146 PolarHBondContact O-N 2.99Å; T143-A146 PolarHBondContact O-N 3.42Å; A146-S148 VanDerWaalsContact C-N 3.32Å; A146-S148 PolarHBondContact O-N 3.46Å; A146-L150 WeakPolarHBondContact O-CB 3.5Å; A146-L150 WeakPolarHBondContact O-CD1 3.34Å; A146-L150 PolarHBondContact O-N 3.48Å
147	Y	77.6	Confident	78.2	Confident	187 Å²	187	93 Å²	93	73%	0.733	55%	0.547	S	S	*	.	H	α-helix	trans	-70.5	-24.8	-178.6	-73.1	-64.4	0	0	0	114.1	T143 P151	T143-Y147 WeakPolarHBondContact O-CD2 3.45Å; T143-Y147 PolarHBondContact O-N 3.08Å; T143-Y147 VanDerWaalsContact O-N 3.13Å; Y147-P151 WeakPolarHBondContact O-CD 3.35Å; Y147-P151 VanDerWaalsContact O-CG 3.26Å; Y147-P151 WeakPolarHBondContact O-CG 3.32Å
148	S	78.6	Confident	79.6	Confident	48 Å²	48	91.7 Å²	91.7	34%	0.336	53%	0.533	S	S	.	.	H	α-helix	trans	-88.2	-40.2	177.9	50.9	0	0	0	0	112.7	V144 L145 A146 P151 I152	V144-S148 PolarHBondContact O-N 3.21Å; V144-S148 PolarHBondContact O-OG 3.13Å; L145-S148 PolarHBondContact O-N 3.42Å; L145-S148 PolarHBondContact O-OG 3.43Å; A146-S148 VanDerWaalsContact C-N 3.32Å; A146-S148 PolarHBondContact O-N 3.46Å; S148-P151 WeakPolarHBondContact O-CD 3.44Å; S148-P151 WeakPolarHBondContact O-CG 3.43Å; S148-I152 VanDerWaalsContact O-CD1 3.22Å; S148-I152 WeakPolarHBondContact O-CD1 3.22Å; S148-I152 VanDerWaalsContact O-CG1 3.22Å; S148-I152 WeakPolarHBondContact O-CG1 3.46Å
149	L	80.6	Confident	81.1	Confident	103 Å²	103	92 Å²	92	54%	0.539	53%	0.526	S	S	.	.	H	α-helix	trans	-81.3	-30.1	-173.7	-64.3	173.3	0	0	0	113.6	L145 I152 G153	L145-L149 HydrophobicContact CB-CD1 4.25Å; L145-L149 HydrophobicContact CD2-CD1 4.38Å; L145-L149 VanDerWaalsContact O-CB 3.25Å; L145-L149 WeakPolarHBondContact O-CB 3.48Å; L145-L149 VanDerWaalsContact O-CG 3.24Å; L145-L149 WeakPolarHBondContact O-CG 3.24Å; L145-L149 PolarHBondContact O-N 3.36Å; L149-I152 PolarHBondContact O-N 3.04Å; L149-G153 PolarHBondContact O-N 3.49Å
150	L	82.8	Confident	82.5	Confident	134 Å²	134	92.6 Å²	92.6	70%	0.702	52%	0.523	S	S	*	.	H	α-helix	trans	-59.8	-51.4	176.6	-89.8	162.2	0	0	0	113.9	A146 I152 G153 G154	A146-L150 WeakPolarHBondContact O-CB 3.5Å; A146-L150 WeakPolarHBondContact O-CD1 3.34Å; A146-L150 PolarHBondContact O-N 3.48Å; L150-I152 VanDerWaalsContact C-N 3.35Å; L150-I152 PolarHBondContact O-N 3.03Å; L150-G153 PolarHBondContact O-N 2.87Å; L150-G154 PolarHBondContact O-N 3.23Å
151	P	83.5	Confident	83.3	Confident	69 Å²	69	92.6 Å²	92.6	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-68	-34.6	178.8	23.9	-31.9	0	0	0	112.3	Y147 S148 G154 L155	Y147-P151 WeakPolarHBondContact O-CD 3.35Å; Y147-P151 VanDerWaalsContact O-CG 3.26Å; Y147-P151 WeakPolarHBondContact O-CG 3.32Å; S148-P151 WeakPolarHBondContact O-CD 3.44Å; S148-P151 WeakPolarHBondContact O-CG 3.43Å; P151-G154 PolarHBondContact O-N 3.34Å; P151-L155 WeakPolarHBondContact O-CB 3.43Å; P151-L155 PolarHBondContact O-N 3.29Å
152	I	85.8	Confident	83.9	Confident	98 Å²	98	88.8 Å²	88.8	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-66.4	-41.7	176.6	-64.1	171.7	0	0	0	110.9	S148 L149 L150 L155 S156	S148-I152 VanDerWaalsContact O-CD1 3.22Å; S148-I152 WeakPolarHBondContact O-CD1 3.22Å; S148-I152 VanDerWaalsContact O-CG1 3.22Å; S148-I152 WeakPolarHBondContact O-CG1 3.46Å; L149-I152 PolarHBondContact O-N 3.04Å; L150-I152 VanDerWaalsContact C-N 3.35Å; L150-I152 PolarHBondContact O-N 3.03Å; I152-L155 PolarHBondContact O-N 3.35Å; I152-S156 WeakPolarHBondContact O-CB 3.3Å; I152-S156 PolarHBondContact O-N 2.78Å; I152-S156 PolarHBondContact O-OG 3.21Å
153	G	89.8	Confident	84.6	Confident	41 Å²	41	86.9 Å²	86.9	42%	0.423	49%	0.493	S	S	.	.	H	α-helix	trans	-63.3	-42.6	173.9	0	0	0	0	0	112.2	L149 L150 S156 L157	L149-G153 PolarHBondContact O-N 3.49Å; L150-G153 PolarHBondContact O-N 2.87Å; G153-S156 PolarHBondContact O-N 2.63Å; G153-L157 PolarHBondContact O-N 2.87Å
154	G	90.6	Very high	85.2	Confident	34 Å²	34	91.5 Å²	91.5	35%	0.351	51%	0.505	S	S	.	.	H	α-helix	trans	-60.8	-47.9	175.4	0	0	0	0	0	112.8	L150 P151 S156 L157 I158	L150-G154 PolarHBondContact O-N 3.23Å; P151-G154 PolarHBondContact O-N 3.34Å; G154-S156 VanDerWaalsContact C-N 3.34Å; G154-S156 PolarHBondContact O-N 2.76Å; G154-L157 PolarHBondContact O-N 3.33Å; G154-I158 VanDerWaalsContact O-CG1 3.32Å; G154-I158 WeakPolarHBondContact O-CG1 3.3Å; G154-I158 PolarHBondContact O-N 2.73Å
155	L	89.9	Confident	85.6	Confident	113 Å²	113	91.8 Å²	91.8	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-61.1	-42.5	175.9	-85.9	158.4	0	0	0	112.1	P151 I152 L157 I158 V159	P151-L155 WeakPolarHBondContact O-CB 3.43Å; P151-L155 PolarHBondContact O-N 3.29Å; I152-L155 PolarHBondContact O-N 3.35Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L155-L157 PolarHBondContact O-N 3.5Å; L155-I158 PolarHBondContact O-N 3.5Å; L155-V159 WeakPolarHBondContact O-CG2 3.42Å; L155-V159 PolarHBondContact O-N 2.8Å
156	S	89.3	Confident	85.7	Confident	61 Å²	61	96 Å²	96	43%	0.427	51%	0.514	S	S	.	.	H	α-helix	trans	-63.4	-40.7	178.2	-59.4	0	0	0	0	111.9	I152 G153 G154 V159 L160	I152-S156 WeakPolarHBondContact O-CB 3.3Å; I152-S156 PolarHBondContact O-N 2.78Å; I152-S156 PolarHBondContact O-OG 3.21Å; G153-S156 PolarHBondContact O-N 2.63Å; G154-S156 VanDerWaalsContact C-N 3.34Å; G154-S156 PolarHBondContact O-N 2.76Å; S156-V159 PolarHBondContact O-N 2.82Å; S156-L160 VanDerWaalsContact O-CG 3.32Å; S156-L160 WeakPolarHBondContact O-CG 3.42Å; S156-L160 PolarHBondContact O-N 2.91Å
157	L	91.7	Very high	85.6	Confident	108 Å²	108	101.9 Å²	101.9	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-65.4	-40.6	176.6	-170.8	69.5	0	0	0	111.7	G153 G154 L155 L160 L161	G153-L157 PolarHBondContact O-N 2.87Å; G154-L157 PolarHBondContact O-N 3.33Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L155-L157 PolarHBondContact O-N 3.5Å; L157-L160 PolarHBondContact O-N 3.38Å; L157-L161 HydrophobicContact CG-CD1 4.16Å; L157-L161 WeakPolarHBondContact O-CB 3.48Å; L157-L161 VanDerWaalsContact O-CG 3.3Å; L157-L161 WeakPolarHBondContact O-CG 3.4Å; L157-L161 PolarHBondContact O-N 3.25Å
158	I	92.4	Very high	85.1	Confident	112 Å²	112	99.1 Å²	99.1	57%	0.574	52%	0.519	S	S	*	.	H	α-helix	trans	-61.9	-44.3	176.2	-68.7	166.3	0	0	0	110.8	G154 L155 L161 A162	G154-I158 VanDerWaalsContact O-CG1 3.32Å; G154-I158 WeakPolarHBondContact O-CG1 3.3Å; G154-I158 PolarHBondContact O-N 2.73Å; L155-I158 PolarHBondContact O-N 3.5Å; I158-L161 PolarHBondContact O-N 2.67Å; I158-A162 WeakPolarHBondContact O-CB 2.95Å; I158-A162 PolarHBondContact O-N 3.17Å
159	V	91.4	Very high	84.2	Confident	95 Å²	95	106.1 Å²	106.1	58%	0.576	54%	0.538	S	S	*	.	H	α-helix	trans	-64	-42.4	177.8	172.5	0	0	0	0	111.3	L155 S156 A162 F163	L155-V159 WeakPolarHBondContact O-CG2 3.42Å; L155-V159 PolarHBondContact O-N 2.8Å; S156-V159 PolarHBondContact O-N 2.82Å; V159-A162 PolarHBondContact O-N 3.46Å; V159-F163 WeakPolarHBondContact O-CB 3.45Å; V159-F163 PolarHBondContact O-N 3.15Å
160	L	91.5	Very high	82.4	Confident	110 Å²	110	108.5 Å²	108.5	58%	0.576	54%	0.544	S	S	*	.	H	α-helix	trans	-65.1	-40.6	177	-72.2	171.9	0	0	0	112.2	S156 L157 F163 W164	S156-L160 VanDerWaalsContact O-CG 3.32Å; S156-L160 WeakPolarHBondContact O-CG 3.42Å; S156-L160 PolarHBondContact O-N 2.91Å; L157-L160 PolarHBondContact O-N 3.38Å; L160-F163 PolarHBondContact O-N 3.39Å; L160-W164 VanDerWaalsContact O-CB 3.27Å; L160-W164 WeakPolarHBondContact O-CB 3.08Å; L160-W164 PolarHBondContact O-N 3.34Å
161	L	90	Very high	80.5	Confident	92 Å²	92	106.4 Å²	106.4	48%	0.482	54%	0.538	S	S	.	.	H	α-helix	trans	-66.4	-41.8	175.4	-73.8	170.3	0	0	0	111.7	L157 I158 W164 M165	L157-L161 HydrophobicContact CG-CD1 4.16Å; L157-L161 WeakPolarHBondContact O-CB 3.48Å; L157-L161 VanDerWaalsContact O-CG 3.3Å; L157-L161 WeakPolarHBondContact O-CG 3.4Å; L157-L161 PolarHBondContact O-N 3.25Å; I158-L161 PolarHBondContact O-N 2.67Å; L161-W164 PolarHBondContact O-N 2.93Å; L161-M165 WeakPolarHBondContact O-CB 3.43Å; L161-M165 VanDerWaalsContact O-CG 3.3Å; L161-M165 WeakPolarHBondContact O-CG 3.33Å; L161-M165 PolarHBondContact O-N 3.15Å
162	A	85.2	Confident	78.5	Confident	56 Å²	56	109.3 Å²	109.3	46%	0.463	56%	0.558	S	S	.	*	H	α-helix	trans	-62.6	-42.4	174.9	0	0	0	0	0	111.6	I158 V159 M165 Y166	I158-A162 WeakPolarHBondContact O-CB 2.95Å; I158-A162 PolarHBondContact O-N 3.17Å; V159-A162 PolarHBondContact O-N 3.46Å; A162-M165 PolarHBondContact O-N 3Å; A162-Y166 VanDerWaalsContact O-CB 3.3Å; A162-Y166 WeakPolarHBondContact O-CB 3.19Å; A162-Y166 PolarHBondContact O-N 3.32Å
163	F	87	Confident	76.3	Confident	101 Å²	101	115 Å²	115	44%	0.443	57%	0.574	S	S	.	*	H	α-helix	trans	-66.5	-40	175.7	-177.7	-102	0	0	0	112.5	V159 L160 Y166 R167	V159-F163 WeakPolarHBondContact O-CB 3.45Å; V159-F163 PolarHBondContact O-N 3.15Å; L160-F163 PolarHBondContact O-N 3.39Å; F163-Y166 PolarHBondContact O-N 2.88Å; F163-R167 HydrophobicContact CE1-CG 4.33Å; F163-R167 HydrophobicContact CZ-CG 4.32Å; F163-R167 PolarHBondContact O-N 3.45Å
164	W	85.3	Confident	73.7	Confident	149 Å²	149	116.5 Å²	116.5	56%	0.564	59%	0.59	S	S	*	*	H	α-helix	trans	-64.7	-44.8	175.2	-176.9	80.3	0	0	0	111.4	L160 L161 Y166 R167 H168	L160-W164 VanDerWaalsContact O-CB 3.27Å; L160-W164 WeakPolarHBondContact O-CB 3.08Å; L160-W164 PolarHBondContact O-N 3.34Å; L161-W164 PolarHBondContact O-N 2.93Å; W164-Y166 VanDerWaalsContact C-N 3.34Å; W164-Y166 PolarHBondContact O-N 3.37Å; W164-R167 PolarHBondContact O-N 3.34Å; W164-H168 AromaticContact CD1-CD2 3.69Å; W164-H168 AromaticContact CD1-NE2 4Å; W164-H168 AromaticContact CD2-CD2 3.83Å; W164-H168 AromaticContact CE2-CD2 3.29Å; W164-H168 AromaticContact CE2-NE2 3.57Å; W164-H168 AromaticContact CZ2-CD2 3.67Å; W164-H168 AromaticContact CZ2-NE2 3.79Å; W164-H168 AromaticContact NE1-CD2 3.19Å; W164-H168 PolarHBondContact NE1-CD2 2.53Å; W164-H168 AromaticContact NE1-NE2 3.2Å; W164-H168 PolarHBondContact NE1-NE2 2.57Å; W164-H168 VanDerWaalsContact NE1-NE2 3.2Å; W164-H168 WeakPolarHBondContact O-CB 3.14Å; W164-H168 PolarHBondContact O-CD2 2.92Å; W164-H168 PolarHBondContact O-N 3.44Å
165	M	81.8	Confident	71.2	Confident	88 Å²	88	123.7 Å²	123.7	43%	0.433	61%	0.614	S	S	.	*	H	α-helix	trans	-62.1	-39.8	173.1	-74.3	-178.2	66.9	0	0	112.1	L161 A162 H168 R169	L161-M165 WeakPolarHBondContact O-CB 3.43Å; L161-M165 VanDerWaalsContact O-CG 3.3Å; L161-M165 WeakPolarHBondContact O-CG 3.33Å; L161-M165 PolarHBondContact O-N 3.15Å; A162-M165 PolarHBondContact O-N 3Å; M165-H168 PolarHBondContact O-N 3.14Å; M165-R169 VanDerWaalsContact O-CB 3.23Å; M165-R169 WeakPolarHBondContact O-CB 3.36Å; M165-R169 WeakPolarHBondContact O-CG 3.42Å; M165-R169 PolarHBondContact O-N 3.17Å
166	Y	77.3	Confident	68.5	Low	171 Å²	171	124.6 Å²	124.6	67%	0.671	62%	0.623	S	S	*	*	H	α-helix	trans	-63.4	-40.9	175.1	178.6	-100.5	0	0	0	111.8	A162 F163 W164	A162-Y166 VanDerWaalsContact O-CB 3.3Å; A162-Y166 WeakPolarHBondContact O-CB 3.19Å; A162-Y166 PolarHBondContact O-N 3.32Å; F163-Y166 PolarHBondContact O-N 2.88Å; W164-Y166 VanDerWaalsContact C-N 3.34Å; W164-Y166 PolarHBondContact O-N 3.37Å
167	R	76.5	Confident	65.8	Low	169 Å²	169	128.7 Å²	128.7	64%	0.638	64%	0.641	S	S	*	*	H	α-helix	trans	-69.7	-35.4	174.9	-89	-165.4	159	151.2	0.2	113.5	F163 W164	F163-R167 HydrophobicContact CE1-CG 4.33Å; F163-R167 HydrophobicContact CZ-CG 4.32Å; F163-R167 PolarHBondContact O-N 3.45Å; W164-R167 PolarHBondContact O-N 3.34Å
168	H	67.3	Low	63.3	Low	129 Å²	129	131.3 Å²	131.3	60%	0.597	65%	0.654	S	S	*	*	H	α-helix	trans	-84.8	-11.7	178.8	-86.1	-82.4	0	0	0	114.4	W164 M165	W164-H168 AromaticContact CD1-CD2 3.69Å; W164-H168 AromaticContact CD1-NE2 4Å; W164-H168 AromaticContact CD2-CD2 3.83Å; W164-H168 AromaticContact CE2-CD2 3.29Å; W164-H168 AromaticContact CE2-NE2 3.57Å; W164-H168 AromaticContact CZ2-CD2 3.67Å; W164-H168 AromaticContact CZ2-NE2 3.79Å; W164-H168 AromaticContact NE1-CD2 3.19Å; W164-H168 PolarHBondContact NE1-CD2 2.53Å; W164-H168 AromaticContact NE1-NE2 3.2Å; W164-H168 PolarHBondContact NE1-NE2 2.57Å; W164-H168 VanDerWaalsContact NE1-NE2 3.2Å; W164-H168 WeakPolarHBondContact O-CB 3.14Å; W164-H168 PolarHBondContact O-CD2 2.92Å; W164-H168 PolarHBondContact O-N 3.44Å; M165-H168 PolarHBondContact O-N 3.14Å
169	R	59.4	Low	60.6	Low	195 Å²	195	133.3 Å²	133.3	74%	0.736	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	25	173.3	-79.6	-172.4	167.7	172.7	-2.1	114.3	M165 P171	M165-R169 VanDerWaalsContact O-CB 3.23Å; M165-R169 WeakPolarHBondContact O-CB 3.36Å; M165-R169 WeakPolarHBondContact O-CG 3.42Å; M165-R169 PolarHBondContact O-N 3.17Å; R169-P171 WeakPolarHBondContact O-CD 3.39Å
170	K	42.7	Very low	57.9	Low	154 Å²	154	136.6 Å²	136.6	67%	0.67	67%	0.669	S	S	*	*			trans	-75.5	122.1	163.9	-69.6	-164.4	171.8	-168.6	0	109.1
171	P	43.2	Very low	55.1	Low	89 Å²	89	138.6 Å²	138.6	58%	0.578	68%	0.681	S	S	*	*			trans	-62.3	147.3	167.9	27.1	-31.8	0	0	0	109.1	R169 Y173	R169-P171 WeakPolarHBondContact O-CD 3.39Å; P171-Y173 PolarHBondContact O-N 2.63Å; P171-Y173 VanDerWaalsContact O-N 3.08Å
172	P	41.6	Very low	52.9	Low	131 Å²	131	139.6 Å²	139.6	85%	0.851	69%	0.693	S	S	*	*			trans	-67.3	111.4	175.4	28.2	-31.2	0	0	0	108.2	G174	P172-G174 PolarHBondContact O-N 2.73Å; P172-G174 VanDerWaalsContact O-N 3.14Å
173	Y	39.2	Very low	50.6	Low	218 Å²	218	139.9 Å²	139.9	86%	0.855	70%	0.701	S	S	*	*			trans	-68.4	108.1	165.8	-81.2	-87.8	0	0	0	107.7	P171	P171-Y173 PolarHBondContact O-N 2.63Å; P171-Y173 VanDerWaalsContact O-N 3.08Å
174	G	34.6	Very low	48.3	Very low	72 Å²	72	141 Å²	141	74%	0.742	72%	0.718	S	S	*	*			trans	-69.1	125.2	168.8	0	0	0	0	0	110	P172	P172-G174 PolarHBondContact O-N 2.73Å; P172-G174 VanDerWaalsContact O-N 3.14Å
175	H	37.6	Very low	46.1	Very low	184 Å²	184	139.6 Å²	139.6	85%	0.852	73%	0.729	S	S	*	*			trans	-74.2	125.9	163.6	-134	-45.4	0	0	0	107.7
176	V	33.4	Very low	44.2	Very low	132 Å²	132	140.6 Å²	140.6	80%	0.8	74%	0.742	S	S	*	*			trans	-143.7	136.9	159.4	-175.5	0	0	0	0	109.9
177	D	32.1	Very low	42.4	Very low	148 Å²	148	138.5 Å²	138.5	79%	0.791	75%	0.749	S	S	*	*			trans	-64.5	162.8	-168.7	-64.3	-69.6	0	0	0	117.4
178	I	40.1	Very low	40.7	Very low	163 Å²	163	136 Å²	136	84%	0.836	76%	0.757	S	S	*	*			trans	-89	128.4	169.5	-64.6	170.3	0	0	0	109.3
179	H	36.4	Very low	39.4	Very low	153 Å²	153	134.5 Å²	134.5	71%	0.708	76%	0.759	S	S	*	*			trans	-170.9	135.7	138.5	-121.7	-95	0	0	0	114.2
180	E	33.3	Very low	38.8	Very low	165 Å²	165	132.7 Å²	132.7	77%	0.771	76%	0.763	S	S	*	*			trans	53.4	140.1	155.6	-79.6	162.9	144.5	0	0	121.1
181	D	33.2	Very low	39.3	Very low	152 Å²	152	128.8 Å²	128.8	81%	0.813	75%	0.752	S	S	*	*			cis	-162.7	171.5	7.5	-148.9	19.4	0	0	0	108.1
182	P	44.7	Very low	39.7	Very low	113 Å²	113	127.2 Å²	127.2	73%	0.734	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-90.8	133	-158.7	35.5	-34	0	0	0	115.2
183	G	35.2	Very low	40.1	Very low	62 Å²	62	127.7 Å²	127.7	64%	0.639	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-96.9	153.4	159.3	0	0	0	0	0	111.2
184	P	38.8	Very low	41.4	Very low	123 Å²	123	121.1 Å²	121.1	80%	0.799	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-65.2	143.4	-177.2	28.6	-33.3	0	0	0	110.7
185	P	39.7	Very low	43.4	Very low	121 Å²	121	122.5 Å²	122.5	79%	0.786	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-72	135.2	-175.8	29	-32.4	0	0	0	110.5
186	P	41.2	Very low	45.7	Very low	109 Å²	109	115 Å²	115	71%	0.708	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-69.7	158.4	162.1	30.1	-31.3	0	0	0	110.1	S188	P186-S188 PolarHBondContact O-N 3.41Å
187	P	41	Very low	48.4	Very low	126 Å²	126	114.5 Å²	114.5	82%	0.818	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-61.1	134.7	-172.2	25	-33.3	0	0	0	111.5
188	S	39.9	Very low	51.3	Low	117 Å²	117	110 Å²	110	82%	0.818	65%	0.649	S	S	*	*			trans	-40.9	130.5	-174.9	-48.4	0	0	0	0	114.1	P186	P186-S188 PolarHBondContact O-N 3.41Å
189	P	40.8	Very low	53.8	Low	97 Å²	97	105.6 Å²	105.6	63%	0.63	63%	0.627	S	S	*	*			trans	-84.9	149.8	176.9	31.4	-29.1	0	0	0	112.6	L193	P189-L193 HydrophobicContact CB-CD1 4.13Å; P189-L193 HydrophobicContact CG-CD1 4.37Å
190	L	46.9	Very low	56.5	Low	158 Å²	158	102.4 Å²	102.4	83%	0.827	61%	0.612	S	S	*	*			trans	-42.8	151.3	168.7	-67.5	146	0	0	0	112.5	G192	L190-G192 PolarHBondContact O-N 2.92Å
191	V	53.5	Low	59.2	Low	72 Å²	72	97.9 Å²	97.9	44%	0.436	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-48.1	-21.8	-175.9	174	0	0	0	0	115	L193 K194	V191-L193 PolarHBondContact O-N 3.12Å; V191-K194 PolarHBondContact O-N 3.23Å
192	G	51	Low	62	Low	55 Å²	55	95.5 Å²	95.5	57%	0.567	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-68	5.3	-177.5	0	0	0	0	0	118	L190	L190-G192 PolarHBondContact O-N 2.92Å
193	L	50.5	Low	63.9	Low	142 Å²	142	91.8 Å²	91.8	74%	0.743	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-123.3	7.2	176.7	-74.2	169.7	0	0	0	114.2	P189 V191	P189-L193 HydrophobicContact CB-CD1 4.13Å; P189-L193 HydrophobicContact CG-CD1 4.37Å; V191-L193 PolarHBondContact O-N 3.12Å
194	K	65.8	Low	66.2	Low	80 Å²	80	98.4 Å²	98.4	35%	0.348	56%	0.559	S	S	.	*	S	Bend	trans	-74.4	129.9	176.5	-65.5	-176.6	170.4	-162.6	0	109.4	V191 L196 L215 M216	V191-K194 PolarHBondContact O-N 3.23Å; K194-L196 PolarHBondContact O-N 3.37Å; K194-L196 VanDerWaalsContact O-N 3.08Å; K194-L215 HydrophobicContact CB-CD1 3.6Å; K194-L215 HydrophobicContact CB-CG 4.46Å; K194-L215 HydrophobicContact CD-CD1 4.42Å; K194-M216 HydrophobicContact CB-CG 4.09Å; K194-M216 HydrophobicContact CB-SD 4.49Å; K194-M216 HydrophobicContact CD-CE 3.97Å; K194-M216 HydrophobicContact CD-CG 3.93Å; K194-M216 HydrophobicContact CD-SD 3.39Å; K194-M216 WeakPolarHBondContact CD-SD 3.16Å; K194-M216 WeakPolarHBondContact CE-SD 3.33Å; K194-M216 HydrophobicContact CG-CE 3.79Å; K194-M216 HydrophobicContact CG-CG 4.11Å; K194-M216 HydrophobicContact CG-SD 3.85Å; K194-M216 PolarHBondContact NZ-SD 3.44Å
195	P	75.9	Confident	67.6	Low	101 Å²	101	94.5 Å²	94.5	66%	0.656	54%	0.541	S	S	*	.			trans	-61.1	118.6	176.2	24.7	-31.6	0	0	0	108.8	M216	P195-M216 PolarHBondContact O-N 3.33Å
196	L	87	Confident	69.1	Low	26 Å²	26	96.7 Å²	96.7	14%	0.136	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.3	175.4	-173.3	164.2	0	0	0	108.2	K194 L198 A213 Q214 L215 V222 W268 I270	K194-L196 PolarHBondContact O-N 3.37Å; K194-L196 VanDerWaalsContact O-N 3.08Å; L196-L198 HydrophobicContact CD2-CD2 3.96Å; L196-L198 HydrophobicContact CD2-CG 4.44Å; L196-A213 HydrophobicContact CD2-CB 3.85Å; L196-A213 HydrophobicContact CG-CB 4.42Å; L196-Q214 VanDerWaalsContact CA-O 3.32Å; L196-Q214 WeakPolarHBondContact CA-O 3.41Å; L196-L215 HydrophobicContact CB-CD1 4.01Å; L196-L215 HydrophobicContact CD1-CD1 4.34Å; L196-L215 HydrophobicContact CG-CD1 4.38Å; L196-V222 HydrophobicContact CD1-CG2 4.05Å; L196-V222 HydrophobicContact CD2-CG2 4.28Å; L196-W268 HydrophobicContact CD1-CE3 4.2Å; L196-W268 HydrophobicContact CD1-CZ3 3.8Å; L196-W268 HydrophobicContact CD2-CH2 3.98Å; L196-W268 HydrophobicContact CD2-CZ3 3.45Å; L196-W268 VanDerWaalsContact CD2-CZ3 3.45Å; L196-W268 HydrophobicContact CG-CZ3 4.18Å; L196-I270 HydrophobicContact CD1-CD1 3.67Å
197	Q	89.9	Confident	70.6	Confident	122 Å²	122	92.5 Å²	92.5	57%	0.57	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	121.2	178.1	-175.8	176.3	4.3	0	0	110.4	L199 A213 Q214	Q197-L199 HydrophobicContact CG-CD2 4.2Å; Q197-A213 CarbonylContact O-C 3.58Å; Q197-A213 WeakPolarHBondContact O-CA 3.4Å; Q197-A213 WeakPolarHBondContact O-CB 3.46Å; Q197-Q214 PolarHBondContact N-O 3.46Å; Q197-Q214 PolarHBondContact O-N 2.93Å
198	L	92.1	Very high	72.4	Confident	54 Å²	54	87.3 Å²	87.3	28%	0.283	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	134.8	169.9	-59.4	179.3	0	0	0	109.3	L196 W211 A213 V222 I224 W268	L196-L198 HydrophobicContact CD2-CD2 3.96Å; L196-L198 HydrophobicContact CD2-CG 4.44Å; L198-W211 HydrophobicContact CB-CD2 4.27Å; L198-W211 HydrophobicContact CB-CE3 3.81Å; L198-W211 HydrophobicContact CB-CZ3 4.24Å; L198-W211 HydrophobicContact CD1-CD2 4.21Å; L198-W211 HydrophobicContact CD1-CE3 4.46Å; L198-W211 HydrophobicContact CD1-CG 4.49Å; L198-W211 HydrophobicContact CD2-CB 3.87Å; L198-W211 HydrophobicContact CD2-CD2 4.47Å; L198-W211 HydrophobicContact CD2-CG 4.11Å; L198-A213 HydrophobicContact CD2-CB 3.99Å; L198-V222 HydrophobicContact CD2-CB 4.09Å; L198-V222 HydrophobicContact CD2-CG1 4.27Å; L198-V222 HydrophobicContact CD2-CG2 4.22Å; L198-I224 HydrophobicContact CD1-CD1 3.87Å; L198-I224 HydrophobicContact CD2-CD1 4.45Å; L198-W268 HydrophobicContact CD1-CH2 4.06Å; L198-W268 HydrophobicContact CD1-CZ2 4.1Å; L198-W268 HydrophobicContact CD2-CH2 3.93Å; L198-W268 HydrophobicContact CD2-CZ3 4.28Å; L198-W268 HydrophobicContact CG-CH2 4.02Å
199	L	92.3	Very high	74.7	Confident	70 Å²	70	83.3 Å²	83.3	37%	0.366	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	-64.8	-177.4	-57.1	175	0	0	0	111.3	Q197 K212 Q214 F219	Q197-L199 HydrophobicContact CG-CD2 4.2Å; L199-K212 WeakPolarHBondContact CA-O 3.38Å; L199-K212 WeakPolarHBondContact CB-O 3.42Å; L199-K212 HydrophobicContact CD1-CG 4.38Å; L199-K212 PolarHBondContact N-O 3.13Å; L199-Q214 HydrophobicContact CD1-CB 4.21Å; L199-F219 HydrophobicContact CD1-CD1 3.91Å; L199-F219 HydrophobicContact CD1-CE1 3.55Å
200	E	92.8	Very high	77.2	Confident	86 Å²	86	80.4 Å²	80.4	40%	0.402	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	148.2	-174.4	57.1	176.7	158.5	0	0	111.7	K202 W211 K212	E200-K202 HydrophobicContact CG-CD 4.33Å; E200-K202 PolarHBondContact O-N 3.03Å; E200-K202 WeakPolarHBondContact OE1-CE 3.49Å; E200-K202 IonicContact OE1-NZ 3.64Å; E200-K202 PolarHBondContact OE1-NZ 2.86Å; E200-K202 IonicContact OE2-NZ 2.7Å; E200-K202 PolarHBondContact OE2-NZ 3.2Å; E200-W211 CarbonylContact O-C 3.47Å; E200-W211 WeakPolarHBondContact O-CA 3.36Å; E200-K212 HydrophobicContact CG-CB 3.88Å; E200-K212 HydrophobicContact CG-CD 4.47Å; E200-K212 PolarHBondContact N-O 3.23Å; E200-K212 PolarHBondContact O-N 3.06Å
201	I	91.8	Very high	79.5	Confident	70 Å²	70	75.8 Å²	75.8	36%	0.359	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	123.3	174	-60.6	172.4	0	0	0	108.4	W211	I201-W211 HydrophobicContact CD1-CH2 3.91Å; I201-W211 HydrophobicContact CD1-CZ2 3.61Å; I201-W211 HydrophobicContact CG1-CD2 3.7Å; I201-W211 VanDerWaalsContact CG1-CE2 3.44Å; I201-W211 HydrophobicContact CG1-CE3 3.86Å; I201-W211 HydrophobicContact CG1-CG 4.46Å; I201-W211 HydrophobicContact CG1-CH2 3.6Å; I201-W211 HydrophobicContact CG1-CZ2 3.4Å; I201-W211 VanDerWaalsContact CG1-CZ2 3.4Å; I201-W211 HydrophobicContact CG1-CZ3 3.82Å
202	K	90.3	Very high	81.5	Confident	101 Å²	101	73.4 Å²	73.4	44%	0.439	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-34.4	177.1	-69.8	-59.7	-169.4	-167.9	0	113.3	E200 V210 K212 F273	E200-K202 HydrophobicContact CG-CD 4.33Å; E200-K202 PolarHBondContact O-N 3.03Å; E200-K202 WeakPolarHBondContact OE1-CE 3.49Å; E200-K202 IonicContact OE1-NZ 3.64Å; E200-K202 PolarHBondContact OE1-NZ 2.86Å; E200-K202 IonicContact OE2-NZ 2.7Å; E200-K202 PolarHBondContact OE2-NZ 3.2Å; K202-V210 PolarHBondContact N-O 3.11Å; K202-K212 HydrophobicContact CG-CB 3.95Å; K202-F273 HydrophobicContact CD-CZ 4.48Å; K202-F273 HydrophobicContact CG-CE2 3.96Å; K202-F273 HydrophobicContact CG-CZ 4.22Å
203	A	85.4	Confident	83.6	Confident	36 Å²	36	70.8 Å²	70.8	30%	0.298	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	153.5	178.3	0	0	0	0	0	112	C209 V210	A203-C209 WeakPolarHBondContact O-CA 3.44Å; A203-V210 HydrophobicContact CB-CB 4.21Å; A203-V210 HydrophobicContact CB-CG2 4.42Å; A203-V210 PolarHBondContact N-O 3.23Å; A203-V210 PolarHBondContact O-N 2.85Å
204	R	82.7	Confident	85.7	Confident	200 Å²	200	67.2 Å²	67.2	76%	0.755	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.3	114.4	162.5	-64.4	-179.9	-178.5	-124.3	0.7	106.8
205	G	68.7	Low	86.9	Confident	41 Å²	41	64.3 Å²	64.3	42%	0.423	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-178	178.4	0	0	0	0	0	111.7	F207 G208	G205-F207 VanDerWaalsContact C-N 3.28Å; G205-F207 PolarHBondContact O-N 3.5Å; G205-G208 PolarHBondContact N-O 2.81Å
206	R	71	Confident	87.4	Confident	168 Å²	168	64 Å²	64	63%	0.634	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-36.3	179.3	-177.9	176.4	176.8	-172.5	1.6	113.1
207	F	73.1	Confident	87.4	Confident	21 Å²	21	70 Å²	70	9%	0.092	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116	11.3	-170.1	-51.7	-66.1	0	0	0	113.3	G205 F225 D229 S232 L348	G205-F207 VanDerWaalsContact C-N 3.28Å; G205-F207 PolarHBondContact O-N 3.5Å; F207-F225 HydrophobicContact CB-CD1 3.67Å; F207-F225 HydrophobicContact CB-CE1 3.59Å; F207-F225 WeakPolarHBondContact O-CD1 3.08Å; F207-F225 WeakPolarHBondContact O-CG 3.38Å; F207-D229 HydrophobicContact CB-CB 4.47Å; F207-S232 WeakPolarHBondContact CD1-OG 3.12Å; F207-S232 VanDerWaalsContact CE1-OG 3.26Å; F207-S232 WeakPolarHBondContact CE1-OG 3.18Å; F207-L348 HydrophobicContact CE2-CD2 4.35Å; F207-L348 HydrophobicContact CZ-CD2 4.09Å
208	G	79.6	Confident	87.5	Confident	17 Å²	17	69.7 Å²	69.7	18%	0.175	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.1	-174	-176	0	0	0	0	0	115.6	G205 I224	G205-G208 PolarHBondContact N-O 2.81Å; G208-I224 WeakPolarHBondContact CA-O 3.29Å
209	C	88.3	Confident	87.7	Confident	33 Å²	33	71.7 Å²	71.7	22%	0.223	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	139.1	175.9	58.3	0	0	0	0	111	A203 W211 K223 I224	A203-C209 WeakPolarHBondContact O-CA 3.44Å; C209-W211 PolarHBondContact SG-NE1 3.48Å; C209-K223 WeakPolarHBondContact O-CA 3.39Å; C209-I224 PolarHBondContact N-O 2.7Å; C209-I224 VanDerWaalsContact N-O 3.16Å; C209-I224 PolarHBondContact O-N 3.38Å
210	V	93.3	Very high	87.9	Confident	36 Å²	36	68.6 Å²	68.6	22%	0.218	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.9	177.4	-176.4	0	0	0	0	108.4	K202 A203 A221 V222 K223	K202-V210 PolarHBondContact N-O 3.11Å; A203-V210 HydrophobicContact CB-CB 4.21Å; A203-V210 HydrophobicContact CB-CG2 4.42Å; A203-V210 PolarHBondContact N-O 3.23Å; A203-V210 PolarHBondContact O-N 2.85Å; V210-A221 HydrophobicContact CG1-CB 4.17Å; V210-V222 WeakPolarHBondContact CA-O 3.35Å; V210-K223 HydrophobicContact CG2-CB 4.21Å; V210-K223 HydrophobicContact CG2-CD 4.44Å; V210-K223 HydrophobicContact CG2-CG 3.99Å
211	W	94.6	Very high	88.1	Confident	60 Å²	60	64.9 Å²	64.9	23%	0.227	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	140	177	-69	76.6	0	0	0	110.7	L198 E200 I201 C209 A221 V222 I224	L198-W211 HydrophobicContact CB-CD2 4.27Å; L198-W211 HydrophobicContact CB-CE3 3.81Å; L198-W211 HydrophobicContact CB-CZ3 4.24Å; L198-W211 HydrophobicContact CD1-CD2 4.21Å; L198-W211 HydrophobicContact CD1-CE3 4.46Å; L198-W211 HydrophobicContact CD1-CG 4.49Å; L198-W211 HydrophobicContact CD2-CB 3.87Å; L198-W211 HydrophobicContact CD2-CD2 4.47Å; L198-W211 HydrophobicContact CD2-CG 4.11Å; E200-W211 CarbonylContact O-C 3.47Å; E200-W211 WeakPolarHBondContact O-CA 3.36Å; I201-W211 HydrophobicContact CD1-CH2 3.91Å; I201-W211 HydrophobicContact CD1-CZ2 3.61Å; I201-W211 HydrophobicContact CG1-CD2 3.7Å; I201-W211 VanDerWaalsContact CG1-CE2 3.44Å; I201-W211 HydrophobicContact CG1-CE3 3.86Å; I201-W211 HydrophobicContact CG1-CG 4.46Å; I201-W211 HydrophobicContact CG1-CH2 3.6Å; I201-W211 HydrophobicContact CG1-CZ2 3.4Å; I201-W211 VanDerWaalsContact CG1-CZ2 3.4Å; I201-W211 HydrophobicContact CG1-CZ3 3.82Å; C209-W211 PolarHBondContact SG-NE1 3.48Å; W211-A221 CarbonylContact O-C 3.59Å; W211-A221 WeakPolarHBondContact O-CA 3.27Å; W211-V222 HydrophobicContact CB-CB 4.45Å; W211-V222 PolarHBondContact N-O 3.37Å; W211-V222 PolarHBondContact O-N 2.81Å; W211-I224 HydrophobicContact CG-CD1 4.47Å
212	K	96.1	Very high	88.3	Confident	22 Å²	22	61.6 Å²	61.6	10%	0.096	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	129.2	154	-175.9	177	-177.6	163.9	0	106.9	L199 E200 K202 F219 F273 D275	L199-K212 WeakPolarHBondContact CA-O 3.38Å; L199-K212 WeakPolarHBondContact CB-O 3.42Å; L199-K212 HydrophobicContact CD1-CG 4.38Å; L199-K212 PolarHBondContact N-O 3.13Å; E200-K212 HydrophobicContact CG-CB 3.88Å; E200-K212 HydrophobicContact CG-CD 4.47Å; E200-K212 PolarHBondContact N-O 3.23Å; E200-K212 PolarHBondContact O-N 3.06Å; K202-K212 HydrophobicContact CG-CB 3.95Å; K212-F219 VanDerWaalsContact CE-CD1 3.43Å; K212-F219 VanDerWaalsContact CE-CG 3.48Å; K212-F219 HydrophobicContact CG-CD1 4.41Å; K212-F273 HydrophobicContact CB-CD2 4.28Å; K212-F273 HydrophobicContact CB-CE2 3.87Å; K212-F273 HydrophobicContact CB-CZ 4.07Å; K212-F273 HydrophobicContact CD-CD1 4.14Å; K212-F273 HydrophobicContact CD-CE1 3.56Å; K212-F273 HydrophobicContact CD-CE2 4.3Å; K212-F273 HydrophobicContact CD-CZ 3.68Å; K212-F273 HydrophobicContact CG-CD1 4.15Å; K212-F273 HydrophobicContact CG-CD2 4.14Å; K212-F273 HydrophobicContact CG-CE1 3.94Å; K212-F273 HydrophobicContact CG-CE2 3.97Å; K212-F273 HydrophobicContact CG-CG 4.26Å; K212-F273 HydrophobicContact CG-CZ 3.88Å; K212-D275 IonicContact NZ-OD1 3.45Å; K212-D275 PolarHBondContact NZ-OD1 2.92Å
213	A	95.3	Very high	88.5	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	159	179.1	0	0	0	0	0	110.3	L196 Q197 L198 F219 V220 V222	L196-A213 HydrophobicContact CD2-CB 3.85Å; L196-A213 HydrophobicContact CG-CB 4.42Å; Q197-A213 CarbonylContact O-C 3.58Å; Q197-A213 WeakPolarHBondContact O-CA 3.4Å; Q197-A213 WeakPolarHBondContact O-CB 3.46Å; L198-A213 HydrophobicContact CD2-CB 3.99Å; A213-F219 CarbonylContact O-C 3.47Å; A213-F219 WeakPolarHBondContact O-CA 3.41Å; A213-V220 HydrophobicContact CB-CG2 3.95Å; A213-V220 PolarHBondContact N-O 3.22Å; A213-V220 PolarHBondContact O-N 3.39Å; A213-V222 HydrophobicContact CB-CG2 3.58Å
214	Q	93.7	Very high	88.8	Confident	68 Å²	68	56.6 Å²	56.6	32%	0.318	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.1	173.2	-175.8	169.4	8.4	0	0	109	L196 Q197 L199 M216 F219	L196-Q214 VanDerWaalsContact CA-O 3.32Å; L196-Q214 WeakPolarHBondContact CA-O 3.41Å; Q197-Q214 PolarHBondContact N-O 3.46Å; Q197-Q214 PolarHBondContact O-N 2.93Å; L199-Q214 HydrophobicContact CD1-CB 4.21Å; Q214-M216 VanDerWaalsContact CG-O 3.29Å; Q214-M216 WeakPolarHBondContact CG-O 2.99Å; Q214-M216 PolarHBondContact NE2-O 3.27Å; Q214-F219 HydrophobicContact CB-CD1 4.47Å
215	L	90.8	Very high	89.3	Confident	19 Å²	19	47.1 Å²	47.1	10%	0.099	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	103.1	174	-178.7	67.2	0	0	0	107.7	K194 L196 N217 D218 V220 I254	K194-L215 HydrophobicContact CB-CD1 3.6Å; K194-L215 HydrophobicContact CB-CG 4.46Å; K194-L215 HydrophobicContact CD-CD1 4.42Å; L196-L215 HydrophobicContact CB-CD1 4.01Å; L196-L215 HydrophobicContact CD1-CD1 4.34Å; L196-L215 HydrophobicContact CG-CD1 4.38Å; L215-N217 PolarHBondContact O-N 2.92Å; L215-D218 PolarHBondContact N-O 3Å; L215-D218 PolarHBondContact O-N 3.47Å; L215-D218 VanDerWaalsContact O-N 3.15Å; L215-V220 HydrophobicContact CB-CG1 3.86Å; L215-V220 HydrophobicContact CB-CG2 3.84Å; L215-V220 HydrophobicContact CD2-CG1 4.14Å; L215-I254 HydrophobicContact CD2-CG2 4.33Å
216	M	87.5	Confident	90.2	Very high	95 Å²	95	47.7 Å²	47.7	47%	0.468	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	-115.2	-166.7	-57.3	179	131.2	0	0	111.8	K194 P195 Q214	K194-M216 HydrophobicContact CB-CG 4.09Å; K194-M216 HydrophobicContact CB-SD 4.49Å; K194-M216 HydrophobicContact CD-CE 3.97Å; K194-M216 HydrophobicContact CD-CG 3.93Å; K194-M216 HydrophobicContact CD-SD 3.39Å; K194-M216 WeakPolarHBondContact CD-SD 3.16Å; K194-M216 WeakPolarHBondContact CE-SD 3.33Å; K194-M216 HydrophobicContact CG-CE 3.79Å; K194-M216 HydrophobicContact CG-CG 4.11Å; K194-M216 HydrophobicContact CG-SD 3.85Å; K194-M216 PolarHBondContact NZ-SD 3.44Å; P195-M216 PolarHBondContact O-N 3.33Å; Q214-M216 VanDerWaalsContact CG-O 3.29Å; Q214-M216 WeakPolarHBondContact CG-O 2.99Å; Q214-M216 PolarHBondContact NE2-O 3.27Å
217	N	87	Confident	91	Very high	151 Å²	151	43.9 Å²	43.9	81%	0.807	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-3.7	-178.6	-66.2	-16.2	0	0	0	112.9	L215	L215-N217 PolarHBondContact O-N 2.92Å
218	D	91.6	Very high	91.7	Very high	116 Å²	116	50.8 Å²	50.8	62%	0.62	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	144.2	-174.9	-59.8	-46.2	0	0	0	111.1	L215	L215-D218 PolarHBondContact N-O 3Å; L215-D218 PolarHBondContact O-N 3.47Å; L215-D218 VanDerWaalsContact O-N 3.15Å
219	F	95.6	Very high	92.1	Very high	96 Å²	96	51.8 Å²	51.8	42%	0.421	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	133.7	167.8	-67.4	-59.2	0	0	0	110.4	L199 K212 A213 Q214 F273	L199-F219 HydrophobicContact CD1-CD1 3.91Å; L199-F219 HydrophobicContact CD1-CE1 3.55Å; K212-F219 VanDerWaalsContact CE-CD1 3.43Å; K212-F219 VanDerWaalsContact CE-CG 3.48Å; K212-F219 HydrophobicContact CG-CD1 4.41Å; A213-F219 CarbonylContact O-C 3.47Å; A213-F219 WeakPolarHBondContact O-CA 3.41Å; Q214-F219 HydrophobicContact CB-CD1 4.47Å; F219-F273 HydrophobicContact CB-CB 4.05Å; F219-F273 HydrophobicContact CB-CD1 4.02Å; F219-F273 HydrophobicContact CB-CG 4.3Å; F219-F273 WeakPolarHBondContact O-CB 3.39Å
220	V	96.9	Very high	92.2	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.024	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	155.6	178.6	-58.7	0	0	0	0	110.5	A213 L215 V222 I254 I270 T271	A213-V220 HydrophobicContact CB-CG2 3.95Å; A213-V220 PolarHBondContact N-O 3.22Å; A213-V220 PolarHBondContact O-N 3.39Å; L215-V220 HydrophobicContact CB-CG1 3.86Å; L215-V220 HydrophobicContact CB-CG2 3.84Å; L215-V220 HydrophobicContact CD2-CG1 4.14Å; V220-V222 HydrophobicContact CG2-CG2 4.16Å; V220-I254 HydrophobicContact CB-CD1 4.16Å; V220-I254 HydrophobicContact CG1-CD1 3.51Å; V220-I270 HydrophobicContact CB-CG2 4Å; V220-I270 HydrophobicContact CG2-CG2 3.91Å; V220-T271 WeakPolarHBondContact CA-O 3.36Å; V220-T271 WeakPolarHBondContact CB-O 3.44Å
221	A	96.9	Very high	92	Very high	9 Å²	9	59.1 Å²	59.1	7%	0.074	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.7	170.8	0	0	0	0	0	109	V210 W211 I270 T271 F273	V210-A221 HydrophobicContact CG1-CB 4.17Å; W211-A221 CarbonylContact O-C 3.59Å; W211-A221 WeakPolarHBondContact O-CA 3.27Å; A221-I270 WeakPolarHBondContact O-CA 3.34Å; A221-T271 PolarHBondContact N-O 2.91Å; A221-T271 PolarHBondContact O-N 3.16Å; A221-F273 HydrophobicContact CB-CD2 4.14Å
222	V	95.6	Very high	91.8	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	107.5	177.2	-176.1	0	0	0	0	108.5	L196 L198 V210 W211 A213 V220 I224 W268 I270	L196-V222 HydrophobicContact CD1-CG2 4.05Å; L196-V222 HydrophobicContact CD2-CG2 4.28Å; L198-V222 HydrophobicContact CD2-CB 4.09Å; L198-V222 HydrophobicContact CD2-CG1 4.27Å; L198-V222 HydrophobicContact CD2-CG2 4.22Å; V210-V222 WeakPolarHBondContact CA-O 3.35Å; W211-V222 HydrophobicContact CB-CB 4.45Å; W211-V222 PolarHBondContact N-O 3.37Å; W211-V222 PolarHBondContact O-N 2.81Å; A213-V222 HydrophobicContact CB-CG2 3.58Å; V220-V222 HydrophobicContact CG2-CG2 4.16Å; V222-I224 HydrophobicContact CG1-CD1 4.41Å; V222-I224 HydrophobicContact CG1-CG1 3.84Å; V222-W268 HydrophobicContact CG1-CB 4.22Å; V222-W268 HydrophobicContact CG1-CD2 3.64Å; V222-W268 HydrophobicContact CG1-CE3 3.44Å; V222-W268 VanDerWaalsContact CG1-CE3 3.44Å; V222-W268 HydrophobicContact CG1-CG 4.03Å; V222-W268 HydrophobicContact CG1-CZ3 3.98Å; V222-I270 HydrophobicContact CG2-CG1 4.34Å; V222-I270 HydrophobicContact CG2-CG2 4.4Å
223	K	94.9	Very high	91.7	Very high	18 Å²	18	57 Å²	57	8%	0.078	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113.8	171.9	-168.4	176	-179.8	-174.2	0	108.2	C209 V210 F225 E236 L269 D345	C209-K223 WeakPolarHBondContact O-CA 3.39Å; V210-K223 HydrophobicContact CG2-CB 4.21Å; V210-K223 HydrophobicContact CG2-CD 4.44Å; V210-K223 HydrophobicContact CG2-CG 3.99Å; K223-F225 HydrophobicContact CB-CE2 3.91Å; K223-F225 HydrophobicContact CD-CE1 4.35Å; K223-F225 HydrophobicContact CD-CE2 3.7Å; K223-F225 HydrophobicContact CD-CZ 3.43Å; K223-F225 VanDerWaalsContact CD-CZ 3.43Å; K223-F225 VanDerWaalsContact CE-CZ 3.42Å; K223-F225 HydrophobicContact CG-CD2 4.23Å; K223-F225 HydrophobicContact CG-CE2 3.49Å; K223-F225 VanDerWaalsContact CG-CE2 3.49Å; K223-F225 HydrophobicContact CG-CZ 3.71Å; K223-E236 IonicContact NZ-OE1 3.74Å; K223-E236 PolarHBondContact NZ-OE1 3.4Å; K223-E236 IonicContact NZ-OE2 3.36Å; K223-E236 PolarHBondContact NZ-OE2 3.01Å; K223-L269 HydrophobicContact CB-CB 4.42Å; K223-L269 PolarHBondContact N-O 3.39Å; K223-L269 PolarHBondContact O-N 2.04Å; K223-D345 IonicContact NZ-OD1 3.99Å; K223-D345 PolarHBondContact NZ-OD1 3Å; K223-D345 IonicContact NZ-OD2 2.99Å
224	I	92.6	Very high	91.6	Very high	14 Å²	14	59.3 Å²	59.3	7%	0.072	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.4	-178.6	-54.4	179.7	0	0	0	108.6	L198 G208 C209 W211 V222 E266 L267 W268	L198-I224 HydrophobicContact CD1-CD1 3.87Å; L198-I224 HydrophobicContact CD2-CD1 4.45Å; G208-I224 WeakPolarHBondContact CA-O 3.29Å; C209-I224 PolarHBondContact N-O 2.7Å; C209-I224 VanDerWaalsContact N-O 3.16Å; C209-I224 PolarHBondContact O-N 3.38Å; W211-I224 HydrophobicContact CG-CD1 4.47Å; V222-I224 HydrophobicContact CG1-CD1 4.41Å; V222-I224 HydrophobicContact CG1-CG1 3.84Å; I224-E266 HydrophobicContact CG2-CB 4.05Å; I224-E266 HydrophobicContact CG2-CG 4.24Å; I224-L267 WeakPolarHBondContact CA-O 3.42Å; I224-W268 HydrophobicContact CD1-CZ2 4Å; I224-W268 HydrophobicContact CG1-CD2 4.4Å; I224-W268 HydrophobicContact CG1-CG 4.33Å
225	F	91.9	Very high	91.4	Very high	1 Å²	1	58 Å²	58	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	135.7	178.9	-59	-111.4	0	0	0	109.8	F207 K223 D229 W233 E236 L267 L269	F207-F225 HydrophobicContact CB-CD1 3.67Å; F207-F225 HydrophobicContact CB-CE1 3.59Å; F207-F225 WeakPolarHBondContact O-CD1 3.08Å; F207-F225 WeakPolarHBondContact O-CG 3.38Å; K223-F225 HydrophobicContact CB-CE2 3.91Å; K223-F225 HydrophobicContact CD-CE1 4.35Å; K223-F225 HydrophobicContact CD-CE2 3.7Å; K223-F225 HydrophobicContact CD-CZ 3.43Å; K223-F225 VanDerWaalsContact CD-CZ 3.43Å; K223-F225 VanDerWaalsContact CE-CZ 3.42Å; K223-F225 HydrophobicContact CG-CD2 4.23Å; K223-F225 HydrophobicContact CG-CE2 3.49Å; K223-F225 VanDerWaalsContact CG-CE2 3.49Å; K223-F225 HydrophobicContact CG-CZ 3.71Å; F225-D229 HydrophobicContact CD1-CB 4.41Å; F225-W233 HydrophobicContact CB-CB 4.19Å; F225-W233 HydrophobicContact CD1-CB 3.98Å; F225-W233 HydrophobicContact CD2-CB 4.02Å; F225-W233 AromaticContact CD2-CD1 3.57Å; F225-W233 HydrophobicContact CD2-CG 4.17Å; F225-W233 HydrophobicContact CE1-CB 4.31Å; F225-W233 HydrophobicContact CE2-CB 4.36Å; F225-W233 AromaticContact CE2-CD1 3.76Å; F225-W233 HydrophobicContact CE2-CG 4.48Å; F225-W233 HydrophobicContact CG-CB 3.83Å; F225-W233 HydrophobicContact CG-CG 4.42Å; F225-W233 HydrophobicContact CZ-CB 4.48Å; F225-E236 VanDerWaalsContact CZ-OE2 3.29Å; F225-E236 WeakPolarHBondContact CZ-OE2 3.48Å; F225-L267 HydrophobicContact CB-CB 4.12Å; F225-L267 WeakPolarHBondContact CD2-O 3.43Å; F225-L267 PolarHBondContact N-O 2.73Å; F225-L267 PolarHBondContact O-N 2.82Å; F225-L269 HydrophobicContact CE2-CB 3.87Å
226	P	87.8	Confident	91.6	Very high	53 Å²	53	57.3 Å²	57.3	34%	0.344	29%	0.291	S	S	.	.			trans	-67.9	157	168.3	31.9	-34.9	0	0	0	110.2	Q228 D229	P226-Q228 HydrophobicContact CB-CG 4.06Å; P226-Q228 HydrophobicContact CG-CG 3.83Å; P226-Q228 PolarHBondContact O-N 2.84Å; P226-Q228 VanDerWaalsContact O-N 3.14Å; P226-D229 WeakPolarHBondContact CD-OD2 3.38Å; P226-D229 HydrophobicContact CG-CB 4.13Å; P226-D229 WeakPolarHBondContact CG-OD2 3.26Å; P226-D229 PolarHBondContact O-N 3.21Å
227	L	87.8	Confident	92	Very high	88 Å²	88	56.7 Å²	56.7	46%	0.461	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-59.7	-29	-176.6	-171.9	63.6	0	0	0	113.6	D229 K230 V265 L267	L227-D229 PolarHBondContact O-N 3.31Å; L227-K230 VanDerWaalsContact O-CB 3.23Å; L227-K230 WeakPolarHBondContact O-CB 3.46Å; L227-K230 PolarHBondContact O-N 2.86Å; L227-V265 HydrophobicContact CD1-CB 4.33Å; L227-V265 HydrophobicContact CD1-CG1 3.96Å; L227-L267 HydrophobicContact CD1-CD1 4.47Å
228	Q	88.1	Confident	92.4	Very high	167 Å²	167	54.1 Å²	54.1	78%	0.78	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-62.5	-28.8	174.5	68.3	-164	29.1	0	0	113.1	P226 K230	P226-Q228 HydrophobicContact CB-CG 4.06Å; P226-Q228 HydrophobicContact CG-CG 3.83Å; P226-Q228 PolarHBondContact O-N 2.84Å; P226-Q228 VanDerWaalsContact O-N 3.14Å; Q228-K230 VanDerWaalsContact C-N 3.3Å; Q228-K230 PolarHBondContact O-N 3.48Å
229	D	88.1	Confident	92.6	Very high	38 Å²	38	49.1 Å²	49.1	20%	0.203	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-96.3	22.6	179.3	-62.9	-34.6	0	0	0	111.8	F207 F225 P226 L227 Q231 S232 W233	F207-D229 HydrophobicContact CB-CB 4.47Å; F225-D229 HydrophobicContact CD1-CB 4.41Å; P226-D229 WeakPolarHBondContact CD-OD2 3.38Å; P226-D229 HydrophobicContact CG-CB 4.13Å; P226-D229 WeakPolarHBondContact CG-OD2 3.26Å; P226-D229 PolarHBondContact O-N 3.21Å; L227-D229 PolarHBondContact O-N 3.31Å; D229-Q231 PolarHBondContact O-N 3.29Å; D229-S232 WeakPolarHBondContact O-CB 3.4Å; D229-S232 PolarHBondContact O-N 3.11Å; D229-S232 VanDerWaalsContact O-N 3.08Å; D229-W233 PolarHBondContact O-N 3.06Å; D229-W233 VanDerWaalsContact O-N 3.1Å
230	K	90.6	Very high	92.6	Very high	98 Å²	98	45.3 Å²	45.3	43%	0.426	22%	0.223	S	C	.	.	H	α-helix	trans	-54.5	-38.6	179.7	177.4	-177.6	173.3	-164.2	0	112.6	L227 Q228 W233 Q234 L267	L227-K230 VanDerWaalsContact O-CB 3.23Å; L227-K230 WeakPolarHBondContact O-CB 3.46Å; L227-K230 PolarHBondContact O-N 2.86Å; Q228-K230 VanDerWaalsContact C-N 3.3Å; Q228-K230 PolarHBondContact O-N 3.48Å; K230-W233 PolarHBondContact O-N 3.32Å; K230-Q234 HydrophobicContact CG-CG 4.31Å; K230-Q234 WeakPolarHBondContact O-CB 3.44Å; K230-Q234 VanDerWaalsContact O-CG 3.3Å; K230-Q234 WeakPolarHBondContact O-CG 3.39Å; K230-Q234 PolarHBondContact O-N 3.17Å; K230-L267 HydrophobicContact CB-CD1 3.66Å; K230-L267 HydrophobicContact CG-CD1 3.83Å
231	Q	89.6	Confident	92.4	Very high	125 Å²	125	48.7 Å²	48.7	58%	0.584	25%	0.247	S	C	*	.	H	α-helix	trans	-62.6	-44	178.9	-173.3	61.1	30.2	0	0	111	D229 W233 Q234 S235	D229-Q231 PolarHBondContact O-N 3.29Å; Q231-W233 PolarHBondContact O-N 3.14Å; Q231-Q234 PolarHBondContact O-N 2.82Å; Q231-S235 WeakPolarHBondContact O-CB 3.3Å; Q231-S235 PolarHBondContact O-N 3.16Å; Q231-S235 PolarHBondContact O-OG 3.12Å
232	S	89.8	Confident	92.3	Very high	21 Å²	21	49 Å²	49	15%	0.147	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-42.9	176.8	-56.5	0	0	0	0	112.2	F207 D229 S235 E236	F207-S232 WeakPolarHBondContact CD1-OG 3.12Å; F207-S232 VanDerWaalsContact CE1-OG 3.26Å; F207-S232 WeakPolarHBondContact CE1-OG 3.18Å; D229-S232 WeakPolarHBondContact O-CB 3.4Å; D229-S232 PolarHBondContact O-N 3.11Å; D229-S232 VanDerWaalsContact O-N 3.08Å; S232-S235 PolarHBondContact O-N 3.08Å; S232-E236 WeakPolarHBondContact O-CB 3.49Å; S232-E236 PolarHBondContact O-N 3.44Å
233	W	93.3	Very high	92.1	Very high	16 Å²	16	51.9 Å²	51.9	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-42	173.7	174.1	82.6	0	0	0	112.1	F225 D229 K230 Q231 R237 A256 L267 W268	F225-W233 HydrophobicContact CB-CB 4.19Å; F225-W233 HydrophobicContact CD1-CB 3.98Å; F225-W233 HydrophobicContact CD2-CB 4.02Å; F225-W233 AromaticContact CD2-CD1 3.57Å; F225-W233 HydrophobicContact CD2-CG 4.17Å; F225-W233 HydrophobicContact CE1-CB 4.31Å; F225-W233 HydrophobicContact CE2-CB 4.36Å; F225-W233 AromaticContact CE2-CD1 3.76Å; F225-W233 HydrophobicContact CE2-CG 4.48Å; F225-W233 HydrophobicContact CG-CB 3.83Å; F225-W233 HydrophobicContact CG-CG 4.42Å; F225-W233 HydrophobicContact CZ-CB 4.48Å; D229-W233 PolarHBondContact O-N 3.06Å; D229-W233 VanDerWaalsContact O-N 3.1Å; K230-W233 PolarHBondContact O-N 3.32Å; Q231-W233 PolarHBondContact O-N 3.14Å; W233-R237 WeakPolarHBondContact O-CB 3.45Å; W233-R237 PolarHBondContact O-N 3.45Å; W233-A256 HydrophobicContact CZ2-CB 3.79Å; W233-L267 HydrophobicContact CB-CB 4.29Å; W233-L267 HydrophobicContact CB-CD1 4.23Å; W233-L267 HydrophobicContact CD2-CB 3.88Å; W233-L267 HydrophobicContact CD2-CD1 4.24Å; W233-L267 HydrophobicContact CD2-CD2 4.34Å; W233-L267 HydrophobicContact CD2-CG 4.39Å; W233-L267 HydrophobicContact CE3-CB 4.46Å; W233-L267 HydrophobicContact CE3-CD1 4.13Å; W233-L267 HydrophobicContact CE3-CD2 4.16Å; W233-L267 HydrophobicContact CE3-CG 4.5Å; W233-L267 HydrophobicContact CG-CB 3.76Å; W233-L267 HydrophobicContact CG-CD1 4.3Å; W233-L267 HydrophobicContact CH2-CD2 4.43Å; W233-L267 HydrophobicContact CZ3-CD2 4.23Å; W233-W268 PolarHBondContact NE1-O 3.27Å
234	Q	93.3	Very high	91.9	Very high	48 Å²	48	51.6 Å²	51.6	22%	0.224	27%	0.268	C	S	.	.	H	α-helix	trans	-64.4	-48.3	177.6	-75.4	180	-39.3	0	0	111.7	K230 Q231 R237 E238	K230-Q234 HydrophobicContact CG-CG 4.31Å; K230-Q234 WeakPolarHBondContact O-CB 3.44Å; K230-Q234 VanDerWaalsContact O-CG 3.3Å; K230-Q234 WeakPolarHBondContact O-CG 3.39Å; K230-Q234 PolarHBondContact O-N 3.17Å; Q231-Q234 PolarHBondContact O-N 2.82Å; Q234-R237 PolarHBondContact O-N 3.16Å; Q234-E238 WeakPolarHBondContact O-CB 3.31Å; Q234-E238 WeakPolarHBondContact O-CG 3.34Å; Q234-E238 PolarHBondContact O-N 2.96Å
235	S	90.8	Very high	92	Very high	40 Å²	40	51.6 Å²	51.6	28%	0.28	27%	0.268	S	S	.	.	H	α-helix	trans	-59.6	-48.3	178.4	-65.6	0	0	0	0	111.8	Q231 S232 R237 E238 I239	Q231-S235 WeakPolarHBondContact O-CB 3.3Å; Q231-S235 PolarHBondContact O-N 3.16Å; Q231-S235 PolarHBondContact O-OG 3.12Å; S232-S235 PolarHBondContact O-N 3.08Å; S235-R237 PolarHBondContact O-N 2.87Å; S235-E238 PolarHBondContact O-N 2.93Å; S235-I239 WeakPolarHBondContact O-CG1 3.47Å; S235-I239 PolarHBondContact O-N 3.45Å
236	E	94.5	Very high	92.1	Very high	5 Å²	5	60.1 Å²	60.1	2%	0.023	31%	0.305	C	S	.	.	H	α-helix	trans	-64	-41.8	178.9	-166.6	169.6	-178.3	0	0	111.8	K223 F225 S232 E238 I239 F240 L269 F346	K223-E236 IonicContact NZ-OE1 3.74Å; K223-E236 PolarHBondContact NZ-OE1 3.4Å; K223-E236 IonicContact NZ-OE2 3.36Å; K223-E236 PolarHBondContact NZ-OE2 3.01Å; F225-E236 VanDerWaalsContact CZ-OE2 3.29Å; F225-E236 WeakPolarHBondContact CZ-OE2 3.48Å; S232-E236 WeakPolarHBondContact O-CB 3.49Å; S232-E236 PolarHBondContact O-N 3.44Å; E236-E238 VanDerWaalsContact C-N 3.34Å; E236-E238 PolarHBondContact O-N 3.29Å; E236-I239 PolarHBondContact O-N 2.94Å; E236-F240 HydrophobicContact CG-CD2 4.02Å; E236-F240 HydrophobicContact CG-CE2 3.79Å; E236-F240 VanDerWaalsContact O-CD2 3.27Å; E236-F240 WeakPolarHBondContact O-CD2 3.43Å; E236-F240 PolarHBondContact O-N 3.45Å; E236-L269 HydrophobicContact CB-CD1 4.01Å; E236-L269 HydrophobicContact CG-CD1 3.84Å; E236-F346 HydrophobicContact CG-CB 4.34Å
237	R	95.6	Very high	92.5	Very high	82 Å²	82	59.9 Å²	59.9	31%	0.309	30%	0.299	S	S	.	.	H	α-helix	trans	-60.9	-41.3	175	-177.3	-171.3	71.7	161.5	4.9	112.1	W233 Q234 S235 F240 S241 A256	W233-R237 WeakPolarHBondContact O-CB 3.45Å; W233-R237 PolarHBondContact O-N 3.45Å; Q234-R237 PolarHBondContact O-N 3.16Å; S235-R237 PolarHBondContact O-N 2.87Å; R237-F240 PolarHBondContact O-N 2.84Å; R237-S241 WeakPolarHBondContact O-CB 3.35Å; R237-S241 PolarHBondContact O-N 2.83Å; R237-S241 PolarHBondContact O-OG 3Å; R237-A256 HydrophobicContact CG-CB 3.8Å
238	E	94.6	Very high	93	Very high	98 Å²	98	61.4 Å²	61.4	46%	0.458	30%	0.304	S	S	.	.	H	α-helix	trans	-64.9	-40.5	178.3	-78.4	176	-166.3	0	0	111.9	Q234 S235 E236 S241 T242	Q234-E238 WeakPolarHBondContact O-CB 3.31Å; Q234-E238 WeakPolarHBondContact O-CG 3.34Å; Q234-E238 PolarHBondContact O-N 2.96Å; S235-E238 PolarHBondContact O-N 2.93Å; E236-E238 VanDerWaalsContact C-N 3.34Å; E236-E238 PolarHBondContact O-N 3.29Å; E238-S241 PolarHBondContact O-N 3.06Å; E238-T242 PolarHBondContact O-N 3.31Å; E238-T242 PolarHBondContact O-OG1 3.28Å; E238-T242 VanDerWaalsContact O-OG1 3.11Å
239	I	95.6	Very high	93.5	Very high	11 Å²	11	53.5 Å²	53.5	6%	0.056	27%	0.267	C	S	.	.	H	α-helix	trans	-61.1	-51.3	173.7	-62.8	-67.7	0	0	0	110	S235 E236 S241 T242 M245 F346 A349	S235-I239 WeakPolarHBondContact O-CG1 3.47Å; S235-I239 PolarHBondContact O-N 3.45Å; E236-I239 PolarHBondContact O-N 2.94Å; I239-S241 PolarHBondContact O-N 3.19Å; I239-T242 VanDerWaalsContact O-CB 3.25Å; I239-T242 WeakPolarHBondContact O-CB 3.38Å; I239-T242 PolarHBondContact O-N 3.4Å; I239-T242 PolarHBondContact O-OG1 3.43Å; I239-M245 HydrophobicContact CG2-CE 3.95Å; I239-M245 WeakPolarHBondContact O-CG 3.26Å; I239-F346 HydrophobicContact CB-CB 4.08Å; I239-F346 HydrophobicContact CG2-CB 3.65Å; I239-F346 HydrophobicContact CG2-CD1 4.27Å; I239-F346 HydrophobicContact CG2-CG 3.97Å; I239-A349 HydrophobicContact CD1-CB 4.18Å; I239-A349 HydrophobicContact CG1-CB 4.11Å; I239-A349 HydrophobicContact CG2-CB 4.28Å
240	F	95.8	Very high	94	Very high	16 Å²	16	52 Å²	52	7%	0.07	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-29.3	176.7	-80.9	-60.5	0	0	0	114.3	E236 R237 T242 L251 F253 L269 T271 F346	E236-F240 HydrophobicContact CG-CD2 4.02Å; E236-F240 HydrophobicContact CG-CE2 3.79Å; E236-F240 VanDerWaalsContact O-CD2 3.27Å; E236-F240 WeakPolarHBondContact O-CD2 3.43Å; E236-F240 PolarHBondContact O-N 3.45Å; R237-F240 PolarHBondContact O-N 2.84Å; F240-T242 VanDerWaalsContact C-N 3.29Å; F240-L251 WeakPolarHBondContact CE1-O 3.49Å; F240-F253 HydrophobicContact CB-CB 3.93Å; F240-F253 HydrophobicContact CB-CD1 4.23Å; F240-F253 HydrophobicContact CB-CD2 3.78Å; F240-F253 HydrophobicContact CB-CE2 4.33Å; F240-F253 HydrophobicContact CB-CG 3.72Å; F240-F253 HydrophobicContact CD1-CB 3.57Å; F240-F253 HydrophobicContact CD1-CD2 4.35Å; F240-F253 HydrophobicContact CD1-CG 4.22Å; F240-F253 AromaticContact CD2-CD2 3.89Å; F240-F253 HydrophobicContact CD2-CD2 3.89Å; F240-F253 HydrophobicContact CE1-CB 4.12Å; F240-F253 HydrophobicContact CG-CB 3.82Å; F240-F253 AromaticContact CG-CD2 3.77Å; F240-F253 HydrophobicContact CG-CD2 3.77Å; F240-F253 AromaticContact CG-CG 3.94Å; F240-F253 HydrophobicContact CG-CG 3.94Å; F240-L269 HydrophobicContact CD2-CD1 4.11Å; F240-L269 HydrophobicContact CD2-CD2 4.19Å; F240-L269 HydrophobicContact CE2-CD1 4.22Å; F240-L269 HydrophobicContact CE2-CD2 3.7Å; F240-T271 HydrophobicContact CE2-CG2 4.38Å; F240-T271 HydrophobicContact CZ-CG2 4.04Å; F240-F346 HydrophobicContact CD1-CD2 4.07Å; F240-F346 HydrophobicContact CD1-CE2 4.19Å; F240-F346 HydrophobicContact CD2-CD2 4.48Å; F240-F346 AromaticContact CE1-CD2 3.48Å; F240-F346 HydrophobicContact CE1-CD2 3.48Å; F240-F346 VanDerWaalsContact CE1-CD2 3.48Å; F240-F346 AromaticContact CE1-CE2 3.41Å; F240-F346 HydrophobicContact CE1-CE2 3.41Å; F240-F346 VanDerWaalsContact CE1-CE2 3.41Å; F240-F346 AromaticContact CE2-CD2 3.92Å; F240-F346 HydrophobicContact CE2-CD2 3.92Å; F240-F346 AromaticContact CZ-CD2 3.4Å; F240-F346 HydrophobicContact CZ-CD2 3.4Å; F240-F346 VanDerWaalsContact CZ-CD2 3.4Å; F240-F346 AromaticContact CZ-CE2 3.67Å; F240-F346 HydrophobicContact CZ-CE2 3.67Å
241	S	94.1	Very high	94.3	Very high	75 Å²	75	47.9 Å²	47.9	52%	0.524	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-2.1	179.8	-54.5	0	0	0	0	113.4	R237 E238 I239	R237-S241 WeakPolarHBondContact O-CB 3.35Å; R237-S241 PolarHBondContact O-N 2.83Å; R237-S241 PolarHBondContact O-OG 3Å; E238-S241 PolarHBondContact O-N 3.06Å; I239-S241 PolarHBondContact O-N 3.19Å
242	T	93.4	Very high	94.7	Very high	15 Å²	15	47.2 Å²	47.2	9%	0.092	24%	0.239	C	C	.	.	S	Bend	trans	-64.8	135.4	177.5	-61.7	0	0	0	0	109.7	E238 I239 F240 G244 M245 P321 I323	E238-T242 PolarHBondContact O-N 3.31Å; E238-T242 PolarHBondContact O-OG1 3.28Å; E238-T242 VanDerWaalsContact O-OG1 3.11Å; I239-T242 VanDerWaalsContact O-CB 3.25Å; I239-T242 WeakPolarHBondContact O-CB 3.38Å; I239-T242 PolarHBondContact O-N 3.4Å; I239-T242 PolarHBondContact O-OG1 3.43Å; F240-T242 VanDerWaalsContact C-N 3.29Å; T242-G244 PolarHBondContact O-N 2.91Å; T242-M245 HydrophobicContact CG2-CG 4.25Å; T242-M245 VanDerWaalsContact O-CB 3.3Å; T242-M245 WeakPolarHBondContact O-CB 3.25Å; T242-M245 WeakPolarHBondContact O-CG 3.48Å; T242-M245 PolarHBondContact O-N 3.13Å; T242-P321 HydrophobicContact CG2-CG 4.17Å; T242-I323 HydrophobicContact CG2-CD1 4.34Å
243	P	92.2	Very high	95	Very high	60 Å²	60	49.1 Å²	49.1	39%	0.39	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	142.4	175.2	-26	34.9	0	0	0	111.7	M245 K320	P243-M245 VanDerWaalsContact C-N 3.29Å; P243-M245 PolarHBondContact O-N 2.86Å; P243-K320 WeakPolarHBondContact O-CB 3.35Å; P243-K320 WeakPolarHBondContact O-CG 3.4Å
244	G	91.3	Very high	95.1	Very high	12 Å²	12	51.2 Å²	51.2	12%	0.124	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	11.8	-178.4	0	0	0	0	0	115	T242 K246 Y306	T242-G244 PolarHBondContact O-N 2.91Å; G244-K246 PolarHBondContact O-N 2.84Å; G244-Y306 WeakPolarHBondContact O-CE1 3.39Å; G244-Y306 PolarHBondContact O-OH 3.15Å
245	M	94.3	Very high	95.1	Very high	15 Å²	15	49.7 Å²	49.7	7%	0.074	25%	0.252	C	S	.	.			trans	-79.4	6.4	176.5	-78	-65.3	-65.2	0	0	115.2	I239 T242 P243 L250 L307 I323 F346	I239-M245 HydrophobicContact CG2-CE 3.95Å; I239-M245 WeakPolarHBondContact O-CG 3.26Å; T242-M245 HydrophobicContact CG2-CG 4.25Å; T242-M245 VanDerWaalsContact O-CB 3.3Å; T242-M245 WeakPolarHBondContact O-CB 3.25Å; T242-M245 WeakPolarHBondContact O-CG 3.48Å; T242-M245 PolarHBondContact O-N 3.13Å; P243-M245 VanDerWaalsContact C-N 3.29Å; P243-M245 PolarHBondContact O-N 2.86Å; M245-L250 HydrophobicContact CE-CD1 4.03Å; M245-L250 HydrophobicContact SD-CD1 4.22Å; M245-L307 HydrophobicContact CE-CD1 3.83Å; M245-L307 HydrophobicContact SD-CD1 4.03Å; M245-I323 HydrophobicContact CE-CD1 4.38Å; M245-I323 HydrophobicContact CG-CD1 4.38Å; M245-I323 HydrophobicContact SD-CD1 3.45Å; M245-I323 WeakPolarHBondContact SD-CD1 3.5Å; M245-F346 HydrophobicContact CE-CE1 4.43Å; M245-F346 HydrophobicContact CE-CZ 4.43Å
246	K	93.7	Very high	95.2	Very high	179 Å²	179	49.2 Å²	49.2	78%	0.778	25%	0.251	S	S	*	.			trans	-96.3	109	177.2	-172.5	-178	178.8	-174.9	0	110	G244	G244-K246 PolarHBondContact O-N 2.84Å
247	H	96.2	Very high	95.1	Very high	48 Å²	48	50.9 Å²	50.9	22%	0.222	26%	0.258	C	S	.	.			trans	-146.1	154.4	-179.9	-177.8	-97.6	0	0	0	110.9	N249 L250 Y306	H247-N249 PolarHBondContact CE1-OD1 2.92Å; H247-N249 PolarHBondContact ND1-N 3.22Å; H247-N249 PolarHBondContact O-N 3.02Å; H247-L250 HydrophobicContact CB-CB 4.24Å; H247-L250 HydrophobicContact CB-CD1 4.02Å; H247-L250 HydrophobicContact CB-CG 3.95Å; H247-L250 PolarHBondContact O-N 3.44Å; H247-Y306 HydrophobicContact CB-CD1 3.47Å; H247-Y306 VanDerWaalsContact CB-CD1 3.47Å; H247-Y306 HydrophobicContact CB-CE1 3.46Å; H247-Y306 VanDerWaalsContact CB-CE1 3.46Å; H247-Y306 HydrophobicContact CB-CG 4.25Å; H247-Y306 AromaticContact CD2-CD1 3.79Å; H247-Y306 AromaticContact CD2-CD2 3.87Å; H247-Y306 AromaticContact CD2-CG 3.66Å; H247-Y306 AromaticContact CG-CD1 3.52Å; H247-Y306 AromaticContact CG-CE1 3.91Å; H247-Y306 AromaticContact CG-CG 3.8Å
248	E	97.6	Very high	94.8	Very high	120 Å²	120	54 Å²	54	56%	0.561	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-31.2	-176.1	-174.2	176.6	177.3	0	0	113.2	K336 V342	E248-K336 VanDerWaalsContact CG-NZ 3.29Å; E248-K336 WeakPolarHBondContact O-CE 3.29Å; E248-K336 PolarHBondContact O-NZ 2.84Å; E248-K336 IonicContact OE1-NZ 2.97Å; E248-V342 WeakPolarHBondContact O-CG1 3.37Å
249	N	98.7	Very high	94.3	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	15.4	-178.7	-54.4	111.9	0	0	0	113.9	H247 T299 R302 G303 T340 A341 V342 L343	H247-N249 PolarHBondContact CE1-OD1 2.92Å; H247-N249 PolarHBondContact ND1-N 3.22Å; H247-N249 PolarHBondContact O-N 3.02Å; N249-T299 VanDerWaalsContact CB-O 3.28Å; N249-T299 WeakPolarHBondContact CB-O 3.38Å; N249-T299 WeakPolarHBondContact ND2-CB 3.2Å; N249-T299 PolarHBondContact ND2-O 2.99Å; N249-R302 WeakPolarHBondContact OD1-CD 3.35Å; N249-G303 VanDerWaalsContact CB-CA 3.49Å; N249-T340 WeakPolarHBondContact ND2-CG2 3.46Å; N249-A341 WeakPolarHBondContact CB-O 3.49Å; N249-A341 PolarHBondContact ND2-O 3.34Å; N249-V342 WeakPolarHBondContact O-CA 3.33Å; N249-L343 PolarHBondContact O-N 3.42Å
250	L	98.4	Very high	93.5	Very high	7 Å²	7	55.3 Å²	55.3	4%	0.037	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-114.5	140.4	167.5	-62.4	-177.4	0	0	0	108.8	M245 H247 Q252 Y306 L307 L343 F346	M245-L250 HydrophobicContact CE-CD1 4.03Å; M245-L250 HydrophobicContact SD-CD1 4.22Å; H247-L250 HydrophobicContact CB-CB 4.24Å; H247-L250 HydrophobicContact CB-CD1 4.02Å; H247-L250 HydrophobicContact CB-CG 3.95Å; H247-L250 PolarHBondContact O-N 3.44Å; L250-Q252 PolarHBondContact O-N 2.93Å; L250-Y306 HydrophobicContact CD1-CD1 3.77Å; L250-Y306 HydrophobicContact CD1-CE1 4.13Å; L250-Y306 HydrophobicContact CG-CD1 4.44Å; L250-L307 HydrophobicContact CD1-CD1 4.39Å; L250-L307 HydrophobicContact CD2-CB 4.39Å; L250-L307 HydrophobicContact CD2-CD1 4.39Å; L250-L343 HydrophobicContact CD2-CB 3.96Å; L250-L343 HydrophobicContact CD2-CD1 4.2Å; L250-L343 HydrophobicContact CD2-CG 4.25Å; L250-F346 HydrophobicContact CD2-CE1 4.48Å; L250-F346 HydrophobicContact CD2-CZ 4.15Å
251	L	98.1	Very high	92.4	Very high	12 Å²	12	58.8 Å²	58.8	6%	0.063	32%	0.321	C	S	.	.			trans	-58.6	127	-179.4	179.3	60.8	0	0	0	110.4	F240 F253 T271 A272 L334 V342 L343 A344	F240-L251 WeakPolarHBondContact CE1-O 3.49Å; L251-F253 PolarHBondContact O-N 3.48Å; L251-T271 HydrophobicContact CD2-CG2 3.96Å; L251-T271 HydrophobicContact CG-CG2 4.21Å; L251-A272 HydrophobicContact CD1-CB 4.36Å; L251-L334 HydrophobicContact CD1-CD1 4.06Å; L251-L334 HydrophobicContact CD2-CD1 4.15Å; L251-V342 HydrophobicContact CD1-CG2 4.4Å; L251-L343 WeakPolarHBondContact CB-O 3.41Å; L251-L343 PolarHBondContact N-O 3.3Å; L251-A344 HydrophobicContact CB-CB 4.12Å; L251-A344 HydrophobicContact CD2-CB 3.63Å; L251-A344 HydrophobicContact CG-CB 4.47Å
252	Q	97.3	Very high	91.1	Very high	111 Å²	111	62.5 Å²	62.5	52%	0.519	33%	0.334	S	S	.	.			trans	-69.8	115.3	-178	-178.8	-179.2	7.4	0	0	111.1	L250 T271 A272	L250-Q252 PolarHBondContact O-N 2.93Å; Q252-T271 CarbonylContact O-C 3.59Å; Q252-T271 WeakPolarHBondContact O-CA 3.3Å; Q252-T271 VanDerWaalsContact O-CB 3.29Å; Q252-T271 WeakPolarHBondContact O-CB 3.18Å; Q252-A272 HydrophobicContact CB-CB 3.95Å; Q252-A272 PolarHBondContact O-N 3.16Å
253	F	96.4	Very high	89.7	Confident	60 Å²	60	70.1 Å²	70.1	26%	0.263	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	135.9	166.4	179.9	-109.4	0	0	0	111.1	F240 L251 A255 A256 L269	F240-F253 HydrophobicContact CB-CB 3.93Å; F240-F253 HydrophobicContact CB-CD1 4.23Å; F240-F253 HydrophobicContact CB-CD2 3.78Å; F240-F253 HydrophobicContact CB-CE2 4.33Å; F240-F253 HydrophobicContact CB-CG 3.72Å; F240-F253 HydrophobicContact CD1-CB 3.57Å; F240-F253 HydrophobicContact CD1-CD2 4.35Å; F240-F253 HydrophobicContact CD1-CG 4.22Å; F240-F253 AromaticContact CD2-CD2 3.89Å; F240-F253 HydrophobicContact CD2-CD2 3.89Å; F240-F253 HydrophobicContact CE1-CB 4.12Å; F240-F253 HydrophobicContact CG-CB 3.82Å; F240-F253 AromaticContact CG-CD2 3.77Å; F240-F253 HydrophobicContact CG-CD2 3.77Å; F240-F253 AromaticContact CG-CG 3.94Å; F240-F253 HydrophobicContact CG-CG 3.94Å; L251-F253 PolarHBondContact O-N 3.48Å; F253-A255 VanDerWaalsContact CE2-C 3.49Å; F253-A255 WeakPolarHBondContact CE2-O 3.28Å; F253-A256 HydrophobicContact CE2-CB 4.04Å; F253-A256 HydrophobicContact CZ-CB 3.84Å; F253-L269 HydrophobicContact CD2-CD2 4.46Å; F253-L269 HydrophobicContact CE2-CG 4.18Å
254	I	94.9	Very high	88.7	Confident	61 Å²	61	74.8 Å²	74.8	31%	0.313	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-55.7	178.5	-59.9	176.8	0	0	0	109.8	L215 V220 I270	L215-I254 HydrophobicContact CD2-CG2 4.33Å; V220-I254 HydrophobicContact CB-CD1 4.16Å; V220-I254 HydrophobicContact CG1-CD1 3.51Å; I254-I270 WeakPolarHBondContact CA-O 3.27Å; I254-I270 HydrophobicContact CB-CB 4.39Å; I254-I270 HydrophobicContact CB-CG2 4.1Å; I254-I270 WeakPolarHBondContact CB-O 3.49Å; I254-I270 HydrophobicContact CD1-CG2 4.31Å; I254-I270 HydrophobicContact CG2-CG2 4.33Å; I254-I270 PolarHBondContact N-O 3.37Å
255	A	93.6	Very high	88.5	Confident	16 Å²	16	75 Å²	75	13%	0.132	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	162.7	-177.2	0	0	0	0	0	111.7	F253 I270	F253-A255 VanDerWaalsContact CE2-C 3.49Å; F253-A255 WeakPolarHBondContact CE2-O 3.28Å; A255-I270 HydrophobicContact CB-CB 4.46Å; A255-I270 HydrophobicContact CB-CD1 4.3Å; A255-I270 PolarHBondContact N-O 3.33Å; A255-I270 WeakPolarHBondContact O-CB 3.39Å; A255-I270 PolarHBondContact O-N 3.08Å
256	A	93.9	Very high	88.1	Confident	30 Å²	30	78.3 Å²	78.3	25%	0.248	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128	166	0	0	0	0	0	108.5	W233 R237 F253 W268	W233-A256 HydrophobicContact CZ2-CB 3.79Å; R237-A256 HydrophobicContact CG-CB 3.8Å; F253-A256 HydrophobicContact CE2-CB 4.04Å; F253-A256 HydrophobicContact CZ-CB 3.84Å; A256-W268 CarbonylContact C-O 3.55Å; A256-W268 VanDerWaalsContact CA-O 3.26Å; A256-W268 WeakPolarHBondContact CA-O 3.26Å
257	E	91	Very high	88.1	Confident	39 Å²	39	69.9 Å²	69.9	18%	0.182	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	146.7	-172.3	-65.6	-176.1	-177.2	0	0	110.6	R259 W268	E257-R259 HydrophobicContact CB-CG 4.46Å; E257-R259 IonicContact OE2-CZ 2.81Å; E257-R259 VanDerWaalsContact OE2-CZ 3.25Å; E257-R259 IonicContact OE2-NE 3.74Å; E257-R259 PolarHBondContact OE2-NE 3.37Å; E257-R259 IonicContact OE2-NH2 2.83Å; E257-R259 PolarHBondContact OE2-NH2 3.41Å; E257-W268 HydrophobicContact CB-CB 4.42Å; E257-W268 PolarHBondContact N-O 2.9Å; E257-W268 PolarHBondContact O-N 3.3Å
258	K	90	Very high	88	Confident	148 Å²	148	68.2 Å²	68.2	64%	0.643	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	118.5	167.1	-176.9	-176.4	-174.1	-166.4	0	107.2	V265 L267	K258-V265 HydrophobicContact CD-CG1 4.05Å; K258-V265 HydrophobicContact CG-CG1 3.67Å; K258-L267 HydrophobicContact CB-CD2 4.21Å; K258-L267 HydrophobicContact CD-CD2 4.44Å; K258-L267 HydrophobicContact CG-CD2 3.9Å
259	R	84.2	Confident	87.9	Confident	72 Å²	72	62.6 Å²	62.6	27%	0.272	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	157.7	-179.4	-67.5	-168.9	170.7	-163.6	-6.7	111	E257 V265 E266 W268	E257-R259 HydrophobicContact CB-CG 4.46Å; E257-R259 IonicContact OE2-CZ 2.81Å; E257-R259 VanDerWaalsContact OE2-CZ 3.25Å; E257-R259 IonicContact OE2-NE 3.74Å; E257-R259 PolarHBondContact OE2-NE 3.37Å; E257-R259 IonicContact OE2-NH2 2.83Å; E257-R259 PolarHBondContact OE2-NH2 3.41Å; R259-V265 WeakPolarHBondContact O-CA 3.46Å; R259-E266 PolarHBondContact N-O 2.87Å; R259-E266 PolarHBondContact O-N 3.18Å; R259-W268 HydrophobicContact CG-CD2 4.42Å; R259-W268 VanDerWaalsContact NH1-CH2 3.31Å
260	G	78.2	Confident	87.8	Confident	65 Å²	65	62.7 Å²	62.7	67%	0.67	33%	0.334	S	S	*	.	S	Bend	trans	87.5	176.9	179.6	0	0	0	0	0	114.9
261	S	72.8	Confident	87.7	Confident	89 Å²	89	62.8 Å²	62.8	62%	0.622	34%	0.335	S	S	*	.			trans	-124.5	143.3	-178.2	62.6	0	0	0	0	111.8	L263 E264	S261-L263 PolarHBondContact O-N 3.31Å; S261-E264 PolarHBondContact O-N 3.17Å; S261-E264 VanDerWaalsContact O-N 3.12Å
262	N	66.8	Low	87.7	Confident	152 Å²	152	62.9 Å²	62.9	81%	0.813	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.4	-83	172.2	-62	-13.2	0	0	0	115.8
263	L	64.3	Low	87.6	Confident	176 Å²	176	59.2 Å²	59.2	92%	0.921	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-15.3	-171.1	-71.2	161.4	0	0	0	114.3	S261	S261-L263 PolarHBondContact O-N 3.31Å
264	E	72.1	Confident	87.7	Confident	158 Å²	158	57.9 Å²	57.9	74%	0.738	32%	0.315	S	S	*	.	S	Bend	trans	-117.3	44.3	179.5	-65.2	-176.1	167.4	0	0	110.8	S261 E266	S261-E264 PolarHBondContact O-N 3.17Å; S261-E264 VanDerWaalsContact O-N 3.12Å; E264-E266 PolarHBondContact O-N 2.81Å
265	V	85.1	Confident	87.6	Confident	17 Å²	17	60.6 Å²	60.6	10%	0.103	33%	0.33	C	S	.	.			trans	-73.4	120.2	176	171.2	0	0	0	0	109.3	L227 K258 R259 L267	L227-V265 HydrophobicContact CD1-CB 4.33Å; L227-V265 HydrophobicContact CD1-CG1 3.96Å; K258-V265 HydrophobicContact CD-CG1 4.05Å; K258-V265 HydrophobicContact CG-CG1 3.67Å; R259-V265 WeakPolarHBondContact O-CA 3.46Å; V265-L267 HydrophobicContact CG1-CD2 4.26Å
266	E	87.4	Confident	87.8	Confident	83 Å²	83	63.3 Å²	63.3	39%	0.388	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	138.2	170.6	-63.6	-173.4	156	0	0	110.1	I224 R259 E264 W268	I224-E266 HydrophobicContact CG2-CB 4.05Å; I224-E266 HydrophobicContact CG2-CG 4.24Å; R259-E266 PolarHBondContact N-O 2.87Å; R259-E266 PolarHBondContact O-N 3.18Å; E264-E266 PolarHBondContact O-N 2.81Å; E266-W268 PolarHBondContact OE2-NE1 3.32Å
267	L	93.1	Very high	87.9	Confident	3 Å²	3	63 Å²	63	2%	0.016	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	115.5	176.7	-59.9	173.4	0	0	0	108.1	I224 F225 L227 K230 W233 K258 V265	I224-L267 WeakPolarHBondContact CA-O 3.42Å; F225-L267 HydrophobicContact CB-CB 4.12Å; F225-L267 WeakPolarHBondContact CD2-O 3.43Å; F225-L267 PolarHBondContact N-O 2.73Å; F225-L267 PolarHBondContact O-N 2.82Å; L227-L267 HydrophobicContact CD1-CD1 4.47Å; K230-L267 HydrophobicContact CB-CD1 3.66Å; K230-L267 HydrophobicContact CG-CD1 3.83Å; W233-L267 HydrophobicContact CB-CB 4.29Å; W233-L267 HydrophobicContact CB-CD1 4.23Å; W233-L267 HydrophobicContact CD2-CB 3.88Å; W233-L267 HydrophobicContact CD2-CD1 4.24Å; W233-L267 HydrophobicContact CD2-CD2 4.34Å; W233-L267 HydrophobicContact CD2-CG 4.39Å; W233-L267 HydrophobicContact CE3-CB 4.46Å; W233-L267 HydrophobicContact CE3-CD1 4.13Å; W233-L267 HydrophobicContact CE3-CD2 4.16Å; W233-L267 HydrophobicContact CE3-CG 4.5Å; W233-L267 HydrophobicContact CG-CB 3.76Å; W233-L267 HydrophobicContact CG-CD1 4.3Å; W233-L267 HydrophobicContact CH2-CD2 4.43Å; W233-L267 HydrophobicContact CZ3-CD2 4.23Å; K258-L267 HydrophobicContact CB-CD2 4.21Å; K258-L267 HydrophobicContact CD-CD2 4.44Å; K258-L267 HydrophobicContact CG-CD2 3.9Å; V265-L267 HydrophobicContact CG1-CD2 4.26Å
268	W	94.6	Very high	88.2	Confident	13 Å²	13	61.4 Å²	61.4	5%	0.049	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	136	-173.7	-72	27.9	0	0	0	109.7	L196 L198 V222 I224 W233 A256 E257 R259 E266	L196-W268 HydrophobicContact CD1-CE3 4.2Å; L196-W268 HydrophobicContact CD1-CZ3 3.8Å; L196-W268 HydrophobicContact CD2-CH2 3.98Å; L196-W268 HydrophobicContact CD2-CZ3 3.45Å; L196-W268 VanDerWaalsContact CD2-CZ3 3.45Å; L196-W268 HydrophobicContact CG-CZ3 4.18Å; L198-W268 HydrophobicContact CD1-CH2 4.06Å; L198-W268 HydrophobicContact CD1-CZ2 4.1Å; L198-W268 HydrophobicContact CD2-CH2 3.93Å; L198-W268 HydrophobicContact CD2-CZ3 4.28Å; L198-W268 HydrophobicContact CG-CH2 4.02Å; V222-W268 HydrophobicContact CG1-CB 4.22Å; V222-W268 HydrophobicContact CG1-CD2 3.64Å; V222-W268 HydrophobicContact CG1-CE3 3.44Å; V222-W268 VanDerWaalsContact CG1-CE3 3.44Å; V222-W268 HydrophobicContact CG1-CG 4.03Å; V222-W268 HydrophobicContact CG1-CZ3 3.98Å; I224-W268 HydrophobicContact CD1-CZ2 4Å; I224-W268 HydrophobicContact CG1-CD2 4.4Å; I224-W268 HydrophobicContact CG1-CG 4.33Å; W233-W268 PolarHBondContact NE1-O 3.27Å; A256-W268 CarbonylContact C-O 3.55Å; A256-W268 VanDerWaalsContact CA-O 3.26Å; A256-W268 WeakPolarHBondContact CA-O 3.26Å; E257-W268 HydrophobicContact CB-CB 4.42Å; E257-W268 PolarHBondContact N-O 2.9Å; E257-W268 PolarHBondContact O-N 3.3Å; R259-W268 HydrophobicContact CG-CD2 4.42Å; R259-W268 VanDerWaalsContact NH1-CH2 3.31Å; E266-W268 PolarHBondContact OE2-NE1 3.32Å
269	L	95.4	Very high	88.6	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	118.3	169.3	-168.3	148.9	0	0	0	107.5	K223 F225 E236 F240 F253 T271	K223-L269 HydrophobicContact CB-CB 4.42Å; K223-L269 PolarHBondContact N-O 3.39Å; K223-L269 PolarHBondContact O-N 2.04Å; F225-L269 HydrophobicContact CE2-CB 3.87Å; E236-L269 HydrophobicContact CB-CD1 4.01Å; E236-L269 HydrophobicContact CG-CD1 3.84Å; F240-L269 HydrophobicContact CD2-CD1 4.11Å; F240-L269 HydrophobicContact CD2-CD2 4.19Å; F240-L269 HydrophobicContact CE2-CD1 4.22Å; F240-L269 HydrophobicContact CE2-CD2 3.7Å; F253-L269 HydrophobicContact CD2-CD2 4.46Å; F253-L269 HydrophobicContact CE2-CG 4.18Å; L269-T271 HydrophobicContact CD2-CG2 3.6Å
270	I	95.9	Very high	89.3	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.1	-170.4	-49.9	176.8	0	0	0	108.8	L196 V220 A221 V222 I254 A255	L196-I270 HydrophobicContact CD1-CD1 3.67Å; V220-I270 HydrophobicContact CB-CG2 4Å; V220-I270 HydrophobicContact CG2-CG2 3.91Å; A221-I270 WeakPolarHBondContact O-CA 3.34Å; V222-I270 HydrophobicContact CG2-CG1 4.34Å; V222-I270 HydrophobicContact CG2-CG2 4.4Å; I254-I270 WeakPolarHBondContact CA-O 3.27Å; I254-I270 HydrophobicContact CB-CB 4.39Å; I254-I270 HydrophobicContact CB-CG2 4.1Å; I254-I270 WeakPolarHBondContact CB-O 3.49Å; I254-I270 HydrophobicContact CD1-CG2 4.31Å; I254-I270 HydrophobicContact CG2-CG2 4.33Å; I254-I270 PolarHBondContact N-O 3.37Å; A255-I270 HydrophobicContact CB-CB 4.46Å; A255-I270 HydrophobicContact CB-CD1 4.3Å; A255-I270 PolarHBondContact N-O 3.33Å; A255-I270 WeakPolarHBondContact O-CB 3.39Å; A255-I270 PolarHBondContact O-N 3.08Å
271	T	96.9	Very high	90.1	Very high	10 Å²	10	52.6 Å²	52.6	6%	0.061	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	171.2	179.1	60.3	0	0	0	0	111.5	V220 A221 F240 L251 Q252 L269	V220-T271 WeakPolarHBondContact CA-O 3.36Å; V220-T271 WeakPolarHBondContact CB-O 3.44Å; A221-T271 PolarHBondContact N-O 2.91Å; A221-T271 PolarHBondContact O-N 3.16Å; F240-T271 HydrophobicContact CE2-CG2 4.38Å; F240-T271 HydrophobicContact CZ-CG2 4.04Å; L251-T271 HydrophobicContact CD2-CG2 3.96Å; L251-T271 HydrophobicContact CG-CG2 4.21Å; Q252-T271 CarbonylContact O-C 3.59Å; Q252-T271 WeakPolarHBondContact O-CA 3.3Å; Q252-T271 VanDerWaalsContact O-CB 3.29Å; Q252-T271 WeakPolarHBondContact O-CB 3.18Å; L269-T271 HydrophobicContact CD2-CG2 3.6Å
272	A	96.9	Very high	91.3	Very high	14 Å²	14	49.6 Å²	49.6	12%	0.116	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	143.1	170.7	0	0	0	0	0	111.6	L251 Q252	L251-A272 HydrophobicContact CD1-CB 4.36Å; Q252-A272 HydrophobicContact CB-CB 3.95Å; Q252-A272 PolarHBondContact O-N 3.16Å
273	F	97.1	Very high	92.9	Very high	33 Å²	33	42.4 Å²	42.4	15%	0.145	22%	0.218	C	C	.	.			trans	-95.2	141.1	172	-170.4	-105	0	0	0	110.9	K202 K212 F219 A221 D275	K202-F273 HydrophobicContact CD-CZ 4.48Å; K202-F273 HydrophobicContact CG-CE2 3.96Å; K202-F273 HydrophobicContact CG-CZ 4.22Å; K212-F273 HydrophobicContact CB-CD2 4.28Å; K212-F273 HydrophobicContact CB-CE2 3.87Å; K212-F273 HydrophobicContact CB-CZ 4.07Å; K212-F273 HydrophobicContact CD-CD1 4.14Å; K212-F273 HydrophobicContact CD-CE1 3.56Å; K212-F273 HydrophobicContact CD-CE2 4.3Å; K212-F273 HydrophobicContact CD-CZ 3.68Å; K212-F273 HydrophobicContact CG-CD1 4.15Å; K212-F273 HydrophobicContact CG-CD2 4.14Å; K212-F273 HydrophobicContact CG-CE1 3.94Å; K212-F273 HydrophobicContact CG-CE2 3.97Å; K212-F273 HydrophobicContact CG-CG 4.26Å; K212-F273 HydrophobicContact CG-CZ 3.88Å; F219-F273 HydrophobicContact CB-CB 4.05Å; F219-F273 HydrophobicContact CB-CD1 4.02Å; F219-F273 HydrophobicContact CB-CG 4.3Å; F219-F273 WeakPolarHBondContact O-CB 3.39Å; A221-F273 HydrophobicContact CB-CD2 4.14Å; F273-D275 HydrophobicContact CE1-CB 4.33Å; F273-D275 VanDerWaalsContact CE1-OD1 3.25Å; F273-D275 WeakPolarHBondContact CE1-OD1 3.26Å
274	H	97	Very high	94.4	Very high	33 Å²	33	39.8 Å²	39.8	15%	0.153	20%	0.2	C	C	.	.			trans	-128.6	114.2	175.6	-62.3	-40.9	0	0	0	110	K276 G277 L335	H274-K276 VanDerWaalsContact C-N 3.26Å; H274-K276 PolarHBondContact O-N 3.1Å; H274-G277 PolarHBondContact O-N 2.8Å; H274-L335 WeakPolarHBondContact CB-O 3.37Å
275	D	94.3	Very high	95.6	Very high	118 Å²	118	35.2 Å²	35.2	63%	0.631	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.7	-171	-69	-76.3	0	0	0	114.1	K212 F273 G277	K212-D275 IonicContact NZ-OD1 3.45Å; K212-D275 PolarHBondContact NZ-OD1 2.92Å; F273-D275 HydrophobicContact CE1-CB 4.33Å; F273-D275 VanDerWaalsContact CE1-OD1 3.25Å; F273-D275 WeakPolarHBondContact CE1-OD1 3.26Å; D275-G277 PolarHBondContact O-N 3.37Å
276	K	96.1	Very high	96.2	Very high	72 Å²	72	37.5 Å²	37.5	31%	0.313	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.3	174.8	-68	-171.6	-175.3	-82.9	0	113.3	H274 Y282 L335 K336 S337 L339	H274-K276 VanDerWaalsContact C-N 3.26Å; H274-K276 PolarHBondContact O-N 3.1Å; K276-Y282 HydrophobicContact CB-CD2 4.2Å; K276-Y282 HydrophobicContact CD-CD2 4.17Å; K276-Y282 HydrophobicContact CD-CE2 3.8Å; K276-Y282 HydrophobicContact CG-CD2 4.43Å; K276-Y282 HydrophobicContact CG-CE2 4.35Å; K276-L335 HydrophobicContact CB-CB 4Å; K276-L335 HydrophobicContact CD-CB 4.33Å; K276-K336 WeakPolarHBondContact CD-O 3.33Å; K276-S337 WeakPolarHBondContact CE-O 3.18Å; K276-L339 HydrophobicContact CD-CD2 3.52Å
277	G	96.3	Very high	96.7	Very high	24 Å²	24	37.3 Å²	37.3	25%	0.247	21%	0.207	C	C	.	.			trans	67.8	-150.1	176.7	0	0	0	0	0	113.1	H274 D275 L334 L335	H274-G277 PolarHBondContact O-N 2.8Å; D275-G277 PolarHBondContact O-N 3.37Å; G277-L334 WeakPolarHBondContact O-CA 3.46Å; G277-L335 PolarHBondContact O-N 2.87Å
278	S	97.9	Very high	96.9	Very high	6 Å²	6	37.3 Å²	37.3	4%	0.042	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-77.6	156.8	178.8	74.2	0	0	0	0	112.2	T280 D281 Y282 K331 V333	S278-T280 PolarHBondContact O-N 3.38Å; S278-D281 PolarHBondContact O-N 3.01Å; S278-D281 VanDerWaalsContact O-N 3.15Å; S278-D281 PolarHBondContact OG-N 3.27Å; S278-D281 VanDerWaalsContact OG-N 3.17Å; S278-D281 PolarHBondContact OG-OD2 3.11Å; S278-Y282 WeakPolarHBondContact O-CB 3.22Å; S278-Y282 PolarHBondContact O-N 2.88Å; S278-K331 VanDerWaalsContact CB-O 3.31Å; S278-K331 WeakPolarHBondContact CB-O 3.16Å; S278-V333 CarbonylContact C-O 3.58Å; S278-V333 WeakPolarHBondContact CA-O 3.01Å
279	L	98.7	Very high	97	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-59.6	-38.6	174.4	177.3	62.5	0	0	0	110.5	D281 Y282 L283 V296 S330 V333 L335 V398 L402	L279-D281 PolarHBondContact O-N 3.25Å; L279-Y282 PolarHBondContact O-N 3.44Å; L279-L283 HydrophobicContact CD1-CD1 3.81Å; L279-L283 HydrophobicContact CD1-CD2 4.16Å; L279-L283 HydrophobicContact CD1-CG 3.71Å; L279-L283 HydrophobicContact CD2-CD1 4.45Å; L279-L283 HydrophobicContact CG-CD1 3.81Å; L279-L283 HydrophobicContact CG-CG 4.12Å; L279-L283 WeakPolarHBondContact O-CB 3.48Å; L279-L283 VanDerWaalsContact O-CG 3.24Å; L279-L283 WeakPolarHBondContact O-CG 2.93Å; L279-L283 PolarHBondContact O-N 3.15Å; L279-V296 HydrophobicContact CD1-CG1 4.08Å; L279-V296 HydrophobicContact CD2-CG1 4.31Å; L279-S330 WeakPolarHBondContact CB-O 3.47Å; L279-S330 PolarHBondContact N-O 2.93Å; L279-V333 HydrophobicContact CB-CB 4.09Å; L279-V333 HydrophobicContact CB-CG1 4.27Å; L279-V333 HydrophobicContact CD2-CB 4.48Å; L279-V333 HydrophobicContact CD2-CG1 4.4Å; L279-V333 PolarHBondContact N-O 2.84Å; L279-L335 HydrophobicContact CD1-CD1 3.96Å; L279-L335 HydrophobicContact CD1-CD2 4.36Å; L279-L335 HydrophobicContact CD1-CG 4.49Å; L279-V398 HydrophobicContact CD2-CG1 3.77Å; L279-L402 HydrophobicContact CD1-CD2 3.78Å; L279-L402 HydrophobicContact CD2-CD2 4.01Å; L279-L402 HydrophobicContact CD2-CG 4.26Å; L279-L402 HydrophobicContact CG-CD2 4.43Å
280	T	97.8	Very high	97.1	Very high	9 Å²	9	39.6 Å²	39.6	6%	0.055	22%	0.221	C	C	.	.	H	α-helix	trans	-53.8	-52.8	171.9	-56.3	0	0	0	0	111.8	S278 Y282 L283 K284 S330 K331 Y416	S278-T280 PolarHBondContact O-N 3.38Å; T280-Y282 VanDerWaalsContact C-N 3.31Å; T280-Y282 PolarHBondContact O-N 3.46Å; T280-L283 PolarHBondContact O-N 2.74Å; T280-K284 HydrophobicContact CG2-CD 4.37Å; T280-K284 WeakPolarHBondContact O-CG 3.3Å; T280-K284 PolarHBondContact O-N 2.73Å; T280-K284 VanDerWaalsContact O-N 3.07Å; T280-S330 PolarHBondContact N-O 3.15Å; T280-S330 WeakPolarHBondContact OG1-CB 3.2Å; T280-S330 PolarHBondContact OG1-OG 2.9Å; T280-K331 VanDerWaalsContact OG1-CA 3.3Å; T280-K331 WeakPolarHBondContact OG1-CA 3.35Å; T280-K331 PolarHBondContact OG1-N 3.07Å; T280-Y416 HydrophobicContact CG2-CE1 4.01Å
281	D	96.2	Very high	97.2	Very high	90 Å²	90	43 Å²	43	48%	0.481	24%	0.239	S	C	.	.	H	α-helix	trans	-67	-37.1	-176.4	-59.2	-41.9	0	0	0	111	S278 L279 G285	S278-D281 PolarHBondContact O-N 3.01Å; S278-D281 VanDerWaalsContact O-N 3.15Å; S278-D281 PolarHBondContact OG-N 3.27Å; S278-D281 VanDerWaalsContact OG-N 3.17Å; S278-D281 PolarHBondContact OG-OD2 3.11Å; L279-D281 PolarHBondContact O-N 3.25Å; D281-G285 PolarHBondContact O-N 3.36Å
282	Y	98.3	Very high	97.2	Very high	26 Å²	26	45.4 Å²	45.4	10%	0.102	25%	0.249	C	C	.	.	H	α-helix	trans	-63.3	-48.2	175.6	-168.8	-98.3	0	0	0	111.9	K276 S278 L279 T280 K284 G285 N286 I288 L335 L339	K276-Y282 HydrophobicContact CB-CD2 4.2Å; K276-Y282 HydrophobicContact CD-CD2 4.17Å; K276-Y282 HydrophobicContact CD-CE2 3.8Å; K276-Y282 HydrophobicContact CG-CD2 4.43Å; K276-Y282 HydrophobicContact CG-CE2 4.35Å; S278-Y282 WeakPolarHBondContact O-CB 3.22Å; S278-Y282 PolarHBondContact O-N 2.88Å; L279-Y282 PolarHBondContact O-N 3.44Å; T280-Y282 VanDerWaalsContact C-N 3.31Å; T280-Y282 PolarHBondContact O-N 3.46Å; Y282-K284 VanDerWaalsContact C-N 3.34Å; Y282-K284 PolarHBondContact O-N 2.91Å; Y282-G285 PolarHBondContact O-N 3.15Å; Y282-N286 HydrophobicContact CD1-CB 4.24Å; Y282-N286 HydrophobicContact CE1-CB 3.93Å; Y282-N286 VanDerWaalsContact O-CB 3.28Å; Y282-N286 WeakPolarHBondContact O-CB 3.44Å; Y282-N286 PolarHBondContact O-N 3.23Å; Y282-N286 PolarHBondContact O-ND2 3.01Å; Y282-I288 HydrophobicContact CD1-CG2 4.45Å; Y282-I288 HydrophobicContact CE1-CG2 3.85Å; Y282-L335 HydrophobicContact CD1-CD1 3.68Å; Y282-L335 HydrophobicContact CD2-CD1 4.11Å; Y282-L335 HydrophobicContact CE1-CD1 4.35Å; Y282-L335 HydrophobicContact CG-CD1 3.53Å; Y282-L339 HydrophobicContact CE1-CD2 3.85Å; Y282-L339 HydrophobicContact CE2-CD2 3.92Å; Y282-L339 VanDerWaalsContact CZ-CD2 3.48Å; Y282-L339 WeakPolarHBondContact OH-CD2 3.21Å
283	L	98.5	Very high	97.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.7	-27.8	-177.6	-70.5	-178	0	0	0	113.5	L279 T280 G285 I288 E401 L402 R405 Y416	L279-L283 HydrophobicContact CD1-CD1 3.81Å; L279-L283 HydrophobicContact CD1-CD2 4.16Å; L279-L283 HydrophobicContact CD1-CG 3.71Å; L279-L283 HydrophobicContact CD2-CD1 4.45Å; L279-L283 HydrophobicContact CG-CD1 3.81Å; L279-L283 HydrophobicContact CG-CG 4.12Å; L279-L283 WeakPolarHBondContact O-CB 3.48Å; L279-L283 VanDerWaalsContact O-CG 3.24Å; L279-L283 WeakPolarHBondContact O-CG 2.93Å; L279-L283 PolarHBondContact O-N 3.15Å; T280-L283 PolarHBondContact O-N 2.74Å; L283-G285 VanDerWaalsContact C-N 3.34Å; L283-I288 HydrophobicContact CD2-CD1 4.14Å; L283-I288 HydrophobicContact CD2-CG2 4.19Å; L283-E401 HydrophobicContact CD1-CB 4.16Å; L283-L402 HydrophobicContact CD1-CD2 4.3Å; L283-L402 HydrophobicContact CD2-CD2 4.41Å; L283-R405 HydrophobicContact CB-CG 4.2Å; L283-R405 HydrophobicContact CD2-CB 3.9Å; L283-R405 HydrophobicContact CD2-CG 4.32Å; L283-R405 PolarHBondContact O-NE 2.67Å; L283-R405 PolarHBondContact O-NH2 2.82Å; L283-Y416 HydrophobicContact CB-CD2 3.65Å; L283-Y416 HydrophobicContact CB-CE2 3.9Å; L283-Y416 HydrophobicContact CD1-CE2 4.22Å
284	K	97.5	Very high	97.4	Very high	122 Å²	122	43.3 Å²	43.3	53%	0.53	24%	0.238	S	C	.	.	H	α-helix	trans	-61.2	-41.8	169.6	-77.9	176.3	177.9	-177.6	0	112.6	T280 Y282 Y416	T280-K284 HydrophobicContact CG2-CD 4.37Å; T280-K284 WeakPolarHBondContact O-CG 3.3Å; T280-K284 PolarHBondContact O-N 2.73Å; T280-K284 VanDerWaalsContact O-N 3.07Å; Y282-K284 VanDerWaalsContact C-N 3.34Å; Y282-K284 PolarHBondContact O-N 2.91Å; K284-Y416 HydrophobicContact CD-CD1 4.2Å; K284-Y416 HydrophobicContact CD-CE1 4.43Å; K284-Y416 HydrophobicContact CG-CD1 3.32Å; K284-Y416 HydrophobicContact CG-CE1 3.89Å; K284-Y416 HydrophobicContact CG-CG 3.79Å
285	G	96.1	Very high	97.5	Very high	61 Å²	61	43.9 Å²	43.9	63%	0.629	24%	0.24	S	C	*	.	H	α-helix	trans	-92.1	-15.6	-176.6	0	0	0	0	0	115	D281 Y282 L283	D281-G285 PolarHBondContact O-N 3.36Å; Y282-G285 PolarHBondContact O-N 3.15Å; L283-G285 VanDerWaalsContact C-N 3.34Å
286	N	97.8	Very high	97.7	Very high	66 Å²	66	38.3 Å²	38.3	35%	0.353	21%	0.211	S	C	.	.			trans	-135.2	150.7	-167.4	-57.7	-88.5	0	0	0	112.2	Y282 R405	Y282-N286 HydrophobicContact CD1-CB 4.24Å; Y282-N286 HydrophobicContact CE1-CB 3.93Å; Y282-N286 VanDerWaalsContact O-CB 3.28Å; Y282-N286 WeakPolarHBondContact O-CB 3.44Å; Y282-N286 PolarHBondContact O-N 3.23Å; Y282-N286 PolarHBondContact O-ND2 3.01Å; N286-R405 PolarHBondContact O-NE 3.35Å; N286-R405 PolarHBondContact O-NH2 3.48Å
287	I	97.5	Very high	97.8	Very high	79 Å²	79	34.9 Å²	34.9	41%	0.405	20%	0.196	S	C	.	.			trans	-105.8	136.3	166.2	-64.4	174.1	0	0	0	106.5	R405 K407 V413	I287-R405 VanDerWaalsContact CG1-NH2 3.26Å; I287-R405 WeakPolarHBondContact CG2-O 3.43Å; I287-K407 HydrophobicContact CG2-CB 3.72Å; I287-K407 HydrophobicContact CG2-CD 4.2Å; I287-K407 HydrophobicContact CG2-CG 4.1Å; I287-V413 HydrophobicContact CD1-CB 4.13Å; I287-V413 HydrophobicContact CD1-CG1 4.25Å; I287-V413 HydrophobicContact CG1-CG1 4.17Å; I287-V413 HydrophobicContact CG2-CG1 4.27Å; I287-V413 HydrophobicContact CG2-CG2 4.33Å
288	I	97.8	Very high	97.9	Very high	2 Å²	2	35 Å²	35	1%	0.01	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-105.5	148.2	-176.1	60.2	176.6	0	0	0	112	Y282 L283 E292 L293 L402 R405 C406 K407	Y282-I288 HydrophobicContact CD1-CG2 4.45Å; Y282-I288 HydrophobicContact CE1-CG2 3.85Å; L283-I288 HydrophobicContact CD2-CD1 4.14Å; L283-I288 HydrophobicContact CD2-CG2 4.19Å; I288-E292 HydrophobicContact CB-CB 4.17Å; I288-L293 HydrophobicContact CD1-CB 3.76Å; I288-L293 HydrophobicContact CD1-CD1 4.36Å; I288-L293 HydrophobicContact CD1-CG 4.29Å; I288-L293 HydrophobicContact CG1-CB 4.35Å; I288-L402 HydrophobicContact CD1-CB 4.38Å; I288-L402 HydrophobicContact CD1-CD2 3.72Å; I288-R405 WeakPolarHBondContact CG1-O 3.36Å; I288-R405 PolarHBondContact N-O 3.17Å; I288-C406 HydrophobicContact CG1-CB 4.43Å; I288-C406 WeakPolarHBondContact O-CA 3.48Å; I288-K407 PolarHBondContact O-N 3.47Å
289	T	97.6	Very high	98	Very high	44 Å²	44	34.9 Å²	34.9	27%	0.27	19%	0.189	S	C	.	.			trans	-74.7	165.3	169.5	62	0	0	0	0	111.2	N291 E292 L293	T289-N291 VanDerWaalsContact C-N 3.31Å; T289-N291 PolarHBondContact O-N 3.49Å; T289-E292 WeakPolarHBondContact CB-OE2 3.34Å; T289-E292 WeakPolarHBondContact CG2-OE2 3.27Å; T289-E292 PolarHBondContact N-OE2 3Å; T289-E292 PolarHBondContact O-N 3.47Å; T289-E292 WeakPolarHBondContact OG1-CB 3.17Å; T289-E292 VanDerWaalsContact OG1-CD 3.3Å; T289-E292 WeakPolarHBondContact OG1-CG 3.26Å; T289-E292 PolarHBondContact OG1-N 2.87Å; T289-E292 PolarHBondContact OG1-OE2 3.13Å; T289-L293 WeakPolarHBondContact O-CB 3.5Å; T289-L293 PolarHBondContact O-N 2.9Å
290	W	97.1	Very high	98	Very high	20 Å²	20	34.9 Å²	34.9	8%	0.076	19%	0.189	C	C	.	.	H	α-helix	trans	-51.5	-48	170.1	174.8	-115.9	0	0	0	113.1	E292 L293 C294 A408 H453 G455 L456 I487 V491	W290-E292 PolarHBondContact O-N 3.07Å; W290-L293 HydrophobicContact CE3-CD2 4.39Å; W290-L293 HydrophobicContact CZ3-CD2 4.11Å; W290-L293 WeakPolarHBondContact O-CB 3.46Å; W290-L293 PolarHBondContact O-N 2.83Å; W290-C294 WeakPolarHBondContact CZ2-SG 3.29Å; W290-C294 PolarHBondContact O-N 2.79Å; W290-C294 PolarHBondContact O-SG 2.98Å; W290-C294 VanDerWaalsContact O-SG 3.37Å; W290-A408 HydrophobicContact CB-CB 3.79Å; W290-A408 HydrophobicContact CE3-CB 4.34Å; W290-H453 AromaticContact CD2-CE1 3.69Å; W290-H453 AromaticContact CE2-CE1 3.98Å; W290-H453 AromaticContact CE3-CE1 3.78Å; W290-G455 VanDerWaalsContact CH2-O 3.3Å; W290-G455 WeakPolarHBondContact CH2-O 3.49Å; W290-L456 HydrophobicContact CE3-CD2 3.99Å; W290-L456 HydrophobicContact CE3-CG 4.21Å; W290-L456 HydrophobicContact CZ3-CD2 3.73Å; W290-L456 HydrophobicContact CZ3-CG 4.03Å; W290-I487 HydrophobicContact CH2-CG2 3.59Å; W290-I487 HydrophobicContact CZ2-CG2 3.68Å; W290-V491 HydrophobicContact CZ2-CB 4.26Å; W290-V491 HydrophobicContact CZ2-CG2 3.9Å
291	N	97.1	Very high	98	Very high	73 Å²	73	34.5 Å²	34.5	39%	0.39	19%	0.187	S	C	.	.	H	α-helix	trans	-67.4	-39.1	-177.3	-76.6	-47.6	0	0	0	112.3	T289 C294 H295 N492	T289-N291 VanDerWaalsContact C-N 3.31Å; T289-N291 PolarHBondContact O-N 3.49Å; N291-C294 PolarHBondContact O-N 3.5Å; N291-H295 WeakPolarHBondContact O-CB 3.32Å; N291-H295 PolarHBondContact O-N 3.26Å; N291-N492 PolarHBondContact OD1-ND2 3.16Å; N291-N492 PolarHBondContact OD1-OD1 3.36Å
292	E	98.4	Very high	98.1	Very high	61 Å²	61	33.2 Å²	33.2	29%	0.285	18%	0.175	S	C	.	.	H	α-helix	trans	-65.8	-41.8	174.4	-68.4	166.8	135.6	0	0	111	I288 T289 W290 C294 H295 V296 L339	I288-E292 HydrophobicContact CB-CB 4.17Å; T289-E292 WeakPolarHBondContact CB-OE2 3.34Å; T289-E292 WeakPolarHBondContact CG2-OE2 3.27Å; T289-E292 PolarHBondContact N-OE2 3Å; T289-E292 PolarHBondContact O-N 3.47Å; T289-E292 WeakPolarHBondContact OG1-CB 3.17Å; T289-E292 VanDerWaalsContact OG1-CD 3.3Å; T289-E292 WeakPolarHBondContact OG1-CG 3.26Å; T289-E292 PolarHBondContact OG1-N 2.87Å; T289-E292 PolarHBondContact OG1-OE2 3.13Å; W290-E292 PolarHBondContact O-N 3.07Å; E292-C294 PolarHBondContact O-N 2.89Å; E292-H295 PolarHBondContact O-N 2.9Å; E292-V296 VanDerWaalsContact O-CG2 3.29Å; E292-V296 WeakPolarHBondContact O-CG2 3.43Å; E292-V296 PolarHBondContact O-N 2.74Å; E292-L339 HydrophobicContact CB-CD1 3.93Å; E292-L339 HydrophobicContact CG-CD1 3.61Å
293	L	98.6	Very high	98.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.1	-50.6	173.1	178.5	150.7	0	0	0	111.1	I288 T289 W290 H295 V296 A297 L402 V403 C406 L456 L459	I288-L293 HydrophobicContact CD1-CB 3.76Å; I288-L293 HydrophobicContact CD1-CD1 4.36Å; I288-L293 HydrophobicContact CD1-CG 4.29Å; I288-L293 HydrophobicContact CG1-CB 4.35Å; T289-L293 WeakPolarHBondContact O-CB 3.5Å; T289-L293 PolarHBondContact O-N 2.9Å; W290-L293 HydrophobicContact CE3-CD2 4.39Å; W290-L293 HydrophobicContact CZ3-CD2 4.11Å; W290-L293 WeakPolarHBondContact O-CB 3.46Å; W290-L293 PolarHBondContact O-N 2.83Å; L293-H295 VanDerWaalsContact C-N 3.32Å; L293-H295 PolarHBondContact O-N 3.17Å; L293-V296 PolarHBondContact O-N 2Å; L293-A297 VanDerWaalsContact O-CB 3.26Å; L293-A297 WeakPolarHBondContact O-CB 3.24Å; L293-A297 PolarHBondContact O-N 3.18Å; L293-L402 HydrophobicContact CD1-CB 4Å; L293-L402 HydrophobicContact CG-CB 4.13Å; L293-V403 HydrophobicContact CD1-CG2 4.12Å; L293-C406 HydrophobicContact CD1-CB 3.62Å; L293-L456 HydrophobicContact CD1-CD2 4.19Å; L293-L459 HydrophobicContact CD1-CD2 4.3Å; L293-L459 HydrophobicContact CD2-CD2 3.31Å; L293-L459 HydrophobicContact CG-CD2 4.36Å
294	C	98.5	Very high	98.2	Very high	2 Å²	2	32 Å²	32	1%	0.014	17%	0.17	C	C	.	.	H	α-helix	trans	-63.9	-40.9	-179.2	-68	0	0	0	0	111.1	W290 N291 E292 A297 E298 R488	W290-C294 WeakPolarHBondContact CZ2-SG 3.29Å; W290-C294 PolarHBondContact O-N 2.79Å; W290-C294 PolarHBondContact O-SG 2.98Å; W290-C294 VanDerWaalsContact O-SG 3.37Å; N291-C294 PolarHBondContact O-N 3.5Å; E292-C294 PolarHBondContact O-N 2.89Å; C294-A297 PolarHBondContact O-N 3.04Å; C294-E298 WeakPolarHBondContact O-CB 3.35Å; C294-E298 PolarHBondContact O-N 2.86Å; C294-R488 HydrophobicContact CB-CB 3.98Å; C294-R488 HydrophobicContact CB-CG 3.8Å
295	H	98.6	Very high	98.2	Very high	45 Å²	45	27.4 Å²	27.4	21%	0.208	15%	0.154	C	C	.	.	H	α-helix	trans	-62.5	-47.2	178.8	-173.9	69	0	0	0	112.1	N291 E292 L293 T299 D338 T340	N291-H295 WeakPolarHBondContact O-CB 3.32Å; N291-H295 PolarHBondContact O-N 3.26Å; E292-H295 PolarHBondContact O-N 2.9Å; L293-H295 VanDerWaalsContact C-N 3.32Å; L293-H295 PolarHBondContact O-N 3.17Å; H295-T299 WeakPolarHBondContact O-CB 3.19Å; H295-T299 WeakPolarHBondContact O-CG2 3.37Å; H295-T299 PolarHBondContact O-N 2.86Å; H295-T299 PolarHBondContact O-OG1 2.71Å; H295-D338 PolarHBondContact NE2-O 3.43Å; H295-T340 PolarHBondContact NE2-OG1 3.17Å
296	V	98.8	Very high	98.3	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.012	13%	0.132	C	C	.	.	H	α-helix	trans	-64.3	-47.5	177.5	175.9	0	0	0	0	110.6	L279 E292 L293 T299 M300 L335 L339 A341 L402	L279-V296 HydrophobicContact CD1-CG1 4.08Å; L279-V296 HydrophobicContact CD2-CG1 4.31Å; E292-V296 VanDerWaalsContact O-CG2 3.29Å; E292-V296 WeakPolarHBondContact O-CG2 3.43Å; E292-V296 PolarHBondContact O-N 2.74Å; L293-V296 PolarHBondContact O-N 2Å; V296-T299 PolarHBondContact O-OG1 3.19Å; V296-M300 WeakPolarHBondContact O-CB 3.37Å; V296-M300 PolarHBondContact O-N 3.23Å; V296-L335 HydrophobicContact CG1-CD2 4.03Å; V296-L335 HydrophobicContact CG2-CD2 4.17Å; V296-L339 HydrophobicContact CG2-CB 4.04Å; V296-L339 WeakPolarHBondContact CG2-O 3.26Å; V296-A341 HydrophobicContact CG1-CB 4.31Å; V296-L402 HydrophobicContact CB-CD2 4.22Å; V296-L402 HydrophobicContact CG1-CD1 4.11Å; V296-L402 HydrophobicContact CG1-CD2 3.79Å
297	A	98.8	Very high	98.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.5	-47.8	179.3	0	0	0	0	0	111.7	L293 C294 M300 S301 L399 L402 V484	L293-A297 VanDerWaalsContact O-CB 3.26Å; L293-A297 WeakPolarHBondContact O-CB 3.24Å; L293-A297 PolarHBondContact O-N 3.18Å; C294-A297 PolarHBondContact O-N 3.04Å; A297-M300 PolarHBondContact O-N 2.9Å; A297-S301 WeakPolarHBondContact O-CB 3.48Å; A297-S301 PolarHBondContact O-N 2.96Å; A297-S301 PolarHBondContact O-OG 3.43Å; A297-L399 HydrophobicContact CB-CD2 3.77Å; A297-L402 HydrophobicContact CB-CD1 4.07Å; A297-V484 HydrophobicContact CB-CG1 3.93Å; A297-V484 HydrophobicContact CB-CG2 4.19Å
298	E	98.6	Very high	98.4	Very high	26 Å²	26	20.5 Å²	20.5	12%	0.121	10%	0.1	C	C	.	.	H	α-helix	trans	-62	-48.5	-179.3	-169.1	-167.6	141.5	0	0	111.6	C294 S301 R302 V484 R488	C294-E298 WeakPolarHBondContact O-CB 3.35Å; C294-E298 PolarHBondContact O-N 2.86Å; E298-S301 PolarHBondContact O-N 3.4Å; E298-R302 WeakPolarHBondContact O-CB 3.33Å; E298-R302 PolarHBondContact O-N 3.06Å; E298-R302 IonicContact OE1-CZ 3.62Å; E298-R302 IonicContact OE1-NH2 2.76Å; E298-R302 PolarHBondContact OE1-NH2 2.96Å; E298-V484 HydrophobicContact CB-CG1 3.9Å; E298-R488 IonicContact OE2-CZ 3.47Å; E298-R488 IonicContact OE2-NH1 2.73Å; E298-R488 PolarHBondContact OE2-NH1 3.19Å
299	T	98.8	Very high	98.3	Very high	4 Å²	4	25.2 Å²	25.2	3%	0.025	12%	0.122	C	C	.	.	H	α-helix	trans	-68.6	-35.4	-179.7	52.8	0	0	0	0	112.7	N249 H295 V296 G303 T340 A341	N249-T299 VanDerWaalsContact CB-O 3.28Å; N249-T299 WeakPolarHBondContact CB-O 3.38Å; N249-T299 WeakPolarHBondContact ND2-CB 3.2Å; N249-T299 PolarHBondContact ND2-O 2.99Å; H295-T299 WeakPolarHBondContact O-CB 3.19Å; H295-T299 WeakPolarHBondContact O-CG2 3.37Å; H295-T299 PolarHBondContact O-N 2.86Å; H295-T299 PolarHBondContact O-OG1 2.71Å; V296-T299 PolarHBondContact O-OG1 3.19Å; T299-G303 PolarHBondContact O-N 2.79Å; T299-G303 VanDerWaalsContact O-N 3.11Å; T299-T340 HydrophobicContact CG2-CG2 4.02Å; T299-A341 WeakPolarHBondContact OG1-CB 3.5Å; T299-A341 PolarHBondContact OG1-N 3.12Å
300	M	98.8	Very high	98.1	Very high	1 Å²	1	26 Å²	26	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-65.8	-47.9	173.7	178.4	-174.4	69.8	0	0	111.3	V296 A297 R302 G303 L304 F328 V333 A341 L343 M395 V398 L399 L402	V296-M300 WeakPolarHBondContact O-CB 3.37Å; V296-M300 PolarHBondContact O-N 3.23Å; A297-M300 PolarHBondContact O-N 2.9Å; M300-R302 VanDerWaalsContact C-N 3.34Å; M300-R302 PolarHBondContact O-N 2.88Å; M300-G303 PolarHBondContact O-N 2.78Å; M300-L304 PolarHBondContact O-N 3.09Å; M300-F328 HydrophobicContact CG-CZ 3.77Å; M300-F328 HydrophobicContact SD-CE1 4.19Å; M300-F328 HydrophobicContact SD-CZ 3.79Å; M300-V333 HydrophobicContact CG-CG1 4.33Å; M300-V333 HydrophobicContact CG-CG2 4.23Å; M300-V333 HydrophobicContact SD-CG1 4.43Å; M300-V333 HydrophobicContact SD-CG2 4.02Å; M300-A341 HydrophobicContact CB-CB 3.83Å; M300-L343 HydrophobicContact CG-CD2 4.23Å; M300-M395 HydrophobicContact CE-CE 4.29Å; M300-M395 HydrophobicContact CE-CG 4.31Å; M300-M395 HydrophobicContact CG-CE 4.46Å; M300-V398 HydrophobicContact CE-CG1 4.17Å; M300-V398 HydrophobicContact SD-CB 4.45Å; M300-V398 HydrophobicContact SD-CG1 3.6Å; M300-L399 HydrophobicContact CE-CD2 3.76Å; M300-L399 HydrophobicContact CE-CG 4.15Å; M300-L402 HydrophobicContact CE-CD1 4.47Å
301	S	98.8	Very high	97.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63	-40	178.6	-61.5	0	0	0	0	112.1	A297 E298 G303 L304 S305 V480	A297-S301 WeakPolarHBondContact O-CB 3.48Å; A297-S301 PolarHBondContact O-N 2.96Å; A297-S301 PolarHBondContact O-OG 3.43Å; E298-S301 PolarHBondContact O-N 3.4Å; S301-G303 VanDerWaalsContact C-N 3.35Å; S301-G303 PolarHBondContact O-N 3.37Å; S301-L304 PolarHBondContact O-N 2.91Å; S301-S305 VanDerWaalsContact O-CB 3.28Å; S301-S305 WeakPolarHBondContact O-CB 3.3Å; S301-S305 PolarHBondContact O-N 3.07Å; S301-V480 VanDerWaalsContact OG-CG1 3.31Å; S301-V480 WeakPolarHBondContact OG-CG1 3.44Å
302	R	98.8	Very high	97.2	Very high	63 Å²	63	27.3 Å²	27.3	24%	0.238	14%	0.139	C	C	.	.	H	α-helix	trans	-59.5	-44.1	172.4	-171.3	-179.7	-59.8	121.7	8	112.4	N249 E298 M300 S305 Y306 E481	N249-R302 WeakPolarHBondContact OD1-CD 3.35Å; E298-R302 WeakPolarHBondContact O-CB 3.33Å; E298-R302 PolarHBondContact O-N 3.06Å; E298-R302 IonicContact OE1-CZ 3.62Å; E298-R302 IonicContact OE1-NH2 2.76Å; E298-R302 PolarHBondContact OE1-NH2 2.96Å; M300-R302 VanDerWaalsContact C-N 3.34Å; M300-R302 PolarHBondContact O-N 2.88Å; R302-S305 PolarHBondContact O-N 3Å; R302-Y306 WeakPolarHBondContact O-CB 3.36Å; R302-Y306 PolarHBondContact O-N 3.08Å; R302-E481 HydrophobicContact CB-CG 4.25Å; R302-E481 WeakPolarHBondContact CG-OE1 3.39Å; R302-E481 IonicContact CZ-OE1 3.86Å; R302-E481 IonicContact NE-OE1 3.41Å; R302-E481 PolarHBondContact NE-OE1 2.94Å; R302-E481 IonicContact NH2-OE1 3.58Å; R302-E481 PolarHBondContact NH2-OE1 2.97Å
303	G	98.7	Very high	96.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-44.2	176.1	0	0	0	0	0	112.7	N249 T299 M300 S301 L307	N249-G303 VanDerWaalsContact CB-CA 3.49Å; T299-G303 PolarHBondContact O-N 2.79Å; T299-G303 VanDerWaalsContact O-N 3.11Å; M300-G303 PolarHBondContact O-N 2.78Å; S301-G303 VanDerWaalsContact C-N 3.35Å; S301-G303 PolarHBondContact O-N 3.37Å; G303-L307 WeakPolarHBondContact O-CB 3.49Å; G303-L307 PolarHBondContact O-N 2.76Å
304	L	98.8	Very high	95.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-71	-39.5	178.5	-168.8	62.3	0	0	0	111.7	M300 S301 Y306 L307 H308 F328 L343 D391 M392 M395 A477	M300-L304 PolarHBondContact O-N 3.09Å; S301-L304 PolarHBondContact O-N 2.91Å; L304-Y306 PolarHBondContact O-N 3.48Å; L304-L307 HydrophobicContact CD1-CD2 4.27Å; L304-L307 WeakPolarHBondContact O-CB 3.4Å; L304-L307 PolarHBondContact O-N 2.85Å; L304-H308 WeakPolarHBondContact CD1-NE2 3.41Å; L304-H308 WeakPolarHBondContact O-CB 3.1Å; L304-H308 PolarHBondContact O-CD2 2.85Å; L304-H308 VanDerWaalsContact O-CG 3.29Å; L304-H308 PolarHBondContact O-N 2.89Å; L304-F328 HydrophobicContact CB-CE2 4.33Å; L304-F328 HydrophobicContact CD1-CD2 3.89Å; L304-F328 HydrophobicContact CD1-CE2 4Å; L304-F328 HydrophobicContact CD2-CD2 4.22Å; L304-F328 HydrophobicContact CD2-CE2 4.02Å; L304-F328 HydrophobicContact CD2-CZ 4.37Å; L304-F328 HydrophobicContact CG-CE2 4.35Å; L304-L343 HydrophobicContact CB-CD1 3.97Å; L304-L343 HydrophobicContact CD1-CD1 4Å; L304-D391 HydrophobicContact CD1-CB 4.39Å; L304-D391 HydrophobicContact CD2-CB 4.26Å; L304-M392 HydrophobicContact CD2-SD 3.81Å; L304-M395 HydrophobicContact CB-CE 3.68Å; L304-M395 HydrophobicContact CD2-CB 4.34Å; L304-M395 HydrophobicContact CD2-CE 3.31Å; L304-M395 HydrophobicContact CD2-SD 4.13Å; L304-M395 HydrophobicContact CG-CE 4.12Å; L304-A477 HydrophobicContact CB-CB 4.05Å; L304-A477 HydrophobicContact CD2-CB 4.22Å; L304-A477 HydrophobicContact CG-CB 4.01Å
305	S	98.7	Very high	93	Very high	27 Å²	27	49 Å²	49	19%	0.189	23%	0.228	C	C	.	.	H	α-helix	trans	-57.4	-49.8	175.2	-173.4	0	0	0	0	110.8	S301 R302 L307 H308 E309 G478	S301-S305 VanDerWaalsContact O-CB 3.28Å; S301-S305 WeakPolarHBondContact O-CB 3.3Å; S301-S305 PolarHBondContact O-N 3.07Å; R302-S305 PolarHBondContact O-N 3Å; S305-L307 VanDerWaalsContact C-N 3.32Å; S305-L307 PolarHBondContact O-N 3.13Å; S305-H308 PolarHBondContact O-N 2.81Å; S305-E309 WeakPolarHBondContact O-CB 3.34Å; S305-E309 PolarHBondContact O-N 3.22Å; S305-G478 WeakPolarHBondContact OG-CA 3.43Å; S305-G478 PolarHBondContact OG-N 3.2Å
306	Y	98.3	Very high	91.4	Very high	42 Å²	42	50.5 Å²	50.5	17%	0.165	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-38.4	176.7	-173.5	-103.6	0	0	0	112.7	G244 H247 L250 R302 L304 E309 V311 K320	G244-Y306 WeakPolarHBondContact O-CE1 3.39Å; G244-Y306 PolarHBondContact O-OH 3.15Å; H247-Y306 HydrophobicContact CB-CD1 3.47Å; H247-Y306 VanDerWaalsContact CB-CD1 3.47Å; H247-Y306 HydrophobicContact CB-CE1 3.46Å; H247-Y306 VanDerWaalsContact CB-CE1 3.46Å; H247-Y306 HydrophobicContact CB-CG 4.25Å; H247-Y306 AromaticContact CD2-CD1 3.79Å; H247-Y306 AromaticContact CD2-CD2 3.87Å; H247-Y306 AromaticContact CD2-CG 3.66Å; H247-Y306 AromaticContact CG-CD1 3.52Å; H247-Y306 AromaticContact CG-CE1 3.91Å; H247-Y306 AromaticContact CG-CG 3.8Å; L250-Y306 HydrophobicContact CD1-CD1 3.77Å; L250-Y306 HydrophobicContact CD1-CE1 4.13Å; L250-Y306 HydrophobicContact CG-CD1 4.44Å; R302-Y306 WeakPolarHBondContact O-CB 3.36Å; R302-Y306 PolarHBondContact O-N 3.08Å; L304-Y306 PolarHBondContact O-N 3.48Å; Y306-E309 PolarHBondContact O-N 2.89Å; Y306-V311 HydrophobicContact CE2-CG2 4.35Å; Y306-K320 HydrophobicContact CE1-CD 4.15Å; Y306-K320 WeakPolarHBondContact O-CE 3.31Å; Y306-K320 PolarHBondContact O-NZ 2.92Å
307	L	98.2	Very high	90.3	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.7	-43.9	176	-169.6	67.8	0	0	0	111.5	M245 L250 G303 L304 S305 E309 K320 I323 H325 L343 F346	M245-L307 HydrophobicContact CE-CD1 3.83Å; M245-L307 HydrophobicContact SD-CD1 4.03Å; L250-L307 HydrophobicContact CD1-CD1 4.39Å; L250-L307 HydrophobicContact CD2-CB 4.39Å; L250-L307 HydrophobicContact CD2-CD1 4.39Å; G303-L307 WeakPolarHBondContact O-CB 3.49Å; G303-L307 PolarHBondContact O-N 2.76Å; L304-L307 HydrophobicContact CD1-CD2 4.27Å; L304-L307 WeakPolarHBondContact O-CB 3.4Å; L304-L307 PolarHBondContact O-N 2.85Å; S305-L307 VanDerWaalsContact C-N 3.32Å; S305-L307 PolarHBondContact O-N 3.13Å; L307-E309 VanDerWaalsContact C-N 3.34Å; L307-K320 PolarHBondContact O-NZ 3.03Å; L307-I323 CarbonylContact C-O 3.6Å; L307-I323 HydrophobicContact CD1-CB 3.89Å; L307-I323 HydrophobicContact CD1-CD1 4.27Å; L307-I323 HydrophobicContact CD1-CG2 3.87Å; L307-I323 HydrophobicContact CG-CB 4.03Å; L307-I323 HydrophobicContact CG-CG2 4.11Å; L307-I323 PolarHBondContact O-N 3.06Å; L307-H325 HydrophobicContact CD2-CB 3.99Å; L307-L343 HydrophobicContact CD2-CD1 4.46Å; L307-F346 HydrophobicContact CD1-CD1 4.47Å; L307-F346 HydrophobicContact CD1-CE1 3.99Å; L307-F346 HydrophobicContact CD2-CD1 4.49Å; L307-F346 HydrophobicContact CD2-CE1 4.02Å
308	H	98.1	Very high	89.6	Confident	18 Å²	18	56.7 Å²	56.7	8%	0.083	29%	0.288	C	S	.	.	H	α-helix	trans	-71.9	-25.5	179.8	-72.8	-166.7	0	0	0	113.4	L304 S305 S322 I323 L388 D391	L304-H308 WeakPolarHBondContact CD1-NE2 3.41Å; L304-H308 WeakPolarHBondContact O-CB 3.1Å; L304-H308 PolarHBondContact O-CD2 2.85Å; L304-H308 VanDerWaalsContact O-CG 3.29Å; L304-H308 PolarHBondContact O-N 2.89Å; S305-H308 PolarHBondContact O-N 2.81Å; H308-S322 WeakPolarHBondContact O-CA 3.31Å; H308-S322 WeakPolarHBondContact O-CB 3.1Å; H308-S322 PolarHBondContact O-OG 2.91Å; H308-I323 PolarHBondContact CD2-O 3.4Å; H308-I323 VanDerWaalsContact CD2-O 3.3Å; H308-L388 HydrophobicContact CB-CD1 4.28Å; H308-L388 HydrophobicContact CB-CD2 4.13Å; H308-D391 IonicContact CD2-OD2 2.8Å; H308-D391 IonicContact CE1-OD2 2.7Å; H308-D391 IonicContact NE2-OD2 2.82Å; H308-D391 PolarHBondContact NE2-OD2 2.92Å
309	E	95.6	Very high	89.1	Confident	101 Å²	101	58.5 Å²	58.5	47%	0.472	30%	0.297	S	S	.	.			trans	-67.5	135.9	-176.9	-167.9	174.5	-170.9	0	0	112.5	S305 Y306 L307 V311 K320	S305-E309 WeakPolarHBondContact O-CB 3.34Å; S305-E309 PolarHBondContact O-N 3.22Å; Y306-E309 PolarHBondContact O-N 2.89Å; L307-E309 VanDerWaalsContact C-N 3.34Å; E309-V311 HydrophobicContact CB-CG2 4.16Å; E309-V311 HydrophobicContact CG-CG2 3.79Å; E309-K320 PolarHBondContact O-NZ 3.49Å
310	D	93.5	Very high	88.9	Confident	61 Å²	61	58.3 Å²	58.3	33%	0.326	30%	0.296	S	S	.	.			trans	-89.6	99.2	168.6	-172.7	14.6	0	0	0	108.5	P312 H319 K320 S322	D310-P312 WeakPolarHBondContact O-CD 3.48Å; D310-H319 IonicContact OD1-CD2 3.26Å; D310-H319 IonicContact OD1-CE1 3.65Å; D310-H319 IonicContact OD1-NE2 2.77Å; D310-H319 PolarHBondContact OD1-NE2 3.04Å; D310-K320 CarbonylContact C-O 3.58Å; D310-S322 PolarHBondContact N-OG 2.88Å
311	V	90.8	Very high	88.7	Confident	34 Å²	34	58.6 Å²	58.6	21%	0.206	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-97	110.9	-174.2	-174.6	0	0	0	0	109.5	Y306 E309 H319 K320	Y306-V311 HydrophobicContact CE2-CG2 4.35Å; E309-V311 HydrophobicContact CB-CG2 4.16Å; E309-V311 HydrophobicContact CG-CG2 3.79Å; V311-H319 PolarHBondContact O-CD2 3.21Å; V311-H319 VanDerWaalsContact O-CD2 3.26Å; V311-K320 HydrophobicContact CB-CB 4.08Å; V311-K320 HydrophobicContact CB-CD 4.46Å; V311-K320 HydrophobicContact CG2-CD 4.09Å; V311-K320 PolarHBondContact N-O 2.99Å; V311-K320 PolarHBondContact O-N 3.42Å
312	P	85.8	Confident	88.5	Confident	87 Å²	87	58.8 Å²	58.8	57%	0.565	30%	0.299	S	S	*	.			trans	-61	164.7	-179.7	-22.1	33.8	0	0	0	113	D310 C314	D310-P312 WeakPolarHBondContact O-CD 3.48Å; P312-C314 PolarHBondContact O-N 2.71Å; P312-C314 VanDerWaalsContact O-N 3.15Å; P312-C314 PolarHBondContact O-SG 2.92Å
313	W	83.8	Confident	88.4	Confident	186 Å²	186	55.8 Å²	55.8	71%	0.705	29%	0.287	S	S	*	.			trans	-52.7	121	177.6	-162.7	-75.1	0	0	0	112	H319	W313-H319 HydrophobicContact CE3-CB 4.25Å
314	C	69.4	Low	88.3	Confident	74 Å²	74	55.8 Å²	55.8	50%	0.5	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-136.3	120.2	-175.3	-78.4	0	0	0	0	110.9	P312 G316 E317	P312-C314 PolarHBondContact O-N 2.71Å; P312-C314 VanDerWaalsContact O-N 3.15Å; P312-C314 PolarHBondContact O-SG 2.92Å; C314-G316 PolarHBondContact O-N 3.04Å; C314-G316 VanDerWaalsContact O-N 3.1Å; C314-E317 PolarHBondContact N-O 3.49Å; C314-E317 PolarHBondContact O-N 2.86Å
315	R	53.6	Low	88.3	Confident	258 Å²	258	55.8 Å²	55.8	97%	0.974	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	32	62.6	166.9	-64.4	-173.4	-176.8	-175.4	2.3	116.2	E317	R315-E317 VanDerWaalsContact C-N 3.35Å
316	G	64.8	Low	88.1	Confident	76 Å²	76	55.8 Å²	55.8	78%	0.784	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	-6.5	172.6	0	0	0	0	0	115	C314	C314-G316 PolarHBondContact O-N 3.04Å; C314-G316 VanDerWaalsContact O-N 3.1Å
317	E	75.1	Confident	88	Confident	117 Å²	117	54.5 Å²	54.5	55%	0.547	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-100.7	137.4	166.8	-63.1	-172.4	178.3	0	0	109.6	C314 R315	C314-E317 PolarHBondContact N-O 3.49Å; C314-E317 PolarHBondContact O-N 2.86Å; R315-E317 VanDerWaalsContact C-N 3.35Å
318	G	83.9	Confident	88.1	Confident	15 Å²	15	54.7 Å²	54.7	16%	0.155	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-67.5	172.3	178.9	0	0	0	0	0	112.8	K320	G318-K320 PolarHBondContact O-N 3.26Å
319	H	90.1	Very high	88.1	Confident	64 Å²	64	55.1 Å²	55.1	30%	0.296	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-62.1	126.6	174	175.1	-134.2	0	0	0	111.1	D310 V311 W313 P321	D310-H319 IonicContact OD1-CD2 3.26Å; D310-H319 IonicContact OD1-CE1 3.65Å; D310-H319 IonicContact OD1-NE2 2.77Å; D310-H319 PolarHBondContact OD1-NE2 3.04Å; V311-H319 PolarHBondContact O-CD2 3.21Å; V311-H319 VanDerWaalsContact O-CD2 3.26Å; W313-H319 HydrophobicContact CE3-CB 4.25Å; H319-P321 WeakPolarHBondContact O-CD 3.5Å
320	K	93.1	Very high	88.2	Confident	1 Å²	1	50.3 Å²	50.3	0%	0.004	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-100.6	107.3	172.6	-177.6	-156.1	161.9	-67.3	0	108.6	P243 Y306 L307 E309 D310 V311 G318	P243-K320 WeakPolarHBondContact O-CB 3.35Å; P243-K320 WeakPolarHBondContact O-CG 3.4Å; Y306-K320 HydrophobicContact CE1-CD 4.15Å; Y306-K320 WeakPolarHBondContact O-CE 3.31Å; Y306-K320 PolarHBondContact O-NZ 2.92Å; L307-K320 PolarHBondContact O-NZ 3.03Å; E309-K320 PolarHBondContact O-NZ 3.49Å; D310-K320 CarbonylContact C-O 3.58Å; V311-K320 HydrophobicContact CB-CB 4.08Å; V311-K320 HydrophobicContact CB-CD 4.46Å; V311-K320 HydrophobicContact CG2-CD 4.09Å; V311-K320 PolarHBondContact N-O 2.99Å; V311-K320 PolarHBondContact O-N 3.42Å; G318-K320 PolarHBondContact O-N 3.26Å
321	P	94.4	Very high	88.4	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.039	27%	0.266	C	S	.	.			trans	-66	162.5	173.9	28.1	-34.4	0	0	0	111.8	T242 H319 R351 F352 E353	T242-P321 HydrophobicContact CG2-CG 4.17Å; H319-P321 WeakPolarHBondContact O-CD 3.5Å; P321-R351 HydrophobicContact CG-CB 4.05Å; P321-F352 VanDerWaalsContact CB-O 3.24Å; P321-F352 WeakPolarHBondContact CB-O 3.34Å; P321-E353 HydrophobicContact CB-CG 4.49Å
322	S	95.7	Very high	88.7	Confident	4 Å²	4	51.4 Å²	51.4	3%	0.028	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	136.5	163.7	-67.2	0	0	0	0	110.2	H308 D310 F352	H308-S322 WeakPolarHBondContact O-CA 3.31Å; H308-S322 WeakPolarHBondContact O-CB 3.1Å; H308-S322 PolarHBondContact O-OG 2.91Å; D310-S322 PolarHBondContact N-OG 2.88Å; S322-F352 WeakPolarHBondContact O-CD2 3.18Å; S322-F352 PolarHBondContact O-N 3.38Å
323	I	97	Very high	89.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	128.8	177.7	-64.2	161.6	0	0	0	108.6	T242 M245 L307 H308 A349 V350 R351	T242-I323 HydrophobicContact CG2-CD1 4.34Å; M245-I323 HydrophobicContact CE-CD1 4.38Å; M245-I323 HydrophobicContact CG-CD1 4.38Å; M245-I323 HydrophobicContact SD-CD1 3.45Å; M245-I323 WeakPolarHBondContact SD-CD1 3.5Å; L307-I323 CarbonylContact C-O 3.6Å; L307-I323 HydrophobicContact CD1-CB 3.89Å; L307-I323 HydrophobicContact CD1-CD1 4.27Å; L307-I323 HydrophobicContact CD1-CG2 3.87Å; L307-I323 HydrophobicContact CG-CB 4.03Å; L307-I323 HydrophobicContact CG-CG2 4.11Å; L307-I323 PolarHBondContact O-N 3.06Å; H308-I323 PolarHBondContact CD2-O 3.4Å; H308-I323 VanDerWaalsContact CD2-O 3.3Å; I323-A349 HydrophobicContact CG2-CB 3.92Å; I323-V350 CarbonylContact C-O 3.59Å; I323-V350 VanDerWaalsContact CA-O 3.29Å; I323-V350 WeakPolarHBondContact CA-O 3.49Å; I323-R351 HydrophobicContact CG1-CB 4.22Å
324	A	96.9	Very high	90.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	138.2	167.1	0	0	0	0	0	110	R326 A349 V350 F352 F387 L388 D391	A324-R326 HydrophobicContact CB-CG 4.01Å; A324-A349 CarbonylContact O-C 3.58Å; A324-A349 WeakPolarHBondContact O-CA 3.26Å; A324-A349 WeakPolarHBondContact O-CB 3.37Å; A324-V350 PolarHBondContact N-O 3.03Å; A324-V350 PolarHBondContact O-N 3.12Å; A324-F352 HydrophobicContact CB-CE2 3.68Å; A324-F352 HydrophobicContact CB-CZ 4.24Å; A324-F387 HydrophobicContact CB-CB 3.58Å; A324-F387 HydrophobicContact CB-CG 4.49Å; A324-L388 HydrophobicContact CB-CD2 4.11Å; A324-D391 WeakPolarHBondContact CA-OD2 3.2Å
325	H	97.6	Very high	91.5	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.184	C	C	.	.			trans	-76.2	-44.1	-178.2	-169.9	-73.6	0	0	0	112.3	L307 D327 F328 A344 D345 D391	L307-H325 HydrophobicContact CD2-CB 3.99Å; H325-D327 PolarHBondContact CE1-O 3.44Å; H325-D327 VanDerWaalsContact CE1-O 3.28Å; H325-D327 PolarHBondContact ND1-N 2.95Å; H325-D327 PolarHBondContact ND1-O 3.27Å; H325-D327 PolarHBondContact O-N 2.9Å; H325-F328 HydrophobicContact CB-CB 4.48Å; H325-F328 PolarHBondContact ND1-N 3.15Å; H325-A344 PolarHBondContact NE2-O 3.46Å; H325-D345 PolarHBondContact CE1-O 3.05Å; H325-D345 PolarHBondContact NE2-O 2.83Å; H325-D391 PolarHBondContact N-OD2 3.28Å
326	R	95.3	Very high	93.6	Very high	26 Å²	26	26.5 Å²	26.5	10%	0.098	15%	0.147	C	C	.	.	S	Bend	trans	66.6	-9.5	176	-53.4	-177.6	59.8	-155.3	10.3	117.2	A324 L348 H362 F387 D391	A324-R326 HydrophobicContact CB-CG 4.01Å; R326-L348 HydrophobicContact CB-CB 4.45Å; R326-L348 WeakPolarHBondContact CD-O 3.47Å; R326-H362 PolarHBondContact NH2-O 3.33Å; R326-F387 HydrophobicContact CG-CD1 3.99Å; R326-F387 VanDerWaalsContact NE-CE1 3.28Å; R326-D391 WeakPolarHBondContact CA-OD1 3.18Å; R326-D391 PolarHBondContact N-OD1 2.98Å
327	D	96.5	Very high	95.1	Very high	16 Å²	16	28.1 Å²	28.1	9%	0.086	15%	0.146	C	C	.	.	S	Bend	trans	-133.2	43.6	167.7	-164.5	34.9	0	0	0	111.5	H325 K329 N332 L348 G366 T367	H325-D327 PolarHBondContact CE1-O 3.44Å; H325-D327 VanDerWaalsContact CE1-O 3.28Å; H325-D327 PolarHBondContact ND1-N 2.95Å; H325-D327 PolarHBondContact ND1-O 3.27Å; H325-D327 PolarHBondContact O-N 2.9Å; D327-K329 PolarHBondContact O-N 2.83Å; D327-K329 IonicContact OD1-NZ 2.63Å; D327-K329 PolarHBondContact OD1-NZ 3.43Å; D327-K329 VanDerWaalsContact OD2-CE 3.25Å; D327-K329 WeakPolarHBondContact OD2-CE 3.12Å; D327-K329 IonicContact OD2-NZ 2.87Å; D327-K329 PolarHBondContact OD2-NZ 3.42Å; D327-N332 PolarHBondContact O-ND2 2.81Å; D327-N332 PolarHBondContact OD2-ND2 3.03Å; D327-L348 HydrophobicContact CB-CD1 4.09Å; D327-G366 WeakPolarHBondContact OD1-CA 3.47Å; D327-T367 WeakPolarHBondContact OD1-CB 3.28Å; D327-T367 PolarHBondContact OD1-N 2.85Å; D327-T367 PolarHBondContact OD1-OG1 2.95Å
328	F	98.6	Very high	96.2	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.018	14%	0.142	C	C	.	.			trans	-68.7	125.9	178.7	-167.2	-87.1	0	0	0	109.7	M300 L304 H325 V333 L343 A394 M395 V398	M300-F328 HydrophobicContact CG-CZ 3.77Å; M300-F328 HydrophobicContact SD-CE1 4.19Å; M300-F328 HydrophobicContact SD-CZ 3.79Å; L304-F328 HydrophobicContact CB-CE2 4.33Å; L304-F328 HydrophobicContact CD1-CD2 3.89Å; L304-F328 HydrophobicContact CD1-CE2 4Å; L304-F328 HydrophobicContact CD2-CD2 4.22Å; L304-F328 HydrophobicContact CD2-CE2 4.02Å; L304-F328 HydrophobicContact CD2-CZ 4.37Å; L304-F328 HydrophobicContact CG-CE2 4.35Å; H325-F328 HydrophobicContact CB-CB 4.48Å; H325-F328 PolarHBondContact ND1-N 3.15Å; F328-V333 HydrophobicContact CE2-CG2 4.49Å; F328-V333 HydrophobicContact CZ-CG2 4.17Å; F328-L343 HydrophobicContact CE2-CD1 3.97Å; F328-L343 HydrophobicContact CE2-CD2 3.59Å; F328-L343 HydrophobicContact CE2-CG 4.44Å; F328-L343 HydrophobicContact CZ-CD2 4.22Å; F328-A394 HydrophobicContact CB-CB 4.06Å; F328-A394 HydrophobicContact CD1-CB 4.25Å; F328-A394 VanDerWaalsContact O-CB 3.32Å; F328-A394 WeakPolarHBondContact O-CB 3.39Å; F328-M395 HydrophobicContact CD1-CB 4.28Å; F328-M395 HydrophobicContact CE1-CB 3.92Å; F328-M395 HydrophobicContact CE1-CE 4.49Å; F328-M395 HydrophobicContact CE1-CG 4.41Å; F328-M395 HydrophobicContact CZ-CE 3.96Å; F328-V398 HydrophobicContact CD1-CG2 4.12Å; F328-V398 HydrophobicContact CE1-CB 4.16Å; F328-V398 HydrophobicContact CE1-CG2 3.9Å
329	K	98.4	Very high	96.9	Very high	27 Å²	27	26.5 Å²	26.5	12%	0.117	14%	0.138	C	C	.	.	S	Bend	trans	-167.6	161.5	-179.1	59.3	-171.5	169.1	-165.2	0	109.5	D327 K331 N332 V333 T367 Y370	D327-K329 PolarHBondContact O-N 2.83Å; D327-K329 IonicContact OD1-NZ 2.63Å; D327-K329 PolarHBondContact OD1-NZ 3.43Å; D327-K329 VanDerWaalsContact OD2-CE 3.25Å; D327-K329 WeakPolarHBondContact OD2-CE 3.12Å; D327-K329 IonicContact OD2-NZ 2.87Å; D327-K329 PolarHBondContact OD2-NZ 3.42Å; K329-K331 HydrophobicContact CD-CB 4.28Å; K329-K331 HydrophobicContact CG-CB 4.21Å; K329-K331 PolarHBondContact O-N 2.72Å; K329-K331 VanDerWaalsContact O-N 3.1Å; K329-N332 WeakPolarHBondContact CE-ND2 3.02Å; K329-N332 VanDerWaalsContact CE-OD1 3.29Å; K329-N332 WeakPolarHBondContact CE-OD1 3.48Å; K329-N332 HydrophobicContact CG-CB 4.06Å; K329-N332 PolarHBondContact O-N 3.22Å; K329-V333 PolarHBondContact O-N 3.24Å; K329-T367 HydrophobicContact CD-CG2 4.36Å; K329-T367 WeakPolarHBondContact CD-OG1 3.29Å; K329-T367 PolarHBondContact NZ-OG1 2.91Å; K329-Y370 HydrophobicContact CB-CD1 3.93Å; K329-Y370 HydrophobicContact CB-CD2 3.83Å; K329-Y370 HydrophobicContact CB-CE1 3.83Å; K329-Y370 HydrophobicContact CB-CE2 3.73Å; K329-Y370 HydrophobicContact CB-CG 3.93Å
330	S	98.6	Very high	97.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-59	-26.8	-179.7	55.9	0	0	0	0	113.4	L279 T280 N332 V333 Y370 E401	L279-S330 WeakPolarHBondContact CB-O 3.47Å; L279-S330 PolarHBondContact N-O 2.93Å; T280-S330 PolarHBondContact N-O 3.15Å; T280-S330 WeakPolarHBondContact OG1-CB 3.2Å; T280-S330 PolarHBondContact OG1-OG 2.9Å; S330-N332 VanDerWaalsContact C-N 3.27Å; S330-N332 PolarHBondContact O-N 2.89Å; S330-V333 PolarHBondContact O-N 3.41Å; S330-Y370 PolarHBondContact OG-OH 2.89Å; S330-E401 WeakPolarHBondContact CB-OE2 3.34Å; S330-E401 VanDerWaalsContact OG-CD 3.26Å; S330-E401 PolarHBondContact OG-OE1 3.25Å; S330-E401 PolarHBondContact OG-OE2 2.76Å
331	K	97.2	Very high	97.6	Very high	107 Å²	107	23.6 Å²	23.6	47%	0.465	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-69.9	-24.3	176.1	-167.6	168.1	-176.8	175.9	0	113.4	S278 T280 K329	S278-K331 VanDerWaalsContact CB-O 3.31Å; S278-K331 WeakPolarHBondContact CB-O 3.16Å; T280-K331 VanDerWaalsContact OG1-CA 3.3Å; T280-K331 WeakPolarHBondContact OG1-CA 3.35Å; T280-K331 PolarHBondContact OG1-N 3.07Å; K329-K331 HydrophobicContact CD-CB 4.28Å; K329-K331 HydrophobicContact CG-CB 4.21Å; K329-K331 PolarHBondContact O-N 2.72Å; K329-K331 VanDerWaalsContact O-N 3.1Å
332	N	98.1	Very high	97.8	Very high	11 Å²	11	23.3 Å²	23.3	6%	0.059	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-99.3	6.9	179.7	-72.4	2.4	0	0	0	112.3	D327 K329 S330 A344	D327-N332 PolarHBondContact O-ND2 2.81Å; D327-N332 PolarHBondContact OD2-ND2 3.03Å; K329-N332 WeakPolarHBondContact CE-ND2 3.02Å; K329-N332 VanDerWaalsContact CE-OD1 3.29Å; K329-N332 WeakPolarHBondContact CE-OD1 3.48Å; K329-N332 HydrophobicContact CG-CB 4.06Å; K329-N332 PolarHBondContact O-N 3.22Å; S330-N332 VanDerWaalsContact C-N 3.27Å; S330-N332 PolarHBondContact O-N 2.89Å; N332-A344 WeakPolarHBondContact CB-O 3.4Å; N332-A344 PolarHBondContact O-N 2.99Å
333	V	98.8	Very high	97.9	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.006	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.5	168.8	-179.2	0	0	0	0	107.2	S278 L279 M300 F328 K329 S330 A341 L343	S278-V333 CarbonylContact C-O 3.58Å; S278-V333 WeakPolarHBondContact CA-O 3.01Å; L279-V333 HydrophobicContact CB-CB 4.09Å; L279-V333 HydrophobicContact CB-CG1 4.27Å; L279-V333 HydrophobicContact CD2-CB 4.48Å; L279-V333 HydrophobicContact CD2-CG1 4.4Å; L279-V333 PolarHBondContact N-O 2.84Å; M300-V333 HydrophobicContact CG-CG1 4.33Å; M300-V333 HydrophobicContact CG-CG2 4.23Å; M300-V333 HydrophobicContact SD-CG1 4.43Å; M300-V333 HydrophobicContact SD-CG2 4.02Å; F328-V333 HydrophobicContact CE2-CG2 4.49Å; F328-V333 HydrophobicContact CZ-CG2 4.17Å; K329-V333 PolarHBondContact O-N 3.24Å; S330-V333 PolarHBondContact O-N 3.41Å; V333-A341 HydrophobicContact CG1-CB 3.8Å; V333-L343 HydrophobicContact CG2-CD2 3.96Å
334	L	98.6	Very high	97.9	Very high	34 Å²	34	23.5 Å²	23.5	18%	0.178	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	154.5	175.7	-52.3	179.6	0	0	0	110.5	L251 G277 A341 V342 A344	L251-L334 HydrophobicContact CD1-CD1 4.06Å; L251-L334 HydrophobicContact CD2-CD1 4.15Å; G277-L334 WeakPolarHBondContact O-CA 3.46Å; L334-A341 CarbonylContact O-C 3.53Å; L334-A341 WeakPolarHBondContact O-CA 3.32Å; L334-V342 HydrophobicContact CB-CG2 3.7Å; L334-V342 PolarHBondContact N-O 3.3Å; L334-V342 PolarHBondContact O-N 3.04Å; L334-A344 HydrophobicContact CD1-CB 3.91Å; L334-A344 HydrophobicContact CG-CB 3.89Å
335	L	98.8	Very high	97.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.6	179.3	-60.6	179.8	0	0	0	111.3	H274 K276 G277 L279 Y282 V296 L339 A341	H274-L335 WeakPolarHBondContact CB-O 3.37Å; K276-L335 HydrophobicContact CB-CB 4Å; K276-L335 HydrophobicContact CD-CB 4.33Å; G277-L335 PolarHBondContact O-N 2.87Å; L279-L335 HydrophobicContact CD1-CD1 3.96Å; L279-L335 HydrophobicContact CD1-CD2 4.36Å; L279-L335 HydrophobicContact CD1-CG 4.49Å; Y282-L335 HydrophobicContact CD1-CD1 3.68Å; Y282-L335 HydrophobicContact CD2-CD1 4.11Å; Y282-L335 HydrophobicContact CE1-CD1 4.35Å; Y282-L335 HydrophobicContact CG-CD1 3.53Å; V296-L335 HydrophobicContact CG1-CD2 4.03Å; V296-L335 HydrophobicContact CG2-CD2 4.17Å; L335-L339 HydrophobicContact CD1-CD2 4.06Å; L335-A341 HydrophobicContact CD2-CB 4.18Å
336	K	98.4	Very high	97.6	Very high	46 Å²	46	25.3 Å²	25.3	20%	0.2	13%	0.134	C	C	.	.			trans	-68	171.6	166.8	-64.3	-173.9	-161.1	169	0	110.9	E248 K276 D338 L339 T340 V342	E248-K336 VanDerWaalsContact CG-NZ 3.29Å; E248-K336 WeakPolarHBondContact O-CE 3.29Å; E248-K336 PolarHBondContact O-NZ 2.84Å; E248-K336 IonicContact OE1-NZ 2.97Å; K276-K336 WeakPolarHBondContact CD-O 3.33Å; K336-D338 WeakPolarHBondContact CB-OD1 3.5Å; K336-D338 PolarHBondContact O-N 2.99Å; K336-D338 VanDerWaalsContact O-N 3.16Å; K336-L339 PolarHBondContact O-N 3.38Å; K336-T340 HydrophobicContact CD-CG2 4.09Å; K336-T340 PolarHBondContact N-O 3.41Å; K336-V342 HydrophobicContact CD-CG1 4.34Å; K336-V342 HydrophobicContact CG-CG1 4.16Å
337	S	96.9	Very high	97.4	Very high	110 Å²	110	24.4 Å²	24.4	77%	0.769	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.8	-179.5	51.4	0	0	0	0	114	K276 L339	K276-S337 WeakPolarHBondContact CE-O 3.18Å; S337-L339 VanDerWaalsContact C-N 3.34Å
338	D	97.6	Very high	97.2	Very high	86 Å²	86	25 Å²	25	46%	0.46	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	11.4	177.9	68.5	-20.6	0	0	0	113.5	H295 K336 T340	H295-D338 PolarHBondContact NE2-O 3.43Å; K336-D338 WeakPolarHBondContact CB-OD1 3.5Å; K336-D338 PolarHBondContact O-N 2.99Å; K336-D338 VanDerWaalsContact O-N 3.16Å; D338-T340 PolarHBondContact O-N 3.28Å; D338-T340 WeakPolarHBondContact OD1-CB 2.95Å; D338-T340 PolarHBondContact OD1-N 2.84Å; D338-T340 PolarHBondContact OD1-OG1 3.49Å; D338-T340 VanDerWaalsContact OD1-OG1 3.13Å; D338-T340 PolarHBondContact OD2-OG1 3.27Å
339	L	98.4	Very high	97	Very high	13 Å²	13	25.5 Å²	25.5	7%	0.068	14%	0.141	C	C	.	.			trans	65.7	12.3	-174.5	-53.9	174	0	0	0	115.1	K276 Y282 E292 V296 L335 K336 S337 A341	K276-L339 HydrophobicContact CD-CD2 3.52Å; Y282-L339 HydrophobicContact CE1-CD2 3.85Å; Y282-L339 HydrophobicContact CE2-CD2 3.92Å; Y282-L339 VanDerWaalsContact CZ-CD2 3.48Å; Y282-L339 WeakPolarHBondContact OH-CD2 3.21Å; E292-L339 HydrophobicContact CB-CD1 3.93Å; E292-L339 HydrophobicContact CG-CD1 3.61Å; V296-L339 HydrophobicContact CG2-CB 4.04Å; V296-L339 WeakPolarHBondContact CG2-O 3.26Å; L335-L339 HydrophobicContact CD1-CD2 4.06Å; K336-L339 PolarHBondContact O-N 3.38Å; S337-L339 VanDerWaalsContact C-N 3.34Å; L339-A341 PolarHBondContact O-N 3.3Å
340	T	98.8	Very high	96.8	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.018	14%	0.14	C	C	.	.			trans	-62.8	122.1	168.2	-66.5	0	0	0	0	109.4	N249 H295 T299 K336 D338	N249-T340 WeakPolarHBondContact ND2-CG2 3.46Å; H295-T340 PolarHBondContact NE2-OG1 3.17Å; T299-T340 HydrophobicContact CG2-CG2 4.02Å; K336-T340 HydrophobicContact CD-CG2 4.09Å; K336-T340 PolarHBondContact N-O 3.41Å; D338-T340 PolarHBondContact O-N 3.28Å; D338-T340 WeakPolarHBondContact OD1-CB 2.95Å; D338-T340 PolarHBondContact OD1-N 2.84Å; D338-T340 PolarHBondContact OD1-OG1 3.49Å; D338-T340 VanDerWaalsContact OD1-OG1 3.13Å; D338-T340 PolarHBondContact OD2-OG1 3.27Å
341	A	98.8	Very high	96.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	141.2	-179.3	0	0	0	0	0	111.6	N249 V296 T299 M300 V333 L334 L335 L339	N249-A341 WeakPolarHBondContact CB-O 3.49Å; N249-A341 PolarHBondContact ND2-O 3.34Å; V296-A341 HydrophobicContact CG1-CB 4.31Å; T299-A341 WeakPolarHBondContact OG1-CB 3.5Å; T299-A341 PolarHBondContact OG1-N 3.12Å; M300-A341 HydrophobicContact CB-CB 3.83Å; V333-A341 HydrophobicContact CG1-CB 3.8Å; L334-A341 CarbonylContact O-C 3.53Å; L334-A341 WeakPolarHBondContact O-CA 3.32Å; L335-A341 HydrophobicContact CD2-CB 4.18Å; L339-A341 PolarHBondContact O-N 3.3Å
342	V	98.7	Very high	96.3	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.1	173.1	-54.5	0	0	0	0	110.8	E248 N249 L251 L334 K336	E248-V342 WeakPolarHBondContact O-CG1 3.37Å; N249-V342 WeakPolarHBondContact O-CA 3.33Å; L251-V342 HydrophobicContact CD1-CG2 4.4Å; L334-V342 HydrophobicContact CB-CG2 3.7Å; L334-V342 PolarHBondContact N-O 3.3Å; L334-V342 PolarHBondContact O-N 3.04Å; K336-V342 HydrophobicContact CD-CG1 4.34Å; K336-V342 HydrophobicContact CG-CG1 4.16Å
343	L	98.8	Very high	95.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	137.6	177.9	-52.9	-169.6	0	0	0	111.1	N249 L250 L251 M300 L304 L307 F328 V333 F346	N249-L343 PolarHBondContact O-N 3.42Å; L250-L343 HydrophobicContact CD2-CB 3.96Å; L250-L343 HydrophobicContact CD2-CD1 4.2Å; L250-L343 HydrophobicContact CD2-CG 4.25Å; L251-L343 WeakPolarHBondContact CB-O 3.41Å; L251-L343 PolarHBondContact N-O 3.3Å; M300-L343 HydrophobicContact CG-CD2 4.23Å; L304-L343 HydrophobicContact CB-CD1 3.97Å; L304-L343 HydrophobicContact CD1-CD1 4Å; L307-L343 HydrophobicContact CD2-CD1 4.46Å; F328-L343 HydrophobicContact CE2-CD1 3.97Å; F328-L343 HydrophobicContact CE2-CD2 3.59Å; F328-L343 HydrophobicContact CE2-CG 4.44Å; F328-L343 HydrophobicContact CZ-CD2 4.22Å; V333-L343 HydrophobicContact CG2-CD2 3.96Å; L343-F346 HydrophobicContact CB-CZ 4.35Å; L343-F346 WeakPolarHBondContact O-CZ 3.38Å
344	A	96.9	Very high	94.7	Very high	7 Å²	7	32.7 Å²	32.7	6%	0.058	18%	0.181	C	C	.	.			trans	-137.2	167.4	-174.8	0	0	0	0	0	111.9	L251 H325 N332 L334	L251-A344 HydrophobicContact CB-CB 4.12Å; L251-A344 HydrophobicContact CD2-CB 3.63Å; L251-A344 HydrophobicContact CG-CB 4.47Å; H325-A344 PolarHBondContact NE2-O 3.46Å; N332-A344 WeakPolarHBondContact CB-O 3.4Å; N332-A344 PolarHBondContact O-N 2.99Å; L334-A344 HydrophobicContact CD1-CB 3.91Å; L334-A344 HydrophobicContact CG-CB 3.89Å
345	D	93.6	Very high	93.5	Very high	38 Å²	38	35.3 Å²	35.3	20%	0.203	22%	0.216	C	C	.	.			trans	63	74.4	179	-159.1	0.6	0	0	0	114.2	K223 H325 G347	K223-D345 IonicContact NZ-OD1 3.99Å; K223-D345 PolarHBondContact NZ-OD1 3Å; K223-D345 IonicContact NZ-OD2 2.99Å; H325-D345 PolarHBondContact CE1-O 3.05Å; H325-D345 PolarHBondContact NE2-O 2.83Å; D345-G347 PolarHBondContact O-N 2.93Å
346	F	94.8	Very high	92.6	Very high	1 Å²	1	41.7 Å²	41.7	0%	0.004	24%	0.244	C	C	.	.			trans	-87.3	18.4	178.1	-55.1	-77	0	0	0	113.1	E236 I239 F240 M245 L250 L307 L343 L348 A349	E236-F346 HydrophobicContact CG-CB 4.34Å; I239-F346 HydrophobicContact CB-CB 4.08Å; I239-F346 HydrophobicContact CG2-CB 3.65Å; I239-F346 HydrophobicContact CG2-CD1 4.27Å; I239-F346 HydrophobicContact CG2-CG 3.97Å; F240-F346 HydrophobicContact CD1-CD2 4.07Å; F240-F346 HydrophobicContact CD1-CE2 4.19Å; F240-F346 HydrophobicContact CD2-CD2 4.48Å; F240-F346 AromaticContact CE1-CD2 3.48Å; F240-F346 HydrophobicContact CE1-CD2 3.48Å; F240-F346 VanDerWaalsContact CE1-CD2 3.48Å; F240-F346 AromaticContact CE1-CE2 3.41Å; F240-F346 HydrophobicContact CE1-CE2 3.41Å; F240-F346 VanDerWaalsContact CE1-CE2 3.41Å; F240-F346 AromaticContact CE2-CD2 3.92Å; F240-F346 HydrophobicContact CE2-CD2 3.92Å; F240-F346 AromaticContact CZ-CD2 3.4Å; F240-F346 HydrophobicContact CZ-CD2 3.4Å; F240-F346 VanDerWaalsContact CZ-CD2 3.4Å; F240-F346 AromaticContact CZ-CE2 3.67Å; F240-F346 HydrophobicContact CZ-CE2 3.67Å; M245-F346 HydrophobicContact CE-CE1 4.43Å; M245-F346 HydrophobicContact CE-CZ 4.43Å; L250-F346 HydrophobicContact CD2-CE1 4.48Å; L250-F346 HydrophobicContact CD2-CZ 4.15Å; L307-F346 HydrophobicContact CD1-CD1 4.47Å; L307-F346 HydrophobicContact CD1-CE1 3.99Å; L307-F346 HydrophobicContact CD2-CD1 4.49Å; L307-F346 HydrophobicContact CD2-CE1 4.02Å; L343-F346 HydrophobicContact CB-CZ 4.35Å; L343-F346 WeakPolarHBondContact O-CZ 3.38Å; F346-L348 PolarHBondContact O-N 2.97Å; F346-L348 VanDerWaalsContact O-N 3.13Å; F346-A349 HydrophobicContact CB-CB 3.99Å; F346-A349 HydrophobicContact CD1-CB 4.39Å; F346-A349 WeakPolarHBondContact O-CB 3.34Å; F346-A349 PolarHBondContact O-N 3.3Å; F346-A349 VanDerWaalsContact O-N 3.08Å
347	G	91.1	Very high	91.4	Very high	8 Å²	8	44.8 Å²	44.8	8%	0.082	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-17.6	-174.6	0	0	0	0	0	115	D345	D345-G347 PolarHBondContact O-N 2.93Å
348	L	91.7	Very high	90	Very high	29 Å²	29	40.9 Å²	40.9	15%	0.152	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	1.4	174.9	-63.7	-177.1	0	0	0	113.5	F207 R326 D327 F346 V365	F207-L348 HydrophobicContact CE2-CD2 4.35Å; F207-L348 HydrophobicContact CZ-CD2 4.09Å; R326-L348 HydrophobicContact CB-CB 4.45Å; R326-L348 WeakPolarHBondContact CD-O 3.47Å; D327-L348 HydrophobicContact CB-CD1 4.09Å; F346-L348 PolarHBondContact O-N 2.97Å; F346-L348 VanDerWaalsContact O-N 3.13Å; L348-V365 HydrophobicContact CD1-CB 4.23Å; L348-V365 HydrophobicContact CD1-CG2 4.25Å
349	A	94.6	Very high	88.5	Confident	14 Å²	14	39.2 Å²	39.2	12%	0.116	24%	0.243	C	C	.	.			trans	-68	149.9	-173.6	0	0	0	0	0	111.9	I239 I323 A324 F346	I239-A349 HydrophobicContact CD1-CB 4.18Å; I239-A349 HydrophobicContact CG1-CB 4.11Å; I239-A349 HydrophobicContact CG2-CB 4.28Å; I323-A349 HydrophobicContact CG2-CB 3.92Å; A324-A349 CarbonylContact O-C 3.58Å; A324-A349 WeakPolarHBondContact O-CA 3.26Å; A324-A349 WeakPolarHBondContact O-CB 3.37Å; F346-A349 HydrophobicContact CB-CB 3.99Å; F346-A349 HydrophobicContact CD1-CB 4.39Å; F346-A349 WeakPolarHBondContact O-CB 3.34Å; F346-A349 PolarHBondContact O-N 3.3Å; F346-A349 VanDerWaalsContact O-N 3.08Å
350	V	93.6	Very high	86.8	Confident	14 Å²	14	46.7 Å²	46.7	9%	0.085	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.1	-178.1	172.8	0	0	0	0	109.4	I323 A324 F352 P358 T361	I323-V350 CarbonylContact C-O 3.59Å; I323-V350 VanDerWaalsContact CA-O 3.29Å; I323-V350 WeakPolarHBondContact CA-O 3.49Å; A324-V350 PolarHBondContact N-O 3.03Å; A324-V350 PolarHBondContact O-N 3.12Å; V350-F352 HydrophobicContact CB-CZ 4.41Å; V350-F352 HydrophobicContact CG1-CE1 4.17Å; V350-F352 HydrophobicContact CG1-CE2 4.35Å; V350-F352 HydrophobicContact CG1-CZ 3.96Å; V350-P358 HydrophobicContact CG1-CB 3.95Å; V350-T361 HydrophobicContact CG1-CG2 4.22Å; V350-T361 HydrophobicContact CG2-CG2 3.55Å
351	R	92.9	Very high	85.3	Confident	115 Å²	115	47.7 Å²	47.7	43%	0.434	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	140.7	171.5	61.7	177.7	173.6	172.4	-13.8	110.8	P321 I323 E353	P321-R351 HydrophobicContact CG-CB 4.05Å; I323-R351 HydrophobicContact CG1-CB 4.22Å; R351-E353 WeakPolarHBondContact CD-OE1 3.34Å; R351-E353 IonicContact CZ-OE1 3.61Å; R351-E353 VanDerWaalsContact CZ-OE1 3.26Å; R351-E353 IonicContact NE-OE1 2.85Å; R351-E353 PolarHBondContact NE-OE1 3.1Å; R351-E353 IonicContact NH1-OE1 3.74Å; R351-E353 PolarHBondContact NH1-OE1 3Å
352	F	92.1	Very high	83.9	Confident	21 Å²	21	54.8 Å²	54.8	9%	0.092	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	103.2	174.8	-62	-81.5	0	0	0	109.7	P321 S322 A324 V350 P358 R384 F387	P321-F352 VanDerWaalsContact CB-O 3.24Å; P321-F352 WeakPolarHBondContact CB-O 3.34Å; S322-F352 WeakPolarHBondContact O-CD2 3.18Å; S322-F352 PolarHBondContact O-N 3.38Å; A324-F352 HydrophobicContact CB-CE2 3.68Å; A324-F352 HydrophobicContact CB-CZ 4.24Å; V350-F352 HydrophobicContact CB-CZ 4.41Å; V350-F352 HydrophobicContact CG1-CE1 4.17Å; V350-F352 HydrophobicContact CG1-CE2 4.35Å; V350-F352 HydrophobicContact CG1-CZ 3.96Å; F352-P358 HydrophobicContact CD1-CB 4.33Å; F352-P358 HydrophobicContact CE1-CB 3.9Å; F352-P358 HydrophobicContact CE1-CG 4.39Å; F352-R384 HydrophobicContact CB-CB 4.1Å; F352-R384 HydrophobicContact CB-CG 3.92Å; F352-R384 HydrophobicContact CD1-CB 3.76Å; F352-R384 HydrophobicContact CD1-CG 4.22Å; F352-R384 HydrophobicContact CD2-CB 4.19Å; F352-R384 HydrophobicContact CD2-CG 3.73Å; F352-R384 HydrophobicContact CE1-CB 4.26Å; F352-R384 HydrophobicContact CE2-CG 4.33Å; F352-R384 HydrophobicContact CG-CB 3.72Å; F352-R384 HydrophobicContact CG-CG 3.67Å; F352-F387 AromaticContact CE1-CD2 3.81Å; F352-F387 HydrophobicContact CE1-CD2 3.81Å; F352-F387 HydrophobicContact CE1-CE2 4.33Å; F352-F387 HydrophobicContact CE1-CG 4.4Å; F352-F387 HydrophobicContact CE2-CB 4.11Å; F352-F387 HydrophobicContact CZ-CB 3.58Å; F352-F387 AromaticContact CZ-CD2 3.52Å; F352-F387 HydrophobicContact CZ-CD2 3.52Å; F352-F387 HydrophobicContact CZ-CE2 4.32Å; F352-F387 AromaticContact CZ-CG 3.66Å; F352-F387 HydrophobicContact CZ-CG 3.66Å
353	E	85.7	Confident	82.8	Confident	48 Å²	48	55.5 Å²	55.5	22%	0.224	33%	0.33	C	S	.	.			trans	-94.6	138.1	176.7	-68.3	-176.7	-175.4	0	0	110.5	P321 R351 G355 K356	P321-E353 HydrophobicContact CB-CG 4.49Å; R351-E353 WeakPolarHBondContact CD-OE1 3.34Å; R351-E353 IonicContact CZ-OE1 3.61Å; R351-E353 VanDerWaalsContact CZ-OE1 3.26Å; R351-E353 IonicContact NE-OE1 2.85Å; R351-E353 PolarHBondContact NE-OE1 3.1Å; R351-E353 IonicContact NH1-OE1 3.74Å; R351-E353 PolarHBondContact NH1-OE1 3Å; E353-G355 PolarHBondContact O-N 3.06Å; E353-K356 HydrophobicContact CB-CB 4.27Å; E353-K356 HydrophobicContact CB-CD 4.17Å; E353-K356 HydrophobicContact CB-CG 4.4Å; E353-K356 PolarHBondContact O-N 2.95Å; E353-K356 VanDerWaalsContact O-N 3.13Å; E353-K356 VanDerWaalsContact OE2-CD 3.27Å; E353-K356 WeakPolarHBondContact OE2-CD 3.33Å; E353-K356 VanDerWaalsContact OE2-CE 3.28Å; E353-K356 WeakPolarHBondContact OE2-CE 3.46Å; E353-K356 IonicContact OE2-NZ 2.67Å; E353-K356 PolarHBondContact OE2-NZ 3.24Å
354	P	78.9	Confident	82	Confident	99 Å²	99	60 Å²	60	64%	0.643	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	126.7	176	-26.6	34.3	0	0	0	111.9	K356	P354-K356 VanDerWaalsContact C-N 3.28Å; P354-K356 PolarHBondContact O-N 3.25Å
355	G	73.4	Confident	81.5	Confident	89 Å²	89	61 Å²	61	92%	0.918	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	6.5	176.5	0	0	0	0	0	115.7	E353	E353-G355 PolarHBondContact O-N 3.06Å
356	K	79.1	Confident	81.4	Confident	134 Å²	134	60.2 Å²	60.2	58%	0.583	36%	0.357	S	S	*	.			trans	-113.9	133	172.7	-63	-172.9	-170.1	167.6	0	110.6	E353 P354	E353-K356 HydrophobicContact CB-CB 4.27Å; E353-K356 HydrophobicContact CB-CD 4.17Å; E353-K356 HydrophobicContact CB-CG 4.4Å; E353-K356 PolarHBondContact O-N 2.95Å; E353-K356 VanDerWaalsContact O-N 3.13Å; E353-K356 VanDerWaalsContact OE2-CD 3.27Å; E353-K356 WeakPolarHBondContact OE2-CD 3.33Å; E353-K356 VanDerWaalsContact OE2-CE 3.28Å; E353-K356 WeakPolarHBondContact OE2-CE 3.46Å; E353-K356 IonicContact OE2-NZ 2.67Å; E353-K356 PolarHBondContact OE2-NZ 3.24Å; P354-K356 VanDerWaalsContact C-N 3.28Å; P354-K356 PolarHBondContact O-N 3.25Å
357	P	73.3	Confident	81.4	Confident	110 Å²	110	62.3 Å²	62.3	71%	0.714	37%	0.37	S	S	*	.			trans	-63.8	154.2	169.4	29.3	-33.6	0	0	0	109.5	G359	P357-G359 PolarHBondContact O-N 3.24Å
358	P	68.3	Low	81.5	Confident	28 Å²	28	68.7 Å²	68.7	18%	0.182	39%	0.392	C	S	.	.			trans	-63.7	9.7	-178.5	21.3	-29.7	0	0	0	116	V350 F352 T361 F382	V350-P358 HydrophobicContact CG1-CB 3.95Å; F352-P358 HydrophobicContact CD1-CB 4.33Å; F352-P358 HydrophobicContact CE1-CB 3.9Å; F352-P358 HydrophobicContact CE1-CG 4.39Å; P358-T361 HydrophobicContact CB-CG2 4.5Å; P358-T361 WeakPolarHBondContact O-CG2 3.3Å; P358-F382 HydrophobicContact CG-CB 4.23Å
359	G	65.3	Low	81.8	Confident	51 Å²	51	68 Å²	68	53%	0.526	39%	0.387	S	S	.	.			trans	78.5	-170	-177.3	0	0	0	0	0	112.8	P357 T361	P357-G359 PolarHBondContact O-N 3.24Å; G359-T361 PolarHBondContact O-N 2.76Å
360	D	62.4	Low	82	Confident	171 Å²	171	67.9 Å²	67.9	91%	0.914	38%	0.384	S	S	*	.	S	Bend	trans	-72.1	61.5	175.3	-67.5	-25.3	0	0	0	111.1
361	T	66.5	Low	82.2	Confident	23 Å²	23	68 Å²	68	14%	0.141	38%	0.384	C	S	.	.			trans	-86	115	177.9	49.5	0	0	0	0	109.7	V350 P358 G359 G363 F382	V350-T361 HydrophobicContact CG1-CG2 4.22Å; V350-T361 HydrophobicContact CG2-CG2 3.55Å; P358-T361 HydrophobicContact CB-CG2 4.5Å; P358-T361 WeakPolarHBondContact O-CG2 3.3Å; G359-T361 PolarHBondContact O-N 2.76Å; T361-G363 PolarHBondContact O-N 3.33Å; T361-F382 WeakPolarHBondContact O-CE1 3.27Å
362	H	71.3	Confident	82.4	Confident	150 Å²	150	62.5 Å²	62.5	69%	0.694	36%	0.363	S	S	*	.			trans	-69.5	128.5	168.1	-67.2	-73.7	0	0	0	110.2	R326 Q364 V365	R326-H362 PolarHBondContact NH2-O 3.33Å; H362-Q364 PolarHBondContact O-N 2.83Å; H362-V365 HydrophobicContact CB-CG1 4.06Å; H362-V365 WeakPolarHBondContact O-CG1 3.46Å
363	G	73.9	Confident	82.7	Confident	16 Å²	16	61.6 Å²	61.6	17%	0.165	36%	0.359	C	S	.	.	S	Bend	trans	-64.2	-39.5	-177.4	0	0	0	0	0	114.4	T361 V365 I380	T361-G363 PolarHBondContact O-N 3.33Å; G363-V365 PolarHBondContact O-N 3.25Å; G363-V365 VanDerWaalsContact O-N 3.12Å; G363-I380 WeakPolarHBondContact O-CD1 3.46Å
364	Q	82.8	Confident	83.2	Confident	93 Å²	93	60.6 Å²	60.6	44%	0.435	35%	0.354	S	S	.	.	S	Bend	trans	-88.1	67.4	-177.3	-74.6	-178.2	-28.4	0	0	113	H362 V375 L376	H362-Q364 PolarHBondContact O-N 2.83Å; Q364-V375 HydrophobicContact CG-CG1 4.42Å; Q364-V375 WeakPolarHBondContact CG-O 3.22Å; Q364-V375 PolarHBondContact NE2-O 3Å; Q364-L376 PolarHBondContact NE2-O 3.42Å
365	V	87.4	Confident	83.9	Confident	30 Å²	30	56 Å²	56	18%	0.182	33%	0.325	C	S	.	.			trans	-123.6	164.3	171.5	-54	0	0	0	0	110.7	L348 H362 G363	L348-V365 HydrophobicContact CD1-CB 4.23Å; L348-V365 HydrophobicContact CD1-CG2 4.25Å; H362-V365 HydrophobicContact CB-CG1 4.06Å; H362-V365 WeakPolarHBondContact O-CG1 3.46Å; G363-V365 PolarHBondContact O-N 3.25Å; G363-V365 VanDerWaalsContact O-N 3.12Å
366	G	90.7	Very high	85	Confident	21 Å²	21	51.8 Å²	51.8	22%	0.216	28%	0.281	C	S	.	.	S	Bend	trans	103.4	-173.4	-176.2	0	0	0	0	0	111.8	D327 M371	D327-G366 WeakPolarHBondContact OD1-CA 3.47Å; G366-M371 WeakPolarHBondContact O-CE 3.43Å
367	T	93.8	Very high	85.6	Confident	45 Å²	45	50.4 Å²	50.4	28%	0.276	28%	0.277	S	S	.	.			trans	-83.9	116.3	-178.6	-56.1	0	0	0	0	110.1	D327 K329 R369 Y370 M371	D327-T367 WeakPolarHBondContact OD1-CB 3.28Å; D327-T367 PolarHBondContact OD1-N 2.85Å; D327-T367 PolarHBondContact OD1-OG1 2.95Å; K329-T367 HydrophobicContact CD-CG2 4.36Å; K329-T367 WeakPolarHBondContact CD-OG1 3.29Å; K329-T367 PolarHBondContact NZ-OG1 2.91Å; T367-R369 VanDerWaalsContact C-N 3.28Å; T367-R369 PolarHBondContact O-N 3.44Å; T367-Y370 HydrophobicContact CG2-CD2 3.93Å; T367-Y370 HydrophobicContact CG2-CE2 4.43Å; T367-Y370 PolarHBondContact O-N 3.29Å; T367-M371 PolarHBondContact O-N 3.4Å
368	R	94.9	Very high	86.4	Confident	142 Å²	142	47.4 Å²	47.4	54%	0.536	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-45.1	-47.3	-171.3	-61.8	-174.5	-172.6	134.5	-0.7	114.5	Y370 M371 L433	R368-Y370 PolarHBondContact O-N 3.12Å; R368-Y370 VanDerWaalsContact O-N 3.13Å; R368-M371 HydrophobicContact CB-SD 4.46Å; R368-M371 HydrophobicContact CG-CE 4.29Å; R368-M371 HydrophobicContact CG-SD 4.45Å; R368-M371 VanDerWaalsContact O-CB 3.27Å; R368-M371 WeakPolarHBondContact O-CB 3.21Å; R368-M371 WeakPolarHBondContact O-CG 3.01Å; R368-M371 PolarHBondContact O-N 3.42Å; R368-L433 VanDerWaalsContact C-CD1 3.45Å; R368-L433 HydrophobicContact CB-CD1 3.5Å; R368-L433 VanDerWaalsContact CB-CD1 3.5Å; R368-L433 WeakPolarHBondContact O-CD1 3.33Å
369	R	96.9	Very high	87.2	Confident	13 Å²	13	49.5 Å²	49.5	5%	0.049	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-56.7	-27.5	179.9	-179.1	-175.3	-65	-66.2	1.3	114.7	T367 P419 F420 G425 Q426	T367-R369 VanDerWaalsContact C-N 3.28Å; T367-R369 PolarHBondContact O-N 3.44Å; R369-P419 WeakPolarHBondContact CD-O 3.36Å; R369-P419 HydrophobicContact CG-CB 4.45Å; R369-P419 WeakPolarHBondContact CG-O 3.47Å; R369-P419 PolarHBondContact NH1-O 3.02Å; R369-F420 HydrophobicContact CG-CD2 4.11Å; R369-F420 VanDerWaalsContact NH1-C 3.28Å; R369-F420 PolarHBondContact NH1-O 3.45Å; R369-G425 PolarHBondContact NH1-O 3.1Å; R369-G425 PolarHBondContact NH2-O 3.5Å; R369-Q426 PolarHBondContact NH2-O 3Å
370	Y	98.3	Very high	88.1	Confident	13 Å²	13	47.8 Å²	47.8	5%	0.051	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-100.8	2.7	-179.1	-65.7	-95.1	0	0	0	112.5	K329 S330 T367 R368 A394 L397 V398 E401 P419	K329-Y370 HydrophobicContact CB-CD1 3.93Å; K329-Y370 HydrophobicContact CB-CD2 3.83Å; K329-Y370 HydrophobicContact CB-CE1 3.83Å; K329-Y370 HydrophobicContact CB-CE2 3.73Å; K329-Y370 HydrophobicContact CB-CG 3.93Å; S330-Y370 PolarHBondContact OG-OH 2.89Å; T367-Y370 HydrophobicContact CG2-CD2 3.93Å; T367-Y370 HydrophobicContact CG2-CE2 4.43Å; T367-Y370 PolarHBondContact O-N 3.29Å; R368-Y370 PolarHBondContact O-N 3.12Å; R368-Y370 VanDerWaalsContact O-N 3.13Å; Y370-A394 HydrophobicContact CD1-CB 4.48Å; Y370-L397 HydrophobicContact CD1-CB 4.02Å; Y370-L397 HydrophobicContact CD1-CD1 3.92Å; Y370-L397 HydrophobicContact CE1-CB 4.13Å; Y370-L397 HydrophobicContact CG-CD1 4.38Å; Y370-V398 HydrophobicContact CE1-CG2 4Å; Y370-E401 VanDerWaalsContact CE1-OE1 3.3Å; Y370-E401 WeakPolarHBondContact CE1-OE1 3.28Å; Y370-E401 PolarHBondContact OH-OE1 2.8Å; Y370-P419 HydrophobicContact CE1-CG 3.94Å
371	M	97.7	Very high	89	Confident	16 Å²	16	43.8 Å²	43.8	8%	0.079	24%	0.242	C	C	.	.			trans	-70.8	132.5	179.4	-70.6	-178.7	176.2	0	0	110.7	G366 T367 R368 V375 L376 Y393	G366-M371 WeakPolarHBondContact O-CE 3.43Å; T367-M371 PolarHBondContact O-N 3.4Å; R368-M371 HydrophobicContact CB-SD 4.46Å; R368-M371 HydrophobicContact CG-CE 4.29Å; R368-M371 HydrophobicContact CG-SD 4.45Å; R368-M371 VanDerWaalsContact O-CB 3.27Å; R368-M371 WeakPolarHBondContact O-CB 3.21Å; R368-M371 WeakPolarHBondContact O-CG 3.01Å; R368-M371 PolarHBondContact O-N 3.42Å; M371-V375 HydrophobicContact CB-CB 4.09Å; M371-V375 HydrophobicContact CB-CG1 3.94Å; M371-V375 HydrophobicContact CG-CG1 3.81Å; M371-V375 HydrophobicContact SD-CG1 3.81Å; M371-L376 HydrophobicContact CB-CD2 3.77Å; M371-L376 HydrophobicContact CB-CG 3.9Å; M371-L376 HydrophobicContact SD-CD2 4.13Å; M371-Y393 VanDerWaalsContact O-CE1 3.26Å; M371-Y393 WeakPolarHBondContact O-CE1 3.17Å
372	A	97.9	Very high	89.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.256	C	S	.	.			trans	-65.9	157.7	173.5	0	0	0	0	0	111.6	E374 V375 L376 I390 Y393	A372-E374 VanDerWaalsContact C-N 3.31Å; A372-E374 WeakPolarHBondContact CB-OE1 3.03Å; A372-E374 WeakPolarHBondContact CB-OE2 3.14Å; A372-E374 PolarHBondContact O-N 3.32Å; A372-V375 HydrophobicContact CB-CG2 4.14Å; A372-V375 WeakPolarHBondContact O-CA 3.44Å; A372-V375 WeakPolarHBondContact O-CB 2.99Å; A372-V375 PolarHBondContact O-N 2.93Å; A372-L376 PolarHBondContact O-N 3.47Å; A372-I390 HydrophobicContact CB-CG1 4.32Å; A372-I390 HydrophobicContact CB-CG2 4.49Å; A372-Y393 VanDerWaalsContact CA-CD1 3.45Å; A372-Y393 HydrophobicContact CB-CD1 3.83Å; A372-Y393 HydrophobicContact CB-CD2 4.25Å; A372-Y393 HydrophobicContact CB-CG 3.67Å
373	P	97.9	Very high	90.6	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	25%	0.249	C	C	.	.	H	α-helix	trans	-50.1	-47.3	-179	-25.8	31.7	0	0	0	113.8	V375 L376 E377 Y393 V437 V438	P373-V375 PolarHBondContact O-N 3.41Å; P373-L376 WeakPolarHBondContact O-CB 3.35Å; P373-L376 PolarHBondContact O-N 3.47Å; P373-L376 VanDerWaalsContact O-N 3.1Å; P373-E377 PolarHBondContact O-N 3.36Å; P373-Y393 HydrophobicContact CG-CE2 4.34Å; P373-V437 HydrophobicContact CG-CG1 3.97Å; P373-V438 HydrophobicContact CB-CG2 4.18Å
374	E	95.6	Very high	91.5	Very high	28 Å²	28	50 Å²	50	13%	0.131	26%	0.26	C	S	.	.	H	α-helix	trans	-64.7	-26.5	-180	66.3	-83.7	-162.3	0	0	113.1	A372 G378 A379 I380 R474	A372-E374 VanDerWaalsContact C-N 3.31Å; A372-E374 WeakPolarHBondContact CB-OE1 3.03Å; A372-E374 WeakPolarHBondContact CB-OE2 3.14Å; A372-E374 PolarHBondContact O-N 3.32Å; E374-G378 PolarHBondContact O-N 3.49Å; E374-A379 PolarHBondContact O-N 3.44Å; E374-I380 HydrophobicContact CG-CG1 4.47Å; E374-R474 IonicContact OE1-CZ 3.25Å; E374-R474 IonicContact OE1-NH1 3.96Å; E374-R474 PolarHBondContact OE1-NH1 3.01Å; E374-R474 IonicContact OE1-NH2 3.86Å; E374-R474 PolarHBondContact OE1-NH2 2.86Å; E374-R474 IonicContact OE2-CZ 3.46Å; E374-R474 IonicContact OE2-NH1 2.87Å; E374-R474 IonicContact OE2-NH2 3.22Å; E374-R474 PolarHBondContact OE2-NH2 3.33Å
375	V	95.3	Very high	92	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.018	26%	0.257	C	S	.	.	H	α-helix	trans	-74.9	-45.2	173.7	-179	0	0	0	0	109.8	Q364 M371 A372 P373 E377 G378 I380 I390	Q364-V375 HydrophobicContact CG-CG1 4.42Å; Q364-V375 WeakPolarHBondContact CG-O 3.22Å; Q364-V375 PolarHBondContact NE2-O 3Å; M371-V375 HydrophobicContact CB-CB 4.09Å; M371-V375 HydrophobicContact CB-CG1 3.94Å; M371-V375 HydrophobicContact CG-CG1 3.81Å; M371-V375 HydrophobicContact SD-CG1 3.81Å; A372-V375 HydrophobicContact CB-CG2 4.14Å; A372-V375 WeakPolarHBondContact O-CA 3.44Å; A372-V375 WeakPolarHBondContact O-CB 2.99Å; A372-V375 PolarHBondContact O-N 2.93Å; P373-V375 PolarHBondContact O-N 3.41Å; V375-E377 VanDerWaalsContact C-N 3.27Å; V375-E377 PolarHBondContact O-N 3.48Å; V375-G378 PolarHBondContact O-N 2.9Å; V375-I380 HydrophobicContact CB-CD1 4.04Å; V375-I380 HydrophobicContact CB-CG1 4.39Å; V375-I380 HydrophobicContact CG1-CD1 4.05Å; V375-I380 HydrophobicContact CG2-CD1 3.81Å; V375-I380 HydrophobicContact CG2-CG1 4.01Å; V375-I390 HydrophobicContact CG2-CB 4.41Å; V375-I390 HydrophobicContact CG2-CD1 3.46Å; V375-I390 VanDerWaalsContact CG2-CD1 3.46Å; V375-I390 HydrophobicContact CG2-CG1 3.64Å; V375-I390 HydrophobicContact CG2-CG2 3.86Å
376	L	95.6	Very high	92.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-37.9	177.5	-67	171.2	0	0	0	111.5	Q364 M371 A372 P373 G378 L430 L433 Q434 V437 V438	Q364-L376 PolarHBondContact NE2-O 3.42Å; M371-L376 HydrophobicContact CB-CD2 3.77Å; M371-L376 HydrophobicContact CB-CG 3.9Å; M371-L376 HydrophobicContact SD-CD2 4.13Å; A372-L376 PolarHBondContact O-N 3.47Å; P373-L376 WeakPolarHBondContact O-CB 3.35Å; P373-L376 PolarHBondContact O-N 3.47Å; P373-L376 VanDerWaalsContact O-N 3.1Å; L376-G378 VanDerWaalsContact C-N 3.26Å; L376-G378 PolarHBondContact O-N 2.71Å; L376-L430 HydrophobicContact CD2-CD1 3.57Å; L376-L433 HydrophobicContact CD1-CB 4.18Å; L376-L433 HydrophobicContact CD2-CB 3.92Å; L376-Q434 HydrophobicContact CB-CG 4.03Å; L376-Q434 PolarHBondContact O-NE2 3.34Å; L376-V437 HydrophobicContact CD1-CB 3.71Å; L376-V437 HydrophobicContact CD1-CG1 3.81Å; L376-V437 HydrophobicContact CD1-CG2 4.16Å; L376-V438 HydrophobicContact CB-CG2 3.92Å; L376-V438 HydrophobicContact CD1-CG2 4.17Å
377	E	92	Very high	92.4	Very high	105 Å²	105	47.2 Å²	47.2	49%	0.491	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-12.2	175.2	-68.1	-178.9	113.4	0	0	113.8	P373 V375 A379 V438	P373-E377 PolarHBondContact O-N 3.36Å; V375-E377 VanDerWaalsContact C-N 3.27Å; V375-E377 PolarHBondContact O-N 3.48Å; E377-A379 HydrophobicContact CB-CB 4.26Å; E377-A379 PolarHBondContact O-N 2.81Å; E377-V438 HydrophobicContact CG-CB 4.4Å; E377-V438 HydrophobicContact CG-CG1 3.6Å; E377-V438 HydrophobicContact CG-CG2 3.98Å; E377-V438 VanDerWaalsContact OE1-CG1 3.3Å; E377-V438 WeakPolarHBondContact OE1-CG1 3.01Å
378	G	88.9	Confident	92.6	Very high	47 Å²	47	46.3 Å²	46.3	49%	0.485	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	15.9	-175	0	0	0	0	0	113.6	E374 V375 L376	E374-G378 PolarHBondContact O-N 3.49Å; V375-G378 PolarHBondContact O-N 2.9Å; L376-G378 VanDerWaalsContact C-N 3.26Å; L376-G378 PolarHBondContact O-N 2.71Å
379	A	85.3	Confident	92.8	Very high	71 Å²	71	42.7 Å²	42.7	59%	0.587	22%	0.224	S	C	*	.			trans	-103.9	47.6	-173.2	0	0	0	0	0	112.1	E374 E377	E374-A379 PolarHBondContact O-N 3.44Å; E377-A379 HydrophobicContact CB-CB 4.26Å; E377-A379 PolarHBondContact O-N 2.81Å
380	I	83.9	Confident	92.8	Very high	15 Å²	15	42.9 Å²	42.9	8%	0.077	23%	0.226	C	C	.	.			trans	-86.5	132.1	-176.6	-58.5	153.8	0	0	0	110.5	G363 E374 V375 I390	G363-I380 WeakPolarHBondContact O-CD1 3.46Å; E374-I380 HydrophobicContact CG-CG1 4.47Å; V375-I380 HydrophobicContact CB-CD1 4.04Å; V375-I380 HydrophobicContact CB-CG1 4.39Å; V375-I380 HydrophobicContact CG1-CD1 4.05Å; V375-I380 HydrophobicContact CG2-CD1 3.81Å; V375-I380 HydrophobicContact CG2-CG1 4.01Å; I380-I390 HydrophobicContact CD1-CD1 4.42Å; I380-I390 HydrophobicContact CG1-CD1 4.28Å; I380-I390 HydrophobicContact CG2-CD1 3.97Å
381	N	81.9	Confident	92.8	Very high	87 Å²	87	42.3 Å²	42.3	47%	0.465	22%	0.224	S	C	.	.			trans	-77.3	126.6	165.7	-174.9	2.1	0	0	0	109.9	Q383 A386	N381-Q383 VanDerWaalsContact ND2-CD 3.26Å; N381-Q383 PolarHBondContact ND2-OE1 2.89Å; N381-Q383 PolarHBondContact O-N 2.03Å; N381-Q383 WeakPolarHBondContact OD1-CG 3.32Å; N381-A386 HydrophobicContact CB-CB 4.25Å; N381-A386 WeakPolarHBondContact O-CB 3.11Å
382	F	85	Confident	92.9	Very high	98 Å²	98	41.7 Å²	41.7	43%	0.43	22%	0.221	S	C	.	.			trans	-80	49.1	-178.2	-66.9	-82.2	0	0	0	113.1	P358 T361 F387	P358-F382 HydrophobicContact CG-CB 4.23Å; T361-F382 WeakPolarHBondContact O-CE1 3.27Å; F382-F387 HydrophobicContact CD1-CE2 4.05Å; F382-F387 AromaticContact CD1-CZ 3.84Å; F382-F387 HydrophobicContact CD1-CZ 3.84Å; F382-F387 HydrophobicContact CE1-CZ 4.24Å
383	Q	87.8	Confident	92.9	Very high	118 Å²	118	41.7 Å²	41.7	55%	0.551	22%	0.221	S	C	*	.	S	Bend	trans	-113.2	150.1	176.8	-73.5	178.6	-10.5	0	0	110.4	N381 D385 A386 F387	N381-Q383 VanDerWaalsContact ND2-CD 3.26Å; N381-Q383 PolarHBondContact ND2-OE1 2.89Å; N381-Q383 PolarHBondContact O-N 2.03Å; N381-Q383 WeakPolarHBondContact OD1-CG 3.32Å; Q383-D385 VanDerWaalsContact C-N 3.33Å; Q383-D385 PolarHBondContact O-N 3.49Å; Q383-A386 WeakPolarHBondContact O-CB 3.06Å; Q383-A386 PolarHBondContact O-N 3.3Å; Q383-A386 VanDerWaalsContact O-N 3.13Å; Q383-F387 WeakPolarHBondContact O-CD2 3.3Å; Q383-F387 PolarHBondContact O-N 2.94Å
384	R	91.6	Very high	93	Very high	103 Å²	103	41.9 Å²	41.9	39%	0.389	22%	0.222	S	C	.	.	H	α-helix	trans	-44.3	-57.7	179.3	178.9	-170.6	68.1	-174.6	-2	112	F352 A386 F387 L388	F352-R384 HydrophobicContact CB-CB 4.1Å; F352-R384 HydrophobicContact CB-CG 3.92Å; F352-R384 HydrophobicContact CD1-CB 3.76Å; F352-R384 HydrophobicContact CD1-CG 4.22Å; F352-R384 HydrophobicContact CD2-CB 4.19Å; F352-R384 HydrophobicContact CD2-CG 3.73Å; F352-R384 HydrophobicContact CE1-CB 4.26Å; F352-R384 HydrophobicContact CE2-CG 4.33Å; F352-R384 HydrophobicContact CG-CB 3.72Å; F352-R384 HydrophobicContact CG-CG 3.67Å; R384-A386 PolarHBondContact O-N 2.89Å; R384-F387 PolarHBondContact O-N 2.99Å; R384-L388 HydrophobicContact CG-CD1 4.08Å; R384-L388 HydrophobicContact CG-CG 4.26Å; R384-L388 WeakPolarHBondContact O-CG 3.31Å; R384-L388 PolarHBondContact O-N 3.4Å; R384-L388 VanDerWaalsContact O-N 3.08Å
385	D	92.7	Very high	93.1	Very high	69 Å²	69	40.5 Å²	40.5	37%	0.369	22%	0.216	S	C	.	.	H	α-helix	trans	-64.9	-29.3	-170.8	-58	-15.9	0	0	0	112.3	Q383 L388 R389	Q383-D385 VanDerWaalsContact C-N 3.33Å; Q383-D385 PolarHBondContact O-N 3.49Å; D385-L388 PolarHBondContact O-N 3.27Å; D385-R389 WeakPolarHBondContact O-CB 3.39Å; D385-R389 VanDerWaalsContact O-CD 3.28Å; D385-R389 WeakPolarHBondContact O-CD 3.38Å; D385-R389 WeakPolarHBondContact O-CG 3.4Å; D385-R389 PolarHBondContact O-N 3.29Å
386	A	93.2	Very high	93.3	Very high	16 Å²	16	40.4 Å²	40.4	13%	0.132	22%	0.215	C	C	.	.	H	α-helix	trans	-64.4	-44.6	173.7	0	0	0	0	0	111.7	N381 Q383 R384 R389 I390	N381-A386 HydrophobicContact CB-CB 4.25Å; N381-A386 WeakPolarHBondContact O-CB 3.11Å; Q383-A386 WeakPolarHBondContact O-CB 3.06Å; Q383-A386 PolarHBondContact O-N 3.3Å; Q383-A386 VanDerWaalsContact O-N 3.13Å; R384-A386 PolarHBondContact O-N 2.89Å; A386-R389 PolarHBondContact O-N 3.14Å; A386-I390 WeakPolarHBondContact O-CG1 3.49Å; A386-I390 PolarHBondContact O-N 3.39Å
387	F	95	Very high	93.5	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.009	22%	0.215	C	C	.	.	H	α-helix	trans	-66.4	-37.2	175.6	-76.2	-86.4	0	0	0	112.9	A324 R326 F352 F382 Q383 R384 R389 I390 D391	A324-F387 HydrophobicContact CB-CB 3.58Å; A324-F387 HydrophobicContact CB-CG 4.49Å; R326-F387 HydrophobicContact CG-CD1 3.99Å; R326-F387 VanDerWaalsContact NE-CE1 3.28Å; F352-F387 AromaticContact CE1-CD2 3.81Å; F352-F387 HydrophobicContact CE1-CD2 3.81Å; F352-F387 HydrophobicContact CE1-CE2 4.33Å; F352-F387 HydrophobicContact CE1-CG 4.4Å; F352-F387 HydrophobicContact CE2-CB 4.11Å; F352-F387 HydrophobicContact CZ-CB 3.58Å; F352-F387 AromaticContact CZ-CD2 3.52Å; F352-F387 HydrophobicContact CZ-CD2 3.52Å; F352-F387 HydrophobicContact CZ-CE2 4.32Å; F352-F387 AromaticContact CZ-CG 3.66Å; F352-F387 HydrophobicContact CZ-CG 3.66Å; F382-F387 HydrophobicContact CD1-CE2 4.05Å; F382-F387 AromaticContact CD1-CZ 3.84Å; F382-F387 HydrophobicContact CD1-CZ 3.84Å; F382-F387 HydrophobicContact CE1-CZ 4.24Å; Q383-F387 WeakPolarHBondContact O-CD2 3.3Å; Q383-F387 PolarHBondContact O-N 2.94Å; R384-F387 PolarHBondContact O-N 2.99Å; F387-R389 VanDerWaalsContact C-N 3.34Å; F387-I390 WeakPolarHBondContact O-CB 3.44Å; F387-I390 PolarHBondContact O-N 3.47Å; F387-D391 PolarHBondContact O-N 2.92Å
388	L	97.4	Very high	93.8	Very high	25 Å²	25	35.4 Å²	35.4	13%	0.131	19%	0.191	C	C	.	.	H	α-helix	trans	-63.5	-42.4	175	-54.4	-173.6	0	0	0	110.7	H308 A324 R384 D385 I390 D391 M392	H308-L388 HydrophobicContact CB-CD1 4.28Å; H308-L388 HydrophobicContact CB-CD2 4.13Å; A324-L388 HydrophobicContact CB-CD2 4.11Å; R384-L388 HydrophobicContact CG-CD1 4.08Å; R384-L388 HydrophobicContact CG-CG 4.26Å; R384-L388 WeakPolarHBondContact O-CG 3.31Å; R384-L388 PolarHBondContact O-N 3.4Å; R384-L388 VanDerWaalsContact O-N 3.08Å; D385-L388 PolarHBondContact O-N 3.27Å; L388-I390 VanDerWaalsContact C-N 3.29Å; L388-I390 PolarHBondContact O-N 3.11Å; L388-D391 WeakPolarHBondContact O-CB 3.29Å; L388-D391 PolarHBondContact O-N 2.86Å; L388-M392 WeakPolarHBondContact O-CG 3.1Å; L388-M392 PolarHBondContact O-N 2.94Å; L388-M392 VanDerWaalsContact O-N 3.11Å
389	R	98.3	Very high	94.3	Very high	67 Å²	67	33.1 Å²	33.1	25%	0.253	17%	0.168	S	C	.	.	H	α-helix	trans	-64.5	-29.4	176.4	-71	160.1	173.5	-178	-0.7	113.2	D385 A386 F387 M392 Y393 A471 E472 R474	D385-R389 WeakPolarHBondContact O-CB 3.39Å; D385-R389 VanDerWaalsContact O-CD 3.28Å; D385-R389 WeakPolarHBondContact O-CD 3.38Å; D385-R389 WeakPolarHBondContact O-CG 3.4Å; D385-R389 PolarHBondContact O-N 3.29Å; A386-R389 PolarHBondContact O-N 3.14Å; F387-R389 VanDerWaalsContact C-N 3.34Å; R389-M392 PolarHBondContact O-N 2.9Å; R389-Y393 PolarHBondContact O-N 3.38Å; R389-Y393 VanDerWaalsContact O-N 3.12Å; R389-A471 HydrophobicContact CB-CB 4.27Å; R389-A471 WeakPolarHBondContact CD-O 3.39Å; R389-A471 VanDerWaalsContact CG-O 3.29Å; R389-A471 WeakPolarHBondContact CG-O 3.15Å; R389-A471 PolarHBondContact NE-O 3.44Å; R389-E472 IonicContact CZ-OE1 3.89Å; R389-E472 IonicContact NH1-OE1 2.69Å; R389-E472 PolarHBondContact NH1-OE1 3.45Å; R389-E472 IonicContact NH2-OE1 2.76Å; R389-E472 PolarHBondContact NH2-OE1 3.36Å; R389-R474 WeakPolarHBondContact O-CD 3.41Å; R389-R474 PolarHBondContact O-NH1 3.45Å
390	I	97.9	Very high	94.9	Very high	17 Å²	17	30.5 Å²	30.5	9%	0.087	14%	0.143	C	C	.	.	H	α-helix	trans	-65.5	-44.8	172.4	-69.5	163.8	0	0	0	110.6	A372 V375 I380 A386 F387 L388 M392 Y393 A394	A372-I390 HydrophobicContact CB-CG1 4.32Å; A372-I390 HydrophobicContact CB-CG2 4.49Å; V375-I390 HydrophobicContact CG2-CB 4.41Å; V375-I390 HydrophobicContact CG2-CD1 3.46Å; V375-I390 VanDerWaalsContact CG2-CD1 3.46Å; V375-I390 HydrophobicContact CG2-CG1 3.64Å; V375-I390 HydrophobicContact CG2-CG2 3.86Å; I380-I390 HydrophobicContact CD1-CD1 4.42Å; I380-I390 HydrophobicContact CG1-CD1 4.28Å; I380-I390 HydrophobicContact CG2-CD1 3.97Å; A386-I390 WeakPolarHBondContact O-CG1 3.49Å; A386-I390 PolarHBondContact O-N 3.39Å; F387-I390 WeakPolarHBondContact O-CB 3.44Å; F387-I390 PolarHBondContact O-N 3.47Å; L388-I390 VanDerWaalsContact C-N 3.29Å; L388-I390 PolarHBondContact O-N 3.11Å; I390-M392 PolarHBondContact O-N 3.47Å; I390-Y393 PolarHBondContact O-N 3.33Å; I390-A394 PolarHBondContact O-N 2.81Å
391	D	98.6	Very high	95.6	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-61.7	-35.9	175.2	-71.1	-21.8	0	0	0	111.5	L304 H308 A324 H325 R326 F387 L388 A394 M395	L304-D391 HydrophobicContact CD1-CB 4.39Å; L304-D391 HydrophobicContact CD2-CB 4.26Å; H308-D391 IonicContact CD2-OD2 2.8Å; H308-D391 IonicContact CE1-OD2 2.7Å; H308-D391 IonicContact NE2-OD2 2.82Å; H308-D391 PolarHBondContact NE2-OD2 2.92Å; A324-D391 WeakPolarHBondContact CA-OD2 3.2Å; H325-D391 PolarHBondContact N-OD2 3.28Å; R326-D391 WeakPolarHBondContact CA-OD1 3.18Å; R326-D391 PolarHBondContact N-OD1 2.98Å; F387-D391 PolarHBondContact O-N 2.92Å; L388-D391 WeakPolarHBondContact O-CB 3.29Å; L388-D391 PolarHBondContact O-N 2.86Å; D391-A394 PolarHBondContact O-N 2.87Å; D391-M395 PolarHBondContact O-N 3.21Å
392	M	98.9	Very high	96.4	Very high	3 Å²	3	25.6 Å²	25.6	2%	0.015	12%	0.117	C	C	.	.	H	α-helix	trans	-68.9	-36	179.7	-65	-52.6	-53.5	0	0	113.3	L304 L388 R389 I390 A394 M395 G396 L475 A477 V480	L304-M392 HydrophobicContact CD2-SD 3.81Å; L388-M392 WeakPolarHBondContact O-CG 3.1Å; L388-M392 PolarHBondContact O-N 2.94Å; L388-M392 VanDerWaalsContact O-N 3.11Å; R389-M392 PolarHBondContact O-N 2.9Å; I390-M392 PolarHBondContact O-N 3.47Å; M392-A394 VanDerWaalsContact C-N 3.33Å; M392-A394 PolarHBondContact O-N 2.93Å; M392-M395 HydrophobicContact CE-CB 4.41Å; M392-M395 HydrophobicContact CE-CG 4.42Å; M392-M395 HydrophobicContact CE-SD 3.54Å; M392-M395 VanDerWaalsContact CE-SD 3.54Å; M392-M395 WeakPolarHBondContact O-CB 3.28Å; M392-M395 PolarHBondContact O-N 2.87Å; M392-M395 HydrophobicContact SD-SD 4.19Å; M392-G396 PolarHBondContact O-N 3.42Å; M392-L475 WeakPolarHBondContact CE-O 3.16Å; M392-L475 WeakPolarHBondContact CG-O 3.28Å; M392-A477 HydrophobicContact CE-CB 4.32Å; M392-A477 HydrophobicContact SD-CB 3.66Å; M392-A477 PolarHBondContact SD-N 2.9Å; M392-V480 HydrophobicContact CE-CB 4.49Å; M392-V480 HydrophobicContact CE-CG2 3.59Å
393	Y	98.9	Very high	97.1	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-57.5	-49	169.6	176.2	-90.2	0	0	0	111	M371 A372 P373 R389 I390 M395 G396 L397 V437 C466 W467	M371-Y393 VanDerWaalsContact O-CE1 3.26Å; M371-Y393 WeakPolarHBondContact O-CE1 3.17Å; A372-Y393 VanDerWaalsContact CA-CD1 3.45Å; A372-Y393 HydrophobicContact CB-CD1 3.83Å; A372-Y393 HydrophobicContact CB-CD2 4.25Å; A372-Y393 HydrophobicContact CB-CG 3.67Å; P373-Y393 HydrophobicContact CG-CE2 4.34Å; R389-Y393 PolarHBondContact O-N 3.38Å; R389-Y393 VanDerWaalsContact O-N 3.12Å; I390-Y393 PolarHBondContact O-N 3.33Å; Y393-M395 VanDerWaalsContact C-N 3.32Å; Y393-M395 PolarHBondContact O-N 2.78Å; Y393-G396 PolarHBondContact O-N 3.36Å; Y393-G396 VanDerWaalsContact O-N 3.17Å; Y393-L397 HydrophobicContact CD1-CD1 4.16Å; Y393-L397 HydrophobicContact CE1-CD1 3.6Å; Y393-L397 HydrophobicContact CE1-CG 4.27Å; Y393-L397 PolarHBondContact O-N 3.25Å; Y393-V437 VanDerWaalsContact OH-CG1 3.28Å; Y393-V437 WeakPolarHBondContact OH-CG1 3.41Å; Y393-C466 WeakPolarHBondContact CA-O 3.43Å; Y393-W467 HydrophobicContact CD2-CB 3.93Å; Y393-W467 HydrophobicContact CE2-CB 3.92Å
394	A	98.9	Very high	97.6	Very high	4 Å²	4	15.9 Å²	15.9	3%	0.033	7%	0.074	C	C	.	.	H	α-helix	trans	-65.5	-34.8	178.6	0	0	0	0	0	112.5	F328 Y370 I390 D391 M392 G396 L397 V398	F328-A394 HydrophobicContact CB-CB 4.06Å; F328-A394 HydrophobicContact CD1-CB 4.25Å; F328-A394 VanDerWaalsContact O-CB 3.32Å; F328-A394 WeakPolarHBondContact O-CB 3.39Å; Y370-A394 HydrophobicContact CD1-CB 4.48Å; I390-A394 PolarHBondContact O-N 2.81Å; D391-A394 PolarHBondContact O-N 2.87Å; M392-A394 VanDerWaalsContact C-N 3.33Å; M392-A394 PolarHBondContact O-N 2.93Å; A394-G396 VanDerWaalsContact C-N 3.33Å; A394-G396 PolarHBondContact O-N 2.82Å; A394-L397 WeakPolarHBondContact O-CB 3.45Å; A394-L397 PolarHBondContact O-N 3.18Å; A394-V398 WeakPolarHBondContact O-CG2 3.43Å; A394-V398 PolarHBondContact O-N 2.84Å; A394-V398 VanDerWaalsContact O-N 3.07Å
395	M	98.9	Very high	97.9	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-60.2	-41.2	171.9	175.1	173.6	-84.6	0	0	112.1	M300 L304 F328 D391 M392 Y393 L397 V398 L399 V480	M300-M395 HydrophobicContact CE-CE 4.29Å; M300-M395 HydrophobicContact CE-CG 4.31Å; M300-M395 HydrophobicContact CG-CE 4.46Å; L304-M395 HydrophobicContact CB-CE 3.68Å; L304-M395 HydrophobicContact CD2-CB 4.34Å; L304-M395 HydrophobicContact CD2-CE 3.31Å; L304-M395 HydrophobicContact CD2-SD 4.13Å; L304-M395 HydrophobicContact CG-CE 4.12Å; F328-M395 HydrophobicContact CD1-CB 4.28Å; F328-M395 HydrophobicContact CE1-CB 3.92Å; F328-M395 HydrophobicContact CE1-CE 4.49Å; F328-M395 HydrophobicContact CE1-CG 4.41Å; F328-M395 HydrophobicContact CZ-CE 3.96Å; D391-M395 PolarHBondContact O-N 3.21Å; M392-M395 HydrophobicContact CE-CB 4.41Å; M392-M395 HydrophobicContact CE-CG 4.42Å; M392-M395 HydrophobicContact CE-SD 3.54Å; M392-M395 VanDerWaalsContact CE-SD 3.54Å; M392-M395 WeakPolarHBondContact O-CB 3.28Å; M392-M395 PolarHBondContact O-N 2.87Å; M392-M395 HydrophobicContact SD-SD 4.19Å; Y393-M395 VanDerWaalsContact C-N 3.32Å; Y393-M395 PolarHBondContact O-N 2.78Å; M395-L397 VanDerWaalsContact C-N 3.28Å; M395-L397 PolarHBondContact O-N 2.85Å; M395-V398 PolarHBondContact O-N 3.19Å; M395-V398 VanDerWaalsContact O-N 3.15Å; M395-L399 HydrophobicContact CG-CD1 4.11Å; M395-L399 HydrophobicContact CG-CG 4.23Å; M395-L399 WeakPolarHBondContact O-CG 3.47Å; M395-L399 PolarHBondContact O-N 2.93Å; M395-V480 HydrophobicContact SD-CB 4.24Å; M395-V480 HydrophobicContact SD-CG1 4.01Å; M395-V480 HydrophobicContact SD-CG2 4.31Å
396	G	98.9	Very high	98.1	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-55.9	-43.8	174.4	0	0	0	0	0	112.2	M392 Y393 A394 L399 W400	M392-G396 PolarHBondContact O-N 3.42Å; Y393-G396 PolarHBondContact O-N 3.36Å; Y393-G396 VanDerWaalsContact O-N 3.17Å; A394-G396 VanDerWaalsContact C-N 3.33Å; A394-G396 PolarHBondContact O-N 2.82Å; G396-L399 PolarHBondContact O-N 3.09Å; G396-W400 PolarHBondContact O-N 3.22Å
397	L	98.9	Very high	98.2	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-64.1	-41	175.9	-60.1	173.6	0	0	0	112.4	Y370 Y393 A394 M395 W400 E401 P419 F420 P444 W467	Y370-L397 HydrophobicContact CD1-CB 4.02Å; Y370-L397 HydrophobicContact CD1-CD1 3.92Å; Y370-L397 HydrophobicContact CE1-CB 4.13Å; Y370-L397 HydrophobicContact CG-CD1 4.38Å; Y393-L397 HydrophobicContact CD1-CD1 4.16Å; Y393-L397 HydrophobicContact CE1-CD1 3.6Å; Y393-L397 HydrophobicContact CE1-CG 4.27Å; Y393-L397 PolarHBondContact O-N 3.25Å; A394-L397 WeakPolarHBondContact O-CB 3.45Å; A394-L397 PolarHBondContact O-N 3.18Å; M395-L397 VanDerWaalsContact C-N 3.28Å; M395-L397 PolarHBondContact O-N 2.85Å; L397-W400 WeakPolarHBondContact O-CB 3.38Å; L397-W400 PolarHBondContact O-N 3.41Å; L397-E401 WeakPolarHBondContact O-CG 3.44Å; L397-E401 PolarHBondContact O-N 3.11Å; L397-P419 HydrophobicContact CB-CB 4.19Å; L397-P419 HydrophobicContact CB-CG 3.94Å; L397-P419 HydrophobicContact CD1-CB 4.49Å; L397-P419 HydrophobicContact CD2-CB 4.01Å; L397-P419 HydrophobicContact CG-CB 4.47Å; L397-F420 HydrophobicContact CD1-CE2 4.11Å; L397-F420 HydrophobicContact CD2-CE2 3.8Å; L397-F420 HydrophobicContact CD2-CZ 4.03Å; L397-P444 HydrophobicContact CD2-CG 3.78Å; L397-W467 HydrophobicContact CD2-CE3 3.79Å; L397-W467 HydrophobicContact CD2-CZ3 4.22Å
398	V	98.9	Very high	98.2	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-69.2	-36.1	177.7	178.3	0	0	0	0	112	L279 M300 F328 Y370 A394 M395 W400 E401 L402	L279-V398 HydrophobicContact CD2-CG1 3.77Å; M300-V398 HydrophobicContact CE-CG1 4.17Å; M300-V398 HydrophobicContact SD-CB 4.45Å; M300-V398 HydrophobicContact SD-CG1 3.6Å; F328-V398 HydrophobicContact CD1-CG2 4.12Å; F328-V398 HydrophobicContact CE1-CB 4.16Å; F328-V398 HydrophobicContact CE1-CG2 3.9Å; Y370-V398 HydrophobicContact CE1-CG2 4Å; A394-V398 WeakPolarHBondContact O-CG2 3.43Å; A394-V398 PolarHBondContact O-N 2.84Å; A394-V398 VanDerWaalsContact O-N 3.07Å; M395-V398 PolarHBondContact O-N 3.19Å; M395-V398 VanDerWaalsContact O-N 3.15Å; V398-W400 VanDerWaalsContact C-N 3.31Å; V398-E401 WeakPolarHBondContact O-CB 3.5Å; V398-E401 PolarHBondContact O-N 3.35Å; V398-L402 PolarHBondContact O-N 2.95Å; V398-L402 VanDerWaalsContact O-N 3.12Å
399	L	98.9	Very high	97.8	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63.5	-38.6	172.3	-72.9	173.8	0	0	0	111.3	A297 M300 M395 G396 E401 L402 V403 I463 V480	A297-L399 HydrophobicContact CB-CD2 3.77Å; M300-L399 HydrophobicContact CE-CD2 3.76Å; M300-L399 HydrophobicContact CE-CG 4.15Å; M395-L399 HydrophobicContact CG-CD1 4.11Å; M395-L399 HydrophobicContact CG-CG 4.23Å; M395-L399 WeakPolarHBondContact O-CG 3.47Å; M395-L399 PolarHBondContact O-N 2.93Å; G396-L399 PolarHBondContact O-N 3.09Å; L399-E401 VanDerWaalsContact C-N 3.34Å; L399-L402 HydrophobicContact CD2-CD1 4.27Å; L399-L402 WeakPolarHBondContact O-CB 3.29Å; L399-L402 PolarHBondContact O-N 3.43Å; L399-V403 WeakPolarHBondContact O-CG2 3.41Å; L399-V403 PolarHBondContact O-N 2.78Å; L399-I463 HydrophobicContact CB-CD1 4.01Å; L399-I463 HydrophobicContact CB-CG1 3.53Å; L399-I463 HydrophobicContact CD1-CG1 4.34Å; L399-V480 HydrophobicContact CD1-CG1 4Å
400	W	98.8	Very high	97.1	Very high	15 Å²	15	18.5 Å²	18.5	6%	0.057	10%	0.097	C	C	.	.	H	α-helix	trans	-61.6	-40.6	172	175.8	93.6	0	0	0	112.1	G396 L397 V398 L402 V403 S404 P419 P444 T445 W450 I463 W467	G396-W400 PolarHBondContact O-N 3.22Å; L397-W400 WeakPolarHBondContact O-CB 3.38Å; L397-W400 PolarHBondContact O-N 3.41Å; V398-W400 VanDerWaalsContact C-N 3.31Å; W400-L402 VanDerWaalsContact C-N 3.28Å; W400-L402 PolarHBondContact O-N 3.25Å; W400-V403 PolarHBondContact O-N 3.12Å; W400-S404 WeakPolarHBondContact O-CB 3.41Å; W400-S404 PolarHBondContact O-N 2.88Å; W400-P419 HydrophobicContact CE3-CG 4.33Å; W400-P419 HydrophobicContact CZ3-CG 4.46Å; W400-P444 HydrophobicContact CD2-CB 3.56Å; W400-P444 HydrophobicContact CD2-CG 4.32Å; W400-P444 HydrophobicContact CE3-CB 4.1Å; W400-P444 HydrophobicContact CG-CB 3.95Å; W400-P444 HydrophobicContact CH2-CB 4.2Å; W400-P444 HydrophobicContact CZ2-CB 3.67Å; W400-P444 HydrophobicContact CZ3-CB 4.39Å; W400-T445 PolarHBondContact NE1-O 3.27Å; W400-W450 AromaticContact CD1-CZ3 3.99Å; W400-W450 AromaticContact NE1-CH2 3.77Å; W400-W450 AromaticContact NE1-CZ3 3.66Å; W400-I463 HydrophobicContact CB-CD1 4.37Å; W400-I463 HydrophobicContact CB-CG2 4.26Å; W400-W467 HydrophobicContact CB-CH2 4.33Å; W400-W467 HydrophobicContact CB-CZ3 3.77Å; W400-W467 AromaticContact CD1-CH2 3.8Å; W400-W467 HydrophobicContact CG-CH2 4.25Å; W400-W467 HydrophobicContact CG-CZ3 4Å
401	E	98.8	Very high	96.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61	-36	174.8	-66	176.6	-115	0	0	112.5	L283 S330 Y370 L397 V398 L399 S404 Y416 P419	L283-E401 HydrophobicContact CD1-CB 4.16Å; S330-E401 WeakPolarHBondContact CB-OE2 3.34Å; S330-E401 VanDerWaalsContact OG-CD 3.26Å; S330-E401 PolarHBondContact OG-OE1 3.25Å; S330-E401 PolarHBondContact OG-OE2 2.76Å; Y370-E401 VanDerWaalsContact CE1-OE1 3.3Å; Y370-E401 WeakPolarHBondContact CE1-OE1 3.28Å; Y370-E401 PolarHBondContact OH-OE1 2.8Å; L397-E401 WeakPolarHBondContact O-CG 3.44Å; L397-E401 PolarHBondContact O-N 3.11Å; V398-E401 WeakPolarHBondContact O-CB 3.5Å; V398-E401 PolarHBondContact O-N 3.35Å; L399-E401 VanDerWaalsContact C-N 3.34Å; E401-S404 PolarHBondContact O-OG 3.19Å; E401-Y416 HydrophobicContact CB-CE2 4.38Å; E401-Y416 HydrophobicContact CG-CE2 4.44Å; E401-Y416 WeakPolarHBondContact OE2-CE2 3.25Å; E401-Y416 PolarHBondContact OE2-OH 3.32Å; E401-P419 HydrophobicContact CG-CG 3.84Å
402	L	98.8	Very high	96.1	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-66	-48.2	173.4	-72.4	169.8	0	0	0	111.2	L279 L283 I288 L293 V296 A297 M300 V398 L399 W400 S404 R405 C406	L279-L402 HydrophobicContact CD1-CD2 3.78Å; L279-L402 HydrophobicContact CD2-CD2 4.01Å; L279-L402 HydrophobicContact CD2-CG 4.26Å; L279-L402 HydrophobicContact CG-CD2 4.43Å; L283-L402 HydrophobicContact CD1-CD2 4.3Å; L283-L402 HydrophobicContact CD2-CD2 4.41Å; I288-L402 HydrophobicContact CD1-CB 4.38Å; I288-L402 HydrophobicContact CD1-CD2 3.72Å; L293-L402 HydrophobicContact CD1-CB 4Å; L293-L402 HydrophobicContact CG-CB 4.13Å; V296-L402 HydrophobicContact CB-CD2 4.22Å; V296-L402 HydrophobicContact CG1-CD1 4.11Å; V296-L402 HydrophobicContact CG1-CD2 3.79Å; A297-L402 HydrophobicContact CB-CD1 4.07Å; M300-L402 HydrophobicContact CE-CD1 4.47Å; V398-L402 PolarHBondContact O-N 2.95Å; V398-L402 VanDerWaalsContact O-N 3.12Å; L399-L402 HydrophobicContact CD2-CD1 4.27Å; L399-L402 WeakPolarHBondContact O-CB 3.29Å; L399-L402 PolarHBondContact O-N 3.43Å; W400-L402 VanDerWaalsContact C-N 3.28Å; W400-L402 PolarHBondContact O-N 3.25Å; L402-S404 VanDerWaalsContact C-N 3.32Å; L402-S404 PolarHBondContact O-N 2.93Å; L402-R405 PolarHBondContact O-N 2.87Å; L402-C406 PolarHBondContact O-N 3.29Å
403	V	98.4	Very high	95.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.7	-42.2	179.8	169.3	0	0	0	0	111.2	L293 L399 W400 R405 C406 W450 L456 L459 I463	L293-V403 HydrophobicContact CD1-CG2 4.12Å; L399-V403 WeakPolarHBondContact O-CG2 3.41Å; L399-V403 PolarHBondContact O-N 2.78Å; W400-V403 PolarHBondContact O-N 3.12Å; V403-R405 PolarHBondContact O-N 2.79Å; V403-R405 VanDerWaalsContact O-N 3.1Å; V403-C406 WeakPolarHBondContact O-CB 3.45Å; V403-C406 PolarHBondContact O-N 3.03Å; V403-W450 HydrophobicContact CG1-CD2 3.64Å; V403-W450 HydrophobicContact CG1-CE3 3.43Å; V403-W450 VanDerWaalsContact CG1-CE3 3.43Å; V403-W450 HydrophobicContact CG1-CG 4.15Å; V403-W450 HydrophobicContact CG1-CH2 4.37Å; V403-W450 HydrophobicContact CG1-CZ3 3.82Å; V403-L456 HydrophobicContact CG1-CD2 4.22Å; V403-L456 HydrophobicContact CG2-CD2 4.13Å; V403-L459 HydrophobicContact CG2-CD2 3.57Å; V403-L459 HydrophobicContact CG2-CG 4.16Å; V403-I463 HydrophobicContact CB-CD1 4.44Å; V403-I463 HydrophobicContact CG2-CD1 3.77Å
404	S	98	Very high	95.7	Very high	11 Å²	11	29.2 Å²	29.2	8%	0.077	17%	0.17	C	C	.	.	H	α-helix	trans	-63.7	-19.1	-178	74.6	0	0	0	0	113.8	W400 E401 L402	W400-S404 WeakPolarHBondContact O-CB 3.41Å; W400-S404 PolarHBondContact O-N 2.88Å; E401-S404 PolarHBondContact O-OG 3.19Å; L402-S404 VanDerWaalsContact C-N 3.32Å; L402-S404 PolarHBondContact O-N 2.93Å
405	R	98.2	Very high	95.6	Very high	16 Å²	16	37.4 Å²	37.4	6%	0.06	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	13.2	178.6	-62.6	-62.6	-66.2	150.9	0.7	113.6	L283 N286 I287 I288 L402 V403 D414 Y416	L283-R405 HydrophobicContact CB-CG 4.2Å; L283-R405 HydrophobicContact CD2-CB 3.9Å; L283-R405 HydrophobicContact CD2-CG 4.32Å; L283-R405 PolarHBondContact O-NE 2.67Å; L283-R405 PolarHBondContact O-NH2 2.82Å; N286-R405 PolarHBondContact O-NE 3.35Å; N286-R405 PolarHBondContact O-NH2 3.48Å; I287-R405 VanDerWaalsContact CG1-NH2 3.26Å; I287-R405 WeakPolarHBondContact CG2-O 3.43Å; I288-R405 WeakPolarHBondContact CG1-O 3.36Å; I288-R405 PolarHBondContact N-O 3.17Å; L402-R405 PolarHBondContact O-N 2.87Å; V403-R405 PolarHBondContact O-N 2.79Å; V403-R405 VanDerWaalsContact O-N 3.1Å; R405-D414 PolarHBondContact NH1-O 2.94Å; R405-Y416 HydrophobicContact CG-CD2 4.14Å
406	C	97.7	Very high	95.5	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.027	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-93	129.6	179.8	-171.1	0	0	0	0	112.1	I288 L293 L402 V403 A408 L456	I288-C406 HydrophobicContact CG1-CB 4.43Å; I288-C406 WeakPolarHBondContact O-CA 3.48Å; L293-C406 HydrophobicContact CD1-CB 3.62Å; L402-C406 PolarHBondContact O-N 3.29Å; V403-C406 WeakPolarHBondContact O-CB 3.45Å; V403-C406 PolarHBondContact O-N 3.03Å; C406-A408 VanDerWaalsContact C-N 3.31Å; C406-A408 PolarHBondContact O-N 3.2Å; C406-A408 VanDerWaalsContact SG-CB 3.51Å; C406-L456 HydrophobicContact CB-CD2 4.36Å
407	K	96	Very high	95.5	Very high	126 Å²	126	41 Å²	41	55%	0.548	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	17.5	176.5	66.5	178.8	178.5	-177.1	0	115	I287 I288 V413	I287-K407 HydrophobicContact CG2-CB 3.72Å; I287-K407 HydrophobicContact CG2-CD 4.2Å; I287-K407 HydrophobicContact CG2-CG 4.1Å; I288-K407 PolarHBondContact O-N 3.47Å; K407-V413 HydrophobicContact CB-CG2 4.23Å
408	A	93.6	Very high	95.4	Very high	23 Å²	23	42.9 Å²	42.9	19%	0.19	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-27.6	-175.4	0	0	0	0	0	113.6	W290 C406 H453 L456	W290-A408 HydrophobicContact CB-CB 3.79Å; W290-A408 HydrophobicContact CE3-CB 4.34Å; C406-A408 VanDerWaalsContact C-N 3.31Å; C406-A408 PolarHBondContact O-N 3.2Å; C406-A408 VanDerWaalsContact SG-CB 3.51Å; A408-H453 PolarHBondContact O-CD2 3.49Å; A408-L456 HydrophobicContact CB-CD1 3.97Å; A408-L456 HydrophobicContact CB-CG 4.37Å
409	A	90.1	Very high	95.4	Very high	9 Å²	9	42.9 Å²	42.9	7%	0.074	23%	0.234	C	C	.	.	S	Bend	trans	-84.7	143.6	172.9	0	0	0	0	0	110.7	G411 H449 H453 L456	A409-G411 PolarHBondContact O-N 2.82Å; A409-H449 WeakPolarHBondContact CB-O 3.44Å; A409-H453 HydrophobicContact CB-CB 4.49Å; A409-L456 HydrophobicContact CB-CD1 3.85Å
410	D	83.1	Confident	95.3	Very high	160 Å²	160	43 Å²	43	86%	0.856	23%	0.234	S	C	*	.	S	Bend	trans	-69.2	97.9	169.3	-65.7	-41.5	0	0	0	109.1
411	G	84.5	Confident	95.3	Very high	39 Å²	39	43.9 Å²	43.9	40%	0.402	24%	0.239	S	C	.	.	S	Bend	trans	175	169	-178.7	0	0	0	0	0	113	A409	A409-G411 PolarHBondContact O-N 2.82Å
412	P	90.5	Very high	95.1	Very high	93 Å²	93	50.2 Å²	50.2	60%	0.604	27%	0.269	S	S	*	.			trans	-67.9	140.6	173.8	29.5	-33.4	0	0	0	110.7
413	V	95.9	Very high	94.9	Very high	39 Å²	39	53.3 Å²	53.3	24%	0.236	28%	0.283	C	S	.	.			trans	-102.4	106.7	170.2	-174.2	0	0	0	0	107.5	I287 K407	I287-V413 HydrophobicContact CD1-CB 4.13Å; I287-V413 HydrophobicContact CD1-CG1 4.25Å; I287-V413 HydrophobicContact CG1-CG1 4.17Å; I287-V413 HydrophobicContact CG2-CG1 4.27Å; I287-V413 HydrophobicContact CG2-CG2 4.33Å; K407-V413 HydrophobicContact CB-CG2 4.23Å
414	D	94.2	Very high	94.7	Very high	75 Å²	75	54.5 Å²	54.5	40%	0.401	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-68.6	164.8	-178.8	-62.2	-38	0	0	0	112	R405 K447	R405-D414 PolarHBondContact NH1-O 2.94Å; D414-K447 IonicContact OD2-NZ 2.55Å; D414-K447 PolarHBondContact OD2-NZ 2.77Å
415	E	96.2	Very high	94.6	Very high	175 Å²	175	55.5 Å²	55.5	82%	0.818	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-55.1	152.4	172.7	-65.5	-167.8	166.3	0	0	111.6	M417	E415-M417 PolarHBondContact O-N 2.96Å
416	Y	97.8	Very high	94.3	Very high	24 Å²	24	60.3 Å²	60.3	9%	0.094	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-63.1	128.4	178.3	172.8	-89.6	0	0	0	110.8	T280 L283 K284 E401 R405 L418	T280-Y416 HydrophobicContact CG2-CE1 4.01Å; L283-Y416 HydrophobicContact CB-CD2 3.65Å; L283-Y416 HydrophobicContact CB-CE2 3.9Å; L283-Y416 HydrophobicContact CD1-CE2 4.22Å; K284-Y416 HydrophobicContact CD-CD1 4.2Å; K284-Y416 HydrophobicContact CD-CE1 4.43Å; K284-Y416 HydrophobicContact CG-CD1 3.32Å; K284-Y416 HydrophobicContact CG-CE1 3.89Å; K284-Y416 HydrophobicContact CG-CG 3.79Å; E401-Y416 HydrophobicContact CB-CE2 4.38Å; E401-Y416 HydrophobicContact CG-CE2 4.44Å; E401-Y416 WeakPolarHBondContact OE2-CE2 3.25Å; E401-Y416 PolarHBondContact OE2-OH 3.32Å; R405-Y416 HydrophobicContact CG-CD2 4.14Å; Y416-L418 HydrophobicContact CE1-CD2 4.16Å; Y416-L418 HydrophobicContact CE1-CG 4.27Å; Y416-L418 WeakPolarHBondContact OH-CD2 3.23Å
417	M	97.3	Very high	94.1	Very high	53 Å²	53	68.4 Å²	68.4	26%	0.261	36%	0.361	S	S	.	.			trans	-125.6	144.8	171.9	-68.4	-168.8	-67.1	0	0	109.5	E415 E421 E422	E415-M417 PolarHBondContact O-N 2.96Å; M417-E421 HydrophobicContact CB-CB 4.24Å; M417-E422 HydrophobicContact CE-CB 4.33Å; M417-E422 HydrophobicContact SD-CB 4.36Å
418	L	97.9	Very high	93.9	Very high	39 Å²	39	62.9 Å²	62.9	20%	0.204	34%	0.339	C	S	.	.			trans	-68.2	155	170.6	-66.9	162.7	0	0	0	110.2	Y416 F420 E421	Y416-L418 HydrophobicContact CE1-CD2 4.16Å; Y416-L418 HydrophobicContact CE1-CG 4.27Å; Y416-L418 WeakPolarHBondContact OH-CD2 3.23Å; L418-F420 PolarHBondContact O-N 3.43Å; L418-E421 HydrophobicContact CB-CB 4.11Å; L418-E421 WeakPolarHBondContact CB-OE2 3.34Å; L418-E421 PolarHBondContact N-OE2 3.37Å; L418-E421 WeakPolarHBondContact O-CB 3.46Å; L418-E421 PolarHBondContact O-N 3.29Å
419	P	98.3	Very high	94	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	131.9	173.7	-24.5	33.2	0	0	0	111.1	R369 Y370 L397 W400 E401 E421 P444	R369-P419 WeakPolarHBondContact CD-O 3.36Å; R369-P419 HydrophobicContact CG-CB 4.45Å; R369-P419 WeakPolarHBondContact CG-O 3.47Å; R369-P419 PolarHBondContact NH1-O 3.02Å; Y370-P419 HydrophobicContact CE1-CG 3.94Å; L397-P419 HydrophobicContact CB-CB 4.19Å; L397-P419 HydrophobicContact CB-CG 3.94Å; L397-P419 HydrophobicContact CD1-CB 4.49Å; L397-P419 HydrophobicContact CD2-CB 4.01Å; L397-P419 HydrophobicContact CG-CB 4.47Å; W400-P419 HydrophobicContact CE3-CG 4.33Å; W400-P419 HydrophobicContact CZ3-CG 4.46Å; E401-P419 HydrophobicContact CG-CG 3.84Å; P419-E421 PolarHBondContact O-N 3.14Å; P419-P444 HydrophobicContact CB-CG 3.95Å
420	F	98.1	Very high	94.2	Very high	1 Å²	1	65.1 Å²	65.1	0%	0.004	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	7.3	-175.2	-45	-75.7	0	0	0	115.9	R369 L397 L418 E422 E423 I424 L433 V437 P444	R369-F420 HydrophobicContact CG-CD2 4.11Å; R369-F420 VanDerWaalsContact NH1-C 3.28Å; R369-F420 PolarHBondContact NH1-O 3.45Å; L397-F420 HydrophobicContact CD1-CE2 4.11Å; L397-F420 HydrophobicContact CD2-CE2 3.8Å; L397-F420 HydrophobicContact CD2-CZ 4.03Å; L418-F420 PolarHBondContact O-N 3.43Å; F420-E422 VanDerWaalsContact C-N 3.32Å; F420-E423 WeakPolarHBondContact CA-OE2 3.19Å; F420-I424 HydrophobicContact CB-CD1 3.92Å; F420-I424 HydrophobicContact CB-CG1 3.93Å; F420-I424 WeakPolarHBondContact O-CG1 3.49Å; F420-I424 PolarHBondContact O-N 3.02Å; F420-I424 VanDerWaalsContact O-N 3.15Å; F420-L433 HydrophobicContact CD2-CD2 4.47Å; F420-V437 HydrophobicContact CE1-CG2 3.89Å; F420-V437 HydrophobicContact CE2-CG2 4.07Å; F420-V437 HydrophobicContact CZ-CG2 3.65Å; F420-P444 HydrophobicContact CD1-CG 4.37Å; F420-P444 HydrophobicContact CE1-CG 4.21Å; F420-P444 HydrophobicContact CE2-CG 4.49Å; F420-P444 HydrophobicContact CZ-CG 4.26Å
421	E	97.5	Very high	94.8	Very high	35 Å²	35	63.4 Å²	63.4	16%	0.164	34%	0.336	C	S	.	.	H	α-helix	trans	-68.2	-33.1	180	-177.7	170.1	173.5	0	0	112.7	M417 L418 P419 E423 G425 Q426	M417-E421 HydrophobicContact CB-CB 4.24Å; L418-E421 HydrophobicContact CB-CB 4.11Å; L418-E421 WeakPolarHBondContact CB-OE2 3.34Å; L418-E421 PolarHBondContact N-OE2 3.37Å; L418-E421 WeakPolarHBondContact O-CB 3.46Å; L418-E421 PolarHBondContact O-N 3.29Å; P419-E421 PolarHBondContact O-N 3.14Å; E421-E423 VanDerWaalsContact C-N 3.34Å; E421-G425 WeakPolarHBondContact O-CA 3.46Å; E421-G425 PolarHBondContact O-N 2.94Å; E421-Q426 HydrophobicContact CG-CG 3.99Å; E421-Q426 WeakPolarHBondContact OE1-CG 3.35Å; E421-Q426 PolarHBondContact OE1-NE2 3.48Å
422	E	94.8	Very high	95.4	Very high	133 Å²	133	65.8 Å²	65.8	62%	0.621	34%	0.336	S	S	*	.	H	α-helix	trans	-67.7	-36.4	178.7	-173.8	170.8	-175.6	0	0	111.7	M417 F420	M417-E422 HydrophobicContact CE-CB 4.33Å; M417-E422 HydrophobicContact SD-CB 4.36Å; F420-E422 VanDerWaalsContact C-N 3.32Å
423	E	94.2	Very high	95.8	Very high	64 Å²	64	61.4 Å²	61.4	30%	0.299	31%	0.308	S	S	.	.	H	α-helix	trans	-86.5	-38.8	-173.3	-60.5	84.6	165.1	0	0	113.2	F420 E421 M442	F420-E423 WeakPolarHBondContact CA-OE2 3.19Å; E421-E423 VanDerWaalsContact C-N 3.34Å; E423-M442 HydrophobicContact CB-CE 4.29Å; E423-M442 HydrophobicContact CG-CE 4.1Å
424	I	95.7	Very high	95.8	Very high	26 Å²	26	62 Å²	62	13%	0.133	31%	0.308	C	S	.	.	H	α-helix	trans	-134.4	13.1	-171.4	58.9	175.5	0	0	0	113.4	F420 P428 E432 L433 V436	F420-I424 HydrophobicContact CB-CD1 3.92Å; F420-I424 HydrophobicContact CB-CG1 3.93Å; F420-I424 WeakPolarHBondContact O-CG1 3.49Å; F420-I424 PolarHBondContact O-N 3.02Å; F420-I424 VanDerWaalsContact O-N 3.15Å; I424-P428 HydrophobicContact CB-CB 4.25Å; I424-P428 HydrophobicContact CD1-CB 3.37Å; I424-P428 HydrophobicContact CD1-CG 3.81Å; I424-P428 HydrophobicContact CG1-CB 3.84Å; I424-P428 HydrophobicContact CG1-CG 4.29Å; I424-E432 HydrophobicContact CG2-CB 4.39Å; I424-L433 HydrophobicContact CD1-CD2 3.48Å; I424-L433 VanDerWaalsContact CD1-CD2 3.48Å; I424-L433 HydrophobicContact CD1-CG 3.85Å; I424-V436 HydrophobicContact CD1-CG2 3.96Å; I424-V436 HydrophobicContact CG2-CG1 3.69Å; I424-V436 HydrophobicContact CG2-CG2 4.3Å
425	G	95.6	Very high	96	Very high	32 Å²	32	62.2 Å²	62.2	33%	0.33	31%	0.307	S	S	.	.			trans	71.5	-169.5	176.2	0	0	0	0	0	114.4	R369 E421	R369-G425 PolarHBondContact NH1-O 3.1Å; R369-G425 PolarHBondContact NH2-O 3.5Å; E421-G425 WeakPolarHBondContact O-CA 3.46Å; E421-G425 PolarHBondContact O-N 2.94Å
426	Q	92.1	Very high	96.1	Very high	117 Å²	117	54.3 Å²	54.3	55%	0.547	27%	0.27	S	S	.	.	S	Bend	trans	-78.8	-28.7	-171	-73.6	-179.4	3.1	0	0	115.1	R369 E421 P428	R369-Q426 PolarHBondContact NH2-O 3Å; E421-Q426 HydrophobicContact CG-CG 3.99Å; E421-Q426 WeakPolarHBondContact OE1-CG 3.35Å; E421-Q426 PolarHBondContact OE1-NE2 3.48Å; Q426-P428 VanDerWaalsContact C-CD 3.45Å; Q426-P428 WeakPolarHBondContact O-CD 3.31Å
427	H	92.4	Very high	96.1	Very high	173 Å²	173	53.2 Å²	53.2	80%	0.801	27%	0.266	S	S	*	.	S	Bend	trans	-127.5	64.4	-172.7	-62.2	-57	0	0	0	112
428	P	93.2	Very high	96.1	Very high	11 Å²	11	51 Å²	51	7%	0.071	26%	0.255	C	S	.	.			trans	-68.6	143.4	-177.1	29.5	-36.7	0	0	0	112	I424 Q426 L433	I424-P428 HydrophobicContact CB-CB 4.25Å; I424-P428 HydrophobicContact CD1-CB 3.37Å; I424-P428 HydrophobicContact CD1-CG 3.81Å; I424-P428 HydrophobicContact CG1-CB 3.84Å; I424-P428 HydrophobicContact CG1-CG 4.29Å; Q426-P428 VanDerWaalsContact C-CD 3.45Å; Q426-P428 WeakPolarHBondContact O-CD 3.31Å; P428-L433 HydrophobicContact CB-CD1 4.27Å; P428-L433 HydrophobicContact CB-CG 4.08Å; P428-L433 HydrophobicContact CG-CD1 3.98Å; P428-L433 HydrophobicContact CG-CD2 4.43Å; P428-L433 HydrophobicContact CG-CG 4.15Å
429	S	95.2	Very high	96.1	Very high	37 Å²	37	55.2 Å²	55.2	26%	0.259	27%	0.274	S	S	.	.			trans	-68.4	167.3	166.1	64	0	0	0	0	111.3	E431 E432 L433	S429-E431 VanDerWaalsContact C-N 3.3Å; S429-E431 WeakPolarHBondContact CB-OE2 3.35Å; S429-E432 WeakPolarHBondContact CB-OE2 3.42Å; S429-E432 PolarHBondContact N-OE2 3.35Å; S429-E432 WeakPolarHBondContact OG-CB 3.48Å; S429-E432 WeakPolarHBondContact OG-CG 3.43Å; S429-E432 PolarHBondContact OG-N 3.13Å; S429-E432 PolarHBondContact OG-OE2 3.28Å; S429-L433 PolarHBondContact O-N 3.32Å
430	L	94	Very high	96	Very high	41 Å²	41	60.9 Å²	60.9	22%	0.215	30%	0.298	C	S	.	.	H	α-helix	trans	-68.2	-38	177.4	-179.5	63.9	0	0	0	110.4	L376 L433 Q434	L376-L430 HydrophobicContact CD2-CD1 3.57Å; L430-L433 PolarHBondContact O-N 3.36Å; L430-Q434 WeakPolarHBondContact O-CG 3.14Å; L430-Q434 PolarHBondContact O-N 3.26Å
431	E	95.9	Very high	96	Very high	125 Å²	125	66.8 Å²	66.8	58%	0.584	32%	0.324	S	S	*	.	H	α-helix	trans	-65.5	-42.6	-178.4	-61.7	76.4	-169.8	0	0	111.5	S429 L433 Q434 E435	S429-E431 VanDerWaalsContact C-N 3.3Å; S429-E431 WeakPolarHBondContact CB-OE2 3.35Å; E431-L433 VanDerWaalsContact C-N 3.32Å; E431-L433 PolarHBondContact O-N 3.31Å; E431-Q434 PolarHBondContact O-N 3.08Å; E431-E435 WeakPolarHBondContact O-CB 3.5Å; E431-E435 PolarHBondContact O-N 3.32Å
432	E	97.3	Very high	96.1	Very high	88 Å²	88	68.2 Å²	68.2	41%	0.411	33%	0.332	S	S	.	.	H	α-helix	trans	-62.1	-41.1	174.4	-74.7	163.6	141.4	0	0	111.6	I424 S429 E435 V436	I424-E432 HydrophobicContact CG2-CB 4.39Å; S429-E432 WeakPolarHBondContact CB-OE2 3.42Å; S429-E432 PolarHBondContact N-OE2 3.35Å; S429-E432 WeakPolarHBondContact OG-CB 3.48Å; S429-E432 WeakPolarHBondContact OG-CG 3.43Å; S429-E432 PolarHBondContact OG-N 3.13Å; S429-E432 PolarHBondContact OG-OE2 3.28Å; E432-E435 PolarHBondContact O-N 3.13Å; E432-V436 WeakPolarHBondContact O-CG2 3.46Å; E432-V436 PolarHBondContact O-N 3.47Å
433	L	97.4	Very high	96.2	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-67.4	-40.1	176.5	-78.9	164.2	0	0	0	112.2	R368 L376 F420 I424 P428 S429 L430 E431 E435 V436 V437	R368-L433 VanDerWaalsContact C-CD1 3.45Å; R368-L433 HydrophobicContact CB-CD1 3.5Å; R368-L433 VanDerWaalsContact CB-CD1 3.5Å; R368-L433 WeakPolarHBondContact O-CD1 3.33Å; L376-L433 HydrophobicContact CD1-CB 4.18Å; L376-L433 HydrophobicContact CD2-CB 3.92Å; F420-L433 HydrophobicContact CD2-CD2 4.47Å; I424-L433 HydrophobicContact CD1-CD2 3.48Å; I424-L433 VanDerWaalsContact CD1-CD2 3.48Å; I424-L433 HydrophobicContact CD1-CG 3.85Å; P428-L433 HydrophobicContact CB-CD1 4.27Å; P428-L433 HydrophobicContact CB-CG 4.08Å; P428-L433 HydrophobicContact CG-CD1 3.98Å; P428-L433 HydrophobicContact CG-CD2 4.43Å; P428-L433 HydrophobicContact CG-CG 4.15Å; S429-L433 PolarHBondContact O-N 3.32Å; L430-L433 PolarHBondContact O-N 3.36Å; E431-L433 VanDerWaalsContact C-N 3.32Å; E431-L433 PolarHBondContact O-N 3.31Å; L433-E435 VanDerWaalsContact C-N 3.34Å; L433-V436 HydrophobicContact CD2-CG2 4.49Å; L433-V436 PolarHBondContact O-N 3.2Å; L433-V437 HydrophobicContact CD2-CG2 4.22Å; L433-V437 WeakPolarHBondContact O-CB 3.08Å; L433-V437 WeakPolarHBondContact O-CG2 3.29Å; L433-V437 PolarHBondContact O-N 3.22Å
434	Q	97.4	Very high	96.4	Very high	52 Å²	52	60.8 Å²	60.8	24%	0.243	30%	0.296	C	S	.	.	I	π-helix	trans	-59.8	-46.7	172.7	-74.4	171.7	-31.1	0	0	110.7	L376 L430 E431 V436 V438 H439	L376-Q434 HydrophobicContact CB-CG 4.03Å; L376-Q434 PolarHBondContact O-NE2 3.34Å; L430-Q434 WeakPolarHBondContact O-CG 3.14Å; L430-Q434 PolarHBondContact O-N 3.26Å; E431-Q434 PolarHBondContact O-N 3.08Å; Q434-V436 PolarHBondContact O-N 3.23Å; Q434-V438 WeakPolarHBondContact O-CA 3.38Å; Q434-V438 WeakPolarHBondContact O-CB 3.01Å; Q434-V438 PolarHBondContact O-N 2.75Å; Q434-H439 PolarHBondContact O-N 2.85Å
435	E	97.7	Very high	96.5	Very high	80 Å²	80	63.1 Å²	63.1	37%	0.374	31%	0.311	S	S	.	.	I	π-helix	trans	-59.3	-48	178.7	-179.9	61.1	-167.5	0	0	112.3	E431 E432 L433 H439 K440	E431-E435 WeakPolarHBondContact O-CB 3.5Å; E431-E435 PolarHBondContact O-N 3.32Å; E432-E435 PolarHBondContact O-N 3.13Å; L433-E435 VanDerWaalsContact C-N 3.34Å; E435-H439 IonicContact OE2-CD2 3.03Å; E435-H439 PolarHBondContact OE2-CD2 3.48Å; E435-K440 HydrophobicContact CG-CD 4.47Å; E435-K440 WeakPolarHBondContact O-CB 3.45Å; E435-K440 WeakPolarHBondContact O-CG 3.39Å; E435-K440 PolarHBondContact O-N 3.1Å; E435-K440 WeakPolarHBondContact OE1-CE 3.4Å; E435-K440 IonicContact OE1-NZ 3.49Å; E435-K440 PolarHBondContact OE1-NZ 3.11Å
436	V	97.8	Very high	96.6	Very high	8 Å²	8	63.2 Å²	63.2	5%	0.048	30%	0.304	C	S	.	.	I	π-helix	trans	-78.2	-44.1	-176.3	-64.2	0	0	0	0	113.5	I424 E432 L433 Q434 K441 M442	I424-V436 HydrophobicContact CD1-CG2 3.96Å; I424-V436 HydrophobicContact CG2-CG1 3.69Å; I424-V436 HydrophobicContact CG2-CG2 4.3Å; E432-V436 WeakPolarHBondContact O-CG2 3.46Å; E432-V436 PolarHBondContact O-N 3.47Å; L433-V436 HydrophobicContact CD2-CG2 4.49Å; L433-V436 PolarHBondContact O-N 3.2Å; Q434-V436 PolarHBondContact O-N 3.23Å; V436-K441 PolarHBondContact O-N 3.37Å; V436-M442 HydrophobicContact CB-CE 3.72Å; V436-M442 HydrophobicContact CG1-CE 3.61Å; V436-M442 WeakPolarHBondContact O-CB 3.43Å; V436-M442 PolarHBondContact O-N 3.08Å
437	V	98.1	Very high	96.8	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.006	29%	0.287	C	S	.	.	I	π-helix	trans	-87.4	-38.6	-171	177.7	0	0	0	0	112.1	P373 L376 Y393 F420 L433 K441 R443	P373-V437 HydrophobicContact CG-CG1 3.97Å; L376-V437 HydrophobicContact CD1-CB 3.71Å; L376-V437 HydrophobicContact CD1-CG1 3.81Å; L376-V437 HydrophobicContact CD1-CG2 4.16Å; Y393-V437 VanDerWaalsContact OH-CG1 3.28Å; Y393-V437 WeakPolarHBondContact OH-CG1 3.41Å; F420-V437 HydrophobicContact CE1-CG2 3.89Å; F420-V437 HydrophobicContact CE2-CG2 4.07Å; F420-V437 HydrophobicContact CZ-CG2 3.65Å; L433-V437 HydrophobicContact CD2-CG2 4.22Å; L433-V437 WeakPolarHBondContact O-CB 3.08Å; L433-V437 WeakPolarHBondContact O-CG2 3.29Å; L433-V437 PolarHBondContact O-N 3.22Å; V437-K441 WeakPolarHBondContact O-CA 3.28Å; V437-R443 PolarHBondContact O-NH1 2.78Å
438	V	97.8	Very high	97	Very high	7 Å²	7	57.9 Å²	57.9	4%	0.042	28%	0.283	C	S	.	.	I	π-helix	trans	-93.4	-60	-174.8	-176.5	0	0	0	0	110.1	P373 L376 E377 Q434 K441	P373-V438 HydrophobicContact CB-CG2 4.18Å; L376-V438 HydrophobicContact CB-CG2 3.92Å; L376-V438 HydrophobicContact CD1-CG2 4.17Å; E377-V438 HydrophobicContact CG-CB 4.4Å; E377-V438 HydrophobicContact CG-CG1 3.6Å; E377-V438 HydrophobicContact CG-CG2 3.98Å; E377-V438 VanDerWaalsContact OE1-CG1 3.3Å; E377-V438 WeakPolarHBondContact OE1-CG1 3.01Å; Q434-V438 WeakPolarHBondContact O-CA 3.38Å; Q434-V438 WeakPolarHBondContact O-CB 3.01Å; Q434-V438 PolarHBondContact O-N 2.75Å; V438-K441 WeakPolarHBondContact O-CG 3.43Å
439	H	97.1	Very high	97	Very high	127 Å²	127	59.1 Å²	59.1	59%	0.588	29%	0.287	S	S	*	.	I	π-helix	trans	-75.2	-48.2	-171.6	-62.5	-43	0	0	0	112.6	Q434 E435	Q434-H439 PolarHBondContact O-N 2.85Å; E435-H439 IonicContact OE2-CD2 3.03Å; E435-H439 PolarHBondContact OE2-CD2 3.48Å
440	K	97.8	Very high	97.1	Very high	120 Å²	120	57.7 Å²	57.7	52%	0.522	28%	0.276	S	S	.	.	S	Bend	trans	-84.1	-10.6	177.3	-66.9	176	177.3	159.8	0	113.8	E435 M442	E435-K440 HydrophobicContact CG-CD 4.47Å; E435-K440 WeakPolarHBondContact O-CB 3.45Å; E435-K440 WeakPolarHBondContact O-CG 3.39Å; E435-K440 PolarHBondContact O-N 3.1Å; E435-K440 WeakPolarHBondContact OE1-CE 3.4Å; E435-K440 IonicContact OE1-NZ 3.49Å; E435-K440 PolarHBondContact OE1-NZ 3.11Å; K440-M442 HydrophobicContact CB-CG 3.61Å; K440-M442 HydrophobicContact CB-SD 4.27Å; K440-M442 HydrophobicContact CD-SD 4.16Å; K440-M442 PolarHBondContact O-N 3.38Å; K440-M442 VanDerWaalsContact O-N 3.13Å
441	K	98.1	Very high	97.2	Very high	124 Å²	124	59.8 Å²	59.8	54%	0.539	29%	0.287	S	S	.	.			trans	51.5	32	-176.5	-58	-172.9	176.5	-169.8	0	113.4	V436 V437 V438	V436-K441 PolarHBondContact O-N 3.37Å; V437-K441 WeakPolarHBondContact O-CA 3.28Å; V438-K441 WeakPolarHBondContact O-CG 3.43Å
442	M	97.9	Very high	97.2	Very high	66 Å²	66	61.7 Å²	61.7	33%	0.325	29%	0.294	S	S	.	.			trans	-74.7	153.6	179.1	-55.2	-163.3	-38.5	0	0	111	E423 V436 K440	E423-M442 HydrophobicContact CB-CE 4.29Å; E423-M442 HydrophobicContact CG-CE 4.1Å; V436-M442 HydrophobicContact CB-CE 3.72Å; V436-M442 HydrophobicContact CG1-CE 3.61Å; V436-M442 WeakPolarHBondContact O-CB 3.43Å; V436-M442 PolarHBondContact O-N 3.08Å; K440-M442 HydrophobicContact CB-CG 3.61Å; K440-M442 HydrophobicContact CB-SD 4.27Å; K440-M442 HydrophobicContact CD-SD 4.16Å; K440-M442 PolarHBondContact O-N 3.38Å; K440-M442 VanDerWaalsContact O-N 3.13Å
443	R	98.4	Very high	97.1	Very high	38 Å²	38	59.2 Å²	59.2	14%	0.143	28%	0.282	C	S	.	.			trans	-136.6	159.4	174.3	-64.4	-64	-177.7	-87.5	-1.6	108.6	V437 T445 W467	V437-R443 PolarHBondContact O-NH1 2.78Å; R443-T445 PolarHBondContact O-N 3.18Å; R443-W467 HydrophobicContact CB-CD2 4.1Å; R443-W467 HydrophobicContact CB-CE3 4.48Å; R443-W467 HydrophobicContact CB-CH2 4.14Å; R443-W467 HydrophobicContact CB-CZ2 3.72Å; R443-W467 HydrophobicContact CB-CZ3 4.5Å; R443-W467 HydrophobicContact CG-CD2 4.02Å; R443-W467 HydrophobicContact CG-CG 4.09Å; R443-W467 HydrophobicContact CG-CZ2 4.34Å; R443-W467 PolarHBondContact NE-O 3.36Å; R443-W467 PolarHBondContact NH2-O 2.93Å
444	P	98.2	Very high	97.1	Very high	3 Å²	3	62.9 Å²	62.9	2%	0.019	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-53.2	136.1	174.1	-25.8	35.3	0	0	0	111.6	L397 W400 P419 F420 I446 W467	L397-P444 HydrophobicContact CD2-CG 3.78Å; W400-P444 HydrophobicContact CD2-CB 3.56Å; W400-P444 HydrophobicContact CD2-CG 4.32Å; W400-P444 HydrophobicContact CE3-CB 4.1Å; W400-P444 HydrophobicContact CG-CB 3.95Å; W400-P444 HydrophobicContact CH2-CB 4.2Å; W400-P444 HydrophobicContact CZ2-CB 3.67Å; W400-P444 HydrophobicContact CZ3-CB 4.39Å; P419-P444 HydrophobicContact CB-CG 3.95Å; F420-P444 HydrophobicContact CD1-CG 4.37Å; F420-P444 HydrophobicContact CE1-CG 4.21Å; F420-P444 HydrophobicContact CE2-CG 4.49Å; F420-P444 HydrophobicContact CZ-CG 4.26Å; P444-I446 PolarHBondContact O-N 3.38Å; P444-W467 HydrophobicContact CB-CH2 4.33Å; P444-W467 HydrophobicContact CB-CZ3 4.19Å; P444-W467 HydrophobicContact CG-CZ3 3.99Å; P444-W467 WeakPolarHBondContact O-CH2 3.41Å
445	T	97.2	Very high	97	Very high	75 Å²	75	60.4 Å²	60.4	46%	0.46	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-62.6	131.4	-172.2	-61.4	0	0	0	0	112.2	W400 R443 W450	W400-T445 PolarHBondContact NE1-O 3.27Å; R443-T445 PolarHBondContact O-N 3.18Å; T445-W450 WeakPolarHBondContact O-CZ3 3.32Å
446	I	97.8	Very high	97	Very high	34 Å²	34	56.6 Å²	56.6	17%	0.174	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-92.1	118.4	168.1	-64.3	175.1	0	0	0	107.9	P444 W450 L451 C460 E464 W467	P444-I446 PolarHBondContact O-N 3.38Å; I446-W450 HydrophobicContact CB-CE3 4.49Å; I446-W450 HydrophobicContact CG2-CE3 4.1Å; I446-L451 HydrophobicContact CG2-CD2 3.88Å; I446-L451 HydrophobicContact CG2-CG 4.22Å; I446-C460 HydrophobicContact CD1-CB 4.1Å; I446-C460 HydrophobicContact CG2-CB 4.12Å; I446-E464 HydrophobicContact CD1-CG 3.72Å; I446-W467 HydrophobicContact CD1-CH2 4.39Å; I446-W467 HydrophobicContact CD1-CZ2 3.96Å; I446-W467 HydrophobicContact CG1-CH2 4.3Å; I446-W467 HydrophobicContact CG1-CZ2 4.29Å
447	K	96.2	Very high	97	Very high	45 Å²	45	57.4 Å²	57.4	20%	0.196	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-81	138.1	-174.6	-56.2	-177.6	-172.8	169.8	0	111.3	D414 H449 W450	D414-K447 IonicContact OD2-NZ 2.55Å; D414-K447 PolarHBondContact OD2-NZ 2.77Å; K447-H449 VanDerWaalsContact CD-CE1 3.46Å; K447-H449 WeakPolarHBondContact CD-CE1 3.5Å; K447-H449 PolarHBondContact O-N 2.62Å; K447-H449 VanDerWaalsContact O-N 3.07Å; K447-W450 HydrophobicContact CB-CD2 3.82Å; K447-W450 HydrophobicContact CB-CE3 4.29Å; K447-W450 HydrophobicContact CB-CG 4.12Å; K447-W450 HydrophobicContact CB-CZ2 4.17Å; K447-W450 HydrophobicContact CD-CH2 4.25Å; K447-W450 HydrophobicContact CD-CZ2 3.53Å; K447-W450 HydrophobicContact CG-CD2 4.23Å; K447-W450 HydrophobicContact CG-CE3 4.49Å; K447-W450 HydrophobicContact CG-CH2 3.99Å; K447-W450 HydrophobicContact CG-CZ2 3.67Å; K447-W450 HydrophobicContact CG-CZ3 4.39Å; K447-W450 VanDerWaalsContact N-CE3 3.34Å; K447-W450 VanDerWaalsContact O-CB 3.3Å; K447-W450 WeakPolarHBondContact O-CB 3.26Å; K447-W450 PolarHBondContact O-N 3.29Å
448	D	95.8	Very high	97	Very high	133 Å²	133	61.5 Å²	61.5	71%	0.711	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-34.9	-178.3	-67.6	-23.5	0	0	0	114.1	W450 L451	D448-W450 VanDerWaalsContact C-N 3.31Å; D448-W450 PolarHBondContact O-N 2.95Å; D448-L451 PolarHBondContact O-N 2.7Å
449	H	94.7	Very high	97.1	Very high	37 Å²	37	61.3 Å²	61.3	17%	0.171	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-25.8	179.7	66.5	-89.7	0	0	0	112.8	A409 K447 L451 K452	A409-H449 WeakPolarHBondContact CB-O 3.44Å; K447-H449 VanDerWaalsContact CD-CE1 3.46Å; K447-H449 WeakPolarHBondContact CD-CE1 3.5Å; K447-H449 PolarHBondContact O-N 2.62Å; K447-H449 VanDerWaalsContact O-N 3.07Å; H449-L451 VanDerWaalsContact C-N 3.29Å; H449-L451 PolarHBondContact O-N 3.07Å; H449-K452 WeakPolarHBondContact O-CB 3.36Å; H449-K452 PolarHBondContact O-N 2.9Å
450	W	96.9	Very high	97.1	Very high	6 Å²	6	55.3 Å²	55.3	2%	0.023	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-63.6	-38.8	173.1	-57.7	-15.8	0	0	0	111.1	W400 V403 T445 I446 K447 D448 K452 H453 L456	W400-W450 AromaticContact CD1-CZ3 3.99Å; W400-W450 AromaticContact NE1-CH2 3.77Å; W400-W450 AromaticContact NE1-CZ3 3.66Å; V403-W450 HydrophobicContact CG1-CD2 3.64Å; V403-W450 HydrophobicContact CG1-CE3 3.43Å; V403-W450 VanDerWaalsContact CG1-CE3 3.43Å; V403-W450 HydrophobicContact CG1-CG 4.15Å; V403-W450 HydrophobicContact CG1-CH2 4.37Å; V403-W450 HydrophobicContact CG1-CZ3 3.82Å; T445-W450 WeakPolarHBondContact O-CZ3 3.32Å; I446-W450 HydrophobicContact CB-CE3 4.49Å; I446-W450 HydrophobicContact CG2-CE3 4.1Å; K447-W450 HydrophobicContact CB-CD2 3.82Å; K447-W450 HydrophobicContact CB-CE3 4.29Å; K447-W450 HydrophobicContact CB-CG 4.12Å; K447-W450 HydrophobicContact CB-CZ2 4.17Å; K447-W450 HydrophobicContact CD-CH2 4.25Å; K447-W450 HydrophobicContact CD-CZ2 3.53Å; K447-W450 HydrophobicContact CG-CD2 4.23Å; K447-W450 HydrophobicContact CG-CE3 4.49Å; K447-W450 HydrophobicContact CG-CH2 3.99Å; K447-W450 HydrophobicContact CG-CZ2 3.67Å; K447-W450 HydrophobicContact CG-CZ3 4.39Å; K447-W450 VanDerWaalsContact N-CE3 3.34Å; K447-W450 VanDerWaalsContact O-CB 3.3Å; K447-W450 WeakPolarHBondContact O-CB 3.26Å; K447-W450 PolarHBondContact O-N 3.29Å; D448-W450 VanDerWaalsContact C-N 3.31Å; D448-W450 PolarHBondContact O-N 2.95Å; W450-K452 PolarHBondContact O-N 3.35Å; W450-H453 PolarHBondContact O-N 3.42Å; W450-H453 VanDerWaalsContact O-N 3.16Å; W450-L456 VanDerWaalsContact O-CB 3.32Å; W450-L456 WeakPolarHBondContact O-CB 3.27Å
451	L	96.8	Very high	97.2	Very high	85 Å²	85	52.9 Å²	52.9	45%	0.445	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-68	-15.1	-179.2	-56.9	179.3	0	0	0	113.4	I446 D448 H449 H453 A457 C460	I446-L451 HydrophobicContact CG2-CD2 3.88Å; I446-L451 HydrophobicContact CG2-CG 4.22Å; D448-L451 PolarHBondContact O-N 2.7Å; H449-L451 VanDerWaalsContact C-N 3.29Å; H449-L451 PolarHBondContact O-N 3.07Å; L451-H453 VanDerWaalsContact C-N 3.34Å; L451-A457 HydrophobicContact CD2-CB 4.49Å; L451-C460 HydrophobicContact CD2-CB 3.98Å
452	K	95.3	Very high	97.2	Very high	166 Å²	166	47 Å²	47	72%	0.722	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-74	-25.6	174.8	-61	179.7	-176.6	176.1	0	112.7	H449 W450	H449-K452 WeakPolarHBondContact O-CB 3.36Å; H449-K452 PolarHBondContact O-N 2.9Å; W450-K452 PolarHBondContact O-N 3.35Å
453	H	95.7	Very high	97.3	Very high	36 Å²	36	43.8 Å²	43.8	17%	0.167	23%	0.228	C	C	.	.	S	Bend	trans	-88	120.8	175.5	-179.7	-89.3	0	0	0	109.6	W290 A408 A409 W450 L451 G455 L456 A457	W290-H453 AromaticContact CD2-CE1 3.69Å; W290-H453 AromaticContact CE2-CE1 3.98Å; W290-H453 AromaticContact CE3-CE1 3.78Å; A408-H453 PolarHBondContact O-CD2 3.49Å; A409-H453 HydrophobicContact CB-CB 4.49Å; W450-H453 PolarHBondContact O-N 3.42Å; W450-H453 VanDerWaalsContact O-N 3.16Å; L451-H453 VanDerWaalsContact C-N 3.34Å; H453-G455 VanDerWaalsContact C-N 3.25Å; H453-G455 PolarHBondContact ND1-N 3.24Å; H453-G455 PolarHBondContact O-N 2.92Å; H453-G455 VanDerWaalsContact O-N 3.14Å; H453-L456 HydrophobicContact CB-CB 4.12Å; H453-L456 HydrophobicContact CB-CD1 4.05Å; H453-L456 HydrophobicContact CB-CG 4.21Å; H453-L456 PolarHBondContact ND1-N 3.22Å; H453-L456 VanDerWaalsContact ND1-N 3.15Å; H453-L456 PolarHBondContact O-N 2.67Å; H453-A457 PolarHBondContact O-N 3.23Å
454	P	95.7	Very high	97.3	Very high	77 Å²	77	46.7 Å²	46.7	50%	0.5	24%	0.243	S	C	.	.	H	α-helix	trans	-61.1	-32.5	-169.7	23	-34.1	0	0	0	113.5	Q458	P454-Q458 WeakPolarHBondContact O-CG 3.32Å; P454-Q458 PolarHBondContact O-N 3.49Å; P454-Q458 PolarHBondContact O-NE2 3.49Å
455	G	96.9	Very high	97.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-73	-39.2	175.1	0	0	0	0	0	113.6	W290 H453 L459	W290-G455 VanDerWaalsContact CH2-O 3.3Å; W290-G455 WeakPolarHBondContact CH2-O 3.49Å; H453-G455 VanDerWaalsContact C-N 3.25Å; H453-G455 PolarHBondContact ND1-N 3.24Å; H453-G455 PolarHBondContact O-N 2.92Å; H453-G455 VanDerWaalsContact O-N 3.14Å; G455-L459 WeakPolarHBondContact O-CB 3.19Å; G455-L459 PolarHBondContact O-N 2.93Å; G455-L459 VanDerWaalsContact O-N 3.08Å
456	L	97.6	Very high	97.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-73.4	-36.3	-179.6	-72.7	176.5	0	0	0	110	W290 L293 V403 C406 A408 A409 W450 H453 Q458 L459 C460	W290-L456 HydrophobicContact CE3-CD2 3.99Å; W290-L456 HydrophobicContact CE3-CG 4.21Å; W290-L456 HydrophobicContact CZ3-CD2 3.73Å; W290-L456 HydrophobicContact CZ3-CG 4.03Å; L293-L456 HydrophobicContact CD1-CD2 4.19Å; V403-L456 HydrophobicContact CG1-CD2 4.22Å; V403-L456 HydrophobicContact CG2-CD2 4.13Å; C406-L456 HydrophobicContact CB-CD2 4.36Å; A408-L456 HydrophobicContact CB-CD1 3.97Å; A408-L456 HydrophobicContact CB-CG 4.37Å; A409-L456 HydrophobicContact CB-CD1 3.85Å; W450-L456 VanDerWaalsContact O-CB 3.32Å; W450-L456 WeakPolarHBondContact O-CB 3.27Å; H453-L456 HydrophobicContact CB-CB 4.12Å; H453-L456 HydrophobicContact CB-CD1 4.05Å; H453-L456 HydrophobicContact CB-CG 4.21Å; H453-L456 PolarHBondContact ND1-N 3.22Å; H453-L456 VanDerWaalsContact ND1-N 3.15Å; H453-L456 PolarHBondContact O-N 2.67Å; L456-Q458 PolarHBondContact O-N 2.86Å; L456-L459 PolarHBondContact O-N 3.03Å; L456-C460 WeakPolarHBondContact O-CB 3.45Å; L456-C460 PolarHBondContact O-N 3.37Å; L456-C460 PolarHBondContact O-SG 2.88Å
457	A	97.8	Very high	97.4	Very high	25 Å²	25	44.8 Å²	44.8	21%	0.207	23%	0.227	C	C	.	.	H	α-helix	trans	-56.8	-49.1	173.1	0	0	0	0	0	112.1	L451 H453 L459 C460 V461	L451-A457 HydrophobicContact CD2-CB 4.49Å; H453-A457 PolarHBondContact O-N 3.23Å; A457-L459 VanDerWaalsContact C-N 3.32Å; A457-L459 PolarHBondContact O-N 2.01Å; A457-C460 WeakPolarHBondContact O-CB 3.46Å; A457-C460 PolarHBondContact O-N 3.35Å; A457-V461 PolarHBondContact O-N 2.91Å; A457-V461 VanDerWaalsContact O-N 3.15Å
458	Q	98.1	Very high	97.5	Very high	87 Å²	87	45.6 Å²	45.6	41%	0.407	23%	0.234	S	C	.	.	H	α-helix	trans	-65.8	-35	177.1	-71.1	177.1	63.4	0	0	112.7	P454 L456 V461 T462 I487	P454-Q458 WeakPolarHBondContact O-CG 3.32Å; P454-Q458 PolarHBondContact O-N 3.49Å; P454-Q458 PolarHBondContact O-NE2 3.49Å; L456-Q458 PolarHBondContact O-N 2.86Å; Q458-V461 PolarHBondContact O-N 2.86Å; Q458-T462 PolarHBondContact O-N 3.27Å; Q458-T462 VanDerWaalsContact O-N 3.15Å; Q458-T462 PolarHBondContact O-OG1 3.45Å; Q458-I487 HydrophobicContact CB-CD1 3.65Å; Q458-I487 HydrophobicContact CB-CG1 3.76Å; Q458-I487 HydrophobicContact CB-CG2 4.32Å
459	L	98.3	Very high	97.7	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-69.7	-35.5	175.2	-170.2	63.7	0	0	0	112	L293 V403 G455 L456 A457 T462 I463 V484	L293-L459 HydrophobicContact CD1-CD2 4.3Å; L293-L459 HydrophobicContact CD2-CD2 3.31Å; L293-L459 HydrophobicContact CG-CD2 4.36Å; V403-L459 HydrophobicContact CG2-CD2 3.57Å; V403-L459 HydrophobicContact CG2-CG 4.16Å; G455-L459 WeakPolarHBondContact O-CB 3.19Å; G455-L459 PolarHBondContact O-N 2.93Å; G455-L459 VanDerWaalsContact O-N 3.08Å; L456-L459 PolarHBondContact O-N 3.03Å; A457-L459 VanDerWaalsContact C-N 3.32Å; A457-L459 PolarHBondContact O-N 2.01Å; L459-T462 WeakPolarHBondContact O-CA 3.39Å; L459-T462 VanDerWaalsContact O-CB 3.26Å; L459-T462 WeakPolarHBondContact O-CB 3.37Å; L459-T462 PolarHBondContact O-N 2.02Å; L459-T462 VanDerWaalsContact O-N 3.11Å; L459-I463 HydrophobicContact CG-CD1 4.4Å; L459-I463 WeakPolarHBondContact O-CG1 3.42Å; L459-I463 PolarHBondContact O-N 2.73Å; L459-V484 HydrophobicContact CD1-CG2 4.06Å
460	C	98.6	Very high	97.8	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.007	23%	0.227	C	C	.	.	H	α-helix	trans	-60.7	-43	173.3	-70.9	0	0	0	0	111.6	I446 L451 L456 A457 T462 I463 E464	I446-C460 HydrophobicContact CD1-CB 4.1Å; I446-C460 HydrophobicContact CG2-CB 4.12Å; L451-C460 HydrophobicContact CD2-CB 3.98Å; L456-C460 WeakPolarHBondContact O-CB 3.45Å; L456-C460 PolarHBondContact O-N 3.37Å; L456-C460 PolarHBondContact O-SG 2.88Å; A457-C460 WeakPolarHBondContact O-CB 3.46Å; A457-C460 PolarHBondContact O-N 3.35Å; C460-T462 VanDerWaalsContact C-N 3.27Å; C460-T462 PolarHBondContact O-N 2.76Å; C460-I463 WeakPolarHBondContact O-CB 3.32Å; C460-I463 PolarHBondContact O-N 2.86Å; C460-I463 VanDerWaalsContact O-N 3.16Å; C460-E464 WeakPolarHBondContact O-CG 3.3Å; C460-E464 PolarHBondContact O-N 2.71Å
461	V	98.6	Very high	97.8	Very high	69 Å²	69	45.1 Å²	45.1	42%	0.418	23%	0.234	S	C	.	.	H	α-helix	trans	-59.7	-40.2	172.6	174.7	0	0	0	0	111.5	A457 Q458 E464 E465	A457-V461 PolarHBondContact O-N 2.91Å; A457-V461 VanDerWaalsContact O-N 3.15Å; Q458-V461 PolarHBondContact O-N 2.86Å; V461-E464 PolarHBondContact O-N 2.94Å; V461-E465 WeakPolarHBondContact CG1-OE1 3.46Å; V461-E465 WeakPolarHBondContact O-CG 3.29Å; V461-E465 PolarHBondContact O-N 3.05Å
462	T	98.8	Very high	97.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-43	175.7	-49	0	0	0	0	111.9	Q458 L459 C460 E464 E465 C466 L475 V480 R483	Q458-T462 PolarHBondContact O-N 3.27Å; Q458-T462 VanDerWaalsContact O-N 3.15Å; Q458-T462 PolarHBondContact O-OG1 3.45Å; L459-T462 WeakPolarHBondContact O-CA 3.39Å; L459-T462 VanDerWaalsContact O-CB 3.26Å; L459-T462 WeakPolarHBondContact O-CB 3.37Å; L459-T462 PolarHBondContact O-N 2.02Å; L459-T462 VanDerWaalsContact O-N 3.11Å; C460-T462 VanDerWaalsContact C-N 3.27Å; C460-T462 PolarHBondContact O-N 2.76Å; T462-E464 VanDerWaalsContact C-N 3.31Å; T462-E464 PolarHBondContact O-N 3.42Å; T462-E465 PolarHBondContact O-N 3.04Å; T462-C466 WeakPolarHBondContact O-CB 3.4Å; T462-C466 PolarHBondContact O-N 3.4Å; T462-C466 PolarHBondContact O-SG 3.18Å; T462-L475 HydrophobicContact CG2-CD1 3.9Å; T462-V480 HydrophobicContact CG2-CG1 4.13Å; T462-V480 HydrophobicContact CG2-CG2 4.23Å; T462-R483 WeakPolarHBondContact OG1-CD 3.45Å
463	I	98.9	Very high	97.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.7	-44.7	175	-71.3	161.8	0	0	0	110.2	L399 W400 V403 L459 C460 E465 C466 W467	L399-I463 HydrophobicContact CB-CD1 4.01Å; L399-I463 HydrophobicContact CB-CG1 3.53Å; L399-I463 HydrophobicContact CD1-CG1 4.34Å; W400-I463 HydrophobicContact CB-CD1 4.37Å; W400-I463 HydrophobicContact CB-CG2 4.26Å; V403-I463 HydrophobicContact CB-CD1 4.44Å; V403-I463 HydrophobicContact CG2-CD1 3.77Å; L459-I463 HydrophobicContact CG-CD1 4.4Å; L459-I463 WeakPolarHBondContact O-CG1 3.42Å; L459-I463 PolarHBondContact O-N 2.73Å; C460-I463 WeakPolarHBondContact O-CB 3.32Å; C460-I463 PolarHBondContact O-N 2.86Å; C460-I463 VanDerWaalsContact O-N 3.16Å; I463-E465 PolarHBondContact O-N 3.03Å; I463-C466 WeakPolarHBondContact O-CB 3.46Å; I463-C466 PolarHBondContact O-N 2.83Å; I463-W467 HydrophobicContact CG2-CD2 3.7Å; I463-W467 HydrophobicContact CG2-CE3 3.47Å; I463-W467 VanDerWaalsContact CG2-CE3 3.47Å; I463-W467 HydrophobicContact CG2-CH2 3.38Å; I463-W467 HydrophobicContact CG2-CZ2 3.59Å; I463-W467 HydrophobicContact CG2-CZ3 3.31Å; I463-W467 VanDerWaalsContact O-CG 3.32Å; I463-W467 PolarHBondContact O-N 2.92Å
464	E	98.8	Very high	98.1	Very high	98 Å²	98	40.8 Å²	40.8	46%	0.458	22%	0.222	S	C	.	.	H	α-helix	trans	-61.3	-43.7	-179.9	-72.6	178.7	125.2	0	0	113.3	I446 C460 V461 T462 W467 D468	I446-E464 HydrophobicContact CD1-CG 3.72Å; C460-E464 WeakPolarHBondContact O-CG 3.3Å; C460-E464 PolarHBondContact O-N 2.71Å; V461-E464 PolarHBondContact O-N 2.94Å; T462-E464 VanDerWaalsContact C-N 3.31Å; T462-E464 PolarHBondContact O-N 3.42Å; E464-W467 HydrophobicContact CG-CZ2 4.32Å; E464-D468 PolarHBondContact O-N 3.48Å
465	E	98.8	Very high	98.2	Very high	60 Å²	60	38.2 Å²	38.2	28%	0.28	20%	0.203	S	C	.	.	H	α-helix	trans	-69.1	-33.5	174.7	-66.8	172.2	-135.2	0	0	112.1	V461 T462 I463 R474 L475 R483	V461-E465 WeakPolarHBondContact CG1-OE1 3.46Å; V461-E465 WeakPolarHBondContact O-CG 3.29Å; V461-E465 PolarHBondContact O-N 3.05Å; T462-E465 PolarHBondContact O-N 3.04Å; I463-E465 PolarHBondContact O-N 3.03Å; E465-R474 WeakPolarHBondContact O-CA 3.33Å; E465-L475 HydrophobicContact CB-CD1 3.84Å; E465-L475 HydrophobicContact CB-CG 3.84Å; E465-L475 VanDerWaalsContact OE2-CD2 3.31Å; E465-L475 WeakPolarHBondContact OE2-CD2 3.07Å; E465-R483 IonicContact OE1-CZ 3.25Å; E465-R483 IonicContact OE1-NH1 2.89Å; E465-R483 PolarHBondContact OE1-NH1 3.08Å; E465-R483 IonicContact OE1-NH2 3.6Å; E465-R483 IonicContact OE2-CZ 3.33Å; E465-R483 IonicContact OE2-NH1 2.72Å; E465-R483 PolarHBondContact OE2-NH1 3.22Å; E465-R483 IonicContact OE2-NH2 2.81Å; E465-R483 PolarHBondContact OE2-NH2 3.13Å
466	C	98.9	Very high	98.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.9	-41.9	176.7	-77.3	0	0	0	0	112.8	Y393 T462 I463 D468 R474 V480	Y393-C466 WeakPolarHBondContact CA-O 3.43Å; T462-C466 WeakPolarHBondContact O-CB 3.4Å; T462-C466 PolarHBondContact O-N 3.4Å; T462-C466 PolarHBondContact O-SG 3.18Å; I463-C466 WeakPolarHBondContact O-CB 3.46Å; I463-C466 PolarHBondContact O-N 2.83Å; C466-D468 VanDerWaalsContact C-N 3.34Å; C466-R474 VanDerWaalsContact O-CD 3.26Å; C466-R474 WeakPolarHBondContact O-CD 3.14Å; C466-R474 WeakPolarHBondContact O-CG 3.48Å; C466-V480 VanDerWaalsContact SG-CG2 3.52Å
467	W	98.6	Very high	98.3	Very high	13 Å²	13	41.2 Å²	41.2	5%	0.049	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	19.3	-176.8	69.5	22.2	0	0	0	113.9	Y393 L397 W400 R443 P444 I446 I463 E464	Y393-W467 HydrophobicContact CD2-CB 3.93Å; Y393-W467 HydrophobicContact CE2-CB 3.92Å; L397-W467 HydrophobicContact CD2-CE3 3.79Å; L397-W467 HydrophobicContact CD2-CZ3 4.22Å; W400-W467 HydrophobicContact CB-CH2 4.33Å; W400-W467 HydrophobicContact CB-CZ3 3.77Å; W400-W467 AromaticContact CD1-CH2 3.8Å; W400-W467 HydrophobicContact CG-CH2 4.25Å; W400-W467 HydrophobicContact CG-CZ3 4Å; R443-W467 HydrophobicContact CB-CD2 4.1Å; R443-W467 HydrophobicContact CB-CE3 4.48Å; R443-W467 HydrophobicContact CB-CH2 4.14Å; R443-W467 HydrophobicContact CB-CZ2 3.72Å; R443-W467 HydrophobicContact CB-CZ3 4.5Å; R443-W467 HydrophobicContact CG-CD2 4.02Å; R443-W467 HydrophobicContact CG-CG 4.09Å; R443-W467 HydrophobicContact CG-CZ2 4.34Å; R443-W467 PolarHBondContact NE-O 3.36Å; R443-W467 PolarHBondContact NH2-O 2.93Å; P444-W467 HydrophobicContact CB-CH2 4.33Å; P444-W467 HydrophobicContact CB-CZ3 4.19Å; P444-W467 HydrophobicContact CG-CZ3 3.99Å; P444-W467 WeakPolarHBondContact O-CH2 3.41Å; I446-W467 HydrophobicContact CD1-CH2 4.39Å; I446-W467 HydrophobicContact CD1-CZ2 3.96Å; I446-W467 HydrophobicContact CG1-CH2 4.3Å; I446-W467 HydrophobicContact CG1-CZ2 4.29Å; I463-W467 HydrophobicContact CG2-CD2 3.7Å; I463-W467 HydrophobicContact CG2-CE3 3.47Å; I463-W467 VanDerWaalsContact CG2-CE3 3.47Å; I463-W467 HydrophobicContact CG2-CH2 3.38Å; I463-W467 HydrophobicContact CG2-CZ2 3.59Å; I463-W467 HydrophobicContact CG2-CZ3 3.31Å; I463-W467 VanDerWaalsContact O-CG 3.32Å; I463-W467 PolarHBondContact O-N 2.92Å; E464-W467 HydrophobicContact CG-CZ2 4.32Å
468	D	98.8	Very high	98.3	Very high	62 Å²	62	41.2 Å²	41.2	33%	0.332	23%	0.227	S	C	.	.			trans	-53	143	178.5	-159.2	-58	0	0	0	110.4	E464 C466 D470 A473 R474	E464-D468 PolarHBondContact O-N 3.48Å; C466-D468 VanDerWaalsContact C-N 3.34Å; D468-D470 VanDerWaalsContact C-N 3.3Å; D468-D470 PolarHBondContact OD1-N 3.41Å; D468-A473 HydrophobicContact CB-CB 4.2Å; D468-R474 HydrophobicContact CB-CG 4.2Å; D468-R474 PolarHBondContact O-NE 3.35Å; D468-R474 PolarHBondContact O-NH2 3.06Å
469	H	98.3	Very high	98.4	Very high	59 Å²	59	39.8 Å²	39.8	27%	0.273	23%	0.226	S	C	.	.	S	Bend	trans	-64.6	-38.9	176.7	-175.7	88.4	0	0	0	110.8	A471	H469-A471 PolarHBondContact O-N 3.42Å
470	D	97.6	Very high	98.4	Very high	85 Å²	85	39.6 Å²	39.6	46%	0.455	23%	0.225	S	C	.	.	S	Bend	trans	-76.4	115.7	171	-175	-2.3	0	0	0	110.1	D468 E472 A473	D468-D470 VanDerWaalsContact C-N 3.3Å; D468-D470 PolarHBondContact OD1-N 3.41Å; D470-E472 PolarHBondContact O-N 3.23Å; D470-E472 PolarHBondContact OD1-N 2.89Å; D470-A473 HydrophobicContact CB-CB 4.14Å; D470-A473 PolarHBondContact O-N 3.24Å
471	A	97.4	Very high	98.4	Very high	21 Å²	21	41.7 Å²	41.7	17%	0.174	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-60.7	-29.2	178.5	0	0	0	0	0	112.7	R389 H469 A473 R474	R389-A471 HydrophobicContact CB-CB 4.27Å; R389-A471 WeakPolarHBondContact CD-O 3.39Å; R389-A471 VanDerWaalsContact CG-O 3.29Å; R389-A471 WeakPolarHBondContact CG-O 3.15Å; R389-A471 PolarHBondContact NE-O 3.44Å; H469-A471 PolarHBondContact O-N 3.42Å; A471-A473 VanDerWaalsContact C-N 3.33Å; A471-R474 PolarHBondContact O-N 2.9Å
472	E	96.4	Very high	98.3	Very high	134 Å²	134	44.5 Å²	44.5	63%	0.626	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-73.8	-26.1	-178.6	-50.3	-131.3	113.4	0	0	113.2	R389 D470 R474	R389-E472 IonicContact CZ-OE1 3.89Å; R389-E472 IonicContact NH1-OE1 2.69Å; R389-E472 PolarHBondContact NH1-OE1 3.45Å; R389-E472 IonicContact NH2-OE1 2.76Å; R389-E472 PolarHBondContact NH2-OE1 3.36Å; D470-E472 PolarHBondContact O-N 3.23Å; D470-E472 PolarHBondContact OD1-N 2.89Å; E472-R474 VanDerWaalsContact C-N 3.27Å
473	A	97.7	Very high	98.3	Very high	48 Å²	48	47.8 Å²	47.8	40%	0.397	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-77.7	-13.2	178	0	0	0	0	0	112.9	D468 D470 A471	D468-A473 HydrophobicContact CB-CB 4.2Å; D470-A473 HydrophobicContact CB-CB 4.14Å; D470-A473 PolarHBondContact O-N 3.24Å; A471-A473 VanDerWaalsContact C-N 3.33Å
474	R	98.6	Very high	98.2	Very high	15 Å²	15	47.9 Å²	47.9	6%	0.057	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-70.9	139.4	-174.8	-60.3	179.7	-165.3	143.5	13.9	112.3	E374 R389 E465 C466 D468 A471 E472	E374-R474 IonicContact OE1-CZ 3.25Å; E374-R474 IonicContact OE1-NH1 3.96Å; E374-R474 PolarHBondContact OE1-NH1 3.01Å; E374-R474 IonicContact OE1-NH2 3.86Å; E374-R474 PolarHBondContact OE1-NH2 2.86Å; E374-R474 IonicContact OE2-CZ 3.46Å; E374-R474 IonicContact OE2-NH1 2.87Å; E374-R474 IonicContact OE2-NH2 3.22Å; E374-R474 PolarHBondContact OE2-NH2 3.33Å; R389-R474 WeakPolarHBondContact O-CD 3.41Å; R389-R474 PolarHBondContact O-NH1 3.45Å; E465-R474 WeakPolarHBondContact O-CA 3.33Å; C466-R474 VanDerWaalsContact O-CD 3.26Å; C466-R474 WeakPolarHBondContact O-CD 3.14Å; C466-R474 WeakPolarHBondContact O-CG 3.48Å; D468-R474 HydrophobicContact CB-CG 4.2Å; D468-R474 PolarHBondContact O-NE 3.35Å; D468-R474 PolarHBondContact O-NH2 3.06Å; A471-R474 PolarHBondContact O-N 2.9Å; E472-R474 VanDerWaalsContact C-N 3.27Å
475	L	98.6	Very high	98.1	Very high	22 Å²	22	44.2 Å²	44.2	12%	0.115	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-61.2	150.5	173.4	-65.9	174.6	0	0	0	112	M392 T462 E465 C479 V480	M392-L475 WeakPolarHBondContact CE-O 3.16Å; M392-L475 WeakPolarHBondContact CG-O 3.28Å; T462-L475 HydrophobicContact CG2-CD1 3.9Å; E465-L475 HydrophobicContact CB-CD1 3.84Å; E465-L475 HydrophobicContact CB-CG 3.84Å; E465-L475 VanDerWaalsContact OE2-CD2 3.31Å; E465-L475 WeakPolarHBondContact OE2-CD2 3.07Å; L475-C479 HydrophobicContact CB-CB 4.43Å; L475-C479 HydrophobicContact CD2-CB 4.21Å; L475-V480 HydrophobicContact CB-CG2 3.91Å; L475-V480 HydrophobicContact CD1-CG2 4.06Å
476	S	98.7	Very high	98	Very high	62 Å²	62	45.9 Å²	45.9	43%	0.434	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-78.8	157.9	164.6	77.6	0	0	0	0	111.2	G478 C479 V480	S476-G478 VanDerWaalsContact C-N 3.28Å; S476-G478 PolarHBondContact O-N 3.3Å; S476-C479 WeakPolarHBondContact O-CB 3.16Å; S476-C479 PolarHBondContact O-N 3Å; S476-C479 VanDerWaalsContact O-N 3.13Å; S476-C479 PolarHBondContact OG-N 3.47Å; S476-C479 PolarHBondContact OG-SG 3.22Å; S476-V480 PolarHBondContact O-N 2.86Å; S476-V480 VanDerWaalsContact O-N 3.1Å
477	A	98.6	Very high	97.8	Very high	1 Å²	1	46 Å²	46	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-59.2	-38	178	0	0	0	0	0	112.9	L304 M392 V480 E481	L304-A477 HydrophobicContact CB-CB 4.05Å; L304-A477 HydrophobicContact CD2-CB 4.22Å; L304-A477 HydrophobicContact CG-CB 4.01Å; M392-A477 HydrophobicContact CE-CB 4.32Å; M392-A477 HydrophobicContact SD-CB 3.66Å; M392-A477 PolarHBondContact SD-N 2.9Å; A477-V480 PolarHBondContact O-N 2.92Å; A477-E481 PolarHBondContact O-N 3.23Å
478	G	98.3	Very high	97.6	Very high	25 Å²	25	48.9 Å²	48.9	26%	0.258	26%	0.263	S	S	.	.	H	α-helix	trans	-64.9	-39.4	175.4	0	0	0	0	0	112.8	S305 S476 V480 E481 E482	S305-G478 WeakPolarHBondContact OG-CA 3.43Å; S305-G478 PolarHBondContact OG-N 3.2Å; S476-G478 VanDerWaalsContact C-N 3.28Å; S476-G478 PolarHBondContact O-N 3.3Å; G478-V480 VanDerWaalsContact C-N 3.31Å; G478-V480 PolarHBondContact O-N 3.15Å; G478-E481 PolarHBondContact O-N 3.14Å; G478-E482 PolarHBondContact O-N 3.37Å
479	C	98.5	Very high	97.2	Very high	57 Å²	57	54.2 Å²	54.2	39%	0.385	28%	0.279	S	S	.	.	H	α-helix	trans	-62.5	-38.9	173.7	-66.3	0	0	0	0	111.9	L475 S476 R483	L475-C479 HydrophobicContact CB-CB 4.43Å; L475-C479 HydrophobicContact CD2-CB 4.21Å; S476-C479 WeakPolarHBondContact O-CB 3.16Å; S476-C479 PolarHBondContact O-N 3Å; S476-C479 VanDerWaalsContact O-N 3.13Å; S476-C479 PolarHBondContact OG-N 3.47Å; S476-C479 PolarHBondContact OG-SG 3.22Å; C479-R483 VanDerWaalsContact O-CB 3.25Å; C479-R483 WeakPolarHBondContact O-CB 3.5Å; C479-R483 PolarHBondContact O-N 3.32Å
480	V	98.7	Very high	96.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.4	-45.3	175.9	178.8	0	0	0	0	110.9	S301 M392 M395 L399 T462 C466 L475 S476 A477 G478 E482 R483 V484	S301-V480 VanDerWaalsContact OG-CG1 3.31Å; S301-V480 WeakPolarHBondContact OG-CG1 3.44Å; M392-V480 HydrophobicContact CE-CB 4.49Å; M392-V480 HydrophobicContact CE-CG2 3.59Å; M395-V480 HydrophobicContact SD-CB 4.24Å; M395-V480 HydrophobicContact SD-CG1 4.01Å; M395-V480 HydrophobicContact SD-CG2 4.31Å; L399-V480 HydrophobicContact CD1-CG1 4Å; T462-V480 HydrophobicContact CG2-CG1 4.13Å; T462-V480 HydrophobicContact CG2-CG2 4.23Å; C466-V480 VanDerWaalsContact SG-CG2 3.52Å; L475-V480 HydrophobicContact CB-CG2 3.91Å; L475-V480 HydrophobicContact CD1-CG2 4.06Å; S476-V480 PolarHBondContact O-N 2.86Å; S476-V480 VanDerWaalsContact O-N 3.1Å; A477-V480 PolarHBondContact O-N 2.92Å; G478-V480 VanDerWaalsContact C-N 3.31Å; G478-V480 PolarHBondContact O-N 3.15Å; V480-E482 PolarHBondContact O-N 3.05Å; V480-R483 PolarHBondContact O-N 2.96Å; V480-V484 HydrophobicContact CG1-CG2 4.21Å; V480-V484 VanDerWaalsContact O-CG2 3.31Å; V480-V484 WeakPolarHBondContact O-CG2 3.15Å; V480-V484 PolarHBondContact O-N 3.41Å
481	E	98.3	Very high	96.2	Very high	45 Å²	45	51.2 Å²	51.2	21%	0.21	27%	0.271	C	S	.	.	H	α-helix	trans	-55.2	-51.7	176.4	-177.5	-170.1	177.4	0	0	111.3	R302 A477 G478 R483 V484 S485	R302-E481 HydrophobicContact CB-CG 4.25Å; R302-E481 WeakPolarHBondContact CG-OE1 3.39Å; R302-E481 IonicContact CZ-OE1 3.86Å; R302-E481 IonicContact NE-OE1 3.41Å; R302-E481 PolarHBondContact NE-OE1 2.94Å; R302-E481 IonicContact NH2-OE1 3.58Å; R302-E481 PolarHBondContact NH2-OE1 2.97Å; A477-E481 PolarHBondContact O-N 3.23Å; G478-E481 PolarHBondContact O-N 3.14Å; E481-R483 VanDerWaalsContact C-N 3.33Å; E481-R483 PolarHBondContact O-N 3.4Å; E481-V484 PolarHBondContact O-N 2.79Å; E481-S485 WeakPolarHBondContact O-CB 3.37Å; E481-S485 PolarHBondContact O-N 3.36Å
482	E	98.1	Very high	95.3	Very high	128 Å²	128	52.9 Å²	52.9	60%	0.598	28%	0.276	S	S	*	.	H	α-helix	trans	-60	-45.5	179.9	-176.1	175.4	-163	0	0	111.1	G478 V480 S485 L486	G478-E482 PolarHBondContact O-N 3.37Å; V480-E482 PolarHBondContact O-N 3.05Å; E482-S485 WeakPolarHBondContact O-CB 3.25Å; E482-S485 PolarHBondContact O-N 3.41Å; E482-L486 HydrophobicContact CG-CD1 4.1Å; E482-L486 HydrophobicContact CG-CG 4.49Å; E482-L486 WeakPolarHBondContact O-CG 3.13Å; E482-L486 PolarHBondContact O-N 2.95Å
483	R	97.9	Very high	93.5	Very high	68 Å²	68	48 Å²	48	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-63.8	-44.8	-179.3	-166.4	-179.4	-69.7	-170.3	2.3	112	T462 E465 C479 V480 E481 S485 L486 I487	T462-R483 WeakPolarHBondContact OG1-CD 3.45Å; E465-R483 IonicContact OE1-CZ 3.25Å; E465-R483 IonicContact OE1-NH1 2.89Å; E465-R483 PolarHBondContact OE1-NH1 3.08Å; E465-R483 IonicContact OE1-NH2 3.6Å; E465-R483 IonicContact OE2-CZ 3.33Å; E465-R483 IonicContact OE2-NH1 2.72Å; E465-R483 PolarHBondContact OE2-NH1 3.22Å; E465-R483 IonicContact OE2-NH2 2.81Å; E465-R483 PolarHBondContact OE2-NH2 3.13Å; C479-R483 VanDerWaalsContact O-CB 3.25Å; C479-R483 WeakPolarHBondContact O-CB 3.5Å; C479-R483 PolarHBondContact O-N 3.32Å; V480-R483 PolarHBondContact O-N 2.96Å; E481-R483 VanDerWaalsContact C-N 3.33Å; E481-R483 PolarHBondContact O-N 3.4Å; R483-S485 VanDerWaalsContact C-N 3.31Å; R483-S485 PolarHBondContact O-N 3.49Å; R483-L486 PolarHBondContact O-N 3.34Å; R483-I487 HydrophobicContact CG-CD1 3.88Å; R483-I487 HydrophobicContact CG-CG1 4.4Å; R483-I487 WeakPolarHBondContact O-CB 3.3Å; R483-I487 WeakPolarHBondContact O-CD1 3.32Å; R483-I487 WeakPolarHBondContact O-CG1 3.17Å; R483-I487 PolarHBondContact O-N 3.26Å
484	V	97.5	Very high	91.5	Very high	3 Å²	3	50 Å²	50	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-42.9	175.9	173	0	0	0	0	110.8	A297 E298 L459 V480 E481 L486 I487 R488	A297-V484 HydrophobicContact CB-CG1 3.93Å; A297-V484 HydrophobicContact CB-CG2 4.19Å; E298-V484 HydrophobicContact CB-CG1 3.9Å; L459-V484 HydrophobicContact CD1-CG2 4.06Å; V480-V484 HydrophobicContact CG1-CG2 4.21Å; V480-V484 VanDerWaalsContact O-CG2 3.31Å; V480-V484 WeakPolarHBondContact O-CG2 3.15Å; V480-V484 PolarHBondContact O-N 3.41Å; E481-V484 PolarHBondContact O-N 2.79Å; V484-L486 PolarHBondContact O-N 2.86Å; V484-I487 PolarHBondContact O-N 2.82Å; V484-R488 WeakPolarHBondContact O-CB 3.07Å; V484-R488 PolarHBondContact O-N 2.7Å
485	S	96.1	Very high	89.2	Confident	21 Å²	21	53.3 Å²	53.3	15%	0.147	29%	0.292	C	S	.	.	H	α-helix	trans	-61.1	-43.7	176.6	-175.5	0	0	0	0	112.2	E481 E482 R483 R489	E481-S485 WeakPolarHBondContact O-CB 3.37Å; E481-S485 PolarHBondContact O-N 3.36Å; E482-S485 WeakPolarHBondContact O-CB 3.25Å; E482-S485 PolarHBondContact O-N 3.41Å; R483-S485 VanDerWaalsContact C-N 3.31Å; R483-S485 PolarHBondContact O-N 3.49Å; S485-R489 VanDerWaalsContact O-CG 3.3Å; S485-R489 WeakPolarHBondContact O-CG 3.42Å; S485-R489 PolarHBondContact O-N 3.18Å; S485-R489 VanDerWaalsContact O-N 3.15Å
486	L	96.3	Very high	86.6	Confident	95 Å²	95	55.6 Å²	55.6	50%	0.497	31%	0.309	S	S	.	.	H	α-helix	trans	-65.5	-45.9	176.5	-70.5	172.9	0	0	0	112.3	E482 R483 V484 R488 R489 S490	E482-L486 HydrophobicContact CG-CD1 4.1Å; E482-L486 HydrophobicContact CG-CG 4.49Å; E482-L486 WeakPolarHBondContact O-CG 3.13Å; E482-L486 PolarHBondContact O-N 2.95Å; R483-L486 PolarHBondContact O-N 3.34Å; V484-L486 PolarHBondContact O-N 2.86Å; L486-R488 VanDerWaalsContact C-N 3.34Å; L486-R488 PolarHBondContact O-N 3.04Å; L486-R489 PolarHBondContact O-N 3.23Å; L486-S490 WeakPolarHBondContact O-CB 3.32Å; L486-S490 PolarHBondContact O-N 3.42Å
487	I	95.1	Very high	83.9	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-46.4	178.3	-67.6	165.1	0	0	0	110.2	W290 Q458 R483 V484 R489 S490 V491	W290-I487 HydrophobicContact CH2-CG2 3.59Å; W290-I487 HydrophobicContact CZ2-CG2 3.68Å; Q458-I487 HydrophobicContact CB-CD1 3.65Å; Q458-I487 HydrophobicContact CB-CG1 3.76Å; Q458-I487 HydrophobicContact CB-CG2 4.32Å; R483-I487 HydrophobicContact CG-CD1 3.88Å; R483-I487 HydrophobicContact CG-CG1 4.4Å; R483-I487 WeakPolarHBondContact O-CB 3.3Å; R483-I487 WeakPolarHBondContact O-CD1 3.32Å; R483-I487 WeakPolarHBondContact O-CG1 3.17Å; R483-I487 PolarHBondContact O-N 3.26Å; V484-I487 PolarHBondContact O-N 2.82Å; I487-R489 VanDerWaalsContact C-N 3.34Å; I487-R489 PolarHBondContact O-N 3.37Å; I487-S490 PolarHBondContact O-N 3.2Å; I487-V491 WeakPolarHBondContact O-CG2 3.49Å; I487-V491 PolarHBondContact O-N 2.79Å
488	R	93.8	Very high	81.3	Confident	72 Å²	72	61.6 Å²	61.6	27%	0.272	34%	0.341	S	S	.	.	H	α-helix	trans	-57.4	-45.4	177.9	-176.6	-174	178.3	179.4	0.6	112	C294 E298 V484 L486 N492	C294-R488 HydrophobicContact CB-CB 3.98Å; C294-R488 HydrophobicContact CB-CG 3.8Å; E298-R488 IonicContact OE2-CZ 3.47Å; E298-R488 IonicContact OE2-NH1 2.73Å; E298-R488 PolarHBondContact OE2-NH1 3.19Å; V484-R488 WeakPolarHBondContact O-CB 3.07Å; V484-R488 PolarHBondContact O-N 2.7Å; L486-R488 VanDerWaalsContact C-N 3.34Å; L486-R488 PolarHBondContact O-N 3.04Å; R488-N492 WeakPolarHBondContact O-CB 3.14Å; R488-N492 PolarHBondContact O-N 2.98Å
489	R	91.9	Very high	78.8	Confident	174 Å²	174	65.9 Å²	65.9	66%	0.657	36%	0.358	S	S	*	.	H	α-helix	trans	-66.3	-42	179.4	-70.6	172.3	-170.3	-174.8	2.8	112.2	S485 L486 I487 G493	S485-R489 VanDerWaalsContact O-CG 3.3Å; S485-R489 WeakPolarHBondContact O-CG 3.42Å; S485-R489 PolarHBondContact O-N 3.18Å; S485-R489 VanDerWaalsContact O-N 3.15Å; L486-R489 PolarHBondContact O-N 3.23Å; I487-R489 VanDerWaalsContact C-N 3.34Å; I487-R489 PolarHBondContact O-N 3.37Å; R489-G493 PolarHBondContact O-N 3.42Å
490	S	88.3	Confident	76.2	Confident	68 Å²	68	67.2 Å²	67.2	48%	0.476	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-46.7	-178.9	-177.7	0	0	0	0	112.3	L486 I487 T494	L486-S490 WeakPolarHBondContact O-CB 3.32Å; L486-S490 PolarHBondContact O-N 3.42Å; I487-S490 PolarHBondContact O-N 3.2Å; S490-T494 PolarHBondContact O-N 3.11Å; S490-T494 PolarHBondContact O-OG1 2.74Å
491	V	85.6	Confident	73.5	Confident	14 Å²	14	70.8 Å²	70.8	9%	0.085	39%	0.389	C	S	.	.	H	α-helix	trans	-71.2	-39.7	-179	178.4	0	0	0	0	112.1	W290 I487 T494	W290-V491 HydrophobicContact CZ2-CB 4.26Å; W290-V491 HydrophobicContact CZ2-CG2 3.9Å; I487-V491 WeakPolarHBondContact O-CG2 3.49Å; I487-V491 PolarHBondContact O-N 2.79Å; V491-T494 PolarHBondContact O-OG1 3.14Å; V491-T494 VanDerWaalsContact O-OG1 3.13Å
492	N	78.5	Confident	70.9	Confident	55 Å²	55	73.7 Å²	73.7	29%	0.294	41%	0.405	S	S	.	.	H	α-helix	trans	-72.3	-32	178	-72.1	-5.8	0	0	0	112	N291 R488 T495 S496	N291-N492 PolarHBondContact OD1-ND2 3.16Å; N291-N492 PolarHBondContact OD1-OD1 3.36Å; R488-N492 WeakPolarHBondContact O-CB 3.14Å; R488-N492 PolarHBondContact O-N 2.98Å; N492-T495 PolarHBondContact O-N 3.49Å; N492-T495 PolarHBondContact O-OG1 2.86Å; N492-S496 PolarHBondContact O-N 2.82Å
493	G	58.7	Low	68.3	Low	31 Å²	31	72.2 Å²	72.2	32%	0.32	41%	0.405	S	S	.	.	H	α-helix	trans	-62.8	-41.2	174.4	0	0	0	0	0	112.8	R489 T495 S496 D497	R489-G493 PolarHBondContact O-N 3.42Å; G493-T495 VanDerWaalsContact C-N 3.29Å; G493-T495 PolarHBondContact O-N 2.71Å; G493-S496 PolarHBondContact O-N 3.26Å; G493-S496 VanDerWaalsContact O-N 3.12Å; G493-D497 PolarHBondContact O-N 2.96Å; G493-D497 VanDerWaalsContact O-N 3.16Å
494	T	54.9	Low	65.8	Low	90 Å²	90	73 Å²	73	55%	0.552	42%	0.417	S	S	*	.	H	α-helix	trans	-64.8	-30.9	179.4	8.1	0	0	0	0	112.9	S490 V491 C498	S490-T494 PolarHBondContact O-N 3.11Å; S490-T494 PolarHBondContact O-OG1 2.74Å; V491-T494 PolarHBondContact O-OG1 3.14Å; V491-T494 VanDerWaalsContact O-OG1 3.13Å; T494-C498 WeakPolarHBondContact O-CB 3.47Å; T494-C498 PolarHBondContact O-N 3.39Å
495	T	51.1	Low	63.2	Low	86 Å²	86	76.8 Å²	76.8	53%	0.528	44%	0.444	S	S	.	.	H	α-helix	trans	-71.1	-31.5	174.3	50.1	0	0	0	0	113.7	N492 G493 L499	N492-T495 PolarHBondContact O-N 3.49Å; N492-T495 PolarHBondContact O-OG1 2.86Å; G493-T495 VanDerWaalsContact C-N 3.29Å; G493-T495 PolarHBondContact O-N 2.71Å; T495-L499 PolarHBondContact O-N 3.48Å
496	S	44.8	Very low	60.7	Low	70 Å²	70	81.2 Å²	81.2	49%	0.49	47%	0.47	S	S	.	.	H	α-helix	trans	-76	-39.5	179	-163.6	0	0	0	0	111.8	N492 G493 C498 L499 V500	N492-S496 PolarHBondContact O-N 2.82Å; G493-S496 PolarHBondContact O-N 3.26Å; G493-S496 VanDerWaalsContact O-N 3.12Å; S496-C498 VanDerWaalsContact C-N 3.33Å; S496-C498 PolarHBondContact O-N 3.29Å; S496-L499 PolarHBondContact O-N 3.41Å; S496-V500 WeakPolarHBondContact O-CG2 3.47Å; S496-V500 PolarHBondContact O-N 2.85Å; S496-V500 VanDerWaalsContact O-N 3.13Å
497	D	42.1	Very low	58.2	Low	115 Å²	115	81.5 Å²	81.5	62%	0.615	48%	0.476	S	S	*	.	H	α-helix	trans	-70.4	-30.6	178.7	-70.1	-22.1	0	0	0	112.4	G493 V500 S501	G493-D497 PolarHBondContact O-N 2.96Å; G493-D497 VanDerWaalsContact O-N 3.16Å; D497-V500 PolarHBondContact O-N 2.69Å; D497-S501 WeakPolarHBondContact O-CB 3.41Å; D497-S501 PolarHBondContact O-N 2.66Å
498	C	42.4	Very low	55.5	Low	73 Å²	73	88.5 Å²	88.5	49%	0.493	51%	0.513	S	S	.	.	H	α-helix	trans	-68.2	-38.5	174.7	-162.4	0	0	0	0	111.9	T494 S496 S501 L502	T494-C498 WeakPolarHBondContact O-CB 3.47Å; T494-C498 PolarHBondContact O-N 3.39Å; S496-C498 VanDerWaalsContact C-N 3.33Å; S496-C498 PolarHBondContact O-N 3.29Å; C498-S501 PolarHBondContact O-N 2.93Å; C498-L502 WeakPolarHBondContact O-CB 3.39Å; C498-L502 PolarHBondContact O-N 3.5Å
499	L	45.7	Very low	53	Low	116 Å²	116	91.1 Å²	91.1	61%	0.607	54%	0.537	S	S	*	.	H	α-helix	trans	-68	-38.4	174.4	-86.4	161.6	0	0	0	112.5	T495 S496 L502 V503	T495-L499 PolarHBondContact O-N 3.48Å; S496-L499 PolarHBondContact O-N 3.41Å; L499-L502 PolarHBondContact O-N 3Å; L499-V503 VanDerWaalsContact O-CG2 3.24Å; L499-V503 WeakPolarHBondContact O-CG2 3.49Å; L499-V503 PolarHBondContact O-N 3.26Å
500	V	44.8	Very low	50.6	Low	84 Å²	84	90.4 Å²	90.4	51%	0.509	55%	0.546	S	S	.	.	H	α-helix	trans	-68.4	-37.4	176.9	175.9	0	0	0	0	111.4	S496 D497 V503 T504	S496-V500 WeakPolarHBondContact O-CG2 3.47Å; S496-V500 PolarHBondContact O-N 2.85Å; S496-V500 VanDerWaalsContact O-N 3.13Å; D497-V500 PolarHBondContact O-N 2.69Å; V500-V503 PolarHBondContact O-N 3.13Å; V500-T504 WeakPolarHBondContact O-CB 3.36Å; V500-T504 PolarHBondContact O-N 3.22Å; V500-T504 PolarHBondContact O-OG1 2.88Å
501	S	42.3	Very low	48.3	Very low	76 Å²	76	95 Å²	95	53%	0.531	56%	0.564	S	S	.	*	H	α-helix	trans	-70.4	-34.9	177	-165.1	0	0	0	0	113	D497 C498 T504 S505	D497-S501 WeakPolarHBondContact O-CB 3.41Å; D497-S501 PolarHBondContact O-N 2.66Å; C498-S501 PolarHBondContact O-N 2.93Å; S501-T504 WeakPolarHBondContact CA-OG1 3.24Å; S501-T504 PolarHBondContact O-OG1 3.1Å; S501-S505 WeakPolarHBondContact O-CB 3.28Å; S501-S505 PolarHBondContact O-N 3.35Å; S501-S505 PolarHBondContact O-OG 2.94Å
502	L	43.3	Very low	46.2	Very low	105 Å²	105	99.2 Å²	99.2	55%	0.55	59%	0.592	S	S	.	*	H	α-helix	trans	-71	-33.4	172.7	-91.8	151	0	0	0	113	C498 L499 S505 V506	C498-L502 WeakPolarHBondContact O-CB 3.39Å; C498-L502 PolarHBondContact O-N 3.5Å; L499-L502 PolarHBondContact O-N 3Å; L502-S505 PolarHBondContact O-OG 2.67Å; L502-V506 WeakPolarHBondContact O-CG2 3.27Å
503	V	43.9	Very low	44.3	Very low	98 Å²	98	102.9 Å²	102.9	59%	0.594	62%	0.619	S	S	*	*	H	α-helix	trans	-78.2	-34.5	177.5	175.2	0	0	0	0	111.8	L499 V500	L499-V503 VanDerWaalsContact O-CG2 3.24Å; L499-V503 WeakPolarHBondContact O-CG2 3.49Å; L499-V503 PolarHBondContact O-N 3.26Å; V500-V503 PolarHBondContact O-N 3.13Å
504	T	44.9	Very low	43.2	Very low	84 Å²	84	111.4 Å²	111.4	52%	0.515	65%	0.647	S	S	.	*	H	α-helix	trans	-77.6	-19.7	178.4	42.6	0	0	0	0	114.1	V500 S501	V500-T504 WeakPolarHBondContact O-CB 3.36Å; V500-T504 PolarHBondContact O-N 3.22Å; V500-T504 PolarHBondContact O-OG1 2.88Å; S501-T504 WeakPolarHBondContact CA-OG1 3.24Å; S501-T504 PolarHBondContact O-OG1 3.1Å
505	S	42.6	Very low	42.7	Very low	82 Å²	82	116.1 Å²	116.1	57%	0.573	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-10.4	175.5	48.9	0	0	0	0	114.4	S501 L502	S501-S505 WeakPolarHBondContact O-CB 3.28Å; S501-S505 PolarHBondContact O-N 3.35Å; S501-S505 PolarHBondContact O-OG 2.94Å; L502-S505 PolarHBondContact O-OG 2.67Å
506	V	43.3	Very low	42.4	Very low	115 Å²	115	117.2 Å²	117.2	70%	0.697	67%	0.674	S	S	*	*	S	Bend	trans	-101.9	-3.7	-176.4	-177	0	0	0	0	113.3	L502	L502-V506 WeakPolarHBondContact O-CG2 3.27Å
507	T	43.5	Very low	42.3	Very low	101 Å²	101	119.3 Å²	119.3	62%	0.62	69%	0.689	S	S	*	*			trans	-117.5	12.5	-177.2	57.1	0	0	0	0	116.6	V509	T507-V509 PolarHBondContact O-N 3.15Å
508	N	38.7	Very low	42.3	Very low	150 Å²	150	125.4 Å²	125.4	80%	0.802	72%	0.719	S	S	*	*			trans	-79.8	75.3	169.4	-80.8	-17.6	0	0	0	110.6
509	V	41.8	Very low	42.3	Very low	126 Å²	126	128.1 Å²	128.1	76%	0.764	73%	0.73	S	S	*	*			trans	-86.9	122.8	156.9	178.5	0	0	0	0	107	T507 L511	T507-V509 PolarHBondContact O-N 3.15Å; V509-L511 PolarHBondContact O-N 3.29Å
510	D	41.6	Very low	42.1	Very low	159 Å²	159	128.7 Å²	128.7	85%	0.85	74%	0.737	S	S	*	*			trans	-43.6	119.3	-179.9	-64.8	-58	0	0	0	113.2
511	L	39.8	Very low	42	Very low	165 Å²	165	131.2 Å²	131.2	86%	0.864	75%	0.749	S	S	*	*			trans	-104.6	133.5	161.4	-83	164.2	0	0	0	108.7	V509	V509-L511 PolarHBondContact O-N 3.29Å
512	P	41.5	Very low	41.9	Very low	103 Å²	103	134.4 Å²	134.4	67%	0.669	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-73.9	155.8	-176	31.7	-33.7	0	0	0	111	K514	P512-K514 PolarHBondContact O-N 3.36Å
513	P	37.8	Very low	41.8	Very low	131 Å²	131	136.3 Å²	136.3	85%	0.851	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-71.2	124.3	-176.5	29.5	-31.9	0	0	0	109.7
514	K	35.9	Very low	41.7	Very low	211 Å²	211	138.8 Å²	138.8	92%	0.917	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-90.1	131.7	166.3	-94.7	-174.2	175.5	-179.9	0	110	P512	P512-K514 PolarHBondContact O-N 3.36Å
515	E	46	Very low	41.5	Very low	188 Å²	188	142.7 Å²	142.7	88%	0.879	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-56.9	147.2	-178.5	-65.7	173.1	144.7	0	0	113.4
516	S	43.3	Very low	41.4	Very low	109 Å²	109	147.4 Å²	147.4	76%	0.762	83%	0.825	S	S	*	*			trans	-45.1	140.4	162.2	40.9	0	0	0	0	114.1
517	S	44.1	Very low	41.2	Very low	114 Å²	114	150.1 Å²	150.1	80%	0.797	84%	0.835	S	S	*	*			trans	-171.2	125.3	142.9	-82.1	0	0	0	0	112.8
518	I	41	Very low	41	Very low	244 Å²	244	154.5 Å²	154.5	100%	1.251	86%	0.855	S	S	*	*			trans	80.4	0	155.7	-51.8	167.7	0	0	0	117.8

Retrieved 518 of 518 residues in 636.6 ms (Link to these results)

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