A0A087XSL6_POEFO Loading...

Crossover junction endonuclease MUS81

Interacts with EME1 to form a DNA structure-specific endonuclease with substrate preference for branched DNA structures with a 5'-end at the branch nick. Typical substrates include 3'-flap structures, D-loops, replication forks and nicked Holliday junctions. May be required in mitosis for the processing of stalled or collapsed replication fork intermediates. May be required in meiosis for the repair of meiosis-specific double strand breaks subsequent to single-end invasion (SEI).

AlphaFold DB , UniProt , Accession A0A087XSL6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 635 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	45.5	Very low	34.7	Very low	230 Å²	230	159 Å²	159	100%	1.133	86%	0.856	S	S	*	*				0	128.2	0	-68.2	-60.9	-164.8	0	0	106.9
2	P	34	Very low	34.8	Very low	137 Å²	137	162.7 Å²	162.7	89%	0.89	86%	0.858	S	S	*	*			cis	-114.1	167.3	44.5	24.9	-7.1	0	0	0	114.7
3	A	31.2	Very low	34.7	Very low	89 Å²	89	168.8 Å²	168.8	74%	0.736	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-78.8	153.5	-169.5	0	0	0	0	0	113.7
4	S	35.5	Very low	34.9	Very low	118 Å²	118	163.5 Å²	163.5	83%	0.825	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-65.9	127.2	180	49.8	0	0	0	0	114.3
5	E	32.7	Very low	35.2	Very low	183 Å²	183	163.4 Å²	163.4	86%	0.855	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-81.5	138.3	157	-76.2	-171	153.2	0	0	110.6
6	P	34.3	Very low	35.8	Very low	119 Å²	119	160.4 Å²	160.4	77%	0.773	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-80	124.6	179.9	30.8	-31.2	0	0	0	111.4	R8	P6-R8 PolarHBondContact O-N 3.34Å
7	V	31.5	Very low	37	Very low	130 Å²	130	157.2 Å²	157.2	79%	0.788	84%	0.843	S	S	*	*			trans	-62.2	115.5	171.5	180	0	0	0	0	109.4	F9	V7-F9 PolarHBondContact O-N 3.07Å
8	R	32	Very low	38.2	Very low	232 Å²	232	149.7 Å²	149.7	88%	0.875	81%	0.805	S	S	*	*			trans	-68	111.6	175.7	-78.6	179.9	172.8	175.4	-0.1	110.4	P6	P6-R8 PolarHBondContact O-N 3.34Å
9	F	34.3	Very low	39.8	Very low	199 Å²	199	144 Å²	144	87%	0.873	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-59.9	136.7	166.5	-72.7	-86.5	0	0	0	111	V7 R11	V7-F9 PolarHBondContact O-N 3.07Å; F9-R11 PolarHBondContact O-N 2.87Å
10	G	33.6	Very low	41.5	Very low	75 Å²	75	137 Å²	137	77%	0.773	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-51.5	126.3	-179.8	0	0	0	0	0	112.3	K12	G10-K12 PolarHBondContact O-N 3.45Å
11	R	37.5	Very low	43.1	Very low	237 Å²	237	131 Å²	131	89%	0.894	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-53.3	125.9	171.1	-71.9	176.1	175.2	174.9	-2.5	108.8	F9 R13	F9-R11 PolarHBondContact O-N 2.87Å; R11-R13 PolarHBondContact O-N 3.32Å; R11-R13 VanDerWaalsContact O-N 3.08Å
12	K	35.5	Very low	44.7	Very low	203 Å²	203	120.5 Å²	120.5	88%	0.883	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-47.2	118.7	162.2	-72.8	179.6	177.8	177.9	0	107.3	G10 A14	G10-K12 PolarHBondContact O-N 3.45Å; K12-A14 PolarHBondContact O-N 3.42Å; K12-A14 VanDerWaalsContact O-N 3.16Å
13	R	33.9	Very low	47	Very low	243 Å²	243	114.3 Å²	114.3	92%	0.917	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-54.6	123.5	169.3	-82.1	-180	172	176.7	-3.1	107.1	R11 L15	R11-R13 PolarHBondContact O-N 3.32Å; R11-R13 VanDerWaalsContact O-N 3.08Å; R13-L15 PolarHBondContact O-N 3.27Å
14	A	37.4	Very low	49.5	Very low	94 Å²	94	111.6 Å²	111.6	78%	0.777	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-56.7	131.6	168.6	0	0	0	0	0	107.9	K12	K12-A14 PolarHBondContact O-N 3.42Å; K12-A14 VanDerWaalsContact O-N 3.16Å
15	L	39.6	Very low	51.7	Low	162 Å²	162	110.1 Å²	110.1	85%	0.848	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-53.7	135.4	169.9	-78.3	155.8	0	0	0	108	R13	R13-L15 PolarHBondContact O-N 3.27Å
16	P	43.6	Very low	54.2	Low	116 Å²	116	102.7 Å²	102.7	75%	0.753	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-57.8	142.6	178.8	22.6	-30.7	0	0	0	110.1	C18	P16-C18 PolarHBondContact O-N 3.21Å
17	S	56.2	Low	56.7	Low	105 Å²	105	97 Å²	97	73%	0.734	50%	0.495	S	S	*	.			trans	-45.5	130.4	169.2	-177.1	0	0	0	0	108.8
18	C	60.2	Low	59.3	Low	23 Å²	23	92.6 Å²	92.6	16%	0.155	47%	0.468	C	S	.	.			trans	-44.3	131.9	-179.7	56.2	0	0	0	0	110.5	P16 N20 L24	P16-C18 PolarHBondContact O-N 3.21Å; C18-N20 PolarHBondContact O-N 3.22Å; C18-L24 HydrophobicContact CB-CD2 4.1Å; C18-L24 WeakPolarHBondContact SG-CD2 3.29Å
19	P	67.5	Low	61.9	Low	41 Å²	41	85.1 Å²	85.1	27%	0.266	45%	0.446	S	S	.	.	S	Bend	trans	-61.1	-11.9	-179.2	-23.2	32.2	0	0	0	114.6	P21 P56 H97	P19-P21 WeakPolarHBondContact O-CD 3.33Å; P19-P56 WeakPolarHBondContact CG-O 3.15Å; P19-H97 PolarHBondContact O-ND1 3.36Å
20	N	73.8	Confident	64.4	Low	3 Å²	3	76.7 Å²	76.7	2%	0.016	41%	0.409	C	S	.	.			trans	-127.2	68.8	-174.4	-60	-54.8	0	0	0	111.3	C18 L22 F23 L24 L52 L57 P58 L59	C18-N20 PolarHBondContact O-N 3.22Å; N20-L22 PolarHBondContact O-N 2.96Å; N20-F23 HydrophobicContact CB-CB 4.42Å; N20-F23 HydrophobicContact CB-CD2 4.33Å; N20-L24 WeakPolarHBondContact O-CB 3.5Å; N20-L24 PolarHBondContact O-N 3.1Å; N20-L24 VanDerWaalsContact O-N 3.12Å; N20-L52 HydrophobicContact CB-CD1 4.03Å; N20-L52 HydrophobicContact CB-CD2 4.4Å; N20-L52 HydrophobicContact CB-CG 4.41Å; N20-L57 PolarHBondContact ND2-O 2.77Å; N20-P58 VanDerWaalsContact OD1-CA 3.29Å; N20-P58 WeakPolarHBondContact OD1-CA 3.46Å; N20-L59 PolarHBondContact OD1-N 2.99Å
21	P	76.3	Confident	67.1	Low	13 Å²	13	75.8 Å²	75.8	8%	0.084	38%	0.382	C	S	.	.	H	α-helix	trans	-67.3	-36.7	-171.5	26.7	-34.6	0	0	0	113.6	P19 L24 Q25 L99	P19-P21 WeakPolarHBondContact O-CD 3.33Å; P21-L24 PolarHBondContact O-N 3.01Å; P21-Q25 WeakPolarHBondContact O-CB 3.4Å; P21-Q25 PolarHBondContact O-N 3.25Å; P21-L99 HydrophobicContact CB-CD1 4.08Å; P21-L99 HydrophobicContact CB-CG 3.99Å
22	L	78.1	Confident	69.4	Low	8 Å²	8	67.8 Å²	67.8	4%	0.042	36%	0.358	C	S	.	.	H	α-helix	trans	-71.6	-42.3	-179.8	-68.7	-178.2	0	0	0	112.8	N20 L24 Q25 W26 I96 L99	N20-L22 PolarHBondContact O-N 2.96Å; L22-L24 VanDerWaalsContact C-N 3.28Å; L22-L24 PolarHBondContact O-N 2.79Å; L22-Q25 PolarHBondContact O-N 2.92Å; L22-W26 HydrophobicContact CB-CH2 4.4Å; L22-W26 HydrophobicContact CB-CZ2 4.14Å; L22-W26 HydrophobicContact CD1-CZ2 4.42Å; L22-W26 PolarHBondContact O-N 2.78Å; L22-I96 HydrophobicContact CD1-CB 4.3Å; L22-L99 HydrophobicContact CD2-CD2 4.12Å
23	F	81.8	Confident	71.9	Confident	7 Å²	7	62.4 Å²	62.4	3%	0.031	34%	0.335	C	S	.	.	H	α-helix	trans	-64.3	-36.4	174.2	-68.4	-25	0	0	0	111.8	N20 W26 L27 L52 L59 L79 L83	N20-F23 HydrophobicContact CB-CB 4.42Å; N20-F23 HydrophobicContact CB-CD2 4.33Å; F23-W26 AromaticContact CD1-CE3 3.7Å; F23-W26 HydrophobicContact CD1-CE3 3.7Å; F23-W26 AromaticContact CD1-CZ3 3.62Å; F23-W26 HydrophobicContact CD1-CZ3 3.62Å; F23-W26 HydrophobicContact CE1-CE3 4.16Å; F23-W26 AromaticContact CE1-CZ3 3.64Å; F23-W26 HydrophobicContact CE1-CZ3 3.64Å; F23-L27 WeakPolarHBondContact O-CB 3.37Å; F23-L27 VanDerWaalsContact O-CG 3.28Å; F23-L27 WeakPolarHBondContact O-CG 3.48Å; F23-L27 PolarHBondContact O-N 2.75Å; F23-L27 VanDerWaalsContact O-N 3.1Å; F23-L52 HydrophobicContact CB-CD2 3.81Å; F23-L59 HydrophobicContact CD2-CB 4.17Å; F23-L59 HydrophobicContact CD2-CD1 4.16Å; F23-L59 HydrophobicContact CE2-CB 3.81Å; F23-L59 HydrophobicContact CE2-CD1 4.39Å; F23-L79 HydrophobicContact CD1-CD2 4.11Å; F23-L83 HydrophobicContact CE1-CD1 4.37Å; F23-L83 HydrophobicContact CZ-CD2 4.35Å
24	L	83.2	Confident	74.4	Confident	33 Å²	33	51 Å²	51	17%	0.173	29%	0.294	C	S	.	.	H	α-helix	trans	-64.3	-45.9	173.9	-177.8	65.4	0	0	0	111.4	C18 N20 P21 L22 L27 T28 I49 L52	C18-L24 HydrophobicContact CB-CD2 4.1Å; C18-L24 WeakPolarHBondContact SG-CD2 3.29Å; N20-L24 WeakPolarHBondContact O-CB 3.5Å; N20-L24 PolarHBondContact O-N 3.1Å; N20-L24 VanDerWaalsContact O-N 3.12Å; P21-L24 PolarHBondContact O-N 3.01Å; L22-L24 VanDerWaalsContact C-N 3.28Å; L22-L24 PolarHBondContact O-N 2.79Å; L24-L27 PolarHBondContact O-N 3.05Å; L24-T28 WeakPolarHBondContact O-CB 3.35Å; L24-T28 PolarHBondContact O-N 3.05Å; L24-T28 PolarHBondContact O-OG1 3.35Å; L24-I49 HydrophobicContact CD1-CB 4.42Å; L24-I49 HydrophobicContact CD1-CG1 4.37Å; L24-I49 HydrophobicContact CD1-CG2 3.69Å; L24-L52 HydrophobicContact CB-CD2 4.1Å
25	Q	82.4	Confident	76.7	Confident	87 Å²	87	53 Å²	53	41%	0.407	29%	0.285	S	S	.	.	H	α-helix	trans	-58.4	-51.9	177.2	-175.6	179.3	3.1	0	0	110.8	P21 L22 L27 T28 D29	P21-Q25 WeakPolarHBondContact O-CB 3.4Å; P21-Q25 PolarHBondContact O-N 3.25Å; L22-Q25 PolarHBondContact O-N 2.92Å; Q25-L27 VanDerWaalsContact C-N 3.33Å; Q25-L27 PolarHBondContact O-N 2.84Å; Q25-T28 WeakPolarHBondContact O-CA 3.14Å; Q25-T28 WeakPolarHBondContact O-CB 3.22Å; Q25-T28 PolarHBondContact O-N 3.2Å; Q25-D29 VanDerWaalsContact O-CG 3.25Å; Q25-D29 PolarHBondContact O-N 2.86Å
26	W	85.9	Confident	79	Confident	27 Å²	27	53.5 Å²	53.5	10%	0.102	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-35.9	-177.2	-65.6	-16.4	0	0	0	114.2	L22 F23 L30 L79 K82 L83 H86	L22-W26 HydrophobicContact CB-CH2 4.4Å; L22-W26 HydrophobicContact CB-CZ2 4.14Å; L22-W26 HydrophobicContact CD1-CZ2 4.42Å; L22-W26 PolarHBondContact O-N 2.78Å; F23-W26 AromaticContact CD1-CE3 3.7Å; F23-W26 HydrophobicContact CD1-CE3 3.7Å; F23-W26 AromaticContact CD1-CZ3 3.62Å; F23-W26 HydrophobicContact CD1-CZ3 3.62Å; F23-W26 HydrophobicContact CE1-CE3 4.16Å; F23-W26 AromaticContact CE1-CZ3 3.64Å; F23-W26 HydrophobicContact CE1-CZ3 3.64Å; W26-L30 WeakPolarHBondContact O-CB 3.44Å; W26-L30 WeakPolarHBondContact O-CD1 2.85Å; W26-L30 WeakPolarHBondContact O-CG 3.34Å; W26-L30 PolarHBondContact O-N 2.67Å; W26-L30 VanDerWaalsContact O-N 3.17Å; W26-L79 HydrophobicContact CB-CD2 4.22Å; W26-L79 HydrophobicContact CE3-CD2 4.01Å; W26-K82 HydrophobicContact CB-CD 3.6Å; W26-K82 HydrophobicContact CD2-CB 3.83Å; W26-K82 HydrophobicContact CD2-CD 3.85Å; W26-K82 HydrophobicContact CD2-CG 4.47Å; W26-K82 HydrophobicContact CE3-CB 3.56Å; W26-K82 HydrophobicContact CE3-CD 4.21Å; W26-K82 HydrophobicContact CG-CB 4.44Å; W26-K82 HydrophobicContact CG-CD 3.54Å; W26-K82 HydrophobicContact CH2-CB 4.35Å; W26-K82 HydrophobicContact CZ3-CB 3.82Å; W26-K82 PolarHBondContact O-NZ 2.82Å; W26-L83 HydrophobicContact CH2-CB 4.32Å; W26-L83 HydrophobicContact CH2-CD1 4.16Å; W26-L83 HydrophobicContact CZ3-CB 4.09Å; W26-L83 HydrophobicContact CZ3-CD1 4.41Å; W26-H86 HydrophobicContact CH2-CB 4.02Å; W26-H86 HydrophobicContact CZ2-CB 3.95Å
27	L	85.6	Confident	81	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-71.9	-33.2	174.6	-72.6	172	0	0	0	112	F23 L24 Q25 R31 Y45 A48 I49 L52 F71 I75 L79	F23-L27 WeakPolarHBondContact O-CB 3.37Å; F23-L27 VanDerWaalsContact O-CG 3.28Å; F23-L27 WeakPolarHBondContact O-CG 3.48Å; F23-L27 PolarHBondContact O-N 2.75Å; F23-L27 VanDerWaalsContact O-N 3.1Å; L24-L27 PolarHBondContact O-N 3.05Å; Q25-L27 VanDerWaalsContact C-N 3.33Å; Q25-L27 PolarHBondContact O-N 2.84Å; L27-R31 WeakPolarHBondContact O-CB 2.86Å; L27-R31 PolarHBondContact O-N 2.61Å; L27-Y45 HydrophobicContact CD2-CD1 4.23Å; L27-A48 HydrophobicContact CD1-CB 4.34Å; L27-I49 HydrophobicContact CB-CD1 4.24Å; L27-I49 HydrophobicContact CB-CG1 3.7Å; L27-L52 HydrophobicContact CD1-CD2 4.12Å; L27-F71 HydrophobicContact CD1-CE1 4.06Å; L27-F71 HydrophobicContact CD1-CZ 3.71Å; L27-I75 HydrophobicContact CD2-CG2 3.91Å; L27-L79 HydrophobicContact CD2-CD1 4.39Å; L27-L79 HydrophobicContact CD2-CD2 4.32Å; L27-L79 HydrophobicContact CG-CD2 4.22Å
28	T	86.1	Confident	82.2	Confident	37 Å²	37	52 Å²	52	23%	0.227	27%	0.268	C	S	.	.	H	α-helix	trans	-66.4	-47.1	175.6	-56.2	0	0	0	0	110.3	L24 Q25 L30 R31 D32	L24-T28 WeakPolarHBondContact O-CB 3.35Å; L24-T28 PolarHBondContact O-N 3.05Å; L24-T28 PolarHBondContact O-OG1 3.35Å; Q25-T28 WeakPolarHBondContact O-CA 3.14Å; Q25-T28 WeakPolarHBondContact O-CB 3.22Å; Q25-T28 PolarHBondContact O-N 3.2Å; T28-L30 VanDerWaalsContact C-N 3.33Å; T28-L30 PolarHBondContact O-N 3.39Å; T28-R31 WeakPolarHBondContact O-CB 3.46Å; T28-R31 PolarHBondContact O-N 2.96Å; T28-D32 PolarHBondContact O-N 3.11Å
29	D	86.9	Confident	83.5	Confident	75 Å²	75	55 Å²	55	40%	0.401	28%	0.282	S	S	.	.	H	α-helix	trans	-59.3	-43.8	176.1	-57.3	-23.2	0	0	0	111.4	Q25 R31 D32 E33	Q25-D29 VanDerWaalsContact O-CG 3.25Å; Q25-D29 PolarHBondContact O-N 2.86Å; D29-R31 VanDerWaalsContact C-N 3.34Å; D29-R31 PolarHBondContact O-N 2.97Å; D29-D32 PolarHBondContact O-N 3.39Å; D29-E33 WeakPolarHBondContact O-CB 3.45Å; D29-E33 PolarHBondContact O-N 3.03Å
30	L	87.3	Confident	84.2	Confident	21 Å²	21	61.8 Å²	61.8	11%	0.11	31%	0.307	C	S	.	.	H	α-helix	trans	-66.7	-34.1	178.6	-73.5	167.1	0	0	0	112.9	W26 T28 A34 Y45 I78	W26-L30 WeakPolarHBondContact O-CB 3.44Å; W26-L30 WeakPolarHBondContact O-CD1 2.85Å; W26-L30 WeakPolarHBondContact O-CG 3.34Å; W26-L30 PolarHBondContact O-N 2.67Å; W26-L30 VanDerWaalsContact O-N 3.17Å; T28-L30 VanDerWaalsContact C-N 3.33Å; T28-L30 PolarHBondContact O-N 3.39Å; L30-A34 WeakPolarHBondContact O-CB 3.39Å; L30-A34 PolarHBondContact O-N 2.81Å; L30-Y45 HydrophobicContact CB-CD1 4.47Å; L30-Y45 HydrophobicContact CB-CD2 4.04Å; L30-Y45 HydrophobicContact CB-CE1 4.38Å; L30-Y45 HydrophobicContact CB-CE2 3.91Å; L30-Y45 HydrophobicContact CB-CG 4.33Å; L30-Y45 HydrophobicContact CD1-CE1 4.43Å; L30-Y45 WeakPolarHBondContact O-CD2 3.3Å; L30-I78 HydrophobicContact CD1-CG2 3.55Å; L30-I78 HydrophobicContact CD2-CG2 4.43Å
31	R	90.6	Very high	84.6	Confident	56 Å²	56	65.1 Å²	65.1	21%	0.211	32%	0.324	C	S	.	.	H	α-helix	trans	-66.2	-45.6	173.7	-179	-158	65.1	-159.2	-7.9	110.5	L27 T28 D29 A34 K35 Q42 I49	L27-R31 WeakPolarHBondContact O-CB 2.86Å; L27-R31 PolarHBondContact O-N 2.61Å; T28-R31 WeakPolarHBondContact O-CB 3.46Å; T28-R31 PolarHBondContact O-N 2.96Å; D29-R31 VanDerWaalsContact C-N 3.34Å; D29-R31 PolarHBondContact O-N 2.97Å; R31-A34 PolarHBondContact O-N 3.49Å; R31-K35 WeakPolarHBondContact O-CB 3.43Å; R31-K35 PolarHBondContact O-N 3Å; R31-Q42 HydrophobicContact CG-CB 4.41Å; R31-I49 HydrophobicContact CB-CD1 4.26Å
32	D	86	Confident	84.9	Confident	70 Å²	70	66.2 Å²	66.2	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-70.7	-38.7	-175.1	-66.1	-16.5	0	0	0	110.9	T28 D29 K35 E36	T28-D32 PolarHBondContact O-N 3.11Å; D29-D32 PolarHBondContact O-N 3.39Å; D32-K35 WeakPolarHBondContact O-CB 3.29Å; D32-K35 PolarHBondContact O-N 2.9Å; D32-E36 PolarHBondContact O-N 2.89Å
33	E	87.2	Confident	85.3	Confident	89 Å²	89	73 Å²	73	42%	0.416	35%	0.354	S	S	.	.	H	α-helix	trans	-62.8	-42.1	170.6	-171.5	-173.2	168.1	0	0	112.1	D29 K35 E36 K37	D29-E33 WeakPolarHBondContact O-CB 3.45Å; D29-E33 PolarHBondContact O-N 3.03Å; E33-K35 VanDerWaalsContact C-N 3.29Å; E33-K35 PolarHBondContact O-N 3.5Å; E33-E36 PolarHBondContact O-N 2.89Å; E33-K37 HydrophobicContact CG-CD 4.19Å; E33-K37 WeakPolarHBondContact O-CB 3.13Å; E33-K37 WeakPolarHBondContact O-CG 3.38Å; E33-K37 PolarHBondContact O-N 2.86Å; E33-K37 IonicContact OE1-NZ 2.97Å; E33-K37 PolarHBondContact OE1-NZ 3.38Å
34	A	86.1	Confident	85.4	Confident	5 Å²	5	75.8 Å²	75.8	4%	0.041	37%	0.372	C	S	.	.	H	α-helix	trans	-66	-33.2	175.8	0	0	0	0	0	112.3	L30 R31 G38 L39 I41 Q42 Y45	L30-A34 WeakPolarHBondContact O-CB 3.39Å; L30-A34 PolarHBondContact O-N 2.81Å; R31-A34 PolarHBondContact O-N 3.49Å; A34-G38 PolarHBondContact O-N 3.16Å; A34-L39 HydrophobicContact CB-CB 4.28Å; A34-L39 PolarHBondContact O-N 3.29Å; A34-I41 HydrophobicContact CB-CG2 3.6Å; A34-Q42 HydrophobicContact CB-CB 3.93Å; A34-Y45 HydrophobicContact CB-CD2 4.21Å; A34-Y45 HydrophobicContact CB-CE2 4.24Å
35	K	87.2	Confident	85.6	Confident	136 Å²	136	75.1 Å²	75.1	59%	0.591	37%	0.367	S	S	*	.	H	α-helix	trans	-70.4	-43.7	176.6	-177.8	176.3	179.9	-171.2	0	111.6	R31 D32 E33 K37 G38 Q42	R31-K35 WeakPolarHBondContact O-CB 3.43Å; R31-K35 PolarHBondContact O-N 3Å; D32-K35 WeakPolarHBondContact O-CB 3.29Å; D32-K35 PolarHBondContact O-N 2.9Å; E33-K35 VanDerWaalsContact C-N 3.29Å; E33-K35 PolarHBondContact O-N 3.5Å; K35-K37 VanDerWaalsContact C-N 3.29Å; K35-K37 PolarHBondContact O-N 3.09Å; K35-G38 PolarHBondContact O-N 2.86Å; K35-G38 VanDerWaalsContact O-N 3.14Å; K35-Q42 VanDerWaalsContact CB-OE1 3.31Å; K35-Q42 VanDerWaalsContact CG-OE1 3.29Å
36	E	86.7	Confident	85.8	Confident	172 Å²	172	73.9 Å²	73.9	80%	0.804	36%	0.362	S	S	*	.	H	α-helix	trans	-62	-38.7	176.1	-171.9	175.6	-168	0	0	111.6	D32 E33 G38	D32-E36 PolarHBondContact O-N 2.89Å; E33-E36 PolarHBondContact O-N 2.89Å; E36-G38 VanDerWaalsContact C-N 3.27Å; E36-G38 PolarHBondContact O-N 3.42Å
37	K	86.2	Confident	85.8	Confident	129 Å²	129	78.4 Å²	78.4	56%	0.561	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	3	176.4	-65.7	176	179.1	176.8	0	114.3	E33 K35 L39	E33-K37 HydrophobicContact CG-CD 4.19Å; E33-K37 WeakPolarHBondContact O-CB 3.13Å; E33-K37 WeakPolarHBondContact O-CG 3.38Å; E33-K37 PolarHBondContact O-N 2.86Å; E33-K37 IonicContact OE1-NZ 2.97Å; E33-K37 PolarHBondContact OE1-NZ 3.38Å; K35-K37 VanDerWaalsContact C-N 3.29Å; K35-K37 PolarHBondContact O-N 3.09Å; K37-L39 HydrophobicContact CB-CD1 3.98Å; K37-L39 HydrophobicContact CB-CG 3.89Å; K37-L39 HydrophobicContact CD-CD1 4.42Å; K37-L39 PolarHBondContact O-N 2.74Å
38	G	82.1	Confident	85.8	Confident	59 Å²	59	78.4 Å²	78.4	61%	0.608	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	17.2	-179.2	0	0	0	0	0	115	A34 K35 E36	A34-G38 PolarHBondContact O-N 3.16Å; K35-G38 PolarHBondContact O-N 2.86Å; K35-G38 VanDerWaalsContact O-N 3.14Å; E36-G38 VanDerWaalsContact C-N 3.27Å; E36-G38 PolarHBondContact O-N 3.42Å
39	L	86.5	Confident	85.7	Confident	87 Å²	87	77 Å²	77	46%	0.455	37%	0.373	S	S	.	.			trans	-79.1	135.6	-175.1	-62.1	173.1	0	0	0	111.3	A34 K37 I41 Q42	A34-L39 HydrophobicContact CB-CB 4.28Å; A34-L39 PolarHBondContact O-N 3.29Å; K37-L39 HydrophobicContact CB-CD1 3.98Å; K37-L39 HydrophobicContact CB-CG 3.89Å; K37-L39 HydrophobicContact CD-CD1 4.42Å; K37-L39 PolarHBondContact O-N 2.74Å; L39-I41 HydrophobicContact CB-CG2 3.9Å; L39-I41 HydrophobicContact CD1-CG2 4.48Å; L39-I41 PolarHBondContact O-N 2.97Å; L39-I41 VanDerWaalsContact O-N 3.1Å; L39-Q42 WeakPolarHBondContact O-CG 3.46Å; L39-Q42 PolarHBondContact O-N 2.88Å
40	K	83	Confident	85.6	Confident	184 Å²	184	77.1 Å²	77.1	80%	0.8	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.9	177.1	-65.8	-177.9	-179.3	176.4	0	113.5	Q42 Y43	K40-Q42 PolarHBondContact O-N 2.96Å; K40-Y43 VanDerWaalsContact O-CD2 3.31Å; K40-Y43 WeakPolarHBondContact O-CD2 3.09Å; K40-Y43 PolarHBondContact O-N 3.08Å
41	I	81.7	Confident	85.4	Confident	72 Å²	72	77 Å²	77	37%	0.369	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-16.6	178.5	-161.1	165.5	0	0	0	113.4	A34 L39 Y43 T44 Y45	A34-I41 HydrophobicContact CB-CG2 3.6Å; L39-I41 HydrophobicContact CB-CG2 3.9Å; L39-I41 HydrophobicContact CD1-CG2 4.48Å; L39-I41 PolarHBondContact O-N 2.97Å; L39-I41 VanDerWaalsContact O-N 3.1Å; I41-Y43 PolarHBondContact O-N 3.46Å; I41-T44 WeakPolarHBondContact O-CA 3.31Å; I41-T44 WeakPolarHBondContact O-CB 3.3Å; I41-T44 PolarHBondContact O-N 3.37Å; I41-Y45 HydrophobicContact CB-CE2 4.34Å; I41-Y45 HydrophobicContact CD1-CE2 4.14Å; I41-Y45 HydrophobicContact CG1-CD2 4.31Å; I41-Y45 HydrophobicContact CG1-CE1 4.49Å; I41-Y45 HydrophobicContact CG1-CE2 3.83Å; I41-Y45 HydrophobicContact CG2-CD2 4.26Å; I41-Y45 HydrophobicContact CG2-CE2 3.72Å; I41-Y45 WeakPolarHBondContact O-CD2 3.48Å; I41-Y45 PolarHBondContact O-N 2.64Å
42	Q	82.8	Confident	85	Confident	36 Å²	36	74.3 Å²	74.3	17%	0.168	36%	0.364	C	S	.	.	H	α-helix	trans	-54.1	-36.5	173.1	69.4	-179.6	-50	0	0	112.5	R31 A34 K35 L39 K40 T44 Y45 Q46	R31-Q42 HydrophobicContact CG-CB 4.41Å; A34-Q42 HydrophobicContact CB-CB 3.93Å; K35-Q42 VanDerWaalsContact CB-OE1 3.31Å; K35-Q42 VanDerWaalsContact CG-OE1 3.29Å; L39-Q42 WeakPolarHBondContact O-CG 3.46Å; L39-Q42 PolarHBondContact O-N 2.88Å; K40-Q42 PolarHBondContact O-N 2.96Å; Q42-T44 VanDerWaalsContact C-N 3.32Å; Q42-T44 PolarHBondContact O-N 3.05Å; Q42-Y45 PolarHBondContact O-N 2.67Å; Q42-Q46 WeakPolarHBondContact O-CB 3.46Å; Q42-Q46 PolarHBondContact O-N 3.35Å
43	Y	85.7	Confident	84.6	Confident	150 Å²	150	75 Å²	75	59%	0.588	37%	0.368	S	S	*	.	H	α-helix	trans	-70	-32.7	179.2	-61.2	-68.8	0	0	0	111.4	K40 I41 K47	K40-Y43 VanDerWaalsContact O-CD2 3.31Å; K40-Y43 WeakPolarHBondContact O-CD2 3.09Å; K40-Y43 PolarHBondContact O-N 3.08Å; I41-Y43 PolarHBondContact O-N 3.46Å; Y43-K47 VanDerWaalsContact O-CG 3.3Å; Y43-K47 WeakPolarHBondContact O-CG 3.25Å; Y43-K47 PolarHBondContact O-N 3.09Å
44	T	84.3	Confident	84.2	Confident	67 Å²	67	79.2 Å²	79.2	41%	0.411	39%	0.385	S	S	.	.	H	α-helix	trans	-69.2	-45.7	175.3	-48.8	0	0	0	0	110.7	I41 Q42 Q46 K47 A48 I75	I41-T44 WeakPolarHBondContact O-CA 3.31Å; I41-T44 WeakPolarHBondContact O-CB 3.3Å; I41-T44 PolarHBondContact O-N 3.37Å; Q42-T44 VanDerWaalsContact C-N 3.32Å; Q42-T44 PolarHBondContact O-N 3.05Å; T44-Q46 PolarHBondContact O-N 2.86Å; T44-K47 PolarHBondContact O-N 3.21Å; T44-A48 PolarHBondContact O-N 3.32Å; T44-I75 HydrophobicContact CG2-CD1 4.01Å
45	Y	86.8	Confident	83.7	Confident	18 Å²	18	81.6 Å²	81.6	7%	0.071	39%	0.393	C	S	.	.	H	α-helix	trans	-64	-39.4	175.2	-63.2	-46.2	0	0	0	112.2	L27 L30 A34 I41 Q42 K47 A48 I49 I75	L27-Y45 HydrophobicContact CD2-CD1 4.23Å; L30-Y45 HydrophobicContact CB-CD1 4.47Å; L30-Y45 HydrophobicContact CB-CD2 4.04Å; L30-Y45 HydrophobicContact CB-CE1 4.38Å; L30-Y45 HydrophobicContact CB-CE2 3.91Å; L30-Y45 HydrophobicContact CB-CG 4.33Å; L30-Y45 HydrophobicContact CD1-CE1 4.43Å; L30-Y45 WeakPolarHBondContact O-CD2 3.3Å; A34-Y45 HydrophobicContact CB-CD2 4.21Å; A34-Y45 HydrophobicContact CB-CE2 4.24Å; I41-Y45 HydrophobicContact CB-CE2 4.34Å; I41-Y45 HydrophobicContact CD1-CE2 4.14Å; I41-Y45 HydrophobicContact CG1-CD2 4.31Å; I41-Y45 HydrophobicContact CG1-CE1 4.49Å; I41-Y45 HydrophobicContact CG1-CE2 3.83Å; I41-Y45 HydrophobicContact CG2-CD2 4.26Å; I41-Y45 HydrophobicContact CG2-CE2 3.72Å; I41-Y45 WeakPolarHBondContact O-CD2 3.48Å; I41-Y45 PolarHBondContact O-N 2.64Å; Q42-Y45 PolarHBondContact O-N 2.67Å; Y45-K47 VanDerWaalsContact C-N 3.33Å; Y45-K47 PolarHBondContact O-N 3.14Å; Y45-A48 PolarHBondContact O-N 2.96Å; Y45-I49 VanDerWaalsContact O-CG1 3.29Å; Y45-I49 WeakPolarHBondContact O-CG1 3.47Å; Y45-I49 PolarHBondContact O-N 3.18Å; Y45-I75 HydrophobicContact CD1-CD1 4.41Å; Y45-I75 HydrophobicContact CD1-CG1 4.49Å; Y45-I75 HydrophobicContact CE1-CG1 4.16Å
46	Q	87.3	Confident	82.8	Confident	62 Å²	62	80 Å²	80	29%	0.29	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-38.2	175.5	-173.3	58.6	62.6	0	0	112.6	Q42 T44 N50	Q42-Q46 WeakPolarHBondContact O-CB 3.46Å; Q42-Q46 PolarHBondContact O-N 3.35Å; T44-Q46 PolarHBondContact O-N 2.86Å; Q46-N50 PolarHBondContact NE2-OD1 3.24Å; Q46-N50 VanDerWaalsContact NE2-OD1 3.14Å; Q46-N50 PolarHBondContact O-N 3.42Å; Q46-N50 VanDerWaalsContact O-N 3.12Å; Q46-N50 PolarHBondContact O-ND2 2.81Å; Q46-N50 PolarHBondContact O-OD1 2.72Å
47	K	86.1	Confident	82.2	Confident	121 Å²	121	76.4 Å²	76.4	53%	0.526	38%	0.383	S	S	.	.	H	α-helix	trans	-66.7	-40.1	173.8	-75.2	176.8	-179	-177.8	0	111.9	Y43 T44 Y45 N50 S51 N70	Y43-K47 VanDerWaalsContact O-CG 3.3Å; Y43-K47 WeakPolarHBondContact O-CG 3.25Å; Y43-K47 PolarHBondContact O-N 3.09Å; T44-K47 PolarHBondContact O-N 3.21Å; Y45-K47 VanDerWaalsContact C-N 3.33Å; Y45-K47 PolarHBondContact O-N 3.14Å; K47-N50 PolarHBondContact O-N 3.3Å; K47-S51 PolarHBondContact O-N 2.78Å; K47-S51 VanDerWaalsContact O-N 3.11Å; K47-S51 PolarHBondContact O-OG 3.36Å; K47-N70 HydrophobicContact CB-CB 4.01Å
48	A	85.3	Confident	81.5	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-64.5	-41.9	175.3	0	0	0	0	0	112.3	L27 T44 Y45 N50 S51 L52 F71 I75	L27-A48 HydrophobicContact CD1-CB 4.34Å; T44-A48 PolarHBondContact O-N 3.32Å; Y45-A48 PolarHBondContact O-N 2.96Å; A48-N50 VanDerWaalsContact C-N 3.34Å; A48-N50 PolarHBondContact O-N 2.68Å; A48-S51 PolarHBondContact O-N 2.65Å; A48-L52 PolarHBondContact O-N 3.15Å; A48-F71 HydrophobicContact CB-CD2 4.18Å; A48-F71 HydrophobicContact CB-CE2 3.83Å; A48-F71 HydrophobicContact CB-CZ 4.17Å; A48-F71 WeakPolarHBondContact O-CE2 3.44Å; A48-I75 HydrophobicContact CB-CD1 4.24Å
49	I	84.9	Confident	81.3	Confident	7 Å²	7	70.7 Å²	70.7	4%	0.036	35%	0.348	C	S	.	.	H	α-helix	trans	-57.8	-45.8	173.6	-71.8	165.4	0	0	0	111.1	L24 L27 R31 Y45 S51 L52 N53	L24-I49 HydrophobicContact CD1-CB 4.42Å; L24-I49 HydrophobicContact CD1-CG1 4.37Å; L24-I49 HydrophobicContact CD1-CG2 3.69Å; L27-I49 HydrophobicContact CB-CD1 4.24Å; L27-I49 HydrophobicContact CB-CG1 3.7Å; R31-I49 HydrophobicContact CB-CD1 4.26Å; Y45-I49 VanDerWaalsContact O-CG1 3.29Å; Y45-I49 WeakPolarHBondContact O-CG1 3.47Å; Y45-I49 PolarHBondContact O-N 3.18Å; I49-S51 VanDerWaalsContact C-N 3.3Å; I49-S51 PolarHBondContact O-N 3.48Å; I49-L52 PolarHBondContact O-N 3Å; I49-N53 PolarHBondContact O-N 2.97Å; I49-N53 PolarHBondContact O-ND2 3.02Å
50	N	83.2	Confident	80.3	Confident	79 Å²	79	73.6 Å²	73.6	42%	0.422	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-35.9	179.4	-69.6	-10.1	0	0	0	112.2	Q46 K47 A48 K54	Q46-N50 PolarHBondContact NE2-OD1 3.24Å; Q46-N50 VanDerWaalsContact NE2-OD1 3.14Å; Q46-N50 PolarHBondContact O-N 3.42Å; Q46-N50 VanDerWaalsContact O-N 3.12Å; Q46-N50 PolarHBondContact O-ND2 2.81Å; Q46-N50 PolarHBondContact O-OD1 2.72Å; K47-N50 PolarHBondContact O-N 3.3Å; A48-N50 VanDerWaalsContact C-N 3.34Å; A48-N50 PolarHBondContact O-N 2.68Å; N50-K54 WeakPolarHBondContact O-CG 3.36Å; N50-K54 PolarHBondContact O-N 3Å
51	S	83.7	Confident	80	Confident	17 Å²	17	67.2 Å²	67.2	12%	0.119	33%	0.331	C	S	.	.	H	α-helix	trans	-69.4	-41.5	174.4	-62.4	0	0	0	0	112.3	K47 A48 I49 K54 Y55 Q69 N70	K47-S51 PolarHBondContact O-N 2.78Å; K47-S51 VanDerWaalsContact O-N 3.11Å; K47-S51 PolarHBondContact O-OG 3.36Å; A48-S51 PolarHBondContact O-N 2.65Å; I49-S51 VanDerWaalsContact C-N 3.3Å; I49-S51 PolarHBondContact O-N 3.48Å; S51-K54 PolarHBondContact O-N 3.02Å; S51-Y55 PolarHBondContact O-N 3.35Å; S51-Q69 WeakPolarHBondContact CB-O 3.48Å; S51-Q69 PolarHBondContact OG-O 3.27Å; S51-N70 PolarHBondContact OG-ND2 3.29Å
52	L	82.3	Confident	79.5	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66	-38	179.1	-171	65.9	0	0	0	112.1	N20 F23 L24 L27 A48 I49 K54 Y55 L59 L68 F71	N20-L52 HydrophobicContact CB-CD1 4.03Å; N20-L52 HydrophobicContact CB-CD2 4.4Å; N20-L52 HydrophobicContact CB-CG 4.41Å; F23-L52 HydrophobicContact CB-CD2 3.81Å; L24-L52 HydrophobicContact CB-CD2 4.1Å; L27-L52 HydrophobicContact CD1-CD2 4.12Å; A48-L52 PolarHBondContact O-N 3.15Å; I49-L52 PolarHBondContact O-N 3Å; L52-K54 VanDerWaalsContact C-N 3.28Å; L52-K54 PolarHBondContact O-N 2.8Å; L52-Y55 PolarHBondContact O-N 2.93Å; L52-L59 HydrophobicContact CD1-CD1 3.69Å; L52-L68 HydrophobicContact CB-CD1 4.36Å; L52-L68 HydrophobicContact CD1-CD1 3.54Å; L52-F71 HydrophobicContact CB-CE2 4.48Å; L52-F71 HydrophobicContact CB-CZ 4.25Å; L52-F71 HydrophobicContact CD1-CZ 4.43Å
53	N	77.5	Confident	79	Confident	85 Å²	85	69.8 Å²	69.8	46%	0.455	34%	0.34	S	S	.	.	H	α-helix	trans	-68	-24.9	176.1	-80.9	-31.8	0	0	0	113.9	I49 Y55	I49-N53 PolarHBondContact O-N 2.97Å; I49-N53 PolarHBondContact O-ND2 3.02Å; N53-Y55 VanDerWaalsContact C-N 3.34Å
54	K	78.3	Confident	78.4	Confident	177 Å²	177	65.5 Å²	65.5	77%	0.77	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-11.7	176.1	-71.4	174.6	-177.7	-177.3	0	112.7	N50 S51 L52 P56	N50-K54 WeakPolarHBondContact O-CG 3.36Å; N50-K54 PolarHBondContact O-N 3Å; S51-K54 PolarHBondContact O-N 3.02Å; L52-K54 VanDerWaalsContact C-N 3.28Å; L52-K54 PolarHBondContact O-N 2.8Å; K54-P56 WeakPolarHBondContact O-CD 3.44Å
55	Y	76.9	Confident	78	Confident	55 Å²	55	62.3 Å²	62.3	22%	0.216	31%	0.305	C	S	.	.			trans	-90.5	119	-175.2	-169.1	-113.8	0	0	0	111.5	S51 L52 N53 L57 L59 L68	S51-Y55 PolarHBondContact O-N 3.35Å; L52-Y55 PolarHBondContact O-N 2.93Å; N53-Y55 VanDerWaalsContact C-N 3.34Å; Y55-L57 HydrophobicContact CD1-CB 4.27Å; Y55-L57 WeakPolarHBondContact CD1-O 3.5Å; Y55-L57 HydrophobicContact CE1-CB 3.59Å; Y55-L57 WeakPolarHBondContact CE1-O 3.47Å; Y55-L57 PolarHBondContact O-N 2.89Å; Y55-L59 HydrophobicContact CD1-CD2 4.2Å; Y55-L59 HydrophobicContact CD1-CG 4.33Å; Y55-L59 HydrophobicContact CE1-CD2 3.59Å; Y55-L59 HydrophobicContact CE1-CG 4.11Å; Y55-L68 HydrophobicContact CD1-CD2 3.96Å; Y55-L68 HydrophobicContact CD2-CD2 3.34Å; Y55-L68 HydrophobicContact CE1-CD2 4.41Å; Y55-L68 HydrophobicContact CE2-CD2 3.88Å; Y55-L68 HydrophobicContact CG-CD1 4.49Å; Y55-L68 HydrophobicContact CG-CD2 3.39Å
56	P	67.7	Low	77.5	Confident	102 Å²	102	67 Å²	67	66%	0.662	33%	0.326	S	S	*	.			trans	-85.3	-2.1	-170.9	33.2	-35.3	0	0	0	114.6	P19 K54	P19-P56 WeakPolarHBondContact CG-O 3.15Å; K54-P56 WeakPolarHBondContact O-CD 3.44Å
57	L	73.4	Confident	76.9	Confident	97 Å²	97	69.2 Å²	69.2	51%	0.508	34%	0.339	S	S	.	.	S	Bend	trans	-111.6	146.5	-175.4	-62	174.7	0	0	0	113.1	N20 Y55	N20-L57 PolarHBondContact ND2-O 2.77Å; Y55-L57 HydrophobicContact CD1-CB 4.27Å; Y55-L57 WeakPolarHBondContact CD1-O 3.5Å; Y55-L57 HydrophobicContact CE1-CB 3.59Å; Y55-L57 WeakPolarHBondContact CE1-O 3.47Å; Y55-L57 PolarHBondContact O-N 2.89Å
58	P	72.8	Confident	76.5	Confident	66 Å²	66	64.2 Å²	64.2	43%	0.429	32%	0.318	S	S	.	.			trans	-67.7	132.6	171.8	25.3	-30.3	0	0	0	111.3	N20 H97	N20-P58 VanDerWaalsContact OD1-CA 3.29Å; N20-P58 WeakPolarHBondContact OD1-CA 3.46Å; P58-H97 WeakPolarHBondContact CB-CE1 3.16Å
59	L	77.8	Confident	76	Confident	2 Å²	2	71.7 Å²	71.7	1%	0.01	35%	0.353	C	S	.	.			trans	-94.2	126.9	174.2	-64.5	174	0	0	0	109.4	N20 F23 L52 Y55 E64 A65 L68 I96 H97	N20-L59 PolarHBondContact OD1-N 2.99Å; F23-L59 HydrophobicContact CD2-CB 4.17Å; F23-L59 HydrophobicContact CD2-CD1 4.16Å; F23-L59 HydrophobicContact CE2-CB 3.81Å; F23-L59 HydrophobicContact CE2-CD1 4.39Å; L52-L59 HydrophobicContact CD1-CD1 3.69Å; Y55-L59 HydrophobicContact CD1-CD2 4.2Å; Y55-L59 HydrophobicContact CD1-CG 4.33Å; Y55-L59 HydrophobicContact CE1-CD2 3.59Å; Y55-L59 HydrophobicContact CE1-CG 4.11Å; L59-E64 HydrophobicContact CD2-CB 3.9Å; L59-A65 HydrophobicContact CD1-CB 3.89Å; L59-L68 HydrophobicContact CD1-CD1 3.86Å; L59-I96 WeakPolarHBondContact O-CD1 3.49Å; L59-H97 PolarHBondContact O-CE1 2.86Å; L59-H97 VanDerWaalsContact O-CE1 3.23Å
60	K	65.9	Low	75.9	Confident	148 Å²	148	75 Å²	75	64%	0.643	37%	0.371	S	S	*	.			trans	-84.7	-22.9	-176.3	-62.8	179.5	178.5	179.2	0	113.6	E64 I96	K60-E64 PolarHBondContact N-OE2 3.49Å; K60-I96 WeakPolarHBondContact O-CD1 3.34Å
61	N	75.9	Confident	75.9	Confident	50 Å²	50	71.9 Å²	71.9	27%	0.267	35%	0.353	S	S	.	.	S	Bend	trans	-154.3	167.9	-177.3	57.3	63.3	0	0	0	111.3	K63 E64	N61-K63 PolarHBondContact O-N 2.78Å; N61-K63 WeakPolarHBondContact OD1-CA 3.42Å; N61-K63 WeakPolarHBondContact OD1-CB 3.37Å; N61-K63 PolarHBondContact OD1-N 2.64Å; N61-E64 PolarHBondContact ND2-OE1 2.74Å; N61-E64 PolarHBondContact O-N 3.3Å; N61-E64 WeakPolarHBondContact OD1-CG 3.32Å; N61-E64 PolarHBondContact OD1-N 2.95Å
62	A	71.1	Confident	75.6	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.008	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-17	179.5	0	0	0	0	0	113.9	A65 C76 L79 D80	A62-A65 WeakPolarHBondContact O-CB 3.37Å; A62-C76 WeakPolarHBondContact CB-O 3.06Å; A62-C76 PolarHBondContact O-SG 3.32Å; A62-L79 HydrophobicContact CB-CB 3.84Å; A62-D80 HydrophobicContact CB-CB 3.7Å; A62-D80 VanDerWaalsContact CB-N 3.34Å
63	K	71.9	Confident	75.4	Confident	162 Å²	162	78.2 Å²	78.2	70%	0.704	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-34.8	176	-62.1	179.6	-179.6	175.9	0	111.9	N61 A65 K66	N61-K63 PolarHBondContact O-N 2.78Å; N61-K63 WeakPolarHBondContact OD1-CA 3.42Å; N61-K63 WeakPolarHBondContact OD1-CB 3.37Å; N61-K63 PolarHBondContact OD1-N 2.64Å; K63-A65 VanDerWaalsContact C-N 3.25Å; K63-A65 PolarHBondContact O-N 2.83Å; K63-K66 WeakPolarHBondContact O-CB 3.29Å; K63-K66 PolarHBondContact O-N 3.35Å
64	E	74.5	Confident	75.4	Confident	59 Å²	59	76.5 Å²	76.5	28%	0.276	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-67.7	-27.3	173.1	-74.2	171.5	-157.7	0	0	111.9	L59 K60 N61 K66 I67	L59-E64 HydrophobicContact CD2-CB 3.9Å; K60-E64 PolarHBondContact N-OE2 3.49Å; N61-E64 PolarHBondContact ND2-OE1 2.74Å; N61-E64 PolarHBondContact O-N 3.3Å; N61-E64 WeakPolarHBondContact OD1-CG 3.32Å; N61-E64 PolarHBondContact OD1-N 2.95Å; E64-K66 PolarHBondContact O-N 3.25Å; E64-I67 WeakPolarHBondContact O-CB 3.42Å; E64-I67 WeakPolarHBondContact O-CG1 3.34Å; E64-I67 PolarHBondContact O-N 2.87Å; E64-I67 VanDerWaalsContact O-N 3.14Å
65	A	74.9	Confident	75.6	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-64	-19.9	174.9	0	0	0	0	0	112.9	L59 A62 K63 I67 L68 F71	L59-A65 HydrophobicContact CD1-CB 3.89Å; A62-A65 WeakPolarHBondContact O-CB 3.37Å; K63-A65 VanDerWaalsContact C-N 3.25Å; K63-A65 PolarHBondContact O-N 2.83Å; A65-I67 PolarHBondContact O-N 3.26Å; A65-L68 WeakPolarHBondContact O-CB 3.13Å; A65-L68 PolarHBondContact O-N 2.86Å; A65-F71 HydrophobicContact CB-CD1 3.57Å; A65-F71 HydrophobicContact CB-CE1 3.73Å; A65-F71 HydrophobicContact CB-CG 4.39Å; A65-F71 WeakPolarHBondContact O-CB 3.33Å; A65-F71 VanDerWaalsContact O-CG 3.23Å; A65-F71 WeakPolarHBondContact O-CG 3.48Å
66	K	77.1	Confident	75.9	Confident	117 Å²	117	66.8 Å²	66.8	51%	0.509	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-63.9	-18.4	174.8	-166.9	167	179.2	165.1	0	113.2	K63 E64 L68 D73	K63-K66 WeakPolarHBondContact O-CB 3.29Å; K63-K66 PolarHBondContact O-N 3.35Å; E64-K66 PolarHBondContact O-N 3.25Å; K66-L68 PolarHBondContact O-N 3.38Å; K66-D73 WeakPolarHBondContact CE-OD1 3.39Å; K66-D73 IonicContact NZ-OD1 3.97Å; K66-D73 PolarHBondContact NZ-OD1 3.19Å; K66-D73 IonicContact NZ-OD2 2.89Å
67	I	74.6	Confident	76.6	Confident	109 Å²	109	68.9 Å²	68.9	56%	0.559	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-68.9	-23.3	174.5	-59.2	168.7	0	0	0	110.8	E64 A65	E64-I67 WeakPolarHBondContact O-CB 3.42Å; E64-I67 WeakPolarHBondContact O-CG1 3.34Å; E64-I67 PolarHBondContact O-N 2.87Å; E64-I67 VanDerWaalsContact O-N 3.14Å; A65-I67 PolarHBondContact O-N 3.26Å
68	L	76.9	Confident	77.1	Confident	15 Å²	15	67 Å²	67	8%	0.079	35%	0.347	C	S	.	.	S	Bend	trans	-83.4	140.3	-178	-56.5	-176.2	0	0	0	111.9	L52 Y55 L59 A65 K66 N70 F71	L52-L68 HydrophobicContact CB-CD1 4.36Å; L52-L68 HydrophobicContact CD1-CD1 3.54Å; Y55-L68 HydrophobicContact CD1-CD2 3.96Å; Y55-L68 HydrophobicContact CD2-CD2 3.34Å; Y55-L68 HydrophobicContact CE1-CD2 4.41Å; Y55-L68 HydrophobicContact CE2-CD2 3.88Å; Y55-L68 HydrophobicContact CG-CD1 4.49Å; Y55-L68 HydrophobicContact CG-CD2 3.39Å; L59-L68 HydrophobicContact CD1-CD1 3.86Å; A65-L68 WeakPolarHBondContact O-CB 3.13Å; A65-L68 PolarHBondContact O-N 2.86Å; K66-L68 PolarHBondContact O-N 3.38Å; L68-N70 PolarHBondContact O-N 3.14Å; L68-F71 HydrophobicContact CB-CD2 3.49Å; L68-F71 VanDerWaalsContact CB-CD2 3.49Å; L68-F71 HydrophobicContact CB-CE2 3.79Å; L68-F71 HydrophobicContact CB-CG 4.19Å; L68-F71 HydrophobicContact CD1-CD2 4.31Å; L68-F71 HydrophobicContact CD1-CE2 3.81Å; L68-F71 HydrophobicContact CD1-CZ 4.08Å; L68-F71 HydrophobicContact CG-CD2 4.48Å; L68-F71 HydrophobicContact CG-CE2 4.44Å; L68-F71 PolarHBondContact O-N 3.49Å
69	Q	75.3	Confident	77.5	Confident	157 Å²	157	63.9 Å²	63.9	73%	0.734	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	140.4	173.6	-69.2	-178.5	-3.5	0	0	110.6	S51 F71	S51-Q69 WeakPolarHBondContact CB-O 3.48Å; S51-Q69 PolarHBondContact OG-O 3.27Å; Q69-F71 VanDerWaalsContact C-N 3.31Å; Q69-F71 PolarHBondContact O-N 2.9Å
70	N	81.9	Confident	77.8	Confident	77 Å²	77	65.9 Å²	65.9	41%	0.412	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	14.7	-178.8	-44.5	-64.8	0	0	0	115.5	K47 S51 L68 I75	K47-N70 HydrophobicContact CB-CB 4.01Å; S51-N70 PolarHBondContact OG-ND2 3.29Å; L68-N70 PolarHBondContact O-N 3.14Å; N70-I75 WeakPolarHBondContact O-CD1 3.35Å
71	F	82.9	Confident	78.6	Confident	13 Å²	13	61.7 Å²	61.7	6%	0.057	32%	0.322	C	S	.	.			trans	-101.2	97.6	167.4	-78.2	-109.2	0	0	0	110.3	L27 A48 L52 A65 L68 Q69 I75 L79	L27-F71 HydrophobicContact CD1-CE1 4.06Å; L27-F71 HydrophobicContact CD1-CZ 3.71Å; A48-F71 HydrophobicContact CB-CD2 4.18Å; A48-F71 HydrophobicContact CB-CE2 3.83Å; A48-F71 HydrophobicContact CB-CZ 4.17Å; A48-F71 WeakPolarHBondContact O-CE2 3.44Å; L52-F71 HydrophobicContact CB-CE2 4.48Å; L52-F71 HydrophobicContact CB-CZ 4.25Å; L52-F71 HydrophobicContact CD1-CZ 4.43Å; A65-F71 HydrophobicContact CB-CD1 3.57Å; A65-F71 HydrophobicContact CB-CE1 3.73Å; A65-F71 HydrophobicContact CB-CG 4.39Å; A65-F71 WeakPolarHBondContact O-CB 3.33Å; A65-F71 VanDerWaalsContact O-CG 3.23Å; A65-F71 WeakPolarHBondContact O-CG 3.48Å; L68-F71 HydrophobicContact CB-CD2 3.49Å; L68-F71 VanDerWaalsContact CB-CD2 3.49Å; L68-F71 HydrophobicContact CB-CE2 3.79Å; L68-F71 HydrophobicContact CB-CG 4.19Å; L68-F71 HydrophobicContact CD1-CD2 4.31Å; L68-F71 HydrophobicContact CD1-CE2 3.81Å; L68-F71 HydrophobicContact CD1-CZ 4.08Å; L68-F71 HydrophobicContact CG-CD2 4.48Å; L68-F71 HydrophobicContact CG-CE2 4.44Å; L68-F71 PolarHBondContact O-N 3.49Å; Q69-F71 VanDerWaalsContact C-N 3.31Å; Q69-F71 PolarHBondContact O-N 2.9Å; F71-I75 HydrophobicContact CD1-CG2 3.76Å; F71-I75 HydrophobicContact CE1-CG2 4.07Å; F71-I75 HydrophobicContact CG-CG2 4.46Å; F71-L79 HydrophobicContact CD1-CD1 4.09Å; F71-L79 HydrophobicContact CE1-CD1 3.57Å
72	G	78.8	Confident	78.8	Confident	39 Å²	39	61.2 Å²	61.2	40%	0.402	32%	0.318	S	S	.	.			trans	-90	172	172.6	0	0	0	0	0	112.9	G74 I75 C76	G72-G74 PolarHBondContact O-N 3.11Å; G72-G74 VanDerWaalsContact O-N 3.1Å; G72-I75 PolarHBondContact O-N 3.36Å; G72-C76 PolarHBondContact O-N 3.08Å
73	D	76.7	Confident	79.3	Confident	111 Å²	111	61.4 Å²	61.4	59%	0.594	32%	0.318	S	S	*	.	H	α-helix	trans	-55.9	-32.1	-177.5	-68.1	-38.4	0	0	0	113.2	K66 K77	K66-D73 WeakPolarHBondContact CE-OD1 3.39Å; K66-D73 IonicContact NZ-OD1 3.97Å; K66-D73 PolarHBondContact NZ-OD1 3.19Å; K66-D73 IonicContact NZ-OD2 2.89Å; D73-K77 VanDerWaalsContact O-CB 3.3Å; D73-K77 WeakPolarHBondContact O-CB 3.41Å; D73-K77 PolarHBondContact O-N 3.39Å
74	G	78.5	Confident	79.7	Confident	49 Å²	49	57.4 Å²	57.4	51%	0.505	30%	0.302	S	S	.	.	H	α-helix	trans	-65.6	-43.5	174.4	0	0	0	0	0	113.7	G72 K77 I78	G72-G74 PolarHBondContact O-N 3.11Å; G72-G74 VanDerWaalsContact O-N 3.1Å; G74-K77 PolarHBondContact O-N 3.44Å; G74-I78 WeakPolarHBondContact O-CD1 3.32Å; G74-I78 WeakPolarHBondContact O-CG1 3.23Å; G74-I78 PolarHBondContact O-N 3.29Å
75	I	83.1	Confident	80	Confident	14 Å²	14	61.2 Å²	61.2	7%	0.072	31%	0.314	C	S	.	.	H	α-helix	trans	-70.6	-41.2	178.9	-64.4	175.1	0	0	0	110	L27 T44 Y45 A48 N70 F71 G72 K77 I78 L79	L27-I75 HydrophobicContact CD2-CG2 3.91Å; T44-I75 HydrophobicContact CG2-CD1 4.01Å; Y45-I75 HydrophobicContact CD1-CD1 4.41Å; Y45-I75 HydrophobicContact CD1-CG1 4.49Å; Y45-I75 HydrophobicContact CE1-CG1 4.16Å; A48-I75 HydrophobicContact CB-CD1 4.24Å; N70-I75 WeakPolarHBondContact O-CD1 3.35Å; F71-I75 HydrophobicContact CD1-CG2 3.76Å; F71-I75 HydrophobicContact CE1-CG2 4.07Å; F71-I75 HydrophobicContact CG-CG2 4.46Å; G72-I75 PolarHBondContact O-N 3.36Å; I75-K77 PolarHBondContact O-N 3.43Å; I75-I78 PolarHBondContact O-N 2.84Å; I75-L79 HydrophobicContact CG2-CD1 3.9Å; I75-L79 HydrophobicContact CG2-CG 4.37Å; I75-L79 WeakPolarHBondContact O-CB 3.32Å; I75-L79 VanDerWaalsContact O-CG 3.31Å; I75-L79 WeakPolarHBondContact O-CG 2.97Å; I75-L79 PolarHBondContact O-N 3.43Å
76	C	82.6	Confident	80.1	Confident	14 Å²	14	62.5 Å²	62.5	10%	0.095	32%	0.32	C	S	.	.	H	α-helix	trans	-60.4	-43.5	174.5	-71.4	0	0	0	0	111.6	A62 G72 L79 D80	A62-C76 WeakPolarHBondContact CB-O 3.06Å; A62-C76 PolarHBondContact O-SG 3.32Å; G72-C76 PolarHBondContact O-N 3.08Å; C76-L79 PolarHBondContact O-N 3.46Å; C76-D80 WeakPolarHBondContact O-CB 3.4Å; C76-D80 PolarHBondContact O-N 3.49Å
77	K	82.6	Confident	80.2	Confident	146 Å²	146	60.5 Å²	60.5	64%	0.635	31%	0.31	S	S	*	.	H	α-helix	trans	-63.2	-44.7	176.9	-171.6	177.1	-179.3	-179.1	0	112.2	D73 G74 I75 L79 D80 D81	D73-K77 VanDerWaalsContact O-CB 3.3Å; D73-K77 WeakPolarHBondContact O-CB 3.41Å; D73-K77 PolarHBondContact O-N 3.39Å; G74-K77 PolarHBondContact O-N 3.44Å; I75-K77 PolarHBondContact O-N 3.43Å; K77-L79 VanDerWaalsContact C-N 3.33Å; K77-L79 PolarHBondContact O-N 2.95Å; K77-D80 PolarHBondContact O-N 2.92Å; K77-D81 PolarHBondContact O-N 3.22Å
78	I	83.4	Confident	80.2	Confident	57 Å²	57	64.7 Å²	64.7	29%	0.292	32%	0.319	S	S	.	.	H	α-helix	trans	-63.2	-40.8	178.1	-67.7	164	0	0	0	111.4	L30 G74 I75 K82	L30-I78 HydrophobicContact CD1-CG2 3.55Å; L30-I78 HydrophobicContact CD2-CG2 4.43Å; G74-I78 WeakPolarHBondContact O-CD1 3.32Å; G74-I78 WeakPolarHBondContact O-CG1 3.23Å; G74-I78 PolarHBondContact O-N 3.29Å; I75-I78 PolarHBondContact O-N 2.84Å; I78-K82 PolarHBondContact O-N 3.03Å
79	L	82.2	Confident	80	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-70	-35	176.7	-71.2	174.4	0	0	0	112.2	F23 W26 L27 A62 F71 I75 C76 K77 K82 L83	F23-L79 HydrophobicContact CD1-CD2 4.11Å; W26-L79 HydrophobicContact CB-CD2 4.22Å; W26-L79 HydrophobicContact CE3-CD2 4.01Å; L27-L79 HydrophobicContact CD2-CD1 4.39Å; L27-L79 HydrophobicContact CD2-CD2 4.32Å; L27-L79 HydrophobicContact CG-CD2 4.22Å; A62-L79 HydrophobicContact CB-CB 3.84Å; F71-L79 HydrophobicContact CD1-CD1 4.09Å; F71-L79 HydrophobicContact CE1-CD1 3.57Å; I75-L79 HydrophobicContact CG2-CD1 3.9Å; I75-L79 HydrophobicContact CG2-CG 4.37Å; I75-L79 WeakPolarHBondContact O-CB 3.32Å; I75-L79 VanDerWaalsContact O-CG 3.31Å; I75-L79 WeakPolarHBondContact O-CG 2.97Å; I75-L79 PolarHBondContact O-N 3.43Å; C76-L79 PolarHBondContact O-N 3.46Å; K77-L79 VanDerWaalsContact C-N 3.33Å; K77-L79 PolarHBondContact O-N 2.95Å; L79-K82 PolarHBondContact O-N 3.45Å; L79-L83 WeakPolarHBondContact O-CB 3.35Å; L79-L83 PolarHBondContact O-N 3Å
80	D	83.3	Confident	79.8	Confident	45 Å²	45	68.3 Å²	68.3	24%	0.241	34%	0.338	C	S	.	.	H	α-helix	trans	-67.2	-42.5	175.3	-151.8	38.7	0	0	0	110.9	A62 C76 K77 K82 L83 Q84	A62-D80 HydrophobicContact CB-CB 3.7Å; A62-D80 VanDerWaalsContact CB-N 3.34Å; C76-D80 WeakPolarHBondContact O-CB 3.4Å; C76-D80 PolarHBondContact O-N 3.49Å; K77-D80 PolarHBondContact O-N 2.92Å; D80-K82 PolarHBondContact O-N 2.82Å; D80-L83 WeakPolarHBondContact O-CB 3.13Å; D80-L83 PolarHBondContact O-N 3.02Å; D80-Q84 WeakPolarHBondContact O-CB 3.39Å; D80-Q84 VanDerWaalsContact O-CG 3.3Å; D80-Q84 WeakPolarHBondContact O-CG 3.15Å; D80-Q84 PolarHBondContact O-N 3.33Å
81	D	82.1	Confident	79.1	Confident	60 Å²	60	65.8 Å²	65.8	32%	0.321	33%	0.331	S	S	.	.	H	α-helix	trans	-63	-42.7	175.1	-73.2	-17.3	0	0	0	111.7	K77 R85	K77-D81 PolarHBondContact O-N 3.22Å; D81-R85 VanDerWaalsContact O-CG 3.31Å; D81-R85 WeakPolarHBondContact O-CG 3.38Å; D81-R85 PolarHBondContact O-N 2.85Å
82	K	81.7	Confident	77.9	Confident	39 Å²	39	70.7 Å²	70.7	17%	0.17	36%	0.364	C	S	.	.	H	α-helix	trans	-66.5	-37.2	174.6	-78.7	-167.5	172.2	-166.7	0	111.9	W26 I78 L79 D80 R85 H86	W26-K82 HydrophobicContact CB-CD 3.6Å; W26-K82 HydrophobicContact CD2-CB 3.83Å; W26-K82 HydrophobicContact CD2-CD 3.85Å; W26-K82 HydrophobicContact CD2-CG 4.47Å; W26-K82 HydrophobicContact CE3-CB 3.56Å; W26-K82 HydrophobicContact CE3-CD 4.21Å; W26-K82 HydrophobicContact CG-CB 4.44Å; W26-K82 HydrophobicContact CG-CD 3.54Å; W26-K82 HydrophobicContact CH2-CB 4.35Å; W26-K82 HydrophobicContact CZ3-CB 3.82Å; W26-K82 PolarHBondContact O-NZ 2.82Å; I78-K82 PolarHBondContact O-N 3.03Å; L79-K82 PolarHBondContact O-N 3.45Å; D80-K82 PolarHBondContact O-N 2.82Å; K82-R85 PolarHBondContact O-N 2.84Å; K82-H86 WeakPolarHBondContact O-CB 3.45Å; K82-H86 PolarHBondContact O-N 3.35Å
83	L	81	Confident	76.8	Confident	5 Å²	5	76.5 Å²	76.5	3%	0.026	39%	0.386	C	S	.	.	H	α-helix	trans	-66	-43.8	176.6	-174.9	63.3	0	0	0	111.9	F23 W26 L79 D80 R85 H86 Y87 I96	F23-L83 HydrophobicContact CE1-CD1 4.37Å; F23-L83 HydrophobicContact CZ-CD2 4.35Å; W26-L83 HydrophobicContact CH2-CB 4.32Å; W26-L83 HydrophobicContact CH2-CD1 4.16Å; W26-L83 HydrophobicContact CZ3-CB 4.09Å; W26-L83 HydrophobicContact CZ3-CD1 4.41Å; L79-L83 WeakPolarHBondContact O-CB 3.35Å; L79-L83 PolarHBondContact O-N 3Å; D80-L83 WeakPolarHBondContact O-CB 3.13Å; D80-L83 PolarHBondContact O-N 3.02Å; L83-R85 PolarHBondContact O-N 3.36Å; L83-H86 WeakPolarHBondContact O-CB 3.35Å; L83-H86 PolarHBondContact O-N 3.33Å; L83-Y87 HydrophobicContact CD1-CE1 4.41Å; L83-Y87 HydrophobicContact CD1-CE2 3.85Å; L83-Y87 HydrophobicContact CD2-CE2 4.06Å; L83-Y87 HydrophobicContact CG-CD2 4.15Å; L83-Y87 HydrophobicContact CG-CE2 3.57Å; L83-Y87 WeakPolarHBondContact O-CD2 3.34Å; L83-Y87 PolarHBondContact O-N 2.77Å; L83-I96 HydrophobicContact CD1-CG2 3.66Å
84	Q	79.8	Confident	76	Confident	79 Å²	79	72.1 Å²	72.1	37%	0.369	37%	0.365	S	S	.	.	H	α-helix	trans	-63.1	-40.3	174.8	-72	177.6	25.2	0	0	112.1	D80 H86 Y87 R88	D80-Q84 WeakPolarHBondContact O-CB 3.39Å; D80-Q84 VanDerWaalsContact O-CG 3.3Å; D80-Q84 WeakPolarHBondContact O-CG 3.15Å; D80-Q84 PolarHBondContact O-N 3.33Å; Q84-H86 VanDerWaalsContact C-N 3.34Å; Q84-Y87 PolarHBondContact O-N 3.4Å; Q84-R88 WeakPolarHBondContact O-CG 3.39Å; Q84-R88 PolarHBondContact O-N 3.33Å
85	R	80.4	Confident	75.1	Confident	139 Å²	139	72.9 Å²	72.9	53%	0.525	36%	0.363	S	S	.	.	H	α-helix	trans	-63.1	-41.2	173.9	-71.8	174.8	-155	156.8	7.5	111.8	D81 K82 L83 R88 Q89	D81-R85 VanDerWaalsContact O-CG 3.31Å; D81-R85 WeakPolarHBondContact O-CG 3.38Å; D81-R85 PolarHBondContact O-N 2.85Å; K82-R85 PolarHBondContact O-N 2.84Å; L83-R85 PolarHBondContact O-N 3.36Å; R85-R88 PolarHBondContact O-N 2.98Å; R85-Q89 WeakPolarHBondContact O-CG 3.27Å; R85-Q89 PolarHBondContact O-N 2.89Å; R85-Q89 VanDerWaalsContact O-N 3.12Å
86	H	78.2	Confident	74.3	Confident	27 Å²	27	73 Å²	73	13%	0.125	36%	0.363	C	S	.	.	H	α-helix	trans	-62.5	-42	175.9	-177.7	-91.9	0	0	0	112	W26 K82 L83 Q84 R88 Q89 N90	W26-H86 HydrophobicContact CH2-CB 4.02Å; W26-H86 HydrophobicContact CZ2-CB 3.95Å; K82-H86 WeakPolarHBondContact O-CB 3.45Å; K82-H86 PolarHBondContact O-N 3.35Å; L83-H86 WeakPolarHBondContact O-CB 3.35Å; L83-H86 PolarHBondContact O-N 3.33Å; Q84-H86 VanDerWaalsContact C-N 3.34Å; H86-R88 PolarHBondContact O-N 2.89Å; H86-Q89 PolarHBondContact O-N 2.69Å; H86-N90 PolarHBondContact CD2-ND2 3.22Å; H86-N90 VanDerWaalsContact CD2-ND2 3.26Å; H86-N90 PolarHBondContact NE2-ND2 3.37Å; H86-N90 WeakPolarHBondContact O-CB 3.42Å; H86-N90 PolarHBondContact O-N 3.42Å
87	Y	78.9	Confident	73.2	Confident	74 Å²	74	75.8 Å²	75.8	29%	0.29	38%	0.375	S	S	.	.	H	α-helix	trans	-66.7	-32.7	174.7	-68.1	-40.5	0	0	0	113.7	L83 Q84 Q89 G91 A94 I96	L83-Y87 HydrophobicContact CD1-CE1 4.41Å; L83-Y87 HydrophobicContact CD1-CE2 3.85Å; L83-Y87 HydrophobicContact CD2-CE2 4.06Å; L83-Y87 HydrophobicContact CG-CD2 4.15Å; L83-Y87 HydrophobicContact CG-CE2 3.57Å; L83-Y87 WeakPolarHBondContact O-CD2 3.34Å; L83-Y87 PolarHBondContact O-N 2.77Å; Q84-Y87 PolarHBondContact O-N 3.4Å; Y87-Q89 VanDerWaalsContact C-N 3.31Å; Y87-G91 CarbonylContact O-C 3.26Å; Y87-G91 VanDerWaalsContact O-C 3.26Å; Y87-G91 VanDerWaalsContact O-CA 3.24Å; Y87-G91 WeakPolarHBondContact O-CA 3.33Å; Y87-G91 PolarHBondContact O-N 2.89Å; Y87-A94 HydrophobicContact CD1-CB 4.5Å; Y87-I96 HydrophobicContact CE1-CG2 4.11Å
88	R	74.1	Confident	71.9	Confident	198 Å²	198	72 Å²	72	75%	0.747	37%	0.366	S	S	*	.	H	α-helix	trans	-67.5	-31.2	173.4	-72.3	178.1	-166.9	166	6.5	112.8	Q84 R85 H86	Q84-R88 WeakPolarHBondContact O-CG 3.39Å; Q84-R88 PolarHBondContact O-N 3.33Å; R85-R88 PolarHBondContact O-N 2.98Å; H86-R88 PolarHBondContact O-N 2.89Å
89	Q	72.6	Confident	70.3	Confident	153 Å²	153	73.9 Å²	73.9	72%	0.715	38%	0.377	S	S	*	.	H	α-helix	trans	-88	-37.2	-177.9	-70.7	173.6	-1.2	0	0	113	R85 H86 Y87	R85-Q89 WeakPolarHBondContact O-CG 3.27Å; R85-Q89 PolarHBondContact O-N 2.89Å; R85-Q89 VanDerWaalsContact O-N 3.12Å; H86-Q89 PolarHBondContact O-N 2.69Å; Y87-Q89 VanDerWaalsContact C-N 3.31Å
90	N	71.5	Confident	68.5	Low	94 Å²	94	79.1 Å²	79.1	50%	0.503	41%	0.41	S	S	.	.	H	α-helix	trans	-112.2	1.2	-171.5	-64	-30.5	0	0	0	113.9	H86 A94	H86-N90 PolarHBondContact CD2-ND2 3.22Å; H86-N90 VanDerWaalsContact CD2-ND2 3.26Å; H86-N90 PolarHBondContact NE2-ND2 3.37Å; H86-N90 WeakPolarHBondContact O-CB 3.42Å; H86-N90 PolarHBondContact O-N 3.42Å; N90-A94 HydrophobicContact CB-CB 3.52Å
91	G	66.9	Low	66.3	Low	25 Å²	25	87.7 Å²	87.7	26%	0.258	45%	0.445	S	S	.	.			trans	89	163.2	-178.5	0	0	0	0	0	114.3	Y87 N93 A94	Y87-G91 CarbonylContact O-C 3.26Å; Y87-G91 VanDerWaalsContact O-C 3.26Å; Y87-G91 VanDerWaalsContact O-CA 3.24Å; Y87-G91 WeakPolarHBondContact O-CA 3.33Å; Y87-G91 PolarHBondContact O-N 2.89Å; G91-N93 PolarHBondContact O-N 2.89Å; G91-N93 VanDerWaalsContact O-N 3.16Å; G91-A94 WeakPolarHBondContact O-CB 3.46Å; G91-A94 PolarHBondContact O-N 3.48Å
92	P	58.6	Low	64.4	Low	116 Å²	116	88.7 Å²	88.7	75%	0.753	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-12.1	-173.3	25.7	-33.2	0	0	0	114.8
93	N	55.1	Low	62	Low	161 Å²	161	91.1 Å²	91.1	86%	0.861	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	17.1	178	-78.4	-14.6	0	0	0	113.5	G91 S95	G91-N93 PolarHBondContact O-N 2.89Å; G91-N93 VanDerWaalsContact O-N 3.16Å; N93-S95 PolarHBondContact O-N 3.32Å
94	A	60.6	Low	59.8	Low	19 Å²	19	96.3 Å²	96.3	16%	0.157	53%	0.532	C	S	.	.			trans	-66	124.6	178.5	0	0	0	0	0	111.6	Y87 N90 G91 I96	Y87-A94 HydrophobicContact CD1-CB 4.5Å; N90-A94 HydrophobicContact CB-CB 3.52Å; G91-A94 WeakPolarHBondContact O-CB 3.46Å; G91-A94 PolarHBondContact O-N 3.48Å; A94-I96 PolarHBondContact O-N 3.38Å
95	S	59.5	Low	57.7	Low	65 Å²	65	98.2 Å²	98.2	46%	0.455	55%	0.55	S	S	.	*			trans	-65.1	121.5	178.8	170.2	0	0	0	0	111.3	N93 H97 S98	N93-S95 PolarHBondContact O-N 3.32Å; S95-H97 VanDerWaalsContact C-N 3.29Å; S95-H97 PolarHBondContact OG-N 3.47Å; S95-S98 VanDerWaalsContact CB-OG 3.26Å; S95-S98 WeakPolarHBondContact CB-OG 3.44Å; S95-S98 PolarHBondContact OG-OG 2.89Å
96	I	65	Low	55.5	Low	16 Å²	16	97.7 Å²	97.7	8%	0.082	57%	0.565	C	S	.	*	T	Hydrogen-bonded Turn	trans	-84.4	-4.9	177.7	62.2	175.7	0	0	0	113.5	L22 L59 K60 L83 Y87 A94	L22-I96 HydrophobicContact CD1-CB 4.3Å; L59-I96 WeakPolarHBondContact O-CD1 3.49Å; K60-I96 WeakPolarHBondContact O-CD1 3.34Å; L83-I96 HydrophobicContact CD1-CG2 3.66Å; Y87-I96 HydrophobicContact CE1-CG2 4.11Å; A94-I96 PolarHBondContact O-N 3.38Å
97	H	59.6	Low	53.3	Low	73 Å²	73	99.9 Å²	99.9	34%	0.338	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.7	6	-173.6	-60.1	-61.9	0	0	0	113.3	P19 P58 L59 S95	P19-H97 PolarHBondContact O-ND1 3.36Å; P58-H97 WeakPolarHBondContact CB-CE1 3.16Å; L59-H97 PolarHBondContact O-CE1 2.86Å; L59-H97 VanDerWaalsContact O-CE1 3.23Å; S95-H97 VanDerWaalsContact C-N 3.29Å; S95-H97 PolarHBondContact OG-N 3.47Å
98	S	54.8	Low	50.9	Low	65 Å²	65	107.4 Å²	107.4	46%	0.455	62%	0.623	S	S	.	*			trans	-135.4	125.8	-179	51.9	0	0	0	0	111.1	S95	S95-S98 VanDerWaalsContact CB-OG 3.26Å; S95-S98 WeakPolarHBondContact CB-OG 3.44Å; S95-S98 PolarHBondContact OG-OG 2.89Å
99	L	50.6	Low	48.7	Very low	98 Å²	98	104.4 Å²	104.4	51%	0.513	63%	0.627	S	S	.	*			trans	-73.8	143.4	171.1	-72.5	161	0	0	0	110.4	P21 L22 K101	P21-L99 HydrophobicContact CB-CD1 4.08Å; P21-L99 HydrophobicContact CB-CG 3.99Å; L22-L99 HydrophobicContact CD2-CD2 4.12Å; L99-K101 PolarHBondContact O-N 3.04Å
100	P	43.8	Very low	46.5	Very low	110 Å²	110	107.4 Å²	107.4	71%	0.714	63%	0.633	S	S	*	*			trans	-59.1	133.8	167.6	-18.3	30.4	0	0	0	110.5	G102	P100-G102 PolarHBondContact O-N 3.49Å; P100-G102 VanDerWaalsContact O-N 3.12Å
101	K	38.3	Very low	44.4	Very low	225 Å²	225	110.5 Å²	110.5	98%	0.978	65%	0.65	S	S	*	*	S	Bend	trans	-63.2	110.6	178.5	-81.3	178.5	175.8	176.9	0	110	L99	L99-K101 PolarHBondContact O-N 3.04Å
102	G	40.6	Very low	42.4	Very low	81 Å²	81	116.5 Å²	116.5	84%	0.835	68%	0.676	S	S	*	*			trans	157.7	7.2	169.7	0	0	0	0	0	119	P100	P100-G102 PolarHBondContact O-N 3.49Å; P100-G102 VanDerWaalsContact O-N 3.12Å
103	A	33.2	Very low	40.8	Very low	90 Å²	90	118.9 Å²	118.9	74%	0.744	68%	0.682	S	S	*	*			trans	-105.7	139.2	179.2	0	0	0	0	0	112.5
104	P	32.9	Very low	39.5	Very low	115 Å²	115	118 Å²	118	75%	0.747	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-67.8	155.9	-178.7	28.3	-32.9	0	0	0	112
105	P	36.2	Very low	37.9	Very low	118 Å²	118	121.7 Å²	121.7	77%	0.766	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-68.2	137.3	-173.2	26.3	-32.8	0	0	0	112
106	P	34	Very low	36.3	Very low	129 Å²	129	124.4 Å²	124.4	84%	0.838	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-67.1	135.3	174.6	24.5	-30	0	0	0	111.3
107	G	31.8	Very low	34.5	Very low	73 Å²	73	129.1 Å²	129.1	75%	0.753	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-62.2	154.7	-172.4	0	0	0	0	0	115.4
108	R	29.8	Very low	32.9	Very low	231 Å²	231	134 Å²	134	87%	0.872	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-50.6	132.8	178.5	-68.5	171.6	174.3	177.4	-2	112.6	Y110	R108-Y110 PolarHBondContact O-N 3.33Å
109	T	26.6	Very low	31.4	Very low	136 Å²	136	135.9 Å²	135.9	83%	0.834	80%	0.798	S	S	*	*			trans	-67.4	110.2	164	34.1	0	0	0	0	110.2	N111	T109-N111 PolarHBondContact O-N 3.39Å
110	Y	27.4	Very low	30.2	Very low	216 Å²	216	139.8 Å²	139.8	85%	0.847	82%	0.818	S	S	*	*			trans	-76.7	109	160.6	-89.1	-87	0	0	0	108.6	R108	R108-Y110 PolarHBondContact O-N 3.33Å
111	N	27.4	Very low	29.2	Very low	159 Å²	159	138.8 Å²	138.8	85%	0.85	82%	0.819	S	S	*	*			trans	-76.1	120.5	157	-91.8	-5.1	0	0	0	107.4	T109	T109-N111 PolarHBondContact O-N 3.39Å
112	N	25.7	Very low	28.9	Very low	150 Å²	150	133.4 Å²	133.4	80%	0.802	81%	0.807	S	S	*	*			trans	-129.1	101.7	165.3	-148.2	12.7	0	0	0	109.2
113	N	24.2	Very low	28	Very low	166 Å²	166	135 Å²	135	89%	0.888	81%	0.806	S	S	*	*			trans	-152.6	86.4	163.7	-104.3	2.8	0	0	0	106.4
114	N	27.4	Very low	27.7	Very low	144 Å²	144	140.5 Å²	140.5	77%	0.77	81%	0.807	S	S	*	*				-165.4	113.2	120.4	-136.7	2.2	0	0	0	111.7
115	S	27.2	Very low	27.2	Very low	95 Å²	95	142 Å²	142	66%	0.664	80%	0.802	S	S	*	*			trans	22.5	124.4	132.3	-44.7	0	0	0	0	120.4
116	S	26.3	Very low	26.6	Very low	122 Å²	122	143.8 Å²	143.8	85%	0.853	80%	0.8	S	S	*	*				65.1	90.4	126.4	-50.2	0	0	0	0	118.6
117	S	26.6	Very low	26.2	Very low	116 Å²	116	145.2 Å²	145.2	81%	0.811	80%	0.799	S	S	*	*			trans	-147.5	98.8	139.4	60.4	0	0	0	0	108.9
118	N	26.3	Very low	25.9	Very low	176 Å²	176	151.4 Å²	151.4	94%	0.941	81%	0.805	S	S	*	*			trans	-70.1	122.7	171.4	-106.1	-3.4	0	0	0	109.5
119	S	23	Very low	25.6	Very low	104 Å²	104	148.2 Å²	148.2	73%	0.727	80%	0.8	S	S	*	*			trans	-154.6	92.4	161	55	0	0	0	0	109.6
120	L	25.8	Very low	25.5	Very low	180 Å²	180	152.3 Å²	152.3	94%	0.942	80%	0.8	S	S	*	*			trans	-138.4	112.4	152.5	-79.9	173.4	0	0	0	108.2
121	A	23.5	Very low	25.4	Very low	89 Å²	89	149.4 Å²	149.4	74%	0.736	80%	0.799	S	S	*	*			trans	-80.7	-176.6	165	0	0	0	0	0	109.8
122	P	30.6	Very low	25.3	Very low	112 Å²	112	149.1 Å²	149.1	73%	0.727	80%	0.798	S	S	*	*			cis	-130.2	177.3	-33.6	23.8	-2.3	0	0	0	113
123	S	23	Very low	25.3	Very low	115 Å²	115	146.7 Å²	146.7	80%	0.804	80%	0.798	S	S	*	*			trans	101.9	140.7	152	-43.6	0	0	0	0	116.2
124	R	25.1	Very low	25.3	Very low	205 Å²	205	142.1 Å²	142.1	77%	0.774	79%	0.791	S	S	*	*			cis	-178.6	131.6	-22.7	173.5	176.1	-168.7	-161.4	4	104.1
125	K	23.7	Very low	25.3	Very low	146 Å²	146	143.4 Å²	143.4	64%	0.635	80%	0.798	S	S	*	*			trans	65.4	148.4	162.5	-72.6	168.5	165.2	-119.2	0	115.4
126	E	23.6	Very low	25.3	Very low	155 Å²	155	143.2 Å²	143.2	72%	0.724	80%	0.802	S	S	*	*			cis	-162	159.8	9.4	-120.3	155.8	-150.1	0	0	108.1
127	I	26.2	Very low	25.5	Very low	160 Å²	160	141.2 Å²	141.2	82%	0.821	80%	0.8	S	S	*	*			trans	-73.4	137.5	176.2	-64.8	158.6	0	0	0	109.2
128	K	24.2	Very low	25.5	Very low	202 Å²	202	145 Å²	145	88%	0.878	80%	0.802	S	S	*	*			trans	-158.2	144.7	143.1	-117.8	173.7	-175	-177.9	0	115.7
129	E	23.4	Very low	25.6	Very low	165 Å²	165	144.1 Å²	144.1	77%	0.771	80%	0.797	S	S	*	*			trans	-64.5	148.6	-173.6	-68.6	164.4	143.5	0	0	116.2
130	R	24.1	Very low	25.9	Very low	222 Å²	222	150.4 Å²	150.4	84%	0.838	81%	0.805	S	S	*	*				36.7	147.4	127.7	-65.9	-172.7	180	-167.8	1.9	122.8
131	N	25.2	Very low	26.1	Very low	154 Å²	154	145.6 Å²	145.6	82%	0.824	80%	0.799	S	S	*	*			trans	87.1	154.4	158.2	-57.1	-15.8	0	0	0	115.7
132	D	25.2	Very low	26.2	Very low	153 Å²	153	145.4 Å²	145.4	82%	0.818	81%	0.806	S	S	*	*			cis	-174.9	158.3	-35.8	-160.4	-4	0	0	0	103.4
133	A	26.4	Very low	26.1	Very low	99 Å²	99	148 Å²	148	82%	0.818	81%	0.813	S	S	*	*			trans	66.3	139.5	175	0	0	0	0	0	116.7
134	G	25.1	Very low	26.4	Very low	71 Å²	71	145.9 Å²	145.9	73%	0.732	81%	0.81	S	S	*	*			cis	170.7	176.7	4.7	0	0	0	0	0	108.5
135	D	26.4	Very low	26.5	Very low	171 Å²	171	139.5 Å²	139.5	91%	0.914	81%	0.808	S	S	*	*			trans	101.3	142.9	160.8	-149.9	31.4	0	0	0	119.8
136	A	27.9	Very low	26.9	Very low	91 Å²	91	139.4 Å²	139.4	75%	0.752	82%	0.819	S	S	*	*			trans	-91.3	158.1	-145.3	0	0	0	0	0	114.7
137	G	29.2	Very low	27.5	Very low	79 Å²	79	141.6 Å²	141.6	81%	0.814	83%	0.827	S	S	*	*			trans	-178.4	89.6	171.5	0	0	0	0	0	112.1
138	K	27.1	Very low	28	Very low	196 Å²	196	144.1 Å²	144.1	85%	0.852	83%	0.832	S	S	*	*			trans	-68.4	123.4	-180	-171.5	-176.8	-168.1	177.7	0	110.6
139	D	28.8	Very low	28.9	Very low	157 Å²	157	143.7 Å²	143.7	84%	0.84	83%	0.83	S	S	*	*			trans	-161.5	150.3	137	-114.6	-25	0	0	0	115.4
140	R	29.9	Very low	29.7	Very low	236 Å²	236	145.3 Å²	145.3	89%	0.891	83%	0.834	S	S	*	*			trans	-77.7	138.8	-163.8	-66	166.1	163.8	175.1	-5.6	113
141	G	28.6	Very low	30.6	Very low	79 Å²	79	144.4 Å²	144.4	81%	0.814	84%	0.837	S	S	*	*			trans	174.4	112.9	163.2	0	0	0	0	0	110.8
142	G	25.8	Very low	32.1	Very low	85 Å²	85	147.9 Å²	147.9	88%	0.876	84%	0.838	S	S	*	*			trans	-74.4	148.7	-174.1	0	0	0	0	0	114.1
143	D	29.9	Very low	34.2	Very low	167 Å²	167	146.5 Å²	146.5	89%	0.893	83%	0.827	S	S	*	*			trans	-164.3	144.2	139.5	-163.6	15	0	0	0	110	G145	D143-G145 PolarHBondContact O-N 3.34Å
144	G	27.8	Very low	36.8	Very low	70 Å²	70	145.5 Å²	145.5	72%	0.722	80%	0.802	S	S	*	*			trans	-75.1	101.3	-169.2	0	0	0	0	0	113.9	T146	G144-T146 PolarHBondContact O-N 3.1Å
145	G	28	Very low	39.4	Very low	71 Å²	71	147.2 Å²	147.2	73%	0.732	79%	0.793	S	S	*	*			trans	-79.3	111.1	165.8	0	0	0	0	0	112.3	D143 K147	D143-G145 PolarHBondContact O-N 3.34Å; G145-K147 PolarHBondContact O-N 2.67Å; G145-K147 VanDerWaalsContact O-N 3.16Å
146	T	32.3	Very low	42.1	Very low	144 Å²	144	139.3 Å²	139.3	88%	0.883	75%	0.752	S	S	*	*			trans	-63.4	110.5	172.2	41	0	0	0	0	111.3	G144 K148	G144-T146 PolarHBondContact O-N 3.1Å; T146-K148 PolarHBondContact O-N 3.12Å
147	K	36.8	Very low	44.7	Very low	201 Å²	201	142.8 Å²	142.8	87%	0.874	75%	0.752	S	S	*	*			trans	-65.8	120.3	171.7	-73.4	178.6	178.6	173.5	0	110	G145 K149	G145-K147 PolarHBondContact O-N 2.67Å; G145-K147 VanDerWaalsContact O-N 3.16Å; K147-K149 PolarHBondContact O-N 3.3Å
148	K	35.2	Very low	47.1	Very low	213 Å²	213	143.8 Å²	143.8	93%	0.926	74%	0.736	S	S	*	*			trans	-54.4	106.9	166.2	-86	179.8	176.3	173.7	0	109.8	T146 K150	T146-K148 PolarHBondContact O-N 3.12Å; K148-K150 PolarHBondContact O-N 3.28Å
149	K	42.9	Very low	49.7	Very low	194 Å²	194	140.6 Å²	140.6	84%	0.843	72%	0.718	S	S	*	*			trans	-62.5	125.2	172.1	-78.5	178.5	177.2	172.6	0	109.4	K147 K151	K147-K149 PolarHBondContact O-N 3.3Å; K149-K151 PolarHBondContact O-N 3.08Å
150	K	40.5	Very low	52.4	Low	199 Å²	199	134.8 Å²	134.8	87%	0.865	69%	0.69	S	S	*	*			trans	-56	134.6	166.8	-72	-179.2	177.1	179.8	0	108.8	K148 R152	K148-K150 PolarHBondContact O-N 3.28Å; K150-R152 PolarHBondContact O-N 3.49Å; K150-R152 VanDerWaalsContact O-N 3.07Å
151	K	42.8	Very low	55.1	Low	203 Å²	203	124 Å²	124	88%	0.883	65%	0.652	S	S	*	*			trans	-62.4	108.4	-178.5	-153.5	178	-174	-176	0	108.4	K149	K149-K151 PolarHBondContact O-N 3.08Å
152	R	57.2	Low	57.7	Low	227 Å²	227	120.2 Å²	120.2	86%	0.857	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-67	138	179.6	-70.6	-179.6	175.5	177.4	-3.5	109.8	K150	K150-R152 PolarHBondContact O-N 3.49Å; K150-R152 VanDerWaalsContact O-N 3.07Å
153	E	69.6	Low	60.7	Low	124 Å²	124	116.9 Å²	116.9	58%	0.579	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-60.8	136.6	172.4	-171.2	178.8	-167.8	0	0	109.6	I155 R244	E153-I155 PolarHBondContact O-N 3.16Å; E153-R244 IonicContact OE1-CZ 2.66Å; E153-R244 IonicContact OE1-NH1 3.05Å; E153-R244 PolarHBondContact OE1-NH1 3.03Å; E153-R244 IonicContact OE1-NH2 3.09Å; E153-R244 PolarHBondContact OE1-NH2 3.29Å; E153-R244 IonicContact OE2-NH1 2.69Å; E153-R244 PolarHBondContact OE2-NH1 3.23Å; E153-R244 IonicContact OE2-NH2 2.97Å
154	Y	81.3	Confident	63.5	Low	78 Å²	78	108.9 Å²	108.9	31%	0.306	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-78.5	116.7	-178.3	176.3	-98.4	0	0	0	109.9	P156 L217 L222	Y154-P156 HydrophobicContact CE1-CB 3.97Å; Y154-P156 HydrophobicContact CE1-CG 4.23Å; Y154-L217 HydrophobicContact CD1-CD2 4.42Å; Y154-L217 HydrophobicContact CE1-CD2 3.75Å; Y154-L222 HydrophobicContact CD1-CD1 3.76Å; Y154-L222 HydrophobicContact CE1-CD1 4.37Å
155	I	80.1	Confident	66.4	Low	106 Å²	106	105.6 Å²	105.6	54%	0.544	50%	0.497	S	S	.	.			trans	-119.6	112.6	173.9	-57.4	175.4	0	0	0	106.8	E153 L241 L245	E153-I155 PolarHBondContact O-N 3.16Å; I155-L241 HydrophobicContact CG1-CD1 4.44Å; I155-L245 HydrophobicContact CG2-CD2 4.36Å
156	P	83.4	Confident	69.3	Low	6 Å²	6	102.2 Å²	102.2	4%	0.039	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-68.2	143.6	179.7	26.1	-31.2	0	0	0	111	Y154 L166 L245	Y154-P156 HydrophobicContact CE1-CB 3.97Å; Y154-P156 HydrophobicContact CE1-CG 4.23Å; P156-L166 HydrophobicContact CG-CD1 3.92Å; P156-L245 HydrophobicContact CG-CD1 4.16Å
157	Q	81.7	Confident	71.9	Confident	164 Å²	164	95.3 Å²	95.3	77%	0.766	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-63.5	145	177.5	-171.6	176.7	6.1	0	0	110.9	S160 Y163	Q157-S160 WeakPolarHBondContact O-CB 3.31Å; Q157-S160 PolarHBondContact O-N 3Å; Q157-S160 VanDerWaalsContact O-N 3.13Å; Q157-S160 PolarHBondContact O-OG 2.7Å; Q157-Y163 VanDerWaalsContact O-CB 3.24Å; Q157-Y163 WeakPolarHBondContact O-CB 3.21Å
158	Q	78.9	Confident	74.4	Confident	99 Å²	99	86 Å²	86	46%	0.463	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	140.8	178	-157.1	179.9	5.4	0	0	110.7	S160 Y163	Q158-S160 PolarHBondContact O-N 3.37Å; Q158-S160 VanDerWaalsContact O-N 3.09Å; Q158-Y163 HydrophobicContact CG-CE1 4.22Å; Q158-Y163 HydrophobicContact CG-CE2 4.42Å
159	R	81.9	Confident	76.9	Confident	130 Å²	130	76.3 Å²	76.3	49%	0.491	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	10.5	-177.6	-50.9	179	65.6	104.9	4.8	115.4	L194 C195 D196	R159-L194 WeakPolarHBondContact CA-O 3.28Å; R159-C195 VanDerWaalsContact O-CA 3.31Å; R159-C195 WeakPolarHBondContact O-CA 3.47Å; R159-C195 PolarHBondContact O-SG 3Å; R159-D196 WeakPolarHBondContact CB-OD2 3.35Å; R159-D196 WeakPolarHBondContact CD-OD2 3.38Å; R159-D196 IonicContact CZ-OD1 3.52Å; R159-D196 IonicContact NE-OD1 3.63Å; R159-D196 PolarHBondContact NE-OD1 3.37Å; R159-D196 IonicContact NE-OD2 3.9Å; R159-D196 PolarHBondContact NE-OD2 3.03Å; R159-D196 IonicContact NH2-OD1 2.84Å; R159-D196 PolarHBondContact NH2-OD1 3.47Å; R159-D196 PolarHBondContact O-N 3.38Å
160	S	86.9	Confident	79	Confident	34 Å²	34	67.7 Å²	67.7	24%	0.238	30%	0.301	C	S	.	.	S	Bend	trans	-77.5	161.4	168.6	73	0	0	0	0	112	Q157 Q158 G162 Y163 A164 C195	Q157-S160 WeakPolarHBondContact O-CB 3.31Å; Q157-S160 PolarHBondContact O-N 3Å; Q157-S160 VanDerWaalsContact O-N 3.13Å; Q157-S160 PolarHBondContact O-OG 2.7Å; Q158-S160 PolarHBondContact O-N 3.37Å; Q158-S160 VanDerWaalsContact O-N 3.09Å; S160-G162 PolarHBondContact O-N 2.66Å; S160-Y163 PolarHBondContact O-N 2.97Å; S160-Y163 PolarHBondContact OG-N 3.18Å; S160-A164 PolarHBondContact O-N 3.19Å; S160-C195 VanDerWaalsContact C-SG 3.56Å
161	G	84.6	Confident	81.2	Confident	9 Å²	9	61.9 Å²	61.9	9%	0.093	27%	0.273	C	S	.	.	H	α-helix	trans	-58.1	-36.4	178.9	0	0	0	0	0	113.2	V165 C195	G161-V165 VanDerWaalsContact O-CG2 3.31Å; G161-V165 WeakPolarHBondContact O-CG2 3Å; G161-V165 PolarHBondContact O-N 3.11Å; G161-V165 VanDerWaalsContact O-N 3.16Å; G161-C195 PolarHBondContact N-SG 2.98Å; G161-C195 VanDerWaalsContact N-SG 3.36Å
162	G	85.1	Confident	83.1	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-72.6	-36.7	179.5	0	0	0	0	0	113.1	S160 L166 S213	S160-G162 PolarHBondContact O-N 2.66Å; G162-L166 WeakPolarHBondContact O-CG 3.47Å; G162-L166 PolarHBondContact O-N 3.47Å; G162-S213 PolarHBondContact N-OG 3.09Å; G162-S213 VanDerWaalsContact N-OG 3.1Å
163	Y	88.8	Confident	84.3	Confident	14 Å²	14	48.3 Å²	48.3	6%	0.055	22%	0.223	C	C	.	.	H	α-helix	trans	-64	-47	174.1	174.8	-91.8	0	0	0	111.3	Q157 Q158 S160 V165 L166 L167 L245	Q157-Y163 VanDerWaalsContact O-CB 3.24Å; Q157-Y163 WeakPolarHBondContact O-CB 3.21Å; Q158-Y163 HydrophobicContact CG-CE1 4.22Å; Q158-Y163 HydrophobicContact CG-CE2 4.42Å; S160-Y163 PolarHBondContact O-N 2.97Å; S160-Y163 PolarHBondContact OG-N 3.18Å; Y163-V165 PolarHBondContact O-N 2.89Å; Y163-L166 PolarHBondContact O-N 2.88Å; Y163-L167 HydrophobicContact CE1-CD2 3.89Å; Y163-L167 WeakPolarHBondContact O-CB 3.33Å; Y163-L167 PolarHBondContact O-N 3.19Å; Y163-L245 HydrophobicContact CD2-CD1 3.91Å; Y163-L245 HydrophobicContact CD2-CD2 4.05Å; Y163-L245 HydrophobicContact CD2-CG 4.37Å; Y163-L245 HydrophobicContact CE2-CB 3.97Å; Y163-L245 HydrophobicContact CE2-CD1 4.21Å; Y163-L245 HydrophobicContact CE2-CD2 3.92Å; Y163-L245 HydrophobicContact CE2-CG 4.24Å
164	A	88	Confident	84.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-41.7	-179.3	0	0	0	0	0	112.7	S160 T168 A191 L194 C195 F199	S160-A164 PolarHBondContact O-N 3.19Å; A164-T168 WeakPolarHBondContact O-CB 3.36Å; A164-T168 PolarHBondContact O-N 3.42Å; A164-T168 PolarHBondContact O-OG1 2.97Å; A164-A191 HydrophobicContact CB-CB 4.09Å; A164-A191 WeakPolarHBondContact CB-O 3.4Å; A164-L194 HydrophobicContact CB-CB 3.78Å; A164-C195 HydrophobicContact CB-CB 3.79Å; A164-F199 HydrophobicContact CB-CE2 4.26Å; A164-F199 HydrophobicContact CB-CZ 4.2Å
165	V	89.2	Confident	84.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.6	-44.9	179.7	165.3	0	0	0	0	112.2	G161 Y163 T168 L169 L187 A191 F199 V214 L217 L223	G161-V165 VanDerWaalsContact O-CG2 3.31Å; G161-V165 WeakPolarHBondContact O-CG2 3Å; G161-V165 PolarHBondContact O-N 3.11Å; G161-V165 VanDerWaalsContact O-N 3.16Å; Y163-V165 PolarHBondContact O-N 2.89Å; V165-T168 PolarHBondContact O-N 2.93Å; V165-L169 HydrophobicContact CG1-CD1 4.2Å; V165-L169 PolarHBondContact O-N 2.96Å; V165-L187 HydrophobicContact CG1-CD1 4.37Å; V165-L187 HydrophobicContact CG1-CD2 4.04Å; V165-A191 HydrophobicContact CG2-CB 4.3Å; V165-F199 HydrophobicContact CG2-CE1 3.92Å; V165-F199 HydrophobicContact CG2-CZ 3.93Å; V165-V214 HydrophobicContact CG2-CG2 4.06Å; V165-L217 HydrophobicContact CB-CD1 4.28Å; V165-L217 HydrophobicContact CG1-CD1 4.11Å; V165-L223 HydrophobicContact CG1-CD1 4.18Å; V165-L223 HydrophobicContact CG1-CD2 3.74Å
166	L	88.4	Confident	83.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-46.5	179.5	-73.4	172	0	0	0	112	P156 G162 Y163 L169 Y170 L217 L222 L223 L234 L241 A242 L245	P156-L166 HydrophobicContact CG-CD1 3.92Å; G162-L166 WeakPolarHBondContact O-CG 3.47Å; G162-L166 PolarHBondContact O-N 3.47Å; Y163-L166 PolarHBondContact O-N 2.88Å; L166-L169 PolarHBondContact O-N 3.22Å; L166-Y170 WeakPolarHBondContact O-CB 3.38Å; L166-Y170 PolarHBondContact O-N 3.39Å; L166-L217 HydrophobicContact CD1-CD2 4.18Å; L166-L217 HydrophobicContact CG-CD1 4.26Å; L166-L217 HydrophobicContact CG-CD2 4.41Å; L166-L222 HydrophobicContact CD2-CB 4.3Å; L166-L223 HydrophobicContact CD2-CD1 3.66Å; L166-L223 HydrophobicContact CG-CD1 4.47Å; L166-L234 HydrophobicContact CD2-CD2 3.56Å; L166-L241 HydrophobicContact CD1-CD2 3.81Å; L166-L241 HydrophobicContact CD1-CG 4.33Å; L166-A242 HydrophobicContact CB-CB 4.24Å; L166-L245 HydrophobicContact CD1-CD1 4.11Å
167	L	87.6	Confident	82.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-68.5	-35.9	-177.6	-174.5	61.1	0	0	0	112.4	Y163 Y170 R171 L194 E246 E249	Y163-L167 HydrophobicContact CE1-CD2 3.89Å; Y163-L167 WeakPolarHBondContact O-CB 3.33Å; Y163-L167 PolarHBondContact O-N 3.19Å; L167-Y170 PolarHBondContact O-N 3.17Å; L167-R171 VanDerWaalsContact O-CG 3.31Å; L167-R171 WeakPolarHBondContact O-CG 3.43Å; L167-R171 PolarHBondContact O-N 3.23Å; L167-L194 HydrophobicContact CB-CD1 4.4Å; L167-L194 HydrophobicContact CD2-CD1 3.95Å; L167-L194 HydrophobicContact CD2-CD2 4.3Å; L167-L194 HydrophobicContact CG-CD1 4.19Å; L167-E246 HydrophobicContact CD1-CB 3.76Å; L167-E246 HydrophobicContact CD1-CG 3.88Å; L167-E249 WeakPolarHBondContact CD2-OE2 3.31Å
168	T	88.7	Confident	82.2	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.025	26%	0.257	C	S	.	.	H	α-helix	trans	-64.5	-49	176.5	-57.3	0	0	0	0	111.2	A164 V165 Y170 R171 Q172 M182 L187 E190 A191	A164-T168 WeakPolarHBondContact O-CB 3.36Å; A164-T168 PolarHBondContact O-N 3.42Å; A164-T168 PolarHBondContact O-OG1 2.97Å; V165-T168 PolarHBondContact O-N 2.93Å; T168-Y170 VanDerWaalsContact C-N 3.31Å; T168-Y170 PolarHBondContact O-N 3.14Å; T168-R171 PolarHBondContact O-N 2.92Å; T168-Q172 WeakPolarHBondContact O-CB 3.27Å; T168-Q172 PolarHBondContact O-N 3.16Å; T168-M182 HydrophobicContact CG2-CE 4.05Å; T168-M182 HydrophobicContact CG2-SD 3.99Å; T168-L187 HydrophobicContact CG2-CD1 3.98Å; T168-E190 HydrophobicContact CG2-CB 3.42Å; T168-E190 VanDerWaalsContact CG2-CB 3.42Å; T168-A191 WeakPolarHBondContact OG1-CA 3.3Å
169	L	87.3	Confident	81.9	Confident	10 Å²	10	49.6 Å²	49.6	5%	0.052	27%	0.266	C	S	.	.	H	α-helix	trans	-63.3	-37.6	177.7	-72.9	168.1	0	0	0	112.3	V165 L166 Q172 Q173 M182 L187 L223 L234	V165-L169 HydrophobicContact CG1-CD1 4.2Å; V165-L169 PolarHBondContact O-N 2.96Å; L166-L169 PolarHBondContact O-N 3.22Å; L169-Q172 PolarHBondContact O-N 2.94Å; L169-Q173 PolarHBondContact O-N 3.16Å; L169-Q173 VanDerWaalsContact O-N 3.08Å; L169-M182 HydrophobicContact CD2-CB 3.89Å; L169-M182 HydrophobicContact CD2-CG 3.75Å; L169-M182 HydrophobicContact CD2-SD 3.74Å; L169-M182 HydrophobicContact CG-SD 4.46Å; L169-L187 HydrophobicContact CD2-CD1 4.16Å; L169-L187 HydrophobicContact CG-CD1 3.91Å; L169-L223 HydrophobicContact CD1-CD2 3.54Å; L169-L223 HydrophobicContact CD1-CG 4Å; L169-L234 HydrophobicContact CB-CD1 3.83Å; L169-L234 HydrophobicContact CB-CD2 4.1Å; L169-L234 HydrophobicContact CB-CG 3.69Å; L169-L234 HydrophobicContact CD1-CD2 4.01Å; L169-L234 HydrophobicContact CD1-CG 4.16Å
170	Y	87.1	Confident	81.6	Confident	14 Å²	14	45.3 Å²	45.3	6%	0.055	26%	0.263	C	S	.	.	H	α-helix	trans	-63.9	-49	176.8	-177	-89.5	0	0	0	111.7	L166 L167 T168 Q172 Q173 Q174 L239 A242 E243 E246	L166-Y170 WeakPolarHBondContact O-CB 3.38Å; L166-Y170 PolarHBondContact O-N 3.39Å; L167-Y170 PolarHBondContact O-N 3.17Å; T168-Y170 VanDerWaalsContact C-N 3.31Å; T168-Y170 PolarHBondContact O-N 3.14Å; Y170-Q172 VanDerWaalsContact C-N 3.3Å; Y170-Q172 PolarHBondContact O-N 3.18Å; Y170-Q173 PolarHBondContact O-N 3.31Å; Y170-Q173 VanDerWaalsContact O-N 3.16Å; Y170-Q174 HydrophobicContact CD1-CG 4.37Å; Y170-Q174 HydrophobicContact CE1-CG 4.01Å; Y170-Q174 VanDerWaalsContact CZ-NE2 3.34Å; Y170-Q174 WeakPolarHBondContact O-CG 3.44Å; Y170-Q174 PolarHBondContact O-N 2.93Å; Y170-Q174 PolarHBondContact OH-NE2 3.14Å; Y170-Q174 VanDerWaalsContact OH-NE2 3.1Å; Y170-L239 HydrophobicContact CD2-CD1 3.77Å; Y170-L239 HydrophobicContact CE2-CD1 3.96Å; Y170-A242 HydrophobicContact CD2-CB 3.84Å; Y170-A242 HydrophobicContact CG-CB 3.99Å; Y170-E243 HydrophobicContact CE2-CB 3.69Å; Y170-E243 HydrophobicContact CE2-CG 4.35Å; Y170-E246 HydrophobicContact CD1-CB 4.32Å; Y170-E246 HydrophobicContact CE1-CB 4.26Å; Y170-E246 VanDerWaalsContact CE1-CD 3.5Å; Y170-E246 HydrophobicContact CE1-CG 4.46Å; Y170-E246 WeakPolarHBondContact CE1-OE2 3.05Å
171	R	85.9	Confident	81.5	Confident	76 Å²	76	46.5 Å²	46.5	29%	0.287	26%	0.262	S	S	.	.	H	α-helix	trans	-61	-38.9	177.6	-73.2	175.8	-177.8	176.6	4.7	112.3	L167 T168 Q173 Q174 E249	L167-R171 VanDerWaalsContact O-CG 3.31Å; L167-R171 WeakPolarHBondContact O-CG 3.43Å; L167-R171 PolarHBondContact O-N 3.23Å; T168-R171 PolarHBondContact O-N 2.92Å; R171-Q173 VanDerWaalsContact C-N 3.33Å; R171-Q173 PolarHBondContact O-N 2.76Å; R171-Q174 PolarHBondContact O-N 3.49Å; R171-E249 IonicContact CZ-OE2 2.74Å; R171-E249 IonicContact NH2-OE1 3.59Å; R171-E249 PolarHBondContact NH2-OE1 3.13Å; R171-E249 IonicContact NH2-OE2 3.03Å; R171-E249 PolarHBondContact NH2-OE2 3.01Å
172	Q	83.8	Confident	81.5	Confident	56 Å²	56	46.1 Å²	46.1	26%	0.262	26%	0.258	S	S	.	.	H	α-helix	trans	-65.5	-36.7	177.3	-170.1	68.4	-7.4	0	0	112.1	T168 L169 Y170 Q174 I175 S178 M182	T168-Q172 WeakPolarHBondContact O-CB 3.27Å; T168-Q172 PolarHBondContact O-N 3.16Å; L169-Q172 PolarHBondContact O-N 2.94Å; Y170-Q172 VanDerWaalsContact C-N 3.3Å; Y170-Q172 PolarHBondContact O-N 3.18Å; Q172-Q174 VanDerWaalsContact C-N 3.28Å; Q172-Q174 PolarHBondContact O-N 3.24Å; Q172-I175 PolarHBondContact O-N 2.75Å; Q172-S178 WeakPolarHBondContact O-CB 3.15Å; Q172-S178 PolarHBondContact O-OG 2.8Å; Q172-S178 VanDerWaalsContact O-OG 3.11Å; Q172-M182 HydrophobicContact CB-SD 3.97Å; Q172-M182 HydrophobicContact CG-CG 4.02Å; Q172-M182 HydrophobicContact CG-SD 4Å
173	Q	82.9	Confident	81.6	Confident	89 Å²	89	48.7 Å²	48.7	42%	0.416	27%	0.269	S	S	.	.	H	α-helix	trans	-67.5	-27.8	177.6	-171.7	169.6	-8.1	0	0	112.8	L169 Y170 R171 I175 S178	L169-Q173 PolarHBondContact O-N 3.16Å; L169-Q173 VanDerWaalsContact O-N 3.08Å; Y170-Q173 PolarHBondContact O-N 3.31Å; Y170-Q173 VanDerWaalsContact O-N 3.16Å; R171-Q173 VanDerWaalsContact C-N 3.33Å; R171-Q173 PolarHBondContact O-N 2.76Å; Q173-I175 VanDerWaalsContact C-N 3.29Å; Q173-I175 PolarHBondContact O-N 2.73Å; Q173-S178 PolarHBondContact O-OG 2.92Å
174	Q	78.5	Confident	81.4	Confident	116 Å²	116	51.1 Å²	51.1	54%	0.542	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-10.5	178.6	-63.9	-67	-3.2	0	0	114.2	Y170 R171 Q172	Y170-Q174 HydrophobicContact CD1-CG 4.37Å; Y170-Q174 HydrophobicContact CE1-CG 4.01Å; Y170-Q174 VanDerWaalsContact CZ-NE2 3.34Å; Y170-Q174 WeakPolarHBondContact O-CG 3.44Å; Y170-Q174 PolarHBondContact O-N 2.93Å; Y170-Q174 PolarHBondContact OH-NE2 3.14Å; Y170-Q174 VanDerWaalsContact OH-NE2 3.1Å; R171-Q174 PolarHBondContact O-N 3.49Å; Q172-Q174 VanDerWaalsContact C-N 3.28Å; Q172-Q174 PolarHBondContact O-N 3.24Å
175	I	81.1	Confident	81.1	Confident	89 Å²	89	56.7 Å²	56.7	46%	0.456	31%	0.307	S	S	.	.	S	Bend	trans	-79.4	126.7	178.7	-61.8	169.3	0	0	0	109.7	Q172 Q173 G177 S178	Q172-I175 PolarHBondContact O-N 2.75Å; Q173-I175 VanDerWaalsContact C-N 3.29Å; Q173-I175 PolarHBondContact O-N 2.73Å; I175-G177 PolarHBondContact O-N 2.87Å; I175-S178 VanDerWaalsContact O-CB 3.32Å; I175-S178 WeakPolarHBondContact O-CB 3.45Å; I175-S178 PolarHBondContact O-N 2.76Å; I175-S178 VanDerWaalsContact O-N 3.08Å; I175-S178 PolarHBondContact O-OG 2.84Å
176	P	58	Low	80.9	Confident	130 Å²	130	60.8 Å²	60.8	84%	0.844	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	120.4	177.7	-21.5	31.7	0	0	0	111.6
177	G	62	Low	80.9	Confident	82 Å²	82	60.8 Å²	60.8	85%	0.845	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.6	11.3	-177.3	0	0	0	0	0	115.2	I175	I175-G177 PolarHBondContact O-N 2.87Å
178	S	71.7	Confident	80.8	Confident	38 Å²	38	62.4 Å²	62.4	27%	0.266	33%	0.334	S	S	.	.			trans	-66.1	150.8	175.4	75	0	0	0	0	112.5	Q172 Q173 I175 G180	Q172-S178 WeakPolarHBondContact O-CB 3.15Å; Q172-S178 PolarHBondContact O-OG 2.8Å; Q172-S178 VanDerWaalsContact O-OG 3.11Å; Q173-S178 PolarHBondContact O-OG 2.92Å; I175-S178 VanDerWaalsContact O-CB 3.32Å; I175-S178 WeakPolarHBondContact O-CB 3.45Å; I175-S178 PolarHBondContact O-N 2.76Å; I175-S178 VanDerWaalsContact O-N 3.08Å; I175-S178 PolarHBondContact O-OG 2.84Å; S178-G180 PolarHBondContact O-N 3.47Å
179	K	71.5	Confident	80.5	Confident	149 Å²	149	66.5 Å²	66.5	65%	0.648	36%	0.363	S	S	*	.			trans	-78.6	-3.3	-175.3	-63.9	174.4	-175.8	165.8	0	113.4	Y181	K179-Y181 HydrophobicContact CB-CD1 4.1Å; K179-Y181 HydrophobicContact CB-CE1 3.76Å; K179-Y181 HydrophobicContact CB-CE2 4.48Å; K179-Y181 WeakPolarHBondContact O-CD1 3.34Å; K179-Y181 WeakPolarHBondContact O-CE1 3.2Å; K179-Y181 PolarHBondContact O-N 3.27Å
180	G	77.4	Confident	80.4	Confident	41 Å²	41	70 Å²	70	42%	0.423	38%	0.379	S	S	.	.	S	Bend	trans	68	4.4	-175.9	0	0	0	0	0	115.2	S178 S233	S178-G180 PolarHBondContact O-N 3.47Å; G180-S233 WeakPolarHBondContact O-CB 3.16Å
181	Y	84.3	Confident	80.5	Confident	58 Å²	58	69.3 Å²	69.3	23%	0.227	38%	0.376	C	S	.	.			trans	-148.3	158.3	177.8	65.9	-98.4	0	0	0	111.2	K179 F183 R231 Y232	K179-Y181 HydrophobicContact CB-CD1 4.1Å; K179-Y181 HydrophobicContact CB-CE1 3.76Å; K179-Y181 HydrophobicContact CB-CE2 4.48Å; K179-Y181 WeakPolarHBondContact O-CD1 3.34Å; K179-Y181 WeakPolarHBondContact O-CE1 3.2Å; K179-Y181 PolarHBondContact O-N 3.27Å; Y181-F183 HydrophobicContact CE2-CE1 4.38Å; Y181-F183 AromaticContact CE2-CE2 3.79Å; Y181-F183 HydrophobicContact CE2-CE2 3.79Å; Y181-F183 AromaticContact CE2-CZ 3.71Å; Y181-F183 HydrophobicContact CE2-CZ 3.71Å; Y181-R231 HydrophobicContact CD2-CB 3.87Å; Y181-R231 HydrophobicContact CD2-CG 3.65Å; Y181-R231 HydrophobicContact CE2-CG 3.91Å; Y181-R231 HydrophobicContact CG-CB 4.07Å; Y181-R231 HydrophobicContact CG-CG 4.2Å; Y181-Y232 CarbonylContact C-O 3.54Å; Y181-Y232 VanDerWaalsContact CA-O 3.31Å; Y181-Y232 WeakPolarHBondContact CA-O 3.46Å
182	M	84.4	Confident	80.5	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.005	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.5	173.6	-64.6	-179.1	76.9	0	0	111.7	T168 L169 Q172 E186 L187 E190 Y232	T168-M182 HydrophobicContact CG2-CE 4.05Å; T168-M182 HydrophobicContact CG2-SD 3.99Å; L169-M182 HydrophobicContact CD2-CB 3.89Å; L169-M182 HydrophobicContact CD2-CG 3.75Å; L169-M182 HydrophobicContact CD2-SD 3.74Å; L169-M182 HydrophobicContact CG-SD 4.46Å; Q172-M182 HydrophobicContact CB-SD 3.97Å; Q172-M182 HydrophobicContact CG-CG 4.02Å; Q172-M182 HydrophobicContact CG-SD 4Å; M182-E186 HydrophobicContact CE-CB 4.14Å; M182-L187 HydrophobicContact CB-CB 4.25Å; M182-L187 HydrophobicContact CE-CD1 4.47Å; M182-L187 HydrophobicContact SD-CD1 3.96Å; M182-E190 HydrophobicContact CE-CB 4.14Å; M182-E190 HydrophobicContact CE-CG 4.11Å; M182-E190 WeakPolarHBondContact CE-OE2 3.49Å; M182-Y232 PolarHBondContact N-O 3.22Å; M182-Y232 PolarHBondContact O-N 3.17Å
183	F	87.1	Confident	80.4	Confident	56 Å²	56	70.3 Å²	70.3	25%	0.246	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	158.3	172	-64.7	-74.4	0	0	0	111.5	Y181 M185 E186 L187 P229 R231	Y181-F183 HydrophobicContact CE2-CE1 4.38Å; Y181-F183 AromaticContact CE2-CE2 3.79Å; Y181-F183 HydrophobicContact CE2-CE2 3.79Å; Y181-F183 AromaticContact CE2-CZ 3.71Å; Y181-F183 HydrophobicContact CE2-CZ 3.71Å; F183-M185 VanDerWaalsContact C-N 3.33Å; F183-M185 PolarHBondContact O-N 3.07Å; F183-E186 HydrophobicContact CB-CG 4.44Å; F183-E186 WeakPolarHBondContact CD2-OE2 3.5Å; F183-E186 PolarHBondContact N-OE2 3.43Å; F183-E186 PolarHBondContact O-N 3.15Å; F183-E186 VanDerWaalsContact O-N 3.17Å; F183-L187 WeakPolarHBondContact O-CB 3.28Å; F183-L187 PolarHBondContact O-N 3.29Å; F183-P229 HydrophobicContact CD1-CB 4.26Å; F183-P229 HydrophobicContact CE1-CB 4.24Å; F183-R231 HydrophobicContact CD1-CG 4.26Å; F183-R231 HydrophobicContact CE1-CG 3.74Å; F183-R231 HydrophobicContact CZ-CG 4.35Å
184	K	84.1	Confident	80.3	Confident	65 Å²	65	67.3 Å²	67.3	28%	0.283	38%	0.379	S	S	.	.	H	α-helix	trans	-48.7	-49.8	-178.8	177.8	168.8	-179.6	-174.7	0	113.5	L187 Q188 W211 Y232	K184-L187 PolarHBondContact O-N 2.97Å; K184-Q188 HydrophobicContact CG-CG 4.49Å; K184-Q188 WeakPolarHBondContact O-CB 2.9Å; K184-Q188 VanDerWaalsContact O-CG 3.27Å; K184-Q188 WeakPolarHBondContact O-CG 3.34Å; K184-Q188 PolarHBondContact O-N 3.05Å; K184-W211 HydrophobicContact CB-CH2 4.24Å; K184-W211 HydrophobicContact CB-CZ2 4.28Å; K184-W211 HydrophobicContact CD-CH2 4.48Å; K184-W211 HydrophobicContact CD-CZ2 3.85Å; K184-W211 HydrophobicContact CG-CH2 3.73Å; K184-W211 HydrophobicContact CG-CZ2 3.59Å; K184-W211 HydrophobicContact CG-CZ3 4.44Å; K184-Y232 HydrophobicContact CB-CE2 4.03Å
185	M	83	Confident	80.7	Confident	117 Å²	117	62.2 Å²	62.2	58%	0.576	36%	0.356	S	S	*	.	H	α-helix	trans	-67.8	-39.4	-176.8	-69.6	-60	-60	0	0	112.6	F183 S189	F183-M185 VanDerWaalsContact C-N 3.33Å; F183-M185 PolarHBondContact O-N 3.07Å; M185-S189 PolarHBondContact O-N 3.27Å; M185-S189 VanDerWaalsContact O-N 3.14Å
186	E	84.4	Confident	80.7	Confident	86 Å²	86	63 Å²	63	40%	0.402	36%	0.361	S	S	.	.	H	α-helix	trans	-65	-48.1	176.2	-64.8	170.5	173.1	0	0	110	M182 F183 Q188 S189 E190	M182-E186 HydrophobicContact CE-CB 4.14Å; F183-E186 HydrophobicContact CB-CG 4.44Å; F183-E186 WeakPolarHBondContact CD2-OE2 3.5Å; F183-E186 PolarHBondContact N-OE2 3.43Å; F183-E186 PolarHBondContact O-N 3.15Å; F183-E186 VanDerWaalsContact O-N 3.17Å; E186-Q188 PolarHBondContact O-N 2.79Å; E186-S189 PolarHBondContact O-N 2.95Å; E186-E190 PolarHBondContact O-N 3.5Å
187	L	87.3	Confident	81.8	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-62.8	-39.9	179.5	-174.9	59.1	0	0	0	112.2	V165 T168 L169 M182 F183 K184 A191 W211 Y232	V165-L187 HydrophobicContact CG1-CD1 4.37Å; V165-L187 HydrophobicContact CG1-CD2 4.04Å; T168-L187 HydrophobicContact CG2-CD1 3.98Å; L169-L187 HydrophobicContact CD2-CD1 4.16Å; L169-L187 HydrophobicContact CG-CD1 3.91Å; M182-L187 HydrophobicContact CB-CB 4.25Å; M182-L187 HydrophobicContact CE-CD1 4.47Å; M182-L187 HydrophobicContact SD-CD1 3.96Å; F183-L187 WeakPolarHBondContact O-CB 3.28Å; F183-L187 PolarHBondContact O-N 3.29Å; K184-L187 PolarHBondContact O-N 2.97Å; L187-A191 WeakPolarHBondContact O-CB 3.42Å; L187-A191 PolarHBondContact O-N 2.75Å; L187-W211 HydrophobicContact CD2-CH2 4.02Å; L187-W211 HydrophobicContact CD2-CZ3 4.16Å; L187-W211 HydrophobicContact CG-CZ3 4.27Å; L187-Y232 HydrophobicContact CD2-CD2 4.36Å; L187-Y232 HydrophobicContact CD2-CG 4.16Å
188	Q	86.4	Confident	82.6	Confident	33 Å²	33	60 Å²	60	15%	0.154	32%	0.315	C	S	.	.	H	α-helix	trans	-64.5	-40.5	175.3	-76	-178.5	-51.8	0	0	112.2	K184 E186 Q192 F199 W211	K184-Q188 HydrophobicContact CG-CG 4.49Å; K184-Q188 WeakPolarHBondContact O-CB 2.9Å; K184-Q188 VanDerWaalsContact O-CG 3.27Å; K184-Q188 WeakPolarHBondContact O-CG 3.34Å; K184-Q188 PolarHBondContact O-N 3.05Å; E186-Q188 PolarHBondContact O-N 2.79Å; Q188-Q192 WeakPolarHBondContact O-CB 3.33Å; Q188-Q192 PolarHBondContact O-N 3.27Å; Q188-F199 HydrophobicContact CB-CB 4.31Å; Q188-F199 HydrophobicContact CG-CB 4.16Å; Q188-F199 PolarHBondContact NE2-O 3.18Å; Q188-W211 HydrophobicContact CG-CD2 4.23Å; Q188-W211 HydrophobicContact CG-CE3 3.4Å; Q188-W211 HydrophobicContact CG-CH2 4.3Å; Q188-W211 HydrophobicContact CG-CZ3 3.44Å; Q188-W211 VanDerWaalsContact CG-CZ3 3.44Å
189	S	83.3	Confident	83.1	Confident	91 Å²	91	58.4 Å²	58.4	64%	0.636	30%	0.303	S	S	*	.	H	α-helix	trans	-69.4	-43.5	-179.6	-170.4	0	0	0	0	112.1	M185 E186	M185-S189 PolarHBondContact O-N 3.27Å; M185-S189 VanDerWaalsContact O-N 3.14Å; E186-S189 PolarHBondContact O-N 2.95Å
190	E	84.4	Confident	83.3	Confident	83 Å²	83	55.6 Å²	55.6	39%	0.388	30%	0.303	S	S	.	.	H	α-helix	trans	-79	-28.9	-177.6	-69	-175.6	-157.9	0	0	113.2	T168 M182 E186 P193	T168-E190 HydrophobicContact CG2-CB 3.42Å; T168-E190 VanDerWaalsContact CG2-CB 3.42Å; M182-E190 HydrophobicContact CE-CB 4.14Å; M182-E190 HydrophobicContact CE-CG 4.11Å; M182-E190 WeakPolarHBondContact CE-OE2 3.49Å; E186-E190 PolarHBondContact O-N 3.5Å; E190-P193 VanDerWaalsContact O-CD 3.3Å; E190-P193 WeakPolarHBondContact O-CD 3.36Å; E190-P193 WeakPolarHBondContact O-CG 3.39Å
191	A	88.3	Confident	83.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-80.8	-22	176.4	0	0	0	0	0	113.5	A164 V165 T168 L187 L194 C195 F199	A164-A191 HydrophobicContact CB-CB 4.09Å; A164-A191 WeakPolarHBondContact CB-O 3.4Å; V165-A191 HydrophobicContact CG2-CB 4.3Å; T168-A191 WeakPolarHBondContact OG1-CA 3.3Å; L187-A191 WeakPolarHBondContact O-CB 3.42Å; L187-A191 PolarHBondContact O-N 2.75Å; A191-L194 PolarHBondContact O-N 3.36Å; A191-L194 VanDerWaalsContact O-N 3.11Å; A191-C195 PolarHBondContact O-N 2.96Å; A191-F199 HydrophobicContact CB-CE2 3.78Å; A191-F199 HydrophobicContact CB-CZ 3.95Å
192	Q	86.7	Confident	82.7	Confident	57 Å²	57	58 Å²	58	27%	0.266	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-54.9	-44.9	-179.6	-169.8	60.2	75.9	0	0	115.2	Q188 L194 C195 K197 F199	Q188-Q192 WeakPolarHBondContact O-CB 3.33Å; Q188-Q192 PolarHBondContact O-N 3.27Å; Q192-L194 PolarHBondContact O-N 3.11Å; Q192-C195 PolarHBondContact O-N 3.34Å; Q192-C195 VanDerWaalsContact O-O 3.1Å; Q192-K197 PolarHBondContact NE2-O 2.93Å; Q192-K197 VanDerWaalsContact NE2-O 3.08Å; Q192-F199 HydrophobicContact CB-CD2 4.45Å
193	P	82.1	Confident	82	Confident	96 Å²	96	61.3 Å²	61.3	62%	0.623	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-66.9	-15.4	179	26	-36.5	0	0	0	114.1	E190	E190-P193 VanDerWaalsContact O-CD 3.3Å; E190-P193 WeakPolarHBondContact O-CD 3.36Å; E190-P193 WeakPolarHBondContact O-CG 3.39Å
194	L	81.1	Confident	80	Confident	26 Å²	26	67.7 Å²	67.7	14%	0.136	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-98	1.8	179.2	-60.2	171.5	0	0	0	112.5	R159 A164 L167 A191 Q192	R159-L194 WeakPolarHBondContact CA-O 3.28Å; A164-L194 HydrophobicContact CB-CB 3.78Å; L167-L194 HydrophobicContact CB-CD1 4.4Å; L167-L194 HydrophobicContact CD2-CD1 3.95Å; L167-L194 HydrophobicContact CD2-CD2 4.3Å; L167-L194 HydrophobicContact CG-CD1 4.19Å; A191-L194 PolarHBondContact O-N 3.36Å; A191-L194 VanDerWaalsContact O-N 3.11Å; Q192-L194 PolarHBondContact O-N 3.11Å
195	C	86.4	Confident	78.4	Confident	8 Å²	8	69.1 Å²	69.1	5%	0.054	40%	0.402	C	S	.	.			trans	-126.6	138.9	-177.9	-169.6	0	0	0	0	112.6	R159 S160 G161 A164 A191 Q192 K197 F199	R159-C195 VanDerWaalsContact O-CA 3.31Å; R159-C195 WeakPolarHBondContact O-CA 3.47Å; R159-C195 PolarHBondContact O-SG 3Å; S160-C195 VanDerWaalsContact C-SG 3.56Å; G161-C195 PolarHBondContact N-SG 2.98Å; G161-C195 VanDerWaalsContact N-SG 3.36Å; A164-C195 HydrophobicContact CB-CB 3.79Å; A191-C195 PolarHBondContact O-N 2.96Å; Q192-C195 PolarHBondContact O-N 3.34Å; Q192-C195 VanDerWaalsContact O-O 3.1Å; C195-K197 PolarHBondContact SG-N 3.42Å; C195-K197 VanDerWaalsContact SG-N 3.43Å; C195-K197 PolarHBondContact SG-O 3.31Å; C195-K197 VanDerWaalsContact SG-O 3.36Å; C195-F199 HydrophobicContact CB-CD2 4.34Å; C195-F199 HydrophobicContact CB-CE2 3.56Å; C195-F199 HydrophobicContact CB-CZ 4.28Å
196	D	80.7	Confident	77.6	Confident	105 Å²	105	65.9 Å²	65.9	56%	0.561	39%	0.392	S	S	*	.	S	Bend	trans	-77.1	-26.4	175.6	-71	-31.8	0	0	0	113.6	R159	R159-D196 WeakPolarHBondContact CB-OD2 3.35Å; R159-D196 WeakPolarHBondContact CD-OD2 3.38Å; R159-D196 IonicContact CZ-OD1 3.52Å; R159-D196 IonicContact NE-OD1 3.63Å; R159-D196 PolarHBondContact NE-OD1 3.37Å; R159-D196 IonicContact NE-OD2 3.9Å; R159-D196 PolarHBondContact NE-OD2 3.03Å; R159-D196 IonicContact NH2-OD1 2.84Å; R159-D196 PolarHBondContact NH2-OD1 3.47Å; R159-D196 PolarHBondContact O-N 3.38Å
197	K	81.4	Confident	76.7	Confident	122 Å²	122	70.9 Å²	70.9	53%	0.53	41%	0.412	S	S	.	.	S	Bend	trans	-94.6	146.8	178.3	-67.2	-173.7	177.6	-176.3	0	110.4	Q192 C195 A210	Q192-K197 PolarHBondContact NE2-O 2.93Å; Q192-K197 VanDerWaalsContact NE2-O 3.08Å; C195-K197 PolarHBondContact SG-N 3.42Å; C195-K197 VanDerWaalsContact SG-N 3.43Å; C195-K197 PolarHBondContact SG-O 3.31Å; C195-K197 VanDerWaalsContact SG-O 3.36Å; K197-A210 HydrophobicContact CB-CB 3.95Å
198	S	78.6	Confident	75.8	Confident	28 Å²	28	78.6 Å²	78.6	20%	0.196	44%	0.442	C	S	.	.			trans	-74	136.4	178.1	179	0	0	0	0	111.4	S200 V201 T209 A210	S198-S200 VanDerWaalsContact C-N 3.33Å; S198-S200 PolarHBondContact OG-N 3.29Å; S198-S200 PolarHBondContact OG-OG 2.91Å; S198-S200 VanDerWaalsContact OG-OG 3.13Å; S198-V201 VanDerWaalsContact CB-O 3.28Å; S198-V201 WeakPolarHBondContact CB-O 3.31Å; S198-V201 PolarHBondContact OG-N 2.83Å; S198-T209 WeakPolarHBondContact O-CB 3.35Å; S198-A210 PolarHBondContact O-N 2.78Å
199	F	81.4	Confident	75.9	Confident	4 Å²	4	78.7 Å²	78.7	2%	0.018	45%	0.445	C	S	.	.	S	Bend	trans	-79.2	-17.9	171.8	-80.1	-79.9	0	0	0	112.9	A164 V165 Q188 A191 Q192 C195 A210 W211	A164-F199 HydrophobicContact CB-CE2 4.26Å; A164-F199 HydrophobicContact CB-CZ 4.2Å; V165-F199 HydrophobicContact CG2-CE1 3.92Å; V165-F199 HydrophobicContact CG2-CZ 3.93Å; Q188-F199 HydrophobicContact CB-CB 4.31Å; Q188-F199 HydrophobicContact CG-CB 4.16Å; Q188-F199 PolarHBondContact NE2-O 3.18Å; A191-F199 HydrophobicContact CB-CE2 3.78Å; A191-F199 HydrophobicContact CB-CZ 3.95Å; Q192-F199 HydrophobicContact CB-CD2 4.45Å; C195-F199 HydrophobicContact CB-CD2 4.34Å; C195-F199 HydrophobicContact CB-CE2 3.56Å; C195-F199 HydrophobicContact CB-CZ 4.28Å; F199-A210 HydrophobicContact CD1-CB 3.7Å; F199-A210 HydrophobicContact CD2-CB 4.09Å; F199-A210 HydrophobicContact CE1-CB 3.75Å; F199-A210 HydrophobicContact CE2-CB 4.13Å; F199-A210 HydrophobicContact CG-CB 3.89Å; F199-A210 HydrophobicContact CZ-CB 3.97Å; F199-W211 HydrophobicContact CD1-CB 4.07Å; F199-W211 AromaticContact CD1-CE3 3.84Å; F199-W211 HydrophobicContact CD1-CE3 3.84Å; F199-W211 HydrophobicContact CE1-CE3 4.22Å
200	S	75.9	Confident	75.9	Confident	91 Å²	91	74.7 Å²	74.7	64%	0.636	42%	0.417	S	S	*	.	S	Bend	trans	-109.5	-28.5	-175.2	50.9	0	0	0	0	114.1	S198	S198-S200 VanDerWaalsContact C-N 3.33Å; S198-S200 PolarHBondContact OG-N 3.29Å; S198-S200 PolarHBondContact OG-OG 2.91Å; S198-S200 VanDerWaalsContact OG-OG 3.13Å
201	V	76.3	Confident	76	Confident	89 Å²	89	72.3 Å²	72.3	54%	0.539	41%	0.405	S	S	.	.	S	Bend	trans	-123.8	128.9	-175.2	-173.7	0	0	0	0	110.1	S198	S198-V201 VanDerWaalsContact CB-O 3.28Å; S198-V201 WeakPolarHBondContact CB-O 3.31Å; S198-V201 PolarHBondContact OG-N 2.83Å
202	P	74.3	Confident	75.8	Confident	60 Å²	60	75 Å²	75	39%	0.39	42%	0.424	S	S	.	.			trans	-70.7	145.8	173	-16.8	30.2	0	0	0	112.2	S206 T209	P202-S206 VanDerWaalsContact CB-O 3.27Å; P202-S206 WeakPolarHBondContact CB-O 3.42Å; P202-T209 HydrophobicContact CB-CG2 4.43Å; P202-T209 HydrophobicContact CG-CG2 3.87Å
203	D	68	Low	75.7	Confident	70 Å²	70	73.2 Å²	73.2	37%	0.374	42%	0.418	S	S	.	.			trans	-67.1	153.3	175.2	-60.5	-31.4	0	0	0	111.6	G205 S206	D203-G205 PolarHBondContact O-N 3.02Å; D203-S206 PolarHBondContact O-N 3.29Å
204	L	46.6	Very low	75.9	Confident	191 Å²	191	68.8 Å²	68.8	100%	1	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	112.5	177.9	-71.7	165.6	0	0	0	110.5
205	G	50.1	Low	76.1	Confident	94 Å²	94	71.5 Å²	71.5	97%	0.969	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.6	-7.7	-177.6	0	0	0	0	0	115.3	D203	D203-G205 PolarHBondContact O-N 3.02Å
206	S	65.4	Low	76	Confident	50 Å²	50	73.6 Å²	73.6	35%	0.35	42%	0.422	S	S	.	.			trans	-111.1	142.7	175.7	178.8	0	0	0	0	111.5	P202 D203 Y208	P202-S206 VanDerWaalsContact CB-O 3.27Å; P202-S206 WeakPolarHBondContact CB-O 3.42Å; D203-S206 PolarHBondContact O-N 3.29Å; S206-Y208 PolarHBondContact OG-N 3.39Å; S206-Y208 VanDerWaalsContact OG-N 3.16Å; S206-Y208 PolarHBondContact OG-O 3.31Å
207	K	65.1	Low	76.3	Confident	190 Å²	190	68.6 Å²	68.6	83%	0.826	40%	0.396	S	S	*	.	S	Bend	trans	-89.3	-6.3	172.6	-64.4	-179.4	-177.3	176.2	0	113
208	Y	70.4	Confident	76.6	Confident	163 Å²	163	65.9 Å²	65.9	64%	0.639	39%	0.386	S	S	*	.			trans	-110.8	136.3	-170	-57.6	-74.1	0	0	0	111.7	S206	S206-Y208 PolarHBondContact OG-N 3.39Å; S206-Y208 VanDerWaalsContact OG-N 3.16Å; S206-Y208 PolarHBondContact OG-O 3.31Å
209	T	86.6	Confident	76.9	Confident	35 Å²	35	72.2 Å²	72.2	22%	0.215	41%	0.413	C	S	.	.			trans	-91.7	170.3	169.9	67.5	0	0	0	0	110.8	S198 P202 W211 S212	S198-T209 WeakPolarHBondContact O-CB 3.35Å; P202-T209 HydrophobicContact CB-CG2 4.43Å; P202-T209 HydrophobicContact CG-CG2 3.87Å; T209-W211 PolarHBondContact O-N 3.38Å; T209-W211 WeakPolarHBondContact OG1-CB 3.35Å; T209-W211 PolarHBondContact OG1-N 3.01Å; T209-S212 WeakPolarHBondContact O-CB 3.36Å; T209-S212 PolarHBondContact O-N 2.88Å; T209-S212 PolarHBondContact O-OG 3.38Å
210	A	83.3	Confident	77.1	Confident	6 Å²	6	76.7 Å²	76.7	5%	0.05	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-21.3	172.4	0	0	0	0	0	113	K197 S198 F199 S212 S213	K197-A210 HydrophobicContact CB-CB 3.95Å; S198-A210 PolarHBondContact O-N 2.78Å; F199-A210 HydrophobicContact CD1-CB 3.7Å; F199-A210 HydrophobicContact CD2-CB 4.09Å; F199-A210 HydrophobicContact CE1-CB 3.75Å; F199-A210 HydrophobicContact CE2-CB 4.13Å; F199-A210 HydrophobicContact CG-CB 3.89Å; F199-A210 HydrophobicContact CZ-CB 3.97Å; A210-S212 PolarHBondContact O-N 3.06Å; A210-S213 WeakPolarHBondContact O-CB 3.4Å; A210-S213 PolarHBondContact O-N 3.42Å; A210-S213 PolarHBondContact O-OG 3.35Å
211	W	87.3	Confident	77.6	Confident	33 Å²	33	76.5 Å²	76.5	13%	0.125	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.2	177.7	-168.2	-99.9	0	0	0	113.8	K184 L187 Q188 F199 T209 S213 V214 Y232	K184-W211 HydrophobicContact CB-CH2 4.24Å; K184-W211 HydrophobicContact CB-CZ2 4.28Å; K184-W211 HydrophobicContact CD-CH2 4.48Å; K184-W211 HydrophobicContact CD-CZ2 3.85Å; K184-W211 HydrophobicContact CG-CH2 3.73Å; K184-W211 HydrophobicContact CG-CZ2 3.59Å; K184-W211 HydrophobicContact CG-CZ3 4.44Å; L187-W211 HydrophobicContact CD2-CH2 4.02Å; L187-W211 HydrophobicContact CD2-CZ3 4.16Å; L187-W211 HydrophobicContact CG-CZ3 4.27Å; Q188-W211 HydrophobicContact CG-CD2 4.23Å; Q188-W211 HydrophobicContact CG-CE3 3.4Å; Q188-W211 HydrophobicContact CG-CH2 4.3Å; Q188-W211 HydrophobicContact CG-CZ3 3.44Å; Q188-W211 VanDerWaalsContact CG-CZ3 3.44Å; F199-W211 HydrophobicContact CD1-CB 4.07Å; F199-W211 AromaticContact CD1-CE3 3.84Å; F199-W211 HydrophobicContact CD1-CE3 3.84Å; F199-W211 HydrophobicContact CE1-CE3 4.22Å; T209-W211 PolarHBondContact O-N 3.38Å; T209-W211 WeakPolarHBondContact OG1-CB 3.35Å; T209-W211 PolarHBondContact OG1-N 3.01Å; W211-S213 PolarHBondContact O-N 3.39Å; W211-S213 VanDerWaalsContact O-N 3.13Å; W211-V214 HydrophobicContact CD2-CG2 3.92Å; W211-V214 HydrophobicContact CE3-CG2 3.84Å; W211-V214 HydrophobicContact CH2-CG2 4.18Å; W211-V214 HydrophobicContact CZ2-CG1 4.33Å; W211-V214 HydrophobicContact CZ2-CG2 4.23Å; W211-V214 HydrophobicContact CZ3-CG2 3.98Å; W211-V214 WeakPolarHBondContact O-CB 3.15Å; W211-V214 PolarHBondContact O-N 3.48Å; W211-Y232 HydrophobicContact CH2-CE2 4.2Å; W211-Y232 HydrophobicContact CZ2-CE1 4.37Å; W211-Y232 HydrophobicContact CZ2-CE2 4.12Å; W211-Y232 AromaticContact CZ2-CZ 3.81Å
212	S	84.3	Confident	78.1	Confident	58 Å²	58	73 Å²	73	41%	0.406	40%	0.402	S	S	.	.	H	α-helix	trans	-57.8	-27.5	177.1	58.1	0	0	0	0	112.8	T209 A210 V214 S215	T209-S212 WeakPolarHBondContact O-CB 3.36Å; T209-S212 PolarHBondContact O-N 2.88Å; T209-S212 PolarHBondContact O-OG 3.38Å; A210-S212 PolarHBondContact O-N 3.06Å; S212-V214 VanDerWaalsContact C-N 3.27Å; S212-V214 PolarHBondContact O-N 3.06Å; S212-S215 PolarHBondContact O-N 3.49Å
213	S	85.1	Confident	78.7	Confident	19 Å²	19	70.3 Å²	70.3	13%	0.133	38%	0.384	C	S	.	.	H	α-helix	trans	-64.3	-24.1	176.2	64.3	0	0	0	0	114.4	G162 A210 W211 S215 T216 L217	G162-S213 PolarHBondContact N-OG 3.09Å; G162-S213 VanDerWaalsContact N-OG 3.1Å; A210-S213 WeakPolarHBondContact O-CB 3.4Å; A210-S213 PolarHBondContact O-N 3.42Å; A210-S213 PolarHBondContact O-OG 3.35Å; W211-S213 PolarHBondContact O-N 3.39Å; W211-S213 VanDerWaalsContact O-N 3.13Å; S213-S215 VanDerWaalsContact C-N 3.34Å; S213-S215 PolarHBondContact O-N 3.39Å; S213-T216 WeakPolarHBondContact O-CB 3.39Å; S213-T216 PolarHBondContact O-N 2.91Å; S213-L217 WeakPolarHBondContact O-CG 3.43Å; S213-L217 PolarHBondContact O-N 3.49Å
214	V	85.5	Confident	79.6	Confident	3 Å²	3	70.8 Å²	70.8	2%	0.018	39%	0.386	C	S	.	.	H	α-helix	trans	-65.8	-37.4	-179.8	178.1	0	0	0	0	111.3	V165 W211 S212 T216 L217 I218 Y232	V165-V214 HydrophobicContact CG2-CG2 4.06Å; W211-V214 HydrophobicContact CD2-CG2 3.92Å; W211-V214 HydrophobicContact CE3-CG2 3.84Å; W211-V214 HydrophobicContact CH2-CG2 4.18Å; W211-V214 HydrophobicContact CZ2-CG1 4.33Å; W211-V214 HydrophobicContact CZ2-CG2 4.23Å; W211-V214 HydrophobicContact CZ3-CG2 3.98Å; W211-V214 WeakPolarHBondContact O-CB 3.15Å; W211-V214 PolarHBondContact O-N 3.48Å; S212-V214 VanDerWaalsContact C-N 3.27Å; S212-V214 PolarHBondContact O-N 3.06Å; V214-T216 VanDerWaalsContact C-N 3.3Å; V214-T216 PolarHBondContact O-N 3.41Å; V214-L217 PolarHBondContact O-N 2.64Å; V214-I218 HydrophobicContact CG1-CD1 4.09Å; V214-I218 WeakPolarHBondContact O-CG1 3.1Å; V214-I218 PolarHBondContact O-N 3.22Å; V214-Y232 HydrophobicContact CG1-CD1 4.21Å; V214-Y232 HydrophobicContact CG1-CE1 3.84Å
215	S	84.6	Confident	81.7	Confident	83 Å²	83	64.7 Å²	64.7	58%	0.58	35%	0.352	S	S	*	.	H	α-helix	trans	-62.2	-40	175.5	-59.7	0	0	0	0	111.4	S212 S213 I218 Q219	S212-S215 PolarHBondContact O-N 3.49Å; S213-S215 VanDerWaalsContact C-N 3.34Å; S213-S215 PolarHBondContact O-N 3.39Å; S215-I218 PolarHBondContact O-N 3.44Å; S215-Q219 WeakPolarHBondContact O-CB 3.47Å; S215-Q219 PolarHBondContact O-N 3.05Å
216	T	84.9	Confident	83.1	Confident	51 Å²	51	62.6 Å²	62.6	31%	0.313	32%	0.32	S	S	.	.	H	α-helix	trans	-65.2	-41.5	175.1	-49.3	0	0	0	0	111.4	S213 V214 I218 Q219 K220	S213-T216 WeakPolarHBondContact O-CB 3.39Å; S213-T216 PolarHBondContact O-N 2.91Å; V214-T216 VanDerWaalsContact C-N 3.3Å; V214-T216 PolarHBondContact O-N 3.41Å; T216-I218 PolarHBondContact O-N 3.16Å; T216-Q219 PolarHBondContact O-N 2.68Å; T216-K220 HydrophobicContact CG2-CG 4.29Å; T216-K220 WeakPolarHBondContact O-CB 3.03Å; T216-K220 WeakPolarHBondContact O-CG 3.34Å; T216-K220 PolarHBondContact O-N 3.18Å
217	L	86.5	Confident	83.6	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.6	-36.9	178.2	-66.3	175.3	0	0	0	112.8	Y154 V165 L166 S213 V214 K220 N221 L222 L223	Y154-L217 HydrophobicContact CD1-CD2 4.42Å; Y154-L217 HydrophobicContact CE1-CD2 3.75Å; V165-L217 HydrophobicContact CB-CD1 4.28Å; V165-L217 HydrophobicContact CG1-CD1 4.11Å; L166-L217 HydrophobicContact CD1-CD2 4.18Å; L166-L217 HydrophobicContact CG-CD1 4.26Å; L166-L217 HydrophobicContact CG-CD2 4.41Å; S213-L217 WeakPolarHBondContact O-CG 3.43Å; S213-L217 PolarHBondContact O-N 3.49Å; V214-L217 PolarHBondContact O-N 2.64Å; L217-K220 PolarHBondContact O-N 3.07Å; L217-N221 PolarHBondContact O-N 2.9Å; L217-L222 HydrophobicContact CB-CB 4.5Å; L217-L222 HydrophobicContact CD2-CB 4.32Å; L217-L222 HydrophobicContact CD2-CD1 3.74Å; L217-L222 PolarHBondContact O-N 3.19Å; L217-L223 HydrophobicContact CB-CB 4.45Å; L217-L223 HydrophobicContact CB-CD1 3.57Å; L217-L223 HydrophobicContact CD1-CD1 3.53Å; L217-L223 HydrophobicContact CG-CD1 4.09Å; L217-L223 PolarHBondContact O-N 2.99Å
218	I	87.6	Confident	83.5	Confident	65 Å²	65	64.3 Å²	64.3	33%	0.333	33%	0.33	S	S	.	.	H	α-helix	trans	-66.6	-46	173.3	-65.9	167.5	0	0	0	110.3	V214 S215 T216 K220 N221 L223 K225 Y232	V214-I218 HydrophobicContact CG1-CD1 4.09Å; V214-I218 WeakPolarHBondContact O-CG1 3.1Å; V214-I218 PolarHBondContact O-N 3.22Å; S215-I218 PolarHBondContact O-N 3.44Å; T216-I218 PolarHBondContact O-N 3.16Å; I218-K220 PolarHBondContact O-N 2.69Å; I218-N221 PolarHBondContact O-N 3.14Å; I218-L223 HydrophobicContact CG1-CB 4.12Å; I218-K225 HydrophobicContact CD1-CB 4.18Å; I218-Y232 HydrophobicContact CD1-CE1 4.28Å
219	Q	86.7	Confident	83.3	Confident	161 Å²	161	59.9 Å²	59.9	75%	0.752	32%	0.321	S	S	*	.	H	α-helix	trans	-61.8	-29.7	177.6	-169.4	-174.5	11.7	0	0	112.7	S215 T216 N221	S215-Q219 WeakPolarHBondContact O-CB 3.47Å; S215-Q219 PolarHBondContact O-N 3.05Å; T216-Q219 PolarHBondContact O-N 2.68Å; Q219-N221 VanDerWaalsContact C-N 3.32Å
220	K	84.5	Confident	83.1	Confident	98 Å²	98	58.6 Å²	58.6	43%	0.426	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	7.7	177.4	-63.8	-69.9	-179.1	179.3	0	113.6	T216 L217 I218 L222	T216-K220 HydrophobicContact CG2-CG 4.29Å; T216-K220 WeakPolarHBondContact O-CB 3.03Å; T216-K220 WeakPolarHBondContact O-CG 3.34Å; T216-K220 PolarHBondContact O-N 3.18Å; L217-K220 PolarHBondContact O-N 3.07Å; I218-K220 PolarHBondContact O-N 2.69Å; K220-L222 HydrophobicContact CB-CD1 4.21Å; K220-L222 HydrophobicContact CB-CG 4.25Å; K220-L222 PolarHBondContact O-N 3.44Å
221	N	86.3	Confident	83.3	Confident	88 Å²	88	62 Å²	62	47%	0.471	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	24.8	178.6	-163.4	47.2	0	0	0	114.7	L217 I218 Q219 T235 E237	L217-N221 PolarHBondContact O-N 2.9Å; I218-N221 PolarHBondContact O-N 3.14Å; Q219-N221 VanDerWaalsContact C-N 3.32Å; N221-T235 WeakPolarHBondContact O-CB 3.31Å; N221-T235 WeakPolarHBondContact O-CG2 3.31Å; N221-T235 PolarHBondContact O-OG1 3.46Å; N221-E237 PolarHBondContact ND2-OE2 2.85Å
222	L	86.5	Confident	83.4	Confident	15 Å²	15	61 Å²	61	8%	0.079	32%	0.322	C	S	.	.	S	Bend	trans	-93.5	-21	178.2	-61.2	172.6	0	0	0	112.6	Y154 L166 L217 K220 T235 E237 G238 L241	Y154-L222 HydrophobicContact CD1-CD1 3.76Å; Y154-L222 HydrophobicContact CE1-CD1 4.37Å; L166-L222 HydrophobicContact CD2-CB 4.3Å; L217-L222 HydrophobicContact CB-CB 4.5Å; L217-L222 HydrophobicContact CD2-CB 4.32Å; L217-L222 HydrophobicContact CD2-CD1 3.74Å; L217-L222 PolarHBondContact O-N 3.19Å; K220-L222 HydrophobicContact CB-CD1 4.21Å; K220-L222 HydrophobicContact CB-CG 4.25Å; K220-L222 PolarHBondContact O-N 3.44Å; L222-T235 WeakPolarHBondContact CA-OG1 3.44Å; L222-T235 PolarHBondContact O-OG1 3.26Å; L222-E237 HydrophobicContact CD2-CB 4.26Å; L222-G238 WeakPolarHBondContact O-CA 3.42Å; L222-L241 HydrophobicContact CD1-CD2 3.74Å; L222-L241 HydrophobicContact CD2-CD2 4.03Å
223	L	87.8	Confident	83.6	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.016	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	148.4	174.1	-90.1	92	0	0	0	110.5	V165 L166 L169 L217 I218 Y232 L234	V165-L223 HydrophobicContact CG1-CD1 4.18Å; V165-L223 HydrophobicContact CG1-CD2 3.74Å; L166-L223 HydrophobicContact CD2-CD1 3.66Å; L166-L223 HydrophobicContact CG-CD1 4.47Å; L169-L223 HydrophobicContact CD1-CD2 3.54Å; L169-L223 HydrophobicContact CD1-CG 4Å; L217-L223 HydrophobicContact CB-CB 4.45Å; L217-L223 HydrophobicContact CB-CD1 3.57Å; L217-L223 HydrophobicContact CD1-CD1 3.53Å; L217-L223 HydrophobicContact CG-CD1 4.09Å; L217-L223 PolarHBondContact O-N 2.99Å; I218-L223 HydrophobicContact CG1-CB 4.12Å; L223-Y232 HydrophobicContact CD2-CD1 4.35Å; L223-L234 HydrophobicContact CD1-CD2 4.38Å; L223-L234 HydrophobicContact CG-CD2 4.48Å
224	I	87.5	Confident	83.8	Confident	80 Å²	80	59.6 Å²	59.6	41%	0.41	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	138.6	169.8	-168.3	171.2	0	0	0	110.6	T226 Y232 S233 T235	I224-T226 HydrophobicContact CD1-CG2 4.19Å; I224-T226 HydrophobicContact CG1-CG2 4.07Å; I224-Y232 WeakPolarHBondContact O-CA 3.38Å; I224-S233 WeakPolarHBondContact CG2-OG 3.45Å; I224-S233 PolarHBondContact N-O 3Å; I224-S233 PolarHBondContact O-N 3.22Å; I224-S233 VanDerWaalsContact O-N 3.14Å; I224-T235 HydrophobicContact CB-CG2 4.23Å
225	K	88.9	Confident	84	Confident	64 Å²	64	60.6 Å²	60.6	28%	0.278	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	120.6	174	-177.6	-171.6	178.3	-175.7	0	108.7	I218 A230 R231 Y232 E286	I218-K225 HydrophobicContact CD1-CB 4.18Å; K225-A230 HydrophobicContact CD-CB 4.27Å; K225-A230 HydrophobicContact CG-CB 4.03Å; K225-R231 WeakPolarHBondContact CA-O 3.44Å; K225-Y232 HydrophobicContact CB-CD1 4.47Å; K225-Y232 HydrophobicContact CB-CE1 4.28Å; K225-Y232 HydrophobicContact CD-CE1 4.39Å; K225-Y232 HydrophobicContact CG-CE1 4.13Å; K225-E286 IonicContact NZ-OE2 3.11Å; K225-E286 PolarHBondContact NZ-OE2 3.32Å
226	T	80.3	Confident	83.9	Confident	49 Å²	49	63.6 Å²	63.6	30%	0.301	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	151.4	178.6	61.7	0	0	0	0	111.5	I224 R231	I224-T226 HydrophobicContact CD1-CG2 4.19Å; I224-T226 HydrophobicContact CG1-CG2 4.07Å; T226-R231 PolarHBondContact N-O 3.08Å; T226-R231 PolarHBondContact O-N 2.98Å
227	H	75.5	Confident	83.9	Confident	138 Å²	138	66.5 Å²	66.5	64%	0.639	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	174.6	174.7	-58.8	-81.1	0	0	0	117.9	P229 A230	H227-P229 CarbonylContact C-O 3.5Å; H227-A230 WeakPolarHBondContact O-CA 3.42Å
228	N	63.8	Low	83.9	Confident	139 Å²	139	66.5 Å²	66.5	74%	0.743	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.1	111.3	167.7	-176.3	13.4	0	0	0	108.6
229	P	65.8	Low	83.9	Confident	69 Å²	69	65.9 Å²	65.9	45%	0.448	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	cis	-63.8	144.7	7.3	-21.1	33	0	0	0	114.3	F183 H227 R231	F183-P229 HydrophobicContact CD1-CB 4.26Å; F183-P229 HydrophobicContact CE1-CB 4.24Å; H227-P229 CarbonylContact C-O 3.5Å; P229-R231 PolarHBondContact O-N 2.81Å
230	A	82.2	Confident	83.8	Confident	8 Å²	8	60.4 Å²	60.4	7%	0.066	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	124	-174.9	0	0	0	0	0	112.7	K225 H227 Y232	K225-A230 HydrophobicContact CD-CB 4.27Å; K225-A230 HydrophobicContact CG-CB 4.03Å; H227-A230 WeakPolarHBondContact O-CA 3.42Å; A230-Y232 HydrophobicContact CB-CE2 3.97Å
231	R	87.6	Confident	83.8	Confident	79 Å²	79	56 Å²	56	30%	0.298	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	128.7	173.6	-61.7	179.4	-174.9	-179	0.4	109	Y181 F183 K225 T226 P229	Y181-R231 HydrophobicContact CD2-CB 3.87Å; Y181-R231 HydrophobicContact CD2-CG 3.65Å; Y181-R231 HydrophobicContact CE2-CG 3.91Å; Y181-R231 HydrophobicContact CG-CB 4.07Å; Y181-R231 HydrophobicContact CG-CG 4.2Å; F183-R231 HydrophobicContact CD1-CG 4.26Å; F183-R231 HydrophobicContact CE1-CG 3.74Å; F183-R231 HydrophobicContact CZ-CG 4.35Å; K225-R231 WeakPolarHBondContact CA-O 3.44Å; T226-R231 PolarHBondContact N-O 3.08Å; T226-R231 PolarHBondContact O-N 2.98Å; P229-R231 PolarHBondContact O-N 2.81Å
232	Y	88.7	Confident	83.9	Confident	12 Å²	12	51.8 Å²	51.8	5%	0.047	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.6	177.7	-62.3	-89	0	0	0	109.1	Y181 M182 K184 L187 W211 V214 I218 L223 I224 K225 A230	Y181-Y232 CarbonylContact C-O 3.54Å; Y181-Y232 VanDerWaalsContact CA-O 3.31Å; Y181-Y232 WeakPolarHBondContact CA-O 3.46Å; M182-Y232 PolarHBondContact N-O 3.22Å; M182-Y232 PolarHBondContact O-N 3.17Å; K184-Y232 HydrophobicContact CB-CE2 4.03Å; L187-Y232 HydrophobicContact CD2-CD2 4.36Å; L187-Y232 HydrophobicContact CD2-CG 4.16Å; W211-Y232 HydrophobicContact CH2-CE2 4.2Å; W211-Y232 HydrophobicContact CZ2-CE1 4.37Å; W211-Y232 HydrophobicContact CZ2-CE2 4.12Å; W211-Y232 AromaticContact CZ2-CZ 3.81Å; V214-Y232 HydrophobicContact CG1-CD1 4.21Å; V214-Y232 HydrophobicContact CG1-CE1 3.84Å; I218-Y232 HydrophobicContact CD1-CE1 4.28Å; L223-Y232 HydrophobicContact CD2-CD1 4.35Å; I224-Y232 WeakPolarHBondContact O-CA 3.38Å; K225-Y232 HydrophobicContact CB-CD1 4.47Å; K225-Y232 HydrophobicContact CB-CE1 4.28Å; K225-Y232 HydrophobicContact CD-CE1 4.39Å; K225-Y232 HydrophobicContact CG-CE1 4.13Å; A230-Y232 HydrophobicContact CB-CE2 3.97Å
233	S	89.1	Confident	83.9	Confident	25 Å²	25	55.9 Å²	55.9	18%	0.175	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	157.7	173.9	57.8	0	0	0	0	110.5	G180 I224	G180-S233 WeakPolarHBondContact O-CB 3.16Å; I224-S233 WeakPolarHBondContact CG2-OG 3.45Å; I224-S233 PolarHBondContact N-O 3Å; I224-S233 PolarHBondContact O-N 3.22Å; I224-S233 VanDerWaalsContact O-N 3.14Å
234	L	89.1	Confident	83.8	Confident	22 Å²	22	60.8 Å²	60.8	12%	0.115	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	145.7	174.2	-67	171.1	0	0	0	110	L166 L169 L223 L239 A242	L166-L234 HydrophobicContact CD2-CD2 3.56Å; L169-L234 HydrophobicContact CB-CD1 3.83Å; L169-L234 HydrophobicContact CB-CD2 4.1Å; L169-L234 HydrophobicContact CB-CG 3.69Å; L169-L234 HydrophobicContact CD1-CD2 4.01Å; L169-L234 HydrophobicContact CD1-CG 4.16Å; L223-L234 HydrophobicContact CD1-CD2 4.38Å; L223-L234 HydrophobicContact CG-CD2 4.48Å; L234-L239 HydrophobicContact CD1-CD1 4.26Å; L234-A242 HydrophobicContact CD1-CB 4.3Å
235	T	89.1	Confident	83.7	Confident	23 Å²	23	58 Å²	58	14%	0.141	30%	0.296	C	S	.	.			trans	-85	170.5	163.5	59.1	0	0	0	0	109.5	N221 L222 I224 E237 G238 L239	N221-T235 WeakPolarHBondContact O-CB 3.31Å; N221-T235 WeakPolarHBondContact O-CG2 3.31Å; N221-T235 PolarHBondContact O-OG1 3.46Å; L222-T235 WeakPolarHBondContact CA-OG1 3.44Å; L222-T235 PolarHBondContact O-OG1 3.26Å; I224-T235 HydrophobicContact CB-CG2 4.23Å; T235-E237 PolarHBondContact O-N 3.21Å; T235-G238 CarbonylContact O-C 3.53Å; T235-G238 WeakPolarHBondContact O-CA 3.28Å; T235-G238 PolarHBondContact O-N 3.5Å; T235-G238 VanDerWaalsContact O-N 3.07Å; T235-G238 PolarHBondContact OG1-N 3.1Å; T235-G238 VanDerWaalsContact OG1-N 3.11Å; T235-L239 WeakPolarHBondContact O-CB 3.26Å; T235-L239 PolarHBondContact O-N 3.11Å
236	D	84.1	Confident	83.4	Confident	147 Å²	147	55.7 Å²	55.7	79%	0.786	29%	0.287	S	S	*	.	H	α-helix	trans	-58.6	-37.4	175.7	-59	-31.2	0	0	0	112	L239 A240	D236-L239 PolarHBondContact O-N 3.25Å; D236-A240 PolarHBondContact O-N 3.17Å; D236-A240 VanDerWaalsContact O-N 3.16Å
237	E	84	Confident	83.5	Confident	112 Å²	112	56 Å²	56	52%	0.523	29%	0.291	S	S	.	.	H	α-helix	trans	-67.2	-40.7	174.1	-65	-178.8	165.6	0	0	111.9	N221 L222 T235 L241	N221-E237 PolarHBondContact ND2-OE2 2.85Å; L222-E237 HydrophobicContact CD2-CB 4.26Å; T235-E237 PolarHBondContact O-N 3.21Å; E237-L241 PolarHBondContact O-N 3.27Å; E237-L241 VanDerWaalsContact O-N 3.15Å
238	G	87.2	Confident	83.7	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.4	-37.4	175.2	0	0	0	0	0	113.1	L222 T235 L241 A242	L222-G238 WeakPolarHBondContact O-CA 3.42Å; T235-G238 CarbonylContact O-C 3.53Å; T235-G238 WeakPolarHBondContact O-CA 3.28Å; T235-G238 PolarHBondContact O-N 3.5Å; T235-G238 VanDerWaalsContact O-N 3.07Å; T235-G238 PolarHBondContact OG1-N 3.1Å; T235-G238 VanDerWaalsContact OG1-N 3.11Å; G238-L241 PolarHBondContact O-N 3.42Å; G238-A242 VanDerWaalsContact O-CB 3.27Å; G238-A242 WeakPolarHBondContact O-CB 3.48Å; G238-A242 PolarHBondContact O-N 3.08Å
239	L	86.8	Confident	84.4	Confident	51 Å²	51	47.3 Å²	47.3	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-65	-48.9	177.8	-172.3	73.7	0	0	0	111.2	Y170 L234 T235 D236 L241 A242 E243	Y170-L239 HydrophobicContact CD2-CD1 3.77Å; Y170-L239 HydrophobicContact CE2-CD1 3.96Å; L234-L239 HydrophobicContact CD1-CD1 4.26Å; T235-L239 WeakPolarHBondContact O-CB 3.26Å; T235-L239 PolarHBondContact O-N 3.11Å; D236-L239 PolarHBondContact O-N 3.25Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-L241 PolarHBondContact O-N 3.34Å; L239-A242 PolarHBondContact O-N 3.28Å; L239-E243 WeakPolarHBondContact O-CB 3.33Å; L239-E243 PolarHBondContact O-N 3.22Å
240	A	84.5	Confident	84.8	Confident	47 Å²	47	49.2 Å²	49.2	39%	0.388	25%	0.252	S	S	.	.	H	α-helix	trans	-63.5	-34.3	178	0	0	0	0	0	112.6	D236 R244	D236-A240 PolarHBondContact O-N 3.17Å; D236-A240 VanDerWaalsContact O-N 3.16Å; A240-R244 WeakPolarHBondContact O-CG 3.44Å; A240-R244 PolarHBondContact O-N 3.45Å; A240-R244 PolarHBondContact O-NE 3.22Å
241	L	86	Confident	84.2	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-70.9	-44.5	173.1	-177.7	63.2	0	0	0	111.5	I155 L166 L222 E237 G238 L239 E243 R244 L245	I155-L241 HydrophobicContact CG1-CD1 4.44Å; L166-L241 HydrophobicContact CD1-CD2 3.81Å; L166-L241 HydrophobicContact CD1-CG 4.33Å; L222-L241 HydrophobicContact CD1-CD2 3.74Å; L222-L241 HydrophobicContact CD2-CD2 4.03Å; E237-L241 PolarHBondContact O-N 3.27Å; E237-L241 VanDerWaalsContact O-N 3.15Å; G238-L241 PolarHBondContact O-N 3.42Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-L241 PolarHBondContact O-N 3.34Å; L241-E243 PolarHBondContact O-N 3.17Å; L241-R244 PolarHBondContact O-N 3.02Å; L241-L245 HydrophobicContact CG-CD1 4.25Å; L241-L245 VanDerWaalsContact O-CG 3.32Å; L241-L245 WeakPolarHBondContact O-CG 3.49Å; L241-L245 PolarHBondContact O-N 2.65Å
242	A	87.5	Confident	83.1	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66	-36.8	-178.8	0	0	0	0	0	112.7	L166 Y170 L234 G238 L239 L245 E246	L166-A242 HydrophobicContact CB-CB 4.24Å; Y170-A242 HydrophobicContact CD2-CB 3.84Å; Y170-A242 HydrophobicContact CG-CB 3.99Å; L234-A242 HydrophobicContact CD1-CB 4.3Å; G238-A242 VanDerWaalsContact O-CB 3.27Å; G238-A242 WeakPolarHBondContact O-CB 3.48Å; G238-A242 PolarHBondContact O-N 3.08Å; L239-A242 PolarHBondContact O-N 3.28Å; A242-L245 PolarHBondContact O-N 3.22Å; A242-E246 PolarHBondContact O-N 3.38Å
243	E	86.8	Confident	81.9	Confident	101 Å²	101	65.9 Å²	65.9	47%	0.472	32%	0.319	S	S	.	.	H	α-helix	trans	-61.4	-43.3	173.6	-177.7	170.2	-145.3	0	0	112.2	Y170 L239 L241 L245 E246 S247	Y170-E243 HydrophobicContact CE2-CB 3.69Å; Y170-E243 HydrophobicContact CE2-CG 4.35Å; L239-E243 WeakPolarHBondContact O-CB 3.33Å; L239-E243 PolarHBondContact O-N 3.22Å; L241-E243 PolarHBondContact O-N 3.17Å; E243-L245 VanDerWaalsContact C-N 3.33Å; E243-L245 PolarHBondContact O-N 2.9Å; E243-E246 PolarHBondContact O-N 2.83Å; E243-S247 WeakPolarHBondContact O-CB 3.24Å; E243-S247 PolarHBondContact O-N 3.17Å; E243-S247 PolarHBondContact O-OG 2.66Å
244	R	84.8	Confident	80.1	Confident	107 Å²	107	71.4 Å²	71.4	40%	0.404	35%	0.347	S	S	.	.	H	α-helix	trans	-61.6	-42.1	173.6	-74.7	-175.4	-68	169.8	-2.6	111.6	E153 A240 L241 V248	E153-R244 IonicContact OE1-CZ 2.66Å; E153-R244 IonicContact OE1-NH1 3.05Å; E153-R244 PolarHBondContact OE1-NH1 3.03Å; E153-R244 IonicContact OE1-NH2 3.09Å; E153-R244 PolarHBondContact OE1-NH2 3.29Å; E153-R244 IonicContact OE2-NH1 2.69Å; E153-R244 PolarHBondContact OE2-NH1 3.23Å; E153-R244 IonicContact OE2-NH2 2.97Å; A240-R244 WeakPolarHBondContact O-CG 3.44Å; A240-R244 PolarHBondContact O-N 3.45Å; A240-R244 PolarHBondContact O-NE 3.22Å; L241-R244 PolarHBondContact O-N 3.02Å; R244-V248 WeakPolarHBondContact O-CG2 3.31Å; R244-V248 PolarHBondContact O-N 2.9Å
245	L	85.6	Confident	78.2	Confident	20 Å²	20	75 Å²	75	11%	0.105	37%	0.37	C	S	.	.	H	α-helix	trans	-67.9	-36.1	179.5	-66.7	174.6	0	0	0	112.6	I155 P156 Y163 L166 L241 A242 E243 E249	I155-L245 HydrophobicContact CG2-CD2 4.36Å; P156-L245 HydrophobicContact CG-CD1 4.16Å; Y163-L245 HydrophobicContact CD2-CD1 3.91Å; Y163-L245 HydrophobicContact CD2-CD2 4.05Å; Y163-L245 HydrophobicContact CD2-CG 4.37Å; Y163-L245 HydrophobicContact CE2-CB 3.97Å; Y163-L245 HydrophobicContact CE2-CD1 4.21Å; Y163-L245 HydrophobicContact CE2-CD2 3.92Å; Y163-L245 HydrophobicContact CE2-CG 4.24Å; L166-L245 HydrophobicContact CD1-CD1 4.11Å; L241-L245 HydrophobicContact CG-CD1 4.25Å; L241-L245 VanDerWaalsContact O-CG 3.32Å; L241-L245 WeakPolarHBondContact O-CG 3.49Å; L241-L245 PolarHBondContact O-N 2.65Å; A242-L245 PolarHBondContact O-N 3.22Å; E243-L245 VanDerWaalsContact C-N 3.33Å; E243-L245 PolarHBondContact O-N 2.9Å; L245-E249 PolarHBondContact O-N 3.21Å
246	E	83.9	Confident	75.9	Confident	17 Å²	17	79.6 Å²	79.6	8%	0.079	40%	0.4	C	S	.	.	H	α-helix	trans	-72.7	-39.3	177.4	-164.9	-167.6	-134	0	0	112.1	L167 Y170 A242 E243 V248 E249 K250	L167-E246 HydrophobicContact CD1-CB 3.76Å; L167-E246 HydrophobicContact CD1-CG 3.88Å; Y170-E246 HydrophobicContact CD1-CB 4.32Å; Y170-E246 HydrophobicContact CE1-CB 4.26Å; Y170-E246 VanDerWaalsContact CE1-CD 3.5Å; Y170-E246 HydrophobicContact CE1-CG 4.46Å; Y170-E246 WeakPolarHBondContact CE1-OE2 3.05Å; A242-E246 PolarHBondContact O-N 3.38Å; E243-E246 PolarHBondContact O-N 2.83Å; E246-V248 VanDerWaalsContact C-N 3.31Å; E246-V248 PolarHBondContact O-N 3.15Å; E246-E249 PolarHBondContact O-N 3.39Å; E246-K250 VanDerWaalsContact CD-NZ 3.32Å; E246-K250 HydrophobicContact CG-CD 4.25Å; E246-K250 HydrophobicContact CG-CG 4.46Å; E246-K250 PolarHBondContact O-N 2.9Å; E246-K250 IonicContact OE1-NZ 2.78Å; E246-K250 WeakPolarHBondContact OE2-CE 3.35Å; E246-K250 IonicContact OE2-NZ 2.64Å; E246-K250 PolarHBondContact OE2-NZ 2.81Å
247	S	80.9	Confident	73.8	Confident	56 Å²	56	79.4 Å²	79.4	39%	0.392	40%	0.403	S	S	.	.	H	α-helix	trans	-58	-44.8	177.7	-59	0	0	0	0	111.3	E243 E249 K250 E251	E243-S247 WeakPolarHBondContact O-CB 3.24Å; E243-S247 PolarHBondContact O-N 3.17Å; E243-S247 PolarHBondContact O-OG 2.66Å; S247-E249 VanDerWaalsContact C-N 3.31Å; S247-E249 PolarHBondContact O-N 2.97Å; S247-K250 PolarHBondContact O-N 2.94Å; S247-E251 WeakPolarHBondContact O-CG 3.38Å; S247-E251 PolarHBondContact O-N 3.02Å
248	V	81.1	Confident	71.4	Confident	73 Å²	73	83.1 Å²	83.1	44%	0.442	42%	0.421	S	S	.	.	H	α-helix	trans	-64.2	-33.1	175.7	175.2	0	0	0	0	112.4	R244 E246 R252	R244-V248 WeakPolarHBondContact O-CG2 3.31Å; R244-V248 PolarHBondContact O-N 2.9Å; E246-V248 VanDerWaalsContact C-N 3.31Å; E246-V248 PolarHBondContact O-N 3.15Å; V248-R252 WeakPolarHBondContact O-CG 3.41Å; V248-R252 PolarHBondContact O-N 2.88Å
249	E	77.7	Confident	68.9	Low	21 Å²	21	86.2 Å²	86.2	10%	0.098	45%	0.453	C	S	.	.	H	α-helix	trans	-75.3	-37.1	177.5	-162.7	-169.5	178.3	0	0	112.2	L167 R171 L245 E246 S247 R252 R253	L167-E249 WeakPolarHBondContact CD2-OE2 3.31Å; R171-E249 IonicContact CZ-OE2 2.74Å; R171-E249 IonicContact NH2-OE1 3.59Å; R171-E249 PolarHBondContact NH2-OE1 3.13Å; R171-E249 IonicContact NH2-OE2 3.03Å; R171-E249 PolarHBondContact NH2-OE2 3.01Å; L245-E249 PolarHBondContact O-N 3.21Å; E246-E249 PolarHBondContact O-N 3.39Å; S247-E249 VanDerWaalsContact C-N 3.31Å; S247-E249 PolarHBondContact O-N 2.97Å; E249-R252 PolarHBondContact O-N 2.93Å; E249-R253 VanDerWaalsContact CD-NH1 3.3Å; E249-R253 PolarHBondContact O-N 2.89Å; E249-R253 VanDerWaalsContact O-N 3.09Å; E249-R253 IonicContact OE1-CZ 3.32Å; E249-R253 VanDerWaalsContact OE1-CZ 3.23Å; E249-R253 IonicContact OE1-NH1 3.3Å; E249-R253 PolarHBondContact OE1-NH1 3.36Å; E249-R253 VanDerWaalsContact OE1-NH1 3.12Å; E249-R253 IonicContact OE1-NH2 2.85Å; E249-R253 PolarHBondContact OE1-NH2 3.33Å; E249-R253 IonicContact OE2-NH1 2.83Å
250	K	73.9	Confident	66.3	Low	108 Å²	108	95.8 Å²	95.8	47%	0.47	49%	0.485	S	S	.	.	H	α-helix	trans	-66.6	-41.6	175.5	-78.3	173.7	172.5	165.8	0	111.8	E246 S247 R252 R253 N254	E246-K250 VanDerWaalsContact CD-NZ 3.32Å; E246-K250 HydrophobicContact CG-CD 4.25Å; E246-K250 HydrophobicContact CG-CG 4.46Å; E246-K250 PolarHBondContact O-N 2.9Å; E246-K250 IonicContact OE1-NZ 2.78Å; E246-K250 WeakPolarHBondContact OE2-CE 3.35Å; E246-K250 IonicContact OE2-NZ 2.64Å; E246-K250 PolarHBondContact OE2-NZ 2.81Å; S247-K250 PolarHBondContact O-N 2.94Å; K250-R252 VanDerWaalsContact C-N 3.29Å; K250-R252 PolarHBondContact O-N 3.26Å; K250-R253 PolarHBondContact O-N 2.86Å; K250-N254 PolarHBondContact O-N 3.16Å
251	E	70.5	Confident	63.9	Low	141 Å²	141	105.3 Å²	105.3	66%	0.659	51%	0.511	S	S	*	.	H	α-helix	trans	-60.1	-38.9	174.7	-75.5	174.6	-178.9	0	0	112.2	S247	S247-E251 WeakPolarHBondContact O-CG 3.38Å; S247-E251 PolarHBondContact O-N 3.02Å
252	R	64.8	Low	61.4	Low	160 Å²	160	109 Å²	109	60%	0.604	55%	0.55	S	S	*	.	H	α-helix	trans	-74.6	-30.4	178.1	-71.7	-178.8	177.6	-157.1	1.5	114	V248 E249 K250 N254	V248-R252 WeakPolarHBondContact O-CG 3.41Å; V248-R252 PolarHBondContact O-N 2.88Å; E249-R252 PolarHBondContact O-N 2.93Å; K250-R252 VanDerWaalsContact C-N 3.29Å; K250-R252 PolarHBondContact O-N 3.26Å; R252-N254 VanDerWaalsContact C-N 3.28Å; R252-N254 PolarHBondContact O-N 3.48Å
253	R	62.1	Low	58.5	Low	149 Å²	149	114 Å²	114	56%	0.562	59%	0.592	S	S	*	*	H	α-helix	trans	-70.5	-22.5	175.2	-83	-172	179.7	111.1	10.6	113.3	E249 K250	E249-R253 VanDerWaalsContact CD-NH1 3.3Å; E249-R253 PolarHBondContact O-N 2.89Å; E249-R253 VanDerWaalsContact O-N 3.09Å; E249-R253 IonicContact OE1-CZ 3.32Å; E249-R253 VanDerWaalsContact OE1-CZ 3.23Å; E249-R253 IonicContact OE1-NH1 3.3Å; E249-R253 PolarHBondContact OE1-NH1 3.36Å; E249-R253 VanDerWaalsContact OE1-NH1 3.12Å; E249-R253 IonicContact OE1-NH2 2.85Å; E249-R253 PolarHBondContact OE1-NH2 3.33Å; E249-R253 IonicContact OE2-NH1 2.83Å; K250-R253 PolarHBondContact O-N 2.86Å
254	N	52.5	Low	55.8	Low	140 Å²	140	114.4 Å²	114.4	75%	0.749	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	10.5	-177.7	-78.7	-8.4	0	0	0	114.6	K250 R252 P256	K250-N254 PolarHBondContact O-N 3.16Å; R252-N254 VanDerWaalsContact C-N 3.28Å; R252-N254 PolarHBondContact O-N 3.48Å; N254-P256 WeakPolarHBondContact O-CD 3.12Å
255	V	47.6	Very low	53	Low	99 Å²	99	112.7 Å²	112.7	60%	0.6	63%	0.628	S	S	*	*	S	Bend	trans	-92.5	115.8	172.5	-173.7	0	0	0	0	109.3	V257	V255-V257 PolarHBondContact O-N 3.46Å
256	P	41	Very low	51	Low	119 Å²	119	117.5 Å²	117.5	77%	0.773	66%	0.66	S	S	*	*			trans	-65.9	126.7	175.3	-15.8	29.7	0	0	0	110.6	N254 E258	N254-P256 WeakPolarHBondContact O-CD 3.12Å; P256-E258 PolarHBondContact O-N 2.95Å
257	V	40.4	Very low	48.4	Very low	142 Å²	142	125.4 Å²	125.4	86%	0.861	70%	0.697	S	S	*	*			trans	-81.9	102	176.7	176.2	0	0	0	0	109.1	V255	V255-V257 PolarHBondContact O-N 3.46Å
258	E	33.8	Very low	45.8	Very low	191 Å²	191	131.6 Å²	131.6	89%	0.893	72%	0.72	S	S	*	*			trans	-106.4	112.6	154.1	-81.7	-164.4	159	0	0	110	P256	P256-E258 PolarHBondContact O-N 2.95Å
259	G	35.1	Very low	43.2	Very low	65 Å²	65	136.7 Å²	136.7	67%	0.67	74%	0.739	S	S	*	*			trans	69.4	106.6	146.7	0	0	0	0	0	119.2
260	R	32.3	Very low	40.7	Very low	252 Å²	252	144.9 Å²	144.9	95%	0.951	78%	0.777	S	S	*	*				-165.2	121	117	-107.8	165.7	-172.1	-174.8	1.7	113.1
261	R	32.9	Very low	38.4	Very low	247 Å²	247	148.6 Å²	148.6	93%	0.932	80%	0.796	S	S	*	*			trans	-56	154.5	155.8	-96.3	175.8	170.7	-160.6	-2.5	110.3
262	G	34.2	Very low	36.4	Very low	81 Å²	81	151.1 Å²	151.1	84%	0.835	81%	0.808	S	S	*	*			trans	-64.4	164.5	-170	0	0	0	0	0	117.2
263	A	27.6	Very low	34.5	Very low	106 Å²	106	152.8 Å²	152.8	88%	0.876	82%	0.823	S	S	*	*			trans	-149.7	130.1	155.5	0	0	0	0	0	107.2
264	A	30.1	Very low	32.8	Very low	109 Å²	109	154.9 Å²	154.9	90%	0.901	84%	0.839	S	S	*	*			trans	-87.9	147.4	172.8	0	0	0	0	0	109.8
265	G	25.2	Very low	31.5	Very low	71 Å²	71	156 Å²	156	73%	0.732	84%	0.844	S	S	*	*			trans	109.7	163.4	161.5	0	0	0	0	0	115.5
266	P	44.5	Very low	30.5	Very low	121 Å²	121	155.7 Å²	155.7	79%	0.786	85%	0.852	S	S	*	*				-126.8	159.5	-92.7	37.8	-26.9	0	0	0	112
267	E	27.6	Very low	29.9	Very low	183 Å²	183	156.8 Å²	156.8	86%	0.855	86%	0.857	S	S	*	*			trans	172.6	143.4	166.1	-98.7	154.9	-138	0	0	106.4
268	E	26.1	Very low	29.4	Very low	185 Å²	185	156.4 Å²	156.4	86%	0.864	85%	0.854	S	S	*	*			cis	-168.5	154.5	-18.5	-116	176.5	-165.3	0	0	103.3
269	E	26.7	Very low	29	Very low	181 Å²	181	153.8 Å²	153.8	85%	0.846	85%	0.847	S	S	*	*			trans	-72	130	-174.4	-63.2	169.7	164.4	0	0	111.7
270	E	25.8	Very low	28.7	Very low	192 Å²	192	158.4 Å²	158.4	90%	0.897	86%	0.855	S	S	*	*			trans	-129.9	109.5	149.9	-76.8	-168.7	169.4	0	0	108.6
271	E	26.7	Very low	28.5	Very low	186 Å²	186	152 Å²	152	87%	0.869	84%	0.844	S	S	*	*			trans	-72	125.1	167.4	-63.9	-177.5	151	0	0	109.2
272	E	27.6	Very low	28.2	Very low	194 Å²	194	144.6 Å²	144.6	91%	0.907	84%	0.836	S	S	*	*			trans	-133.4	137.9	154.3	-78.9	-162.3	165.5	0	0	110.3
273	E	25.4	Very low	27.8	Very low	196 Å²	196	145.9 Å²	145.9	92%	0.916	83%	0.832	S	S	*	*			trans	-65	142.3	-153.6	-62.8	177.6	137.6	0	0	116.3	D275	E273-D275 PolarHBondContact O-N 3.19Å
274	E	25.9	Very low	27.7	Very low	193 Å²	193	148.6 Å²	148.6	90%	0.902	83%	0.832	S	S	*	*			trans	-70.1	116.1	166.6	-69.1	-171.2	149.2	0	0	111.3
275	D	24.8	Very low	27.6	Very low	162 Å²	162	152.4 Å²	152.4	87%	0.866	83%	0.831	S	S	*	*			trans	-100	103.5	159.3	-113.5	-18.1	0	0	0	109.8	E273 V277	E273-D275 PolarHBondContact O-N 3.19Å; D275-V277 PolarHBondContact O-N 3.4Å
276	A	27.6	Very low	27.7	Very low	93 Å²	93	156 Å²	156	77%	0.769	83%	0.829	S	S	*	*			trans	-67.3	106.8	179.3	0	0	0	0	0	111.8
277	V	27.4	Very low	26.9	Very low	142 Å²	142	155.6 Å²	155.6	86%	0.861	83%	0.828	S	S	*	*			trans	-99.9	100.7	161.9	-97.7	0	0	0	0	110.3	D275 D279	D275-V277 PolarHBondContact O-N 3.4Å; V277-D279 PolarHBondContact O-N 3.02Å
278	V	29.6	Very low	26.9	Very low	134 Å²	134	149 Å²	149	81%	0.812	80%	0.802	S	S	*	*			trans	-67.7	110.1	163.5	-75.5	0	0	0	0	109.7
279	D	26.1	Very low	26.9	Very low	137 Å²	137	145.5 Å²	145.5	73%	0.733	80%	0.799	S	S	*	*			trans	-107.9	119	164.9	-166.7	8.8	0	0	0	111.1	V277	V277-D279 PolarHBondContact O-N 3.02Å
280	L	29.7	Very low	26.9	Very low	162 Å²	162	140.1 Å²	140.1	85%	0.848	78%	0.781	S	S	*	*			trans	-94.8	89.3	178.6	-76.8	160.4	0	0	0	108
281	T	27.4	Very low	27	Very low	117 Å²	117	136.1 Å²	136.1	72%	0.718	77%	0.774	S	S	*	*			trans	-137.5	94.7	160.5	52.2	0	0	0	0	111
282	A	26.1	Very low	27	Very low	92 Å²	92	135.7 Å²	135.7	76%	0.76	78%	0.777	S	S	*	*			trans	-80.8	159.9	154.4	0	0	0	0	0	109.6
283	S	26	Very low	27	Very low	108 Å²	108	131 Å²	131	76%	0.755	77%	0.772	S	S	*	*			trans	78.9	98.7	171.3	43.1	0	0	0	0	118.5
284	D	25.7	Very low	27	Very low	163 Å²	163	128.5 Å²	128.5	87%	0.872	77%	0.769	S	S	*	*				-163.8	112.3	107.1	-93.1	-19.8	0	0	0	110.7
285	E	28.8	Very low	27	Very low	188 Å²	188	130.8 Å²	130.8	88%	0.879	77%	0.77	S	S	*	*			trans	-95.1	98.9	178.9	-79.6	-84.8	157.4	0	0	109.8
286	E	26.3	Very low	27.1	Very low	147 Å²	147	129.1 Å²	129.1	69%	0.687	77%	0.771	S	S	*	*			trans	-89.3	103.6	161.3	-77.7	-142.8	153.8	0	0	110.4	K225 S288	K225-E286 IonicContact NZ-OE2 3.11Å; K225-E286 PolarHBondContact NZ-OE2 3.32Å; E286-S288 PolarHBondContact O-N 3.42Å
287	S	28.1	Very low	26.9	Very low	112 Å²	112	132.5 Å²	132.5	78%	0.783	78%	0.776	S	S	*	*			trans	-88.8	100.9	170.2	74.9	0	0	0	0	110.9
288	S	27.1	Very low	26.8	Very low	44 Å²	44	134.3 Å²	134.3	31%	0.308	78%	0.775	S	S	.	*			trans	-97.2	114.5	165.1	-54.9	0	0	0	0	109.3	E286	E286-S288 PolarHBondContact O-N 3.42Å
289	S	26.9	Very low	26.5	Very low	112 Å²	112	133.8 Å²	133.8	78%	0.783	78%	0.777	S	S	*	*			trans	-99.7	115.7	173.2	141.5	0	0	0	0	108.2
290	S	27.1	Very low	26.5	Very low	68 Å²	68	135.1 Å²	135.1	48%	0.476	78%	0.784	S	S	.	*	P	Polyproline II helix	trans	-93	116.9	175.1	51.4	0	0	0	0	110.9
291	S	27.3	Very low	26.3	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-95.8	131	163.1	53.3	0	0	0	0	109.9
292	L	25.6	Very low	26.1	Very low	176 Å²	176	136.1 Å²	136.1	92%	0.921	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79.7	132.3	171.6	-71.8	158	0	0	0	109.8
293	A	27.4	Very low	26.1	Very low	97 Å²	97	144 Å²	144	80%	0.802	80%	0.798	S	S	*	*			trans	-107	126	163.1	0	0	0	0	0	108.5
294	V	26.4	Very low	26	Very low	142 Å²	142	143 Å²	143	86%	0.861	80%	0.796	S	S	*	*			trans	-86.2	132	171.4	171.5	0	0	0	0	108.4
295	R	26	Very low	25.9	Very low	242 Å²	242	141.2 Å²	141.2	91%	0.913	80%	0.796	S	S	*	*			trans	-84.6	142.3	174.1	-59.9	170.3	80.4	-179.6	3.9	108.6
296	S	25.9	Very low	25.6	Very low	126 Å²	126	135.3 Å²	135.3	88%	0.881	79%	0.786	S	S	*	*			trans	-109.2	139.1	160	35.1	0	0	0	0	109.9
297	D	24.5	Very low	25.5	Very low	164 Å²	164	137 Å²	137	88%	0.877	79%	0.794	S	S	*	*			trans	-83.1	157.1	-165.5	-150.5	-8	0	0	0	112.6
298	Q	24.8	Very low	25.3	Very low	180 Å²	180	137 Å²	137	84%	0.841	79%	0.79	S	S	*	*			trans	-88	141	175.5	-70.5	176.9	-9.3	0	0	110.2
299	S	24.3	Very low	25.2	Very low	124 Å²	124	142.5 Å²	142.5	87%	0.867	82%	0.815	S	S	*	*			trans	-145.3	145	149.7	63.8	0	0	0	0	111.4
300	L	25.3	Very low	25.1	Very low	165 Å²	165	141.5 Å²	141.5	86%	0.864	81%	0.808	S	S	*	*			trans	-91.6	165.7	-161.9	-70.3	152.9	0	0	0	113.6
301	S	24.7	Very low	25	Very low	108 Å²	108	143.5 Å²	143.5	76%	0.755	82%	0.821	S	S	*	*			trans	123.8	140.2	158.2	65.6	0	0	0	0	111.3
302	E	24.7	Very low	24.8	Very low	192 Å²	192	142.1 Å²	142.1	90%	0.897	82%	0.824	S	S	*	*			cis	-164.5	152.7	-8.9	-108.9	176.1	150.7	0	0	104.4
303	R	25.6	Very low	24.9	Very low	257 Å²	257	141.6 Å²	141.6	97%	0.97	82%	0.823	S	S	*	*			trans	-99.8	138.6	179.2	-83.5	179.7	168.5	-179.3	-3.7	111.4
304	A	23.7	Very low	24.9	Very low	87 Å²	87	141.2 Å²	141.2	72%	0.719	82%	0.82	S	S	*	*			trans	-157.2	111.2	150.5	0	0	0	0	0	107.2
305	S	23.5	Very low	24.9	Very low	125 Å²	125	138.5 Å²	138.5	87%	0.874	82%	0.82	S	S	*	*				51.7	130.2	92	58.5	0	0	0	0	113.1
306	G	22.9	Very low	25	Very low	65 Å²	65	131 Å²	131	67%	0.67	82%	0.818	S	S	*	*			cis	-164.8	158.3	7.5	0	0	0	0	0	106.6
307	E	24.4	Very low	25	Very low	182 Å²	182	133 Å²	133	85%	0.85	82%	0.818	S	S	*	*				86.5	136.6	108.4	-85.7	-167.9	163.6	0	0	116.7
308	T	23.1	Very low	25.6	Very low	113 Å²	113	130.5 Å²	130.5	69%	0.693	81%	0.811	S	S	*	*			trans	98.7	112.6	146.7	61.9	0	0	0	0	121.5
309	L	24.6	Very low	25.7	Very low	159 Å²	159	129.6 Å²	129.6	83%	0.832	81%	0.811	S	S	*	*				70.3	144.5	123.9	-61.8	169.2	0	0	0	117.6
310	S	25.1	Very low	26.4	Very low	91 Å²	91	129.7 Å²	129.7	64%	0.636	81%	0.809	S	S	*	*			cis	-176.3	157.8	1.2	165.9	0	0	0	0	107.2
311	S	24.4	Very low	26.4	Very low	109 Å²	109	125.5 Å²	125.5	76%	0.762	81%	0.805	S	S	*	*			trans	58.3	116.8	147.2	53.1	0	0	0	0	119.1
312	G	24.7	Very low	26.5	Very low	80 Å²	80	129.8 Å²	129.8	83%	0.825	81%	0.81	S	S	*	*				101.7	146.9	82.6	0	0	0	0	0	107.3
313	D	26.8	Very low	26.9	Very low	166 Å²	166	127 Å²	127	89%	0.888	81%	0.807	S	S	*	*			cis	-164.7	173.2	10.9	-176.5	21.4	0	0	0	106.2
314	A	27.3	Very low	26.8	Very low	89 Å²	89	123.7 Å²	123.7	74%	0.736	80%	0.802	S	S	*	*			trans	-64.3	161.3	-168.8	0	0	0	0	0	118.3
315	G	26.8	Very low	26.9	Very low	85 Å²	85	123.7 Å²	123.7	88%	0.876	80%	0.803	S	S	*	*				108.7	116.9	129.9	0	0	0	0	0	117.6
316	G	27.2	Very low	27	Very low	84 Å²	84	124.5 Å²	124.5	87%	0.866	80%	0.802	S	S	*	*			trans	149.6	91.8	157.5	0	0	0	0	0	116.2
317	L	27.1	Very low	27.2	Very low	167 Å²	167	129.4 Å²	129.4	87%	0.874	81%	0.81	S	S	*	*			trans	-91	160	149.9	-75.8	165.2	0	0	0	107.6
318	P	36.2	Very low	27.5	Very low	113 Å²	113	126.5 Å²	126.5	73%	0.734	81%	0.805	S	S	*	*			cis	-141.8	163.8	25.2	34.6	-11.7	0	0	0	117.9
319	L	27.4	Very low	27.8	Very low	160 Å²	160	127.4 Å²	127.4	84%	0.838	81%	0.81	S	S	*	*			trans	7.3	160.9	148.5	-64.9	156.2	0	0	0	120.9
320	P	39.3	Very low	28.4	Very low	127 Å²	127	125.5 Å²	125.5	83%	0.825	81%	0.81	S	S	*	*			cis	-138.7	160.6	10.7	35.7	-15.1	0	0	0	115.6
321	G	24.4	Very low	28.9	Very low	77 Å²	77	132 Å²	132	79%	0.794	82%	0.82	S	S	*	*			trans	174.9	131.3	170.8	0	0	0	0	0	115.1
322	K	27	Very low	29.2	Very low	197 Å²	197	136.3 Å²	136.3	86%	0.857	83%	0.826	S	S	*	*			trans	-59.5	151.8	-171.9	-71.3	162.6	169.1	173.4	0	115.3
323	T	32.6	Very low	29.9	Very low	135 Å²	135	137.7 Å²	137.7	83%	0.828	82%	0.82	S	S	*	*			trans	61	103	146.5	41.7	0	0	0	0	119.1
324	Q	23.9	Very low	30.7	Very low	186 Å²	186	135.3 Å²	135.3	87%	0.869	81%	0.807	S	S	*	*			trans	-137.3	114.7	153.8	-75.1	-176.7	-7.3	0	0	107.2
325	A	27	Very low	32	Very low	88 Å²	88	141.7 Å²	141.7	73%	0.727	81%	0.812	S	S	*	*				57.1	81	80.4	0	0	0	0	0	111.2	M327	A325-M327 PolarHBondContact O-N 3.12Å
326	T	25.8	Very low	34.1	Very low	141 Å²	141	142.6 Å²	142.6	87%	0.865	80%	0.797	S	S	*	*			trans	-65.9	99.5	174.6	-19.7	0	0	0	0	109.1	T328	T326-T328 PolarHBondContact O-N 2.84Å
327	M	26.3	Very low	36.9	Very low	169 Å²	169	140.7 Å²	140.7	83%	0.833	77%	0.77	S	S	*	*			trans	-78.1	110.2	169.9	-86.4	-83.7	131.3	0	0	109.4	A325 T329	A325-M327 PolarHBondContact O-N 3.12Å; M327-T329 PolarHBondContact O-N 3.29Å
328	T	30.7	Very low	39.8	Very low	121 Å²	121	132.8 Å²	132.8	74%	0.742	73%	0.729	S	S	*	*			trans	-37	116.3	163.9	47.5	0	0	0	0	114.4	T326	T326-T328 PolarHBondContact O-N 2.84Å
329	T	28.8	Very low	42.3	Very low	131 Å²	131	130.9 Å²	130.9	80%	0.804	71%	0.712	S	S	*	*			trans	-86.3	104.3	150.1	54.6	0	0	0	0	108.1	M327 R331	M327-T329 PolarHBondContact O-N 3.29Å; T329-R331 VanDerWaalsContact C-N 3.35Å; T329-R331 PolarHBondContact O-N 2.9Å
330	S	36.9	Very low	45.3	Very low	119 Å²	119	125.9 Å²	125.9	83%	0.832	69%	0.689	S	S	*	*			trans	-57.6	90.6	172.7	-179.2	0	0	0	0	110.8
331	R	36.1	Very low	47.6	Very low	227 Å²	227	122.2 Å²	122.2	86%	0.857	68%	0.675	S	S	*	*			trans	-86.2	125.3	155.9	-88.9	-179	170.9	-179.1	-2.6	106.6	T329 P333	T329-R331 VanDerWaalsContact C-N 3.35Å; T329-R331 PolarHBondContact O-N 2.9Å; R331-P333 WeakPolarHBondContact O-CD 3.45Å
332	K	30.8	Very low	50.8	Low	201 Å²	201	121.2 Å²	121.2	87%	0.874	65%	0.653	S	S	*	*			trans	-40.2	111.8	175	-71.5	179.4	177.2	177.2	0	110.6	N334	K332-N334 PolarHBondContact O-N 3.36Å
333	P	39.4	Very low	53.9	Low	109 Å²	109	112.4 Å²	112.4	71%	0.708	62%	0.615	S	S	*	*			trans	-99.8	87.1	-171.4	34.5	-26.3	0	0	0	108.7	R331	R331-P333 WeakPolarHBondContact O-CD 3.45Å
334	N	43.5	Very low	56.8	Low	115 Å²	115	109.8 Å²	109.8	62%	0.615	60%	0.595	S	S	*	*	S	Bend	trans	178.8	-3.1	159.8	-97.6	-11.7	0	0	0	117.7	K332	K332-N334 PolarHBondContact O-N 3.36Å
335	R	54.1	Low	60.2	Low	223 Å²	223	101.7 Å²	101.7	84%	0.842	56%	0.559	S	S	*	*	S	Bend	trans	-79	-25.7	-173.5	-86.5	-168.3	160.4	-172	-5.7	115.7	R407	R335-R407 PolarHBondContact O-NH1 2.96Å; R335-R407 VanDerWaalsContact O-NH1 3.1Å; R335-R407 PolarHBondContact O-NH2 3.33Å
336	D	72.1	Confident	63.4	Low	105 Å²	105	98.7 Å²	98.7	56%	0.561	53%	0.53	S	S	*	.	S	Bend	trans	-114.3	0.2	-170.5	-60.3	-43.4	0	0	0	114.9	R407 C514	D336-R407 VanDerWaalsContact CA-NH2 3.27Å; D336-R407 PolarHBondContact O-NH2 3.45Å; D336-C514 VanDerWaalsContact O-CB 3.29Å; D336-C514 WeakPolarHBondContact O-CB 3.15Å; D336-C514 PolarHBondContact O-N 2.97Å
337	C	84.8	Confident	66.9	Low	43 Å²	43	92 Å²	92	29%	0.291	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	153.7	-177.3	-51	0	0	0	0	112.7	R407 T511 L512	C337-R407 PolarHBondContact O-NH1 3.21Å; C337-T511 HydrophobicContact CB-CG2 4.06Å; C337-L512 CarbonylContact C-O 3.4Å; C337-L512 WeakPolarHBondContact CA-O 3.49Å; C337-L512 WeakPolarHBondContact CB-O 3.49Å
338	L	89	Confident	70.2	Confident	2 Å²	2	83.9 Å²	83.9	1%	0.01	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	118.1	166.8	-58.9	178.5	0	0	0	108.5	Y343 A390 E392 R407 L409 T511 L512	L338-Y343 HydrophobicContact CB-CD1 3.69Å; L338-Y343 HydrophobicContact CB-CE1 4.24Å; L338-Y343 HydrophobicContact CB-CG 4.33Å; L338-Y343 HydrophobicContact CD1-CG 4.43Å; L338-A390 HydrophobicContact CD1-CB 4.26Å; L338-E392 HydrophobicContact CD2-CB 3.96Å; L338-E392 HydrophobicContact CD2-CG 4.17Å; L338-R407 HydrophobicContact CD2-CB 4.33Å; L338-L409 HydrophobicContact CD1-CD1 3.81Å; L338-L409 HydrophobicContact CD1-CG 3.88Å; L338-L409 HydrophobicContact CG-CD1 4.03Å; L338-L409 HydrophobicContact CG-CG 4.48Å; L338-T511 CarbonylContact O-C 3.57Å; L338-T511 WeakPolarHBondContact O-CA 3.33Å; L338-L512 HydrophobicContact CB-CB 4.22Å; L338-L512 HydrophobicContact CD1-CD1 4.49Å; L338-L512 PolarHBondContact N-O 3.49Å; L338-L512 PolarHBondContact O-N 3.46Å
339	L	89.5	Confident	73.2	Confident	72 Å²	72	78.2 Å²	78.2	38%	0.377	41%	0.414	S	S	.	.			trans	-81.3	155.6	-177.5	-64.5	173.7	0	0	0	111.5	G341 T342 Y343 T511	L339-G341 PolarHBondContact O-N 3.5Å; L339-T342 HydrophobicContact CB-CG2 3.96Å; L339-T342 PolarHBondContact N-OG1 3.4Å; L339-T342 WeakPolarHBondContact O-CB 3.2Å; L339-T342 PolarHBondContact O-N 3.39Å; L339-T342 PolarHBondContact O-OG1 3.42Å; L339-Y343 WeakPolarHBondContact O-CD1 3.1Å; L339-Y343 WeakPolarHBondContact O-CE1 3.01Å; L339-T511 HydrophobicContact CD2-CG2 3.96Å
340	P	90.3	Very high	76.3	Confident	55 Å²	55	72.1 Å²	72.1	36%	0.357	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	136.1	173.2	-26.8	34.1	0	0	0	112.2	T342 T511	P340-T342 PolarHBondContact O-N 2.97Å; P340-T511 WeakPolarHBondContact CD-OG1 3.28Å
341	G	87.7	Confident	78.7	Confident	51 Å²	51	70 Å²	70	53%	0.526	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	-16	-178.8	0	0	0	0	0	115.7	L339 Y343 K393	L339-G341 PolarHBondContact O-N 3.5Å; G341-Y343 VanDerWaalsContact C-N 3.34Å; G341-K393 WeakPolarHBondContact O-CD 3.49Å; G341-K393 PolarHBondContact O-NZ 3.36Å
342	T	90.4	Very high	80.9	Confident	55 Å²	55	63.2 Å²	63.2	34%	0.337	33%	0.333	S	S	.	.	S	Bend	trans	-86.9	0.3	179.2	69.3	0	0	0	0	114.2	L339 P340 K393	L339-T342 HydrophobicContact CB-CG2 3.96Å; L339-T342 PolarHBondContact N-OG1 3.4Å; L339-T342 WeakPolarHBondContact O-CB 3.2Å; L339-T342 PolarHBondContact O-N 3.39Å; L339-T342 PolarHBondContact O-OG1 3.42Å; P340-T342 PolarHBondContact O-N 2.97Å; T342-K393 PolarHBondContact O-N 3.36Å
343	Y	93.3	Very high	83.4	Confident	13 Å²	13	54.4 Å²	54.4	5%	0.051	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	162.7	179.4	64.3	-90.9	0	0	0	111.8	L338 L339 G341 V345 A390 R391 Y507 R510 L512	L338-Y343 HydrophobicContact CB-CD1 3.69Å; L338-Y343 HydrophobicContact CB-CE1 4.24Å; L338-Y343 HydrophobicContact CB-CG 4.33Å; L338-Y343 HydrophobicContact CD1-CG 4.43Å; L339-Y343 WeakPolarHBondContact O-CD1 3.1Å; L339-Y343 WeakPolarHBondContact O-CE1 3.01Å; G341-Y343 VanDerWaalsContact C-N 3.34Å; Y343-V345 HydrophobicContact CE2-CG2 4.36Å; Y343-A390 HydrophobicContact CD2-CB 3.73Å; Y343-A390 HydrophobicContact CE2-CB 4.17Å; Y343-A390 HydrophobicContact CG-CB 4.34Å; Y343-R391 CarbonylContact C-O 3.52Å; Y343-R391 WeakPolarHBondContact CA-O 3.44Å; Y343-R391 VanDerWaalsContact CB-O 3.25Å; Y343-R391 WeakPolarHBondContact CB-O 3.27Å; Y343-Y507 PolarHBondContact OH-O 2.87Å; Y343-R510 WeakPolarHBondContact CE1-O 3.45Å; Y343-R510 PolarHBondContact OH-O 3.31Å; Y343-L512 HydrophobicContact CD1-CD1 4.45Å; Y343-L512 HydrophobicContact CD2-CD1 4.06Å; Y343-L512 HydrophobicContact CE1-CD1 4.02Å; Y343-L512 HydrophobicContact CE1-CG 4.04Å; Y343-L512 HydrophobicContact CE2-CD1 3.59Å; Y343-L512 HydrophobicContact CE2-CG 4.29Å; Y343-L512 HydrophobicContact CG-CD1 4.45Å
344	D	92.9	Very high	85	Confident	79 Å²	79	50.9 Å²	50.9	42%	0.422	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	144.3	170.3	-66.7	-44.8	0	0	0	110.7	I346 A390 R391 K393	D344-I346 HydrophobicContact CB-CG1 4.32Å; D344-A390 CarbonylContact O-C 3.58Å; D344-A390 WeakPolarHBondContact O-CA 3.49Å; D344-R391 PolarHBondContact N-O 2.76Å; D344-R391 PolarHBondContact O-N 3.36Å; D344-K393 WeakPolarHBondContact OD1-CE 3.44Å; D344-K393 IonicContact OD1-NZ 2.86Å; D344-K393 PolarHBondContact OD1-NZ 3.2Å; D344-K393 WeakPolarHBondContact OD2-CE 3.24Å; D344-K393 IonicContact OD2-NZ 3.75Å
345	V	94.8	Very high	85.8	Confident	17 Å²	17	50.2 Å²	50.2	10%	0.103	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	116.1	172.9	179.6	0	0	0	0	108.7	Y343 W388 V389 L411 L503	Y343-V345 HydrophobicContact CE2-CG2 4.36Å; V345-W388 HydrophobicContact CG1-CB 4.09Å; V345-W388 HydrophobicContact CG1-CG 4.33Å; V345-V389 WeakPolarHBondContact CA-O 3.47Å; V345-L411 HydrophobicContact CG1-CD2 4.04Å; V345-L503 HydrophobicContact CG1-CB 4.22Å
346	I	95.4	Very high	85.7	Confident	24 Å²	24	40.9 Å²	40.9	12%	0.123	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135.3	-174.5	-58.6	175.4	0	0	0	109.2	D344 D377 W388 V389 R391	D344-I346 HydrophobicContact CB-CG1 4.32Å; I346-D377 HydrophobicContact CG2-CB 4.29Å; I346-W388 WeakPolarHBondContact O-CA 3.38Å; I346-V389 HydrophobicContact CB-CG2 4.27Å; I346-V389 PolarHBondContact N-O 3.03Å; I346-V389 PolarHBondContact O-N 3.33Å; I346-R391 HydrophobicContact CD1-CB 3.86Å; I346-R391 HydrophobicContact CD1-CG 4.41Å; I346-R391 VanDerWaalsContact CD1-CZ 3.46Å
347	L	97.2	Very high	85	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	125.4	173	173.9	64.9	0	0	0	109.5	V349 L369 V374 G375 F376 D377 F386 W388 L496	L347-V349 HydrophobicContact CD2-CG2 4.19Å; L347-V349 HydrophobicContact CG-CG2 4.13Å; L347-L369 HydrophobicContact CD2-CD1 4.09Å; L347-L369 HydrophobicContact CD2-CD2 4.06Å; L347-V374 HydrophobicContact CB-CG1 4.49Å; L347-V374 HydrophobicContact CD2-CG1 4.42Å; L347-G375 PolarHBondContact N-O 2.85Å; L347-F376 HydrophobicContact CB-CB 4.02Å; L347-F376 HydrophobicContact CD2-CB 4.16Å; L347-F376 HydrophobicContact CG-CB 4.2Å; L347-F376 CarbonylContact O-C 3.54Å; L347-F376 WeakPolarHBondContact O-CA 3.46Å; L347-F376 WeakPolarHBondContact O-CB 3.42Å; L347-D377 PolarHBondContact O-N 3.39Å; L347-F386 HydrophobicContact CD1-CB 4.2Å; L347-F386 HydrophobicContact CD1-CD1 4.49Å; L347-W388 HydrophobicContact CD1-CD2 4.39Å; L347-W388 HydrophobicContact CD1-CZ2 3.98Å; L347-L496 HydrophobicContact CD1-CD2 4.44Å; L347-L496 HydrophobicContact CD2-CB 4.28Å
348	C	96.2	Very high	83.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.7	167.9	-64.3	0	0	0	0	109.8	D377 F386 L387 V389	C348-D377 CarbonylContact C-O 3.59Å; C348-D377 WeakPolarHBondContact CA-O 3.38Å; C348-F386 WeakPolarHBondContact O-CA 3.42Å; C348-L387 HydrophobicContact CB-CD1 3.59Å; C348-L387 HydrophobicContact CB-CG 4.11Å; C348-L387 PolarHBondContact N-O 3.07Å; C348-L387 PolarHBondContact O-N 3.31Å; C348-L387 VanDerWaalsContact O-N 3.15Å; C348-V389 VanDerWaalsContact SG-CG2 3.59Å
349	V	95.1	Very high	82.3	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.6	177.1	-178.6	0	0	0	0	108.2	L347 E353 T354 L369 F376 D377 V378 R379 F386	L347-V349 HydrophobicContact CD2-CG2 4.19Å; L347-V349 HydrophobicContact CG-CG2 4.13Å; V349-E353 HydrophobicContact CG1-CB 4.09Å; V349-T354 HydrophobicContact CG1-CG2 3.87Å; V349-L369 HydrophobicContact CG2-CD1 4.28Å; V349-F376 HydrophobicContact CG2-CB 4.24Å; V349-F376 HydrophobicContact CG2-CD2 4.17Å; V349-F376 HydrophobicContact CG2-CG 4.47Å; V349-D377 PolarHBondContact N-O 3.2Å; V349-V378 WeakPolarHBondContact O-CA 3.5Å; V349-R379 PolarHBondContact O-N 3.13Å; V349-F386 HydrophobicContact CB-CD1 4.26Å; V349-F386 HydrophobicContact CB-CE1 4.27Å; V349-F386 HydrophobicContact CG1-CD1 4.1Å; V349-F386 HydrophobicContact CG1-CE1 3.65Å; V349-F386 HydrophobicContact CG2-CD1 3.96Å; V349-F386 HydrophobicContact CG2-CE1 4.07Å
350	D	93.5	Very high	81	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	140.3	174.2	-174	58.7	0	0	0	111.4	I352 E353 R379 L381 D385	D350-I352 PolarHBondContact O-N 3.1Å; D350-I352 WeakPolarHBondContact OD2-CB 3.4Å; D350-I352 WeakPolarHBondContact OD2-CG1 3.32Å; D350-I352 PolarHBondContact OD2-N 2.92Å; D350-E353 WeakPolarHBondContact O-CB 3.34Å; D350-E353 PolarHBondContact O-N 2.95Å; D350-R379 CarbonylContact C-O 3.47Å; D350-R379 VanDerWaalsContact CA-O 3.28Å; D350-R379 WeakPolarHBondContact CA-O 3.42Å; D350-L381 HydrophobicContact CB-CB 4.08Å; D350-L381 HydrophobicContact CB-CD1 4.04Å; D350-L381 HydrophobicContact CB-CG 4Å; D350-L381 WeakPolarHBondContact OD1-CB 3.32Å; D350-L381 PolarHBondContact OD1-N 3.26Å; D350-D385 PolarHBondContact N-O 2.98Å
351	F	86	Confident	79.7	Confident	74 Å²	74	55.4 Å²	55.4	33%	0.325	31%	0.314	S	S	.	.	H	α-helix	trans	-59.7	-33.5	-178.8	82	-75.6	0	0	0	111.7	E353 T354 T355 V378 R379 K380	F351-E353 PolarHBondContact O-N 2.84Å; F351-T354 CarbonylContact O-C 3.54Å; F351-T354 WeakPolarHBondContact O-CA 3.35Å; F351-T354 PolarHBondContact O-N 3.45Å; F351-T354 PolarHBondContact O-OG1 3.25Å; F351-T355 PolarHBondContact O-N 2.67Å; F351-T355 PolarHBondContact O-OG1 2.9Å; F351-V378 HydrophobicContact CB-CG1 4.16Å; F351-R379 PolarHBondContact N-O 3.09Å; F351-K380 HydrophobicContact CD1-CB 3.94Å; F351-K380 HydrophobicContact CD1-CG 4.05Å; F351-K380 HydrophobicContact CE1-CB 4.19Å; F351-K380 HydrophobicContact CE1-CD 4.13Å; F351-K380 HydrophobicContact CE1-CG 3.79Å
352	I	83.3	Confident	78.8	Confident	85 Å²	85	54.6 Å²	54.6	44%	0.436	30%	0.296	S	S	.	.	H	α-helix	trans	-61.3	-34.9	178.7	-59.6	173.2	0	0	0	109.9	D350 T354 G356 K362	D350-I352 PolarHBondContact O-N 3.1Å; D350-I352 WeakPolarHBondContact OD2-CB 3.4Å; D350-I352 WeakPolarHBondContact OD2-CG1 3.32Å; D350-I352 PolarHBondContact OD2-N 2.92Å; I352-T354 PolarHBondContact O-N 2.79Å; I352-G356 PolarHBondContact O-N 3.27Å; I352-K362 PolarHBondContact O-NZ 3.39Å
353	E	82.4	Confident	78.1	Confident	16 Å²	16	56.3 Å²	56.3	8%	0.075	30%	0.3	C	S	.	.	H	α-helix	trans	-68.4	-14	175.5	-73.3	-57.8	98.6	0	0	113.9	V349 D350 F351 K362 D385 F386 R417	V349-E353 HydrophobicContact CG1-CB 4.09Å; D350-E353 WeakPolarHBondContact O-CB 3.34Å; D350-E353 PolarHBondContact O-N 2.95Å; F351-E353 PolarHBondContact O-N 2.84Å; E353-K362 WeakPolarHBondContact O-CB 3.27Å; E353-K362 VanDerWaalsContact O-CD 3.3Å; E353-K362 WeakPolarHBondContact O-CD 3.27Å; E353-K362 WeakPolarHBondContact O-CG 3.41Å; E353-K362 IonicContact OE1-NZ 3.67Å; E353-K362 PolarHBondContact OE1-NZ 3.44Å; E353-D385 HydrophobicContact CG-CB 3.97Å; E353-F386 HydrophobicContact CB-CZ 4.37Å; E353-F386 HydrophobicContact CG-CE2 4.48Å; E353-F386 HydrophobicContact CG-CZ 4.1Å; E353-R417 IonicContact OE1-NH1 3.63Å; E353-R417 IonicContact OE2-CZ 3.12Å; E353-R417 IonicContact OE2-NE 3.65Å; E353-R417 IonicContact OE2-NH1 2.67Å; E353-R417 PolarHBondContact OE2-NH1 3.24Å
354	T	73.4	Confident	77.6	Confident	34 Å²	34	57.7 Å²	57.7	21%	0.209	31%	0.307	C	S	.	.	H	α-helix	trans	-107.3	-28.8	176.3	66.4	0	0	0	0	114	V349 F351 I352 V366 V378	V349-T354 HydrophobicContact CG1-CG2 3.87Å; F351-T354 CarbonylContact O-C 3.54Å; F351-T354 WeakPolarHBondContact O-CA 3.35Å; F351-T354 PolarHBondContact O-N 3.45Å; F351-T354 PolarHBondContact O-OG1 3.25Å; I352-T354 PolarHBondContact O-N 2.79Å; T354-V366 HydrophobicContact CG2-CG2 3.73Å; T354-V378 HydrophobicContact CG2-CG1 3.91Å; T354-V378 HydrophobicContact CG2-CG2 3.94Å; T354-V378 WeakPolarHBondContact OG1-CG1 3.48Å
355	T	60.3	Low	77.3	Confident	101 Å²	101	54 Å²	54	62%	0.62	29%	0.287	S	S	*	.	H	α-helix	trans	-120.2	-7.4	-171.2	61.2	0	0	0	0	115.9	F351	F351-T355 PolarHBondContact O-N 2.67Å; F351-T355 PolarHBondContact O-OG1 2.9Å
356	G	51.1	Low	77	Confident	27 Å²	27	54.6 Å²	54.6	28%	0.278	29%	0.291	S	S	.	.	S	Bend	trans	-108.9	119.4	-173.5	0	0	0	0	0	116	I352 K362	I352-G356 PolarHBondContact O-N 3.27Å; G356-K362 WeakPolarHBondContact O-CD 3.46Å; G356-K362 WeakPolarHBondContact O-CE 3.32Å; G356-K362 PolarHBondContact O-NZ 3.29Å
357	G	58.6	Low	76.7	Confident	70 Å²	70	58.7 Å²	58.7	72%	0.722	31%	0.308	S	S	*	.	S	Bend	trans	101.2	-153.4	174.1	0	0	0	0	0	114	H359	G357-H359 PolarHBondContact O-N 3.4Å
358	S	57.5	Low	76.3	Confident	79 Å²	79	60.6 Å²	60.6	55%	0.552	32%	0.316	S	S	*	.			trans	-60.2	107.1	-175	-177.7	0	0	0	0	111.6	Y360 R361	S358-Y360 PolarHBondContact O-N 2.88Å; S358-R361 PolarHBondContact O-N 3.47Å
359	H	59.3	Low	76.1	Confident	144 Å²	144	60.6 Å²	60.6	67%	0.667	32%	0.317	S	S	*	.	H	α-helix	trans	-56.2	-28.8	-168.6	-158.9	-86.9	0	0	0	113.6	G357 Q363	G357-H359 PolarHBondContact O-N 3.4Å; H359-Q363 PolarHBondContact O-N 2.85Å
360	Y	62	Low	75.9	Confident	169 Å²	169	66.2 Å²	66.2	66%	0.663	34%	0.343	S	S	*	.	H	α-helix	trans	-66.5	-50.1	-177.7	179.6	-93	0	0	0	113.3	S358 E364	S358-Y360 PolarHBondContact O-N 2.88Å; Y360-E364 PolarHBondContact O-N 3.16Å
361	R	63	Low	75.8	Confident	121 Å²	121	75.6 Å²	75.6	46%	0.457	38%	0.378	S	S	.	.	H	α-helix	trans	-76.8	-25.6	-171.8	-63.4	-175.7	-167.5	143.6	1.5	113.5	S358 E364 L365	S358-R361 PolarHBondContact O-N 3.47Å; R361-E364 VanDerWaalsContact O-CB 3.28Å; R361-E364 WeakPolarHBondContact O-CB 3.12Å; R361-E364 PolarHBondContact O-N 3.25Å; R361-L365 PolarHBondContact O-N 3.46Å
362	K	68.4	Low	76.1	Confident	33 Å²	33	74.4 Å²	74.4	14%	0.143	38%	0.375	C	S	.	.	H	α-helix	trans	-77	-35.9	177.4	-67.5	-165.1	163.8	-161.6	0	112	I352 E353 G356 E364 L365 V366	I352-K362 PolarHBondContact O-NZ 3.39Å; E353-K362 WeakPolarHBondContact O-CB 3.27Å; E353-K362 VanDerWaalsContact O-CD 3.3Å; E353-K362 WeakPolarHBondContact O-CD 3.27Å; E353-K362 WeakPolarHBondContact O-CG 3.41Å; E353-K362 IonicContact OE1-NZ 3.67Å; E353-K362 PolarHBondContact OE1-NZ 3.44Å; G356-K362 WeakPolarHBondContact O-CD 3.46Å; G356-K362 WeakPolarHBondContact O-CE 3.32Å; G356-K362 PolarHBondContact O-NZ 3.29Å; K362-E364 PolarHBondContact O-N 3.06Å; K362-L365 PolarHBondContact O-N 3.04Å; K362-V366 PolarHBondContact O-N 3.3Å
363	Q	76.2	Confident	76.4	Confident	92 Å²	92	73.6 Å²	73.6	43%	0.43	39%	0.387	S	S	.	.	H	α-helix	trans	-64.5	-31.3	167.7	-127.6	175	18.8	0	0	111.8	H359 V366 K367	H359-Q363 PolarHBondContact O-N 2.85Å; Q363-V366 PolarHBondContact O-N 3.42Å; Q363-K367 VanDerWaalsContact O-CB 3.27Å; Q363-K367 WeakPolarHBondContact O-CB 3.25Å; Q363-K367 WeakPolarHBondContact O-CD 3.47Å; Q363-K367 WeakPolarHBondContact O-CG 3.25Å; Q363-K367 PolarHBondContact O-N 3.05Å
364	E	83	Confident	76.8	Confident	41 Å²	41	73.5 Å²	73.5	19%	0.192	39%	0.388	C	S	.	.	H	α-helix	trans	-63	-46.9	175.9	-165.6	175.3	-173.9	0	0	112.1	Y360 R361 K362 V366 K367 E368 V489	Y360-E364 PolarHBondContact O-N 3.16Å; R361-E364 VanDerWaalsContact O-CB 3.28Å; R361-E364 WeakPolarHBondContact O-CB 3.12Å; R361-E364 PolarHBondContact O-N 3.25Å; K362-E364 PolarHBondContact O-N 3.06Å; E364-V366 PolarHBondContact O-N 3.48Å; E364-K367 PolarHBondContact O-N 3.46Å; E364-E368 WeakPolarHBondContact O-CB 3.41Å; E364-E368 WeakPolarHBondContact O-CG 3.37Å; E364-E368 PolarHBondContact O-N 3.21Å; E364-V489 HydrophobicContact CB-CG1 4.22Å; E364-V489 HydrophobicContact CG-CG1 3.84Å; E364-V489 WeakPolarHBondContact OE2-CG1 3.38Å
365	L	86.9	Confident	77.5	Confident	2 Å²	2	74.2 Å²	74.2	1%	0.01	40%	0.402	C	S	.	.	H	α-helix	trans	-56.7	-48.2	175.9	179.6	63.5	0	0	0	112.1	R361 K362 E368 L369 F386 V489 A493 L496	R361-L365 PolarHBondContact O-N 3.46Å; K362-L365 PolarHBondContact O-N 3.04Å; L365-E368 PolarHBondContact O-N 2.9Å; L365-L369 HydrophobicContact CD1-CD1 4.23Å; L365-L369 HydrophobicContact CD1-CG 4.4Å; L365-L369 HydrophobicContact CG-CD1 4.16Å; L365-L369 VanDerWaalsContact O-CG 3.32Å; L365-L369 WeakPolarHBondContact O-CG 3.37Å; L365-L369 PolarHBondContact O-N 3.38Å; L365-F386 HydrophobicContact CD2-CE1 3.85Å; L365-F386 HydrophobicContact CD2-CZ 3.66Å; L365-V489 HydrophobicContact CB-CG2 3.77Å; L365-V489 HydrophobicContact CD1-CG2 4.2Å; L365-A493 HydrophobicContact CD1-CB 3.84Å; L365-L496 HydrophobicContact CD1-CD1 4.21Å
366	V	88	Confident	79.1	Confident	29 Å²	29	71.4 Å²	71.4	18%	0.176	38%	0.382	C	S	.	.	H	α-helix	trans	-63.9	-45.4	179.6	176.4	0	0	0	0	110.9	T354 K362 Q363 E364 E368 L369 Q370 F376	T354-V366 HydrophobicContact CG2-CG2 3.73Å; K362-V366 PolarHBondContact O-N 3.3Å; Q363-V366 PolarHBondContact O-N 3.42Å; E364-V366 PolarHBondContact O-N 3.48Å; V366-E368 VanDerWaalsContact C-N 3.35Å; V366-E368 PolarHBondContact O-N 3.48Å; V366-L369 PolarHBondContact O-N 3.22Å; V366-Q370 WeakPolarHBondContact O-CB 3.36Å; V366-Q370 VanDerWaalsContact O-CG 3.28Å; V366-Q370 WeakPolarHBondContact O-CG 3.42Å; V366-Q370 PolarHBondContact O-N 3.07Å; V366-F376 HydrophobicContact CG1-CE2 4.23Å; V366-F376 HydrophobicContact CG1-CZ 3.8Å
367	K	88.3	Confident	81.1	Confident	111 Å²	111	72 Å²	72	48%	0.483	38%	0.379	S	S	.	.	H	α-helix	trans	-60.7	-42.8	177.5	-75.9	169.4	-175.9	176.1	0	111.8	Q363 E364 Q370 R371	Q363-K367 VanDerWaalsContact O-CB 3.27Å; Q363-K367 WeakPolarHBondContact O-CB 3.25Å; Q363-K367 WeakPolarHBondContact O-CD 3.47Å; Q363-K367 WeakPolarHBondContact O-CG 3.25Å; Q363-K367 PolarHBondContact O-N 3.05Å; E364-K367 PolarHBondContact O-N 3.46Å; K367-Q370 PolarHBondContact O-N 3.11Å; K367-R371 VanDerWaalsContact O-CB 3.27Å; K367-R371 WeakPolarHBondContact O-CB 3.49Å; K367-R371 PolarHBondContact O-N 3.15Å
368	E	90.4	Very high	82.7	Confident	39 Å²	39	72 Å²	72	18%	0.182	36%	0.364	C	S	.	.	H	α-helix	trans	-68.7	-40.2	178.7	-73	-61.6	143.7	0	0	112.1	E364 L365 V366 Q370 R371 N372 R490 A493	E364-E368 WeakPolarHBondContact O-CB 3.41Å; E364-E368 WeakPolarHBondContact O-CG 3.37Å; E364-E368 PolarHBondContact O-N 3.21Å; L365-E368 PolarHBondContact O-N 2.9Å; V366-E368 VanDerWaalsContact C-N 3.35Å; V366-E368 PolarHBondContact O-N 3.48Å; E368-Q370 PolarHBondContact O-N 3.31Å; E368-R371 PolarHBondContact O-N 3.35Å; E368-R371 IonicContact OE1-NH1 2.82Å; E368-N372 WeakPolarHBondContact O-CB 3.4Å; E368-N372 PolarHBondContact O-N 3.35Å; E368-N372 PolarHBondContact O-ND2 3.46Å; E368-N372 VanDerWaalsContact O-ND2 3.11Å; E368-R490 HydrophobicContact CG-CG 4.21Å; E368-A493 HydrophobicContact CB-CB 3.66Å
369	L	91.3	Very high	84.3	Confident	1 Å²	1	70.6 Å²	70.6	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-63.2	-41.3	173.8	-71.8	172.7	0	0	0	112.1	L347 V349 L365 V366 N372 G373 V374 F376 A493 L496	L347-L369 HydrophobicContact CD2-CD1 4.09Å; L347-L369 HydrophobicContact CD2-CD2 4.06Å; V349-L369 HydrophobicContact CG2-CD1 4.28Å; L365-L369 HydrophobicContact CD1-CD1 4.23Å; L365-L369 HydrophobicContact CD1-CG 4.4Å; L365-L369 HydrophobicContact CG-CD1 4.16Å; L365-L369 VanDerWaalsContact O-CG 3.32Å; L365-L369 WeakPolarHBondContact O-CG 3.37Å; L365-L369 PolarHBondContact O-N 3.38Å; V366-L369 PolarHBondContact O-N 3.22Å; L369-N372 PolarHBondContact O-N 2.83Å; L369-G373 PolarHBondContact O-N 2.96Å; L369-V374 PolarHBondContact O-N 3.45Å; L369-F376 HydrophobicContact CB-CD1 3.98Å; L369-F376 HydrophobicContact CB-CE1 3.99Å; L369-A493 HydrophobicContact CD2-CB 4.49Å; L369-L496 HydrophobicContact CD2-CB 4.13Å
370	Q	91.3	Very high	85.9	Confident	119 Å²	119	70 Å²	70	56%	0.556	34%	0.342	S	S	*	.	H	α-helix	trans	-63.8	-45.3	174	-73	176.3	-17.8	0	0	111.7	V366 K367 E368 N372 G373 F376	V366-Q370 WeakPolarHBondContact O-CB 3.36Å; V366-Q370 VanDerWaalsContact O-CG 3.28Å; V366-Q370 WeakPolarHBondContact O-CG 3.42Å; V366-Q370 PolarHBondContact O-N 3.07Å; K367-Q370 PolarHBondContact O-N 3.11Å; E368-Q370 PolarHBondContact O-N 3.31Å; Q370-N372 PolarHBondContact O-N 2.89Å; Q370-G373 PolarHBondContact O-N 3.39Å; Q370-F376 HydrophobicContact CG-CE1 3.65Å; Q370-F376 HydrophobicContact CG-CZ 3.84Å
371	R	91.9	Very high	87.3	Confident	201 Å²	201	62.5 Å²	62.5	76%	0.758	31%	0.313	S	S	*	.	H	α-helix	trans	-59.3	-34.7	176.7	-174.4	-179.8	-179.5	169.7	2.3	112.2	K367 E368 G373	K367-R371 VanDerWaalsContact O-CB 3.27Å; K367-R371 WeakPolarHBondContact O-CB 3.49Å; K367-R371 PolarHBondContact O-N 3.15Å; E368-R371 PolarHBondContact O-N 3.35Å; E368-R371 IonicContact OE1-NH1 2.82Å; R371-G373 PolarHBondContact O-N 3.43Å
372	N	91.6	Very high	88.7	Confident	48 Å²	48	58.7 Å²	58.7	26%	0.257	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-1.6	177.1	-70.7	-29.1	0	0	0	114.1	E368 L369 Q370 V374 T497 R501	E368-N372 WeakPolarHBondContact O-CB 3.4Å; E368-N372 PolarHBondContact O-N 3.35Å; E368-N372 PolarHBondContact O-ND2 3.46Å; E368-N372 VanDerWaalsContact O-ND2 3.11Å; L369-N372 PolarHBondContact O-N 2.83Å; Q370-N372 PolarHBondContact O-N 2.89Å; N372-V374 VanDerWaalsContact C-N 3.3Å; N372-V374 HydrophobicContact CB-CG2 4.07Å; N372-V374 PolarHBondContact O-N 3.31Å; N372-T497 HydrophobicContact CB-CG2 3.82Å; N372-T497 PolarHBondContact ND2-OG1 2.86Å; N372-R501 PolarHBondContact O-NH2 2.62Å
373	G	90.1	Very high	89.9	Confident	68 Å²	68	57.5 Å²	57.5	70%	0.701	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	31	178.8	0	0	0	0	0	113.3	L369 Q370 R371	L369-G373 PolarHBondContact O-N 2.96Å; Q370-G373 PolarHBondContact O-N 3.39Å; R371-G373 PolarHBondContact O-N 3.43Å
374	V	90.3	Very high	90.7	Very high	14 Å²	14	53.4 Å²	53.4	9%	0.085	28%	0.281	C	S	.	.			trans	-88.5	128.3	179.8	-178.9	0	0	0	0	109.4	L347 L369 N372 F376 T497 T500	L347-V374 HydrophobicContact CB-CG1 4.49Å; L347-V374 HydrophobicContact CD2-CG1 4.42Å; L369-V374 PolarHBondContact O-N 3.45Å; N372-V374 VanDerWaalsContact C-N 3.3Å; N372-V374 HydrophobicContact CB-CG2 4.07Å; N372-V374 PolarHBondContact O-N 3.31Å; V374-F376 WeakPolarHBondContact O-CD1 3.41Å; V374-F376 PolarHBondContact O-N 3.02Å; V374-T497 HydrophobicContact CG2-CG2 3.62Å; V374-T500 HydrophobicContact CG1-CG2 3.9Å
375	G	88.9	Confident	91.3	Very high	50 Å²	50	52.6 Å²	52.6	52%	0.515	28%	0.278	S	S	.	.			trans	-69.9	117.3	168.2	0	0	0	0	0	110.2	L347	L347-G375 PolarHBondContact N-O 2.85Å
376	F	93.2	Very high	91.7	Very high	41 Å²	41	52.5 Å²	52.5	18%	0.18	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	152	175.6	68.9	-88.7	0	0	0	112	L347 V349 V366 L369 Q370 V374 V378	L347-F376 HydrophobicContact CB-CB 4.02Å; L347-F376 HydrophobicContact CD2-CB 4.16Å; L347-F376 HydrophobicContact CG-CB 4.2Å; L347-F376 CarbonylContact O-C 3.54Å; L347-F376 WeakPolarHBondContact O-CA 3.46Å; L347-F376 WeakPolarHBondContact O-CB 3.42Å; V349-F376 HydrophobicContact CG2-CB 4.24Å; V349-F376 HydrophobicContact CG2-CD2 4.17Å; V349-F376 HydrophobicContact CG2-CG 4.47Å; V366-F376 HydrophobicContact CG1-CE2 4.23Å; V366-F376 HydrophobicContact CG1-CZ 3.8Å; L369-F376 HydrophobicContact CB-CD1 3.98Å; L369-F376 HydrophobicContact CB-CE1 3.99Å; Q370-F376 HydrophobicContact CG-CE1 3.65Å; Q370-F376 HydrophobicContact CG-CZ 3.84Å; V374-F376 WeakPolarHBondContact O-CD1 3.41Å; V374-F376 PolarHBondContact O-N 3.02Å; F376-V378 HydrophobicContact CD2-CG2 4.09Å; F376-V378 HydrophobicContact CE2-CG2 3.92Å
377	D	93.3	Very high	92.2	Very high	41 Å²	41	51.1 Å²	51.1	22%	0.219	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.2	177.8	-95.1	45.7	0	0	0	109.3	I346 L347 C348 V349 R379 R391	I346-D377 HydrophobicContact CG2-CB 4.29Å; L347-D377 PolarHBondContact O-N 3.39Å; C348-D377 CarbonylContact C-O 3.59Å; C348-D377 WeakPolarHBondContact CA-O 3.38Å; V349-D377 PolarHBondContact N-O 3.2Å; D377-R379 HydrophobicContact CB-CG 4.24Å; D377-R379 IonicContact OD2-CZ 3.02Å; D377-R379 IonicContact OD2-NE 3.24Å; D377-R379 PolarHBondContact OD2-NE 3.1Å; D377-R379 IonicContact OD2-NH2 3.15Å; D377-R379 PolarHBondContact OD2-NH2 2.66Å; D377-R391 IonicContact OD1-CZ 2.68Å; D377-R391 IonicContact OD1-NH1 3.31Å; D377-R391 PolarHBondContact OD1-NH1 2.6Å; D377-R391 IonicContact OD1-NH2 3.53Å; D377-R391 PolarHBondContact OD1-NH2 2.93Å; D377-R391 IonicContact OD2-CZ 2.67Å; D377-R391 VanDerWaalsContact OD2-CZ 3.25Å; D377-R391 IonicContact OD2-NH1 3Å; D377-R391 PolarHBondContact OD2-NH1 3.39Å; D377-R391 VanDerWaalsContact OD2-NH1 3.15Å; D377-R391 IonicContact OD2-NH2 3.55Å; D377-R391 PolarHBondContact OD2-NH2 3.05Å
378	V	92.3	Very high	92.6	Very high	68 Å²	68	45.9 Å²	45.9	41%	0.412	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	120.7	172.8	-175.8	0	0	0	0	109.1	V349 F351 T354 F376	V349-V378 WeakPolarHBondContact O-CA 3.5Å; F351-V378 HydrophobicContact CB-CG1 4.16Å; T354-V378 HydrophobicContact CG2-CG1 3.91Å; T354-V378 HydrophobicContact CG2-CG2 3.94Å; T354-V378 WeakPolarHBondContact OG1-CG1 3.48Å; F376-V378 HydrophobicContact CD2-CG2 4.09Å; F376-V378 HydrophobicContact CE2-CG2 3.92Å
379	R	91.2	Very high	92.9	Very high	50 Å²	50	44 Å²	44	19%	0.189	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	165.5	-172.7	-63.2	-179.6	175.4	-151.4	-10	111.4	V349 D350 F351 D377 L381 E408	V349-R379 PolarHBondContact O-N 3.13Å; D350-R379 CarbonylContact C-O 3.47Å; D350-R379 VanDerWaalsContact CA-O 3.28Å; D350-R379 WeakPolarHBondContact CA-O 3.42Å; F351-R379 PolarHBondContact N-O 3.09Å; D377-R379 HydrophobicContact CB-CG 4.24Å; D377-R379 IonicContact OD2-CZ 3.02Å; D377-R379 IonicContact OD2-NE 3.24Å; D377-R379 PolarHBondContact OD2-NE 3.1Å; D377-R379 IonicContact OD2-NH2 3.15Å; D377-R379 PolarHBondContact OD2-NH2 2.66Å; R379-L381 PolarHBondContact O-N 3.36Å; R379-E408 IonicContact CZ-OE1 3.35Å; R379-E408 IonicContact CZ-OE2 3.2Å; R379-E408 VanDerWaalsContact NH1-CD 3.33Å; R379-E408 IonicContact NH1-OE1 3.08Å; R379-E408 PolarHBondContact NH1-OE1 3.15Å; R379-E408 IonicContact NH1-OE2 3.62Å; R379-E408 PolarHBondContact NH1-OE2 3.05Å; R379-E408 IonicContact NH2-OE1 2.74Å; R379-E408 PolarHBondContact NH2-OE1 2.99Å; R379-E408 IonicContact NH2-OE2 3.47Å
380	K	91.5	Very high	93	Very high	131 Å²	131	44 Å²	44	57%	0.57	24%	0.237	S	C	*	.			trans	-85.1	108.9	168.6	-179.7	169.8	-179.6	175.9	0	110.6	F351 N544	F351-K380 HydrophobicContact CD1-CB 3.94Å; F351-K380 HydrophobicContact CD1-CG 4.05Å; F351-K380 HydrophobicContact CE1-CB 4.19Å; F351-K380 HydrophobicContact CE1-CD 4.13Å; F351-K380 HydrophobicContact CE1-CG 3.79Å; K380-N544 PolarHBondContact O-ND2 3.25Å
381	L	93.1	Very high	93.1	Very high	12 Å²	12	41 Å²	41	6%	0.063	22%	0.22	C	C	.	.			trans	-95.2	127.2	172.2	-54.9	-172.7	0	0	0	109	D350 R379 V383 L387 F540	D350-L381 HydrophobicContact CB-CB 4.08Å; D350-L381 HydrophobicContact CB-CD1 4.04Å; D350-L381 HydrophobicContact CB-CG 4Å; D350-L381 WeakPolarHBondContact OD1-CB 3.32Å; D350-L381 PolarHBondContact OD1-N 3.26Å; R379-L381 PolarHBondContact O-N 3.36Å; L381-V383 VanDerWaalsContact C-N 3.31Å; L381-L387 HydrophobicContact CD1-CD2 3.94Å; L381-L387 HydrophobicContact CD1-CG 3.97Å; L381-L387 HydrophobicContact CD2-CD2 3.91Å; L381-L387 HydrophobicContact CD2-CG 4.28Å; L381-F540 HydrophobicContact CD2-CE2 3.86Å; L381-F540 HydrophobicContact CD2-CZ 4.03Å
382	N	92.1	Very high	93.2	Very high	42 Å²	42	34.4 Å²	34.4	23%	0.225	20%	0.198	C	C	.	.	S	Bend	trans	-77	-22.7	176.8	-70.9	-20.6	0	0	0	111.7	R438 N544 A547 V548	N382-R438 PolarHBondContact O-NH2 3.07Å; N382-N544 WeakPolarHBondContact CB-OD1 3.5Å; N382-N544 PolarHBondContact N-OD1 3.22Å; N382-N544 PolarHBondContact ND2-O 3.19Å; N382-N544 PolarHBondContact ND2-OD1 3.3Å; N382-A547 HydrophobicContact CB-CB 3.84Å; N382-V548 WeakPolarHBondContact ND2-CG2 3.34Å
383	V	92.7	Very high	93	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.042	21%	0.208	C	C	.	.	S	Bend	trans	-145.8	141.2	175.9	67.6	0	0	0	0	110.1	L381 I414 R438 L439 C442 F543 A547	L381-V383 VanDerWaalsContact C-N 3.31Å; V383-I414 HydrophobicContact CG1-CD1 4.12Å; V383-R438 HydrophobicContact CG2-CB 4.19Å; V383-L439 HydrophobicContact CG2-CD2 3.93Å; V383-L439 HydrophobicContact CG2-CG 4.08Å; V383-C442 HydrophobicContact CG1-CB 3.63Å; V383-C442 HydrophobicContact CG2-CB 4.41Å; V383-F543 HydrophobicContact CG1-CE1 4.4Å; V383-F543 HydrophobicContact CG1-CE2 3.85Å; V383-F543 HydrophobicContact CG1-CZ 3.48Å; V383-F543 VanDerWaalsContact CG1-CZ 3.48Å; V383-A547 HydrophobicContact CB-CB 3.92Å; V383-A547 HydrophobicContact CG1-CB 3.33Å
384	G	93.8	Very high	92.8	Very high	7 Å²	7	36.5 Å²	36.5	7%	0.072	19%	0.19	C	C	.	.			trans	76.6	159.9	-174.3	0	0	0	0	0	113.4
385	D	94.5	Very high	92.2	Very high	24 Å²	24	39.3 Å²	39.3	13%	0.128	22%	0.215	C	C	.	.	S	Bend	trans	-100.8	-30.5	-179.7	-60.7	-48.3	0	0	0	111.8	D350 E353 I415 R417	D350-D385 PolarHBondContact N-O 2.98Å; E353-D385 HydrophobicContact CG-CB 3.97Å; D385-I415 PolarHBondContact N-O 3.36Å; D385-R417 HydrophobicContact CB-CB 4.39Å; D385-R417 PolarHBondContact OD2-N 3.43Å
386	F	96.9	Very high	91.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	146.7	175.1	-45.8	-90.4	0	0	0	111.6	L347 C348 V349 E353 L365 I415 R417 L496	L347-F386 HydrophobicContact CD1-CB 4.2Å; L347-F386 HydrophobicContact CD1-CD1 4.49Å; C348-F386 WeakPolarHBondContact O-CA 3.42Å; V349-F386 HydrophobicContact CB-CD1 4.26Å; V349-F386 HydrophobicContact CB-CE1 4.27Å; V349-F386 HydrophobicContact CG1-CD1 4.1Å; V349-F386 HydrophobicContact CG1-CE1 3.65Å; V349-F386 HydrophobicContact CG2-CD1 3.96Å; V349-F386 HydrophobicContact CG2-CE1 4.07Å; E353-F386 HydrophobicContact CB-CZ 4.37Å; E353-F386 HydrophobicContact CG-CE2 4.48Å; E353-F386 HydrophobicContact CG-CZ 4.1Å; L365-F386 HydrophobicContact CD2-CE1 3.85Å; L365-F386 HydrophobicContact CD2-CZ 3.66Å; F386-I415 HydrophobicContact CB-CB 4.08Å; F386-I415 HydrophobicContact CB-CD1 4.48Å; F386-I415 HydrophobicContact CD2-CB 4.13Å; F386-I415 HydrophobicContact CD2-CG2 3.9Å; F386-I415 PolarHBondContact N-O 3.31Å; F386-I415 VanDerWaalsContact N-O 3.12Å; F386-I415 PolarHBondContact O-N 3.04Å; F386-R417 HydrophobicContact CD2-CB 4.47Å; F386-R417 HydrophobicContact CE2-CB 3.79Å; F386-L496 HydrophobicContact CB-CD2 4.12Å; F386-L496 HydrophobicContact CD1-CD1 3.79Å; F386-L496 HydrophobicContact CD1-CD2 4.25Å; F386-L496 HydrophobicContact CD2-CD1 4.41Å; F386-L496 HydrophobicContact CD2-CD2 4.24Å; F386-L496 HydrophobicContact CE1-CD1 3.64Å; F386-L496 HydrophobicContact CE2-CD1 4.3Å; F386-L496 HydrophobicContact CG-CD1 4.18Å; F386-L496 HydrophobicContact CG-CD2 3.93Å; F386-L496 HydrophobicContact CZ-CD1 3.94Å
387	L	97.1	Very high	90.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	175.2	171	57.7	82	0	0	0	109.8	C348 L381 V389 V410 F540 F543	C348-L387 HydrophobicContact CB-CD1 3.59Å; C348-L387 HydrophobicContact CB-CG 4.11Å; C348-L387 PolarHBondContact N-O 3.07Å; C348-L387 PolarHBondContact O-N 3.31Å; C348-L387 VanDerWaalsContact O-N 3.15Å; L381-L387 HydrophobicContact CD1-CD2 3.94Å; L381-L387 HydrophobicContact CD1-CG 3.97Å; L381-L387 HydrophobicContact CD2-CD2 3.91Å; L381-L387 HydrophobicContact CD2-CG 4.28Å; L387-V389 HydrophobicContact CD1-CG1 3.74Å; L387-V410 HydrophobicContact CD1-CG2 4.01Å; L387-V410 HydrophobicContact CD2-CG2 4.37Å; L387-F540 HydrophobicContact CD1-CD2 4.41Å; L387-F540 HydrophobicContact CD1-CE2 4.28Å; L387-F543 HydrophobicContact CD2-CD1 4.19Å; L387-F543 HydrophobicContact CD2-CE1 3.35Å; L387-F543 HydrophobicContact CD2-CZ 3.75Å
388	W	97.3	Very high	90	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.6	176.1	-68.5	-93.5	0	0	0	111.5	V345 I346 L347 L411 I415 L496 M499 T500 L503	V345-W388 HydrophobicContact CG1-CB 4.09Å; V345-W388 HydrophobicContact CG1-CG 4.33Å; I346-W388 WeakPolarHBondContact O-CA 3.38Å; L347-W388 HydrophobicContact CD1-CD2 4.39Å; L347-W388 HydrophobicContact CD1-CZ2 3.98Å; W388-L411 HydrophobicContact CB-CB 4.21Å; W388-L411 HydrophobicContact CB-CD2 3.99Å; W388-L411 HydrophobicContact CB-CG 4.49Å; W388-L411 PolarHBondContact O-N 3.36Å; W388-I415 HydrophobicContact CH2-CD1 3.46Å; W388-I415 VanDerWaalsContact CH2-CD1 3.46Å; W388-I415 HydrophobicContact CH2-CG1 4.31Å; W388-I415 HydrophobicContact CZ3-CD1 3.9Å; W388-I415 HydrophobicContact CZ3-CG1 4.26Å; W388-L496 HydrophobicContact CH2-CD2 4.42Å; W388-L496 HydrophobicContact CZ2-CD2 4.44Å; W388-M499 HydrophobicContact CH2-CB 3.8Å; W388-M499 HydrophobicContact CH2-CE 4.19Å; W388-M499 HydrophobicContact CH2-CG 4.38Å; W388-M499 HydrophobicContact CZ2-CB 3.55Å; W388-T500 PolarHBondContact NE1-OG1 3.13Å; W388-L503 HydrophobicContact CB-CD1 4.28Å; W388-L503 HydrophobicContact CD2-CD1 3.4Å; W388-L503 VanDerWaalsContact CD2-CD1 3.4Å; W388-L503 HydrophobicContact CE3-CD1 3.69Å; W388-L503 HydrophobicContact CG-CD1 3.68Å; W388-L503 HydrophobicContact CH2-CD1 4.4Å; W388-L503 HydrophobicContact CZ2-CD1 4.21Å; W388-L503 HydrophobicContact CZ3-CD1 4.18Å
389	V	95.8	Very high	89.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.9	173.5	-61.4	0	0	0	0	110.4	V345 I346 C348 L387 L409 V410 F540	V345-V389 WeakPolarHBondContact CA-O 3.47Å; I346-V389 HydrophobicContact CB-CG2 4.27Å; I346-V389 PolarHBondContact N-O 3.03Å; I346-V389 PolarHBondContact O-N 3.33Å; C348-V389 VanDerWaalsContact SG-CG2 3.59Å; L387-V389 HydrophobicContact CD1-CG1 3.74Å; V389-L409 CarbonylContact C-O 3.59Å; V389-L409 VanDerWaalsContact CA-O 3.29Å; V389-L409 WeakPolarHBondContact CA-O 3.42Å; V389-V410 HydrophobicContact CG1-CB 4.46Å; V389-F540 HydrophobicContact CG1-CB 4.33Å; V389-F540 HydrophobicContact CG1-CD2 3.77Å; V389-F540 HydrophobicContact CG1-CG 4.3Å
390	A	95	Very high	88.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	106.5	163.5	0	0	0	0	0	108.2	L338 Y343 D344 E408 L409 L411 L512	L338-A390 HydrophobicContact CD1-CB 4.26Å; Y343-A390 HydrophobicContact CD2-CB 3.73Å; Y343-A390 HydrophobicContact CE2-CB 4.17Å; Y343-A390 HydrophobicContact CG-CB 4.34Å; D344-A390 CarbonylContact O-C 3.58Å; D344-A390 WeakPolarHBondContact O-CA 3.49Å; A390-E408 WeakPolarHBondContact O-CA 3.39Å; A390-L409 HydrophobicContact CB-CB 4.5Å; A390-L409 PolarHBondContact N-O 2.98Å; A390-L409 PolarHBondContact O-N 3.36Å; A390-L411 HydrophobicContact CB-CD1 4.05Å; A390-L512 HydrophobicContact CB-CD1 3.25Å
391	R	93.1	Very high	87.3	Confident	56 Å²	56	53.9 Å²	53.9	21%	0.211	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.8	179.8	177.7	179	-62.1	144.4	27.1	110.3	Y343 D344 I346 D377 E408	Y343-R391 CarbonylContact C-O 3.52Å; Y343-R391 WeakPolarHBondContact CA-O 3.44Å; Y343-R391 VanDerWaalsContact CB-O 3.25Å; Y343-R391 WeakPolarHBondContact CB-O 3.27Å; D344-R391 PolarHBondContact N-O 2.76Å; D344-R391 PolarHBondContact O-N 3.36Å; I346-R391 HydrophobicContact CD1-CB 3.86Å; I346-R391 HydrophobicContact CD1-CG 4.41Å; I346-R391 VanDerWaalsContact CD1-CZ 3.46Å; D377-R391 IonicContact OD1-CZ 2.68Å; D377-R391 IonicContact OD1-NH1 3.31Å; D377-R391 PolarHBondContact OD1-NH1 2.6Å; D377-R391 IonicContact OD1-NH2 3.53Å; D377-R391 PolarHBondContact OD1-NH2 2.93Å; D377-R391 IonicContact OD2-CZ 2.67Å; D377-R391 VanDerWaalsContact OD2-CZ 3.25Å; D377-R391 IonicContact OD2-NH1 3Å; D377-R391 PolarHBondContact OD2-NH1 3.39Å; D377-R391 VanDerWaalsContact OD2-NH1 3.15Å; D377-R391 IonicContact OD2-NH2 3.55Å; D377-R391 PolarHBondContact OD2-NH2 3.05Å; R391-E408 HydrophobicContact CB-CG 4.28Å; R391-E408 HydrophobicContact CG-CG 4.24Å; R391-E408 IonicContact CZ-OE1 3.92Å; R391-E408 VanDerWaalsContact CZ-OE1 3.31Å; R391-E408 IonicContact NE-OE1 3.22Å; R391-E408 PolarHBondContact NE-OE1 3Å; R391-E408 IonicContact NH2-OE1 2.68Å; R391-E408 PolarHBondContact NH2-OE1 3.11Å
392	E	92.5	Very high	86.1	Confident	63 Å²	63	63.9 Å²	63.9	29%	0.294	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	136	172.8	-174	177.2	-159.4	0	0	112.1	L338 V394 R407	L338-E392 HydrophobicContact CD2-CB 3.96Å; L338-E392 HydrophobicContact CD2-CG 4.17Å; E392-V394 HydrophobicContact CB-CG2 4.46Å; E392-V394 HydrophobicContact CG-CG2 4.17Å; E392-V394 PolarHBondContact O-N 2.91Å; E392-R407 HydrophobicContact CB-CB 4.32Å; E392-R407 WeakPolarHBondContact CB-O 3.44Å; E392-R407 PolarHBondContact N-O 3.06Å; E392-R407 WeakPolarHBondContact OE2-CB 3.44Å; E392-R407 VanDerWaalsContact OE2-CG 3.29Å; E392-R407 WeakPolarHBondContact OE2-CG 3.09Å; E392-R407 PolarHBondContact OE2-N 3.49Å
393	K	88.9	Confident	84.9	Confident	107 Å²	107	65.3 Å²	65.3	47%	0.465	38%	0.377	S	S	.	.			trans	-78.6	101.3	172.8	-70.7	176.7	179.4	162.7	0	109.2	G341 T342 D344	G341-K393 WeakPolarHBondContact O-CD 3.49Å; G341-K393 PolarHBondContact O-NZ 3.36Å; T342-K393 PolarHBondContact O-N 3.36Å; D344-K393 WeakPolarHBondContact OD1-CE 3.44Å; D344-K393 IonicContact OD1-NZ 2.86Å; D344-K393 PolarHBondContact OD1-NZ 3.2Å; D344-K393 WeakPolarHBondContact OD2-CE 3.24Å; D344-K393 IonicContact OD2-NZ 3.75Å
394	V	84.8	Confident	84	Confident	54 Å²	54	67.2 Å²	67.2	33%	0.327	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-99.7	122	177.5	-173.3	0	0	0	0	109.7	E392 P404	E392-V394 HydrophobicContact CB-CG2 4.46Å; E392-V394 HydrophobicContact CG-CG2 4.17Å; E392-V394 PolarHBondContact O-N 2.91Å; V394-P404 HydrophobicContact CG1-CB 3.91Å; V394-P404 HydrophobicContact CG1-CG 3.55Å
395	A	78.5	Confident	83.1	Confident	73 Å²	73	71.8 Å²	71.8	60%	0.603	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-72.9	141.6	171.2	0	0	0	0	0	110.2	V397	A395-V397 PolarHBondContact O-N 3.06Å
396	P	77.3	Confident	82.4	Confident	111 Å²	111	71.6 Å²	71.6	72%	0.721	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-56.3	124.6	172.8	-23.3	33.3	0	0	0	110.7
397	V	77.3	Confident	82	Confident	69 Å²	69	74.9 Å²	74.9	42%	0.418	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-86.5	122.3	177.4	-177.2	0	0	0	0	108.5	A395 G399 Q400 P404	A395-V397 PolarHBondContact O-N 3.06Å; V397-G399 PolarHBondContact O-N 3.26Å; V397-Q400 HydrophobicContact CB-CG 4.28Å; V397-Q400 HydrophobicContact CG1-CG 4.46Å; V397-Q400 PolarHBondContact O-N 2.95Å; V397-P404 HydrophobicContact CG2-CG 3.98Å
398	P	73.6	Confident	81.9	Confident	126 Å²	126	76.7 Å²	76.7	82%	0.818	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	130.7	177	-24.5	33.7	0	0	0	111.3
399	G	74.8	Confident	81.7	Confident	88 Å²	88	76.8 Å²	76.8	91%	0.907	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	-5.1	179.5	0	0	0	0	0	115.7	V397	V397-G399 PolarHBondContact O-N 3.26Å
400	Q	76.3	Confident	81.6	Confident	107 Å²	107	76.8 Å²	76.8	50%	0.5	45%	0.452	S	S	.	.			trans	-92.7	130.6	170.4	-69	-173.3	-15.8	0	0	111.6	V397 R402	V397-Q400 HydrophobicContact CB-CG 4.28Å; V397-Q400 HydrophobicContact CG1-CG 4.46Å; V397-Q400 PolarHBondContact O-N 2.95Å; Q400-R402 WeakPolarHBondContact CB-O 3.36Å; Q400-R402 PolarHBondContact O-N 3.24Å
401	L	69.1	Low	81.6	Confident	186 Å²	186	76.8 Å²	76.8	97%	0.974	45%	0.452	S	S	*	.	S	Bend	trans	-65.7	-20.3	177.1	-73.9	166.6	0	0	0	113.3
402	R	67.7	Low	81.6	Confident	222 Å²	222	74.7 Å²	74.7	84%	0.838	44%	0.444	S	S	*	.	S	Bend	trans	-139.1	140.5	177.7	-65.7	-176.3	-179.8	176	0.4	108.9	Q400	Q400-R402 WeakPolarHBondContact CB-O 3.36Å; Q400-R402 PolarHBondContact O-N 3.24Å
403	A	66.1	Low	81.7	Confident	71 Å²	71	73.5 Å²	73.5	59%	0.587	44%	0.437	S	S	*	.			trans	-56.8	141	171.2	0	0	0	0	0	109.9	A405	A403-A405 PolarHBondContact O-N 3.05Å
404	P	73	Confident	82.1	Confident	47 Å²	47	68.4 Å²	68.4	31%	0.305	42%	0.415	S	S	.	.			trans	-59	141.3	175.2	-8.5	16.7	0	0	0	110.1	V394 V397 G406	V394-P404 HydrophobicContact CG1-CB 3.91Å; V394-P404 HydrophobicContact CG1-CG 3.55Å; V397-P404 HydrophobicContact CG2-CG 3.98Å; P404-G406 PolarHBondContact O-N 3.33Å; P404-G406 VanDerWaalsContact O-N 3.11Å
405	A	74.9	Confident	82.7	Confident	104 Å²	104	65.8 Å²	65.8	86%	0.86	40%	0.4	S	S	*	.			trans	-66.9	112.3	170.8	0	0	0	0	0	108.6	A403	A403-A405 PolarHBondContact O-N 3.05Å
406	G	81.2	Confident	83.5	Confident	20 Å²	20	63 Å²	63	21%	0.206	37%	0.374	C	S	.	.			trans	-62.7	152.6	174.2	0	0	0	0	0	111.7	P404	P404-G406 PolarHBondContact O-N 3.33Å; P404-G406 VanDerWaalsContact O-N 3.11Å
407	R	88.5	Confident	84.3	Confident	69 Å²	69	58.9 Å²	58.9	26%	0.26	34%	0.344	S	S	.	.			trans	-65.2	143.3	174.8	-64.2	169.4	65.5	-141.2	-7.9	109.9	R335 D336 C337 L338 E392	R335-R407 PolarHBondContact O-NH1 2.96Å; R335-R407 VanDerWaalsContact O-NH1 3.1Å; R335-R407 PolarHBondContact O-NH2 3.33Å; D336-R407 VanDerWaalsContact CA-NH2 3.27Å; D336-R407 PolarHBondContact O-NH2 3.45Å; C337-R407 PolarHBondContact O-NH1 3.21Å; L338-R407 HydrophobicContact CD2-CB 4.33Å; E392-R407 HydrophobicContact CB-CB 4.32Å; E392-R407 WeakPolarHBondContact CB-O 3.44Å; E392-R407 PolarHBondContact N-O 3.06Å; E392-R407 WeakPolarHBondContact OE2-CB 3.44Å; E392-R407 VanDerWaalsContact OE2-CG 3.29Å; E392-R407 WeakPolarHBondContact OE2-CG 3.09Å; E392-R407 PolarHBondContact OE2-N 3.49Å
408	E	93.3	Very high	85	Confident	38 Å²	38	56.3 Å²	56.3	18%	0.178	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	120.7	-178.7	-65.3	-175.2	142.4	0	0	110.9	R379 A390 R391 S539 F540	R379-E408 IonicContact CZ-OE1 3.35Å; R379-E408 IonicContact CZ-OE2 3.2Å; R379-E408 VanDerWaalsContact NH1-CD 3.33Å; R379-E408 IonicContact NH1-OE1 3.08Å; R379-E408 PolarHBondContact NH1-OE1 3.15Å; R379-E408 IonicContact NH1-OE2 3.62Å; R379-E408 PolarHBondContact NH1-OE2 3.05Å; R379-E408 IonicContact NH2-OE1 2.74Å; R379-E408 PolarHBondContact NH2-OE1 2.99Å; R379-E408 IonicContact NH2-OE2 3.47Å; A390-E408 WeakPolarHBondContact O-CA 3.39Å; R391-E408 HydrophobicContact CB-CG 4.28Å; R391-E408 HydrophobicContact CG-CG 4.24Å; R391-E408 IonicContact CZ-OE1 3.92Å; R391-E408 VanDerWaalsContact CZ-OE1 3.31Å; R391-E408 IonicContact NE-OE1 3.22Å; R391-E408 PolarHBondContact NE-OE1 3Å; R391-E408 IonicContact NH2-OE1 2.68Å; R391-E408 PolarHBondContact NH2-OE1 3.11Å; E408-S539 WeakPolarHBondContact O-CA 3.38Å; E408-F540 HydrophobicContact CB-CB 4.02Å; E408-F540 PolarHBondContact O-N 3.12Å
409	L	93.6	Very high	85.8	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133	174.3	-56.9	-177.5	0	0	0	109.5	L338 V389 A390 L512 C514 L537 I538	L338-L409 HydrophobicContact CD1-CD1 3.81Å; L338-L409 HydrophobicContact CD1-CG 3.88Å; L338-L409 HydrophobicContact CG-CD1 4.03Å; L338-L409 HydrophobicContact CG-CG 4.48Å; V389-L409 CarbonylContact C-O 3.59Å; V389-L409 VanDerWaalsContact CA-O 3.29Å; V389-L409 WeakPolarHBondContact CA-O 3.42Å; A390-L409 HydrophobicContact CB-CB 4.5Å; A390-L409 PolarHBondContact N-O 2.98Å; A390-L409 PolarHBondContact O-N 3.36Å; L409-L512 HydrophobicContact CD1-CB 3.77Å; L409-C514 HydrophobicContact CD1-CB 4.48Å; L409-C514 HydrophobicContact CD2-CB 3.67Å; L409-C514 VanDerWaalsContact CD2-SG 3.57Å; L409-L537 HydrophobicContact CB-CB 4.01Å; L409-L537 HydrophobicContact CB-CD1 4.15Å; L409-L537 HydrophobicContact CD1-CB 4.5Å; L409-I538 WeakPolarHBondContact CA-O 3.23Å
410	V	95.1	Very high	86.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.2	179.2	58.8	0	0	0	0	110.5	L387 V389 L444 I538 F543	L387-V410 HydrophobicContact CD1-CG2 4.01Å; L387-V410 HydrophobicContact CD2-CG2 4.37Å; V389-V410 HydrophobicContact CG1-CB 4.46Å; V410-L444 HydrophobicContact CG1-CD2 3.86Å; V410-L444 HydrophobicContact CG2-CD1 3.93Å; V410-L444 HydrophobicContact CG2-CD2 4Å; V410-I538 HydrophobicContact CG1-CD1 4.09Å; V410-I538 HydrophobicContact CG1-CG1 3.37Å; V410-I538 WeakPolarHBondContact CG1-O 3.34Å; V410-I538 PolarHBondContact N-O 3.15Å; V410-F543 HydrophobicContact CG1-CB 3.75Å; V410-F543 HydrophobicContact CG1-CG 4.07Å
411	L	94.6	Very high	86.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	157.2	174.4	-83.5	64.5	0	0	0	110.2	V345 W388 A390 Y413 L503 Y507 L537	V345-L411 HydrophobicContact CG1-CD2 4.04Å; W388-L411 HydrophobicContact CB-CB 4.21Å; W388-L411 HydrophobicContact CB-CD2 3.99Å; W388-L411 HydrophobicContact CB-CG 4.49Å; W388-L411 PolarHBondContact O-N 3.36Å; A390-L411 HydrophobicContact CB-CD1 4.05Å; L411-Y413 HydrophobicContact CB-CD2 4.33Å; L411-Y413 PolarHBondContact O-N 2.67Å; L411-L503 HydrophobicContact CD2-CB 4.25Å; L411-L503 HydrophobicContact CD2-CD1 4.21Å; L411-L503 HydrophobicContact CD2-CD2 4.37Å; L411-Y507 HydrophobicContact CD2-CD2 3.71Å; L411-Y507 HydrophobicContact CD2-CE2 3.42Å; L411-Y507 VanDerWaalsContact CD2-CE2 3.42Å; L411-Y507 HydrophobicContact CG-CD2 4.42Å; L411-Y507 HydrophobicContact CG-CE2 3.92Å; L411-L537 HydrophobicContact CD1-CD1 4.21Å; L411-L537 HydrophobicContact CG-CD1 4.49Å
412	D	92.6	Very high	87.8	Confident	11 Å²	11	42 Å²	42	6%	0.059	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	-8.6	-178.9	-76.3	-48.3	0	0	0	115.8	R445 R446 S534	D412-R445 HydrophobicContact CB-CB 4.49Å; D412-R445 VanDerWaalsContact CG-NE 3.31Å; D412-R445 IonicContact OD1-CZ 2.81Å; D412-R445 VanDerWaalsContact OD1-CZ 3.24Å; D412-R445 IonicContact OD1-NE 2.65Å; D412-R445 PolarHBondContact OD1-NE 3.3Å; D412-R445 IonicContact OD1-NH2 3.25Å; D412-R445 PolarHBondContact OD1-NH2 3.04Å; D412-R445 IonicContact OD2-CZ 3.24Å; D412-R445 IonicContact OD2-NE 3.48Å; D412-R445 PolarHBondContact OD2-NE 2.94Å; D412-R445 IonicContact OD2-NH2 3.72Å; D412-R445 PolarHBondContact OD2-NH2 3.29Å; D412-R446 HydrophobicContact CB-CB 4.39Å; D412-R446 HydrophobicContact CB-CG 4.09Å; D412-R446 CarbonylContact O-C 3.47Å; D412-R446 WeakPolarHBondContact O-CA 3.33Å; D412-R446 WeakPolarHBondContact O-CB 3.44Å; D412-R446 PolarHBondContact O-N 3.24Å; D412-S534 WeakPolarHBondContact OD2-CB 3.27Å
413	Y	95.1	Very high	88.9	Confident	38 Å²	38	31.4 Å²	31.4	15%	0.149	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.2	-174.2	-58.2	-87.9	0	0	0	110.8	L411 R446 I448 M499 L503	L411-Y413 HydrophobicContact CB-CD2 4.33Å; L411-Y413 PolarHBondContact O-N 2.67Å; Y413-R446 HydrophobicContact CD1-CB 3.62Å; Y413-R446 HydrophobicContact CD1-CG 4.15Å; Y413-R446 HydrophobicContact CE1-CB 3.92Å; Y413-R446 HydrophobicContact CE1-CG 3.95Å; Y413-R446 HydrophobicContact CG-CB 4.21Å; Y413-I448 HydrophobicContact CD1-CD1 4.22Å; Y413-M499 HydrophobicContact CD1-CE 4.32Å; Y413-L503 HydrophobicContact CD2-CD1 4.1Å; Y413-L503 HydrophobicContact CD2-CD2 3.56Å; Y413-L503 HydrophobicContact CE2-CD2 3.33Å; Y413-L503 HydrophobicContact CG-CD1 4.38Å; Y413-L503 HydrophobicContact CG-CD2 4.3Å
414	I	96.5	Very high	90	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	135.1	176	-176.3	165.7	0	0	0	109.4	V383 L439 L444 R446 P447 I448 F543	V383-I414 HydrophobicContact CG1-CD1 4.12Å; I414-L439 HydrophobicContact CD1-CD2 3.7Å; I414-L439 HydrophobicContact CG1-CD2 3.98Å; I414-L439 HydrophobicContact CG2-CD2 4.31Å; I414-L444 HydrophobicContact CB-CB 4.45Å; I414-L444 HydrophobicContact CB-CD1 3.73Å; I414-L444 HydrophobicContact CD1-CD1 4.01Å; I414-L444 HydrophobicContact CG1-CD1 4.38Å; I414-L444 HydrophobicContact CG2-CB 3.99Å; I414-L444 HydrophobicContact CG2-CD1 4.17Å; I414-R446 PolarHBondContact N-O 2.63Å; I414-P447 HydrophobicContact CG2-CB 4.16Å; I414-P447 CarbonylContact O-C 3.59Å; I414-I448 PolarHBondContact O-N 3.35Å; I414-F543 HydrophobicContact CD1-CE2 4.36Å; I414-F543 HydrophobicContact CD1-CZ 3.95Å
415	I	97.5	Very high	90.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.5	178.6	-64.5	169.4	0	0	0	109.4	D385 F386 W388 I448 L450 Y495 L496	D385-I415 PolarHBondContact N-O 3.36Å; F386-I415 HydrophobicContact CB-CB 4.08Å; F386-I415 HydrophobicContact CB-CD1 4.48Å; F386-I415 HydrophobicContact CD2-CB 4.13Å; F386-I415 HydrophobicContact CD2-CG2 3.9Å; F386-I415 PolarHBondContact N-O 3.31Å; F386-I415 VanDerWaalsContact N-O 3.12Å; F386-I415 PolarHBondContact O-N 3.04Å; W388-I415 HydrophobicContact CH2-CD1 3.46Å; W388-I415 VanDerWaalsContact CH2-CD1 3.46Å; W388-I415 HydrophobicContact CH2-CG1 4.31Å; W388-I415 HydrophobicContact CZ3-CD1 3.9Å; W388-I415 HydrophobicContact CZ3-CG1 4.26Å; I415-I448 CarbonylContact C-O 3.43Å; I415-I448 WeakPolarHBondContact CA-O 3.42Å; I415-I448 HydrophobicContact CB-CB 4.5Å; I415-I448 HydrophobicContact CG1-CB 3.74Å; I415-I448 HydrophobicContact CG1-CD1 4.01Å; I415-I448 HydrophobicContact CG1-CG1 4.48Å; I415-I448 HydrophobicContact CG1-CG2 3.83Å; I415-L450 HydrophobicContact CG2-CB 3.63Å; I415-L450 HydrophobicContact CG2-CD2 4.27Å; I415-Y495 HydrophobicContact CD1-CE1 4.05Å; I415-L496 HydrophobicContact CD1-CD2 3.44Å; I415-L496 VanDerWaalsContact CD1-CD2 3.44Å
416	E	96.4	Very high	91.4	Very high	15 Å²	15	22.5 Å²	22.5	7%	0.07	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116.9	159.5	-173.4	89.2	173.3	0	0	107.8	L439 I448 Y449 L450	E416-L439 HydrophobicContact CB-CD1 3.69Å; E416-L439 HydrophobicContact CG-CD1 4.03Å; E416-I448 PolarHBondContact N-O 2.98Å; E416-Y449 HydrophobicContact CB-CD2 4.03Å; E416-Y449 HydrophobicContact CB-CE2 4.18Å; E416-Y449 HydrophobicContact CG-CD2 4.3Å; E416-Y449 HydrophobicContact CG-CE2 3.92Å; E416-L450 PolarHBondContact O-N 3.01Å
417	R	93.9	Very high	91.8	Very high	24 Å²	24	23.7 Å²	23.7	9%	0.091	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	128.9	175.4	175	176.5	169.6	-94.9	9.7	109.3	E353 D385 F386 L450 E452	E353-R417 IonicContact OE1-NH1 3.63Å; E353-R417 IonicContact OE2-CZ 3.12Å; E353-R417 IonicContact OE2-NE 3.65Å; E353-R417 IonicContact OE2-NH1 2.67Å; E353-R417 PolarHBondContact OE2-NH1 3.24Å; D385-R417 HydrophobicContact CB-CB 4.39Å; D385-R417 PolarHBondContact OD2-N 3.43Å; F386-R417 HydrophobicContact CD2-CB 4.47Å; F386-R417 HydrophobicContact CE2-CB 3.79Å; R417-L450 CarbonylContact C-O 3.4Å; R417-L450 WeakPolarHBondContact CA-O 3.13Å; R417-L450 HydrophobicContact CB-CB 4.48Å; R417-L450 HydrophobicContact CB-CD2 4.48Å; R417-L450 HydrophobicContact CG-CD2 4.43Å; R417-E452 IonicContact CZ-OE1 3.12Å; R417-E452 IonicContact CZ-OE2 3.11Å; R417-E452 IonicContact NE-OE2 3.39Å; R417-E452 PolarHBondContact NE-OE2 3.44Å; R417-E452 IonicContact NH2-OE1 3.82Å; R417-E452 PolarHBondContact NH2-OE1 3.18Å; R417-E452 IonicContact NH2-OE2 3.78Å; R417-E452 PolarHBondContact NH2-OE2 3.48Å
418	K	92.2	Very high	91.6	Very high	14 Å²	14	25.3 Å²	25.3	6%	0.061	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	116.3	179.9	-148.2	77.9	-180	-179	0	111	D422 L423 S426 Y449 L450 V451 E452	K418-D422 WeakPolarHBondContact CE-O 3.45Å; K418-L423 HydrophobicContact CG-CB 3.8Å; K418-L423 HydrophobicContact CG-CD1 4.29Å; K418-S426 WeakPolarHBondContact CE-OG 3.3Å; K418-S426 PolarHBondContact NZ-OG 2.85Å; K418-Y449 HydrophobicContact CB-CE1 3.71Å; K418-Y449 WeakPolarHBondContact CD-OH 3.31Å; K418-Y449 HydrophobicContact CG-CE1 4.3Å; K418-Y449 VanDerWaalsContact CG-OH 3.31Å; K418-Y449 WeakPolarHBondContact CG-OH 3.49Å; K418-L450 PolarHBondContact N-O 3.27Å; K418-V451 WeakPolarHBondContact O-CA 3.44Å; K418-E452 PolarHBondContact O-N 3.18Å
419	R	88.9	Confident	91.1	Very high	54 Å²	54	27 Å²	27	20%	0.204	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	154.4	168.3	-59.1	170.2	58.3	-118.3	-11.8	109.6	D421 D422 L423 E452	R419-D421 VanDerWaalsContact C-N 3.29Å; R419-D421 WeakPolarHBondContact CB-OD1 3.48Å; R419-D421 IonicContact CZ-OD1 3.6Å; R419-D421 IonicContact CZ-OD2 3.95Å; R419-D421 IonicContact NE-OD1 3.99Å; R419-D421 IonicContact NH1-OD1 2.7Å; R419-D421 PolarHBondContact NH1-OD1 3.36Å; R419-D421 IonicContact NH1-OD2 3.35Å; R419-D421 PolarHBondContact NH1-OD2 2.85Å; R419-D421 VanDerWaalsContact NH2-CG 3.3Å; R419-D421 IonicContact NH2-OD1 2.66Å; R419-D421 PolarHBondContact NH2-OD1 3.22Å; R419-D421 IonicContact NH2-OD2 2.68Å; R419-D421 PolarHBondContact NH2-OD2 3.46Å; R419-D421 PolarHBondContact O-N 3.08Å; R419-D422 HydrophobicContact CB-CB 4.35Å; R419-D422 WeakPolarHBondContact CB-OD2 3.29Å; R419-D422 WeakPolarHBondContact CD-OD2 3.32Å; R419-D422 IonicContact NH1-OD2 3.48Å; R419-D422 PolarHBondContact NH1-OD2 3.12Å; R419-D422 PolarHBondContact O-N 2.92Å; R419-D422 VanDerWaalsContact O-N 3.14Å; R419-L423 WeakPolarHBondContact O-CB 3.34Å; R419-L423 PolarHBondContact O-N 2.89Å; R419-E452 WeakPolarHBondContact CA-O 3.48Å; R419-E452 HydrophobicContact CG-CB 4.33Å
420	M	87.9	Confident	90.4	Very high	12 Å²	12	29.1 Å²	29.1	6%	0.059	16%	0.163	C	C	.	.	H	α-helix	trans	-61.6	-35.6	-176.1	-158.9	63.1	73.2	0	0	113.4	L423 C424 V451 E452 L461 L468 I472	M420-L423 HydrophobicContact SD-CD2 4.03Å; M420-C424 WeakPolarHBondContact O-CB 3.39Å; M420-C424 PolarHBondContact O-N 2.7Å; M420-V451 HydrophobicContact CE-CG1 3.96Å; M420-E452 PolarHBondContact N-O 3.42Å; M420-E452 VanDerWaalsContact N-O 3.07Å; M420-L461 HydrophobicContact CB-CD1 4.09Å; M420-L461 HydrophobicContact CG-CD1 3.39Å; M420-L468 HydrophobicContact CG-CD1 3.92Å; M420-L468 HydrophobicContact SD-CB 4.11Å; M420-L468 HydrophobicContact SD-CD1 3.85Å; M420-L468 HydrophobicContact SD-CG 4.45Å; M420-I472 HydrophobicContact CE-CD1 4.3Å
421	D	85.9	Confident	90.1	Very high	67 Å²	67	35.3 Å²	35.3	36%	0.358	19%	0.186	S	C	.	.	H	α-helix	trans	-67.1	-43.5	172.8	52.5	-33.7	0	0	0	112.5	R419 L423 C424 G425 L461	R419-D421 VanDerWaalsContact C-N 3.29Å; R419-D421 WeakPolarHBondContact CB-OD1 3.48Å; R419-D421 IonicContact CZ-OD1 3.6Å; R419-D421 IonicContact CZ-OD2 3.95Å; R419-D421 IonicContact NE-OD1 3.99Å; R419-D421 IonicContact NH1-OD1 2.7Å; R419-D421 PolarHBondContact NH1-OD1 3.36Å; R419-D421 IonicContact NH1-OD2 3.35Å; R419-D421 PolarHBondContact NH1-OD2 2.85Å; R419-D421 VanDerWaalsContact NH2-CG 3.3Å; R419-D421 IonicContact NH2-OD1 2.66Å; R419-D421 PolarHBondContact NH2-OD1 3.22Å; R419-D421 IonicContact NH2-OD2 2.68Å; R419-D421 PolarHBondContact NH2-OD2 3.46Å; R419-D421 PolarHBondContact O-N 3.08Å; D421-L423 VanDerWaalsContact C-N 3.33Å; D421-L423 PolarHBondContact O-N 2.71Å; D421-C424 WeakPolarHBondContact O-CB 3.38Å; D421-C424 PolarHBondContact O-N 3.44Å; D421-G425 PolarHBondContact O-N 3.43Å; D421-L461 HydrophobicContact CB-CD2 3.94Å
422	D	88.8	Confident	89.8	Confident	73 Å²	73	36.3 Å²	36.3	39%	0.39	19%	0.19	S	C	.	.	H	α-helix	trans	-67.2	-35	176.6	-66.2	-44.6	0	0	0	112	K418 R419 S426	K418-D422 WeakPolarHBondContact CE-O 3.45Å; R419-D422 HydrophobicContact CB-CB 4.35Å; R419-D422 WeakPolarHBondContact CB-OD2 3.29Å; R419-D422 WeakPolarHBondContact CD-OD2 3.32Å; R419-D422 IonicContact NH1-OD2 3.48Å; R419-D422 PolarHBondContact NH1-OD2 3.12Å; R419-D422 PolarHBondContact O-N 2.92Å; R419-D422 VanDerWaalsContact O-N 3.14Å; D422-S426 VanDerWaalsContact O-CB 3.27Å; D422-S426 WeakPolarHBondContact O-CB 3.29Å; D422-S426 PolarHBondContact O-N 3.18Å; D422-S426 PolarHBondContact O-OG 3.46Å
423	L	90.3	Very high	89.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-47.9	173.5	178.4	61.7	0	0	0	110.6	K418 R419 M420 D421 S426 I427 F432 L468 I472	K418-L423 HydrophobicContact CG-CB 3.8Å; K418-L423 HydrophobicContact CG-CD1 4.29Å; R419-L423 WeakPolarHBondContact O-CB 3.34Å; R419-L423 PolarHBondContact O-N 2.89Å; M420-L423 HydrophobicContact SD-CD2 4.03Å; D421-L423 VanDerWaalsContact C-N 3.33Å; D421-L423 PolarHBondContact O-N 2.71Å; L423-S426 PolarHBondContact O-N 3.28Å; L423-I427 HydrophobicContact CD1-CD1 4.05Å; L423-I427 HydrophobicContact CD1-CG1 4.39Å; L423-I427 HydrophobicContact CG-CD1 4.03Å; L423-I427 WeakPolarHBondContact O-CG1 3.02Å; L423-I427 PolarHBondContact O-N 2.81Å; L423-F432 HydrophobicContact CD1-CD2 3.76Å; L423-F432 HydrophobicContact CD1-CE2 3.58Å; L423-F432 HydrophobicContact CD1-CZ 4.3Å; L423-L468 HydrophobicContact CD2-CB 4.49Å; L423-L468 HydrophobicContact CD2-CD2 4.17Å; L423-L468 HydrophobicContact CG-CD2 4.1Å; L423-I472 HydrophobicContact CD2-CD1 4.04Å; L423-I472 HydrophobicContact CD2-CG1 3.84Å
424	C	89.8	Confident	89.2	Confident	4 Å²	4	47.4 Å²	47.4	3%	0.027	23%	0.234	C	C	.	.	H	α-helix	trans	-57.1	-51.2	176.5	-176.9	0	0	0	0	111.2	M420 D421 S426 I427 I428 L461 L468	M420-C424 WeakPolarHBondContact O-CB 3.39Å; M420-C424 PolarHBondContact O-N 2.7Å; D421-C424 WeakPolarHBondContact O-CB 3.38Å; D421-C424 PolarHBondContact O-N 3.44Å; C424-S426 VanDerWaalsContact C-N 3.31Å; C424-S426 PolarHBondContact O-N 2.87Å; C424-I427 PolarHBondContact O-N 2.7Å; C424-I428 WeakPolarHBondContact O-CG1 3.47Å; C424-I428 PolarHBondContact O-N 2.89Å; C424-L461 HydrophobicContact CB-CD2 4.33Å; C424-L468 HydrophobicContact CB-CD2 4.15Å
425	G	87.1	Confident	88.8	Confident	30 Å²	30	49.1 Å²	49.1	31%	0.309	24%	0.243	S	C	.	.	H	α-helix	trans	-56.8	-44.7	176.6	0	0	0	0	0	112.6	D421 I427 I428 D429	D421-G425 PolarHBondContact O-N 3.43Å; G425-I427 VanDerWaalsContact C-N 3.29Å; G425-I427 PolarHBondContact O-N 3.28Å; G425-I428 PolarHBondContact O-N 3.33Å; G425-D429 PolarHBondContact O-N 3.12Å; G425-D429 VanDerWaalsContact O-OD2 3.05Å
426	S	89.8	Confident	88.5	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.014	25%	0.245	C	C	.	.	H	α-helix	trans	-68	-26.2	-177.9	-56.4	0	0	0	0	113.8	K418 D422 L423 C424 D429 G430 R431 F432	K418-S426 WeakPolarHBondContact CE-OG 3.3Å; K418-S426 PolarHBondContact NZ-OG 2.85Å; D422-S426 VanDerWaalsContact O-CB 3.27Å; D422-S426 WeakPolarHBondContact O-CB 3.29Å; D422-S426 PolarHBondContact O-N 3.18Å; D422-S426 PolarHBondContact O-OG 3.46Å; L423-S426 PolarHBondContact O-N 3.28Å; C424-S426 VanDerWaalsContact C-N 3.31Å; C424-S426 PolarHBondContact O-N 2.87Å; S426-D429 VanDerWaalsContact C-OD1 3.3Å; S426-D429 WeakPolarHBondContact CA-OD1 3.38Å; S426-G430 CarbonylContact O-C 3.6Å; S426-G430 PolarHBondContact O-N 2.97Å; S426-R431 PolarHBondContact O-N 3.12Å; S426-R431 VanDerWaalsContact O-N 3.14Å; S426-F432 VanDerWaalsContact O-CB 3.23Å; S426-F432 WeakPolarHBondContact O-CB 2.86Å; S426-F432 PolarHBondContact O-N 2.81Å
427	I	89.2	Confident	88.1	Confident	45 Å²	45	54.6 Å²	54.6	23%	0.231	27%	0.266	C	S	.	.	H	α-helix	trans	-76	-42.1	174.8	-69.2	165	0	0	0	109.8	L423 C424 G425 G430 F432 L463 L468 A471	L423-I427 HydrophobicContact CD1-CD1 4.05Å; L423-I427 HydrophobicContact CD1-CG1 4.39Å; L423-I427 HydrophobicContact CG-CD1 4.03Å; L423-I427 WeakPolarHBondContact O-CG1 3.02Å; L423-I427 PolarHBondContact O-N 2.81Å; C424-I427 PolarHBondContact O-N 2.7Å; G425-I427 VanDerWaalsContact C-N 3.29Å; G425-I427 PolarHBondContact O-N 3.28Å; I427-G430 PolarHBondContact O-N 2.89Å; I427-F432 HydrophobicContact CG1-CB 4.09Å; I427-F432 HydrophobicContact CG1-CD1 4Å; I427-F432 HydrophobicContact CG1-CG 3.99Å; I427-L463 HydrophobicContact CB-CD1 3.73Å; I427-L463 HydrophobicContact CD1-CD1 4.18Å; I427-L463 HydrophobicContact CG2-CD1 3.59Å; I427-L468 HydrophobicContact CD1-CD2 3.87Å; I427-A471 HydrophobicContact CD1-CB 3.75Å
428	I	85.2	Confident	87.9	Confident	102 Å²	102	55.8 Å²	55.8	52%	0.523	27%	0.271	S	S	.	.	H	α-helix	trans	-66.8	-43.5	-178.7	-65.6	167.4	0	0	0	111.2	C424 G425 G430 L463	C424-I428 WeakPolarHBondContact O-CG1 3.47Å; C424-I428 PolarHBondContact O-N 2.89Å; G425-I428 PolarHBondContact O-N 3.33Å; I428-G430 VanDerWaalsContact C-N 3.31Å; I428-L463 HydrophobicContact CD1-CG 4.17Å; I428-L463 HydrophobicContact CG1-CD1 4.06Å; I428-L463 HydrophobicContact CG1-CD2 4.27Å; I428-L463 HydrophobicContact CG1-CG 4.1Å
429	D	82.5	Confident	87.9	Confident	74 Å²	74	55.2 Å²	55.2	40%	0.396	27%	0.268	S	S	.	.	S	Bend	trans	-83.3	-5.2	-178.3	64.7	30	0	0	0	114.2	G425 S426 R431	G425-D429 PolarHBondContact O-N 3.12Å; G425-D429 VanDerWaalsContact O-OD2 3.05Å; S426-D429 VanDerWaalsContact C-OD1 3.3Å; S426-D429 WeakPolarHBondContact CA-OD1 3.38Å; D429-R431 VanDerWaalsContact C-N 3.32Å; D429-R431 VanDerWaalsContact CG-NE 3.25Å; D429-R431 PolarHBondContact O-N 3.18Å; D429-R431 WeakPolarHBondContact OD1-CB 3.36Å; D429-R431 VanDerWaalsContact OD1-CG 3.26Å; D429-R431 WeakPolarHBondContact OD1-CG 3.44Å; D429-R431 PolarHBondContact OD1-N 3.4Å; D429-R431 IonicContact OD1-NE 2.6Å; D429-R431 PolarHBondContact OD1-NE 2.66Å; D429-R431 IonicContact OD2-CZ 3.93Å; D429-R431 IonicContact OD2-NE 2.67Å; D429-R431 PolarHBondContact OD2-NE 2.98Å; D429-R431 IonicContact OD2-NH2 2.7Å; D429-R431 PolarHBondContact OD2-NH2 2.75Å
430	G	80.1	Confident	87.9	Confident	46 Å²	46	57.3 Å²	57.3	47%	0.474	28%	0.279	S	S	.	.	S	Bend	trans	80.4	-1.5	179.6	0	0	0	0	0	115.8	S426 I427 I428 F432	S426-G430 CarbonylContact O-C 3.6Å; S426-G430 PolarHBondContact O-N 2.97Å; I427-G430 PolarHBondContact O-N 2.89Å; I428-G430 VanDerWaalsContact C-N 3.31Å; G430-F432 VanDerWaalsContact C-N 3.28Å; G430-F432 PolarHBondContact O-N 3.38Å
431	R	86.8	Confident	87.8	Confident	131 Å²	131	63.2 Å²	63.2	49%	0.494	30%	0.301	S	S	.	.	H	α-helix	trans	-68	-24.8	179.7	-67.2	-174.9	-69.2	171.6	-4	113.1	S426 D429 R433 E434 Q435	S426-R431 PolarHBondContact O-N 3.12Å; S426-R431 VanDerWaalsContact O-N 3.14Å; D429-R431 VanDerWaalsContact C-N 3.32Å; D429-R431 VanDerWaalsContact CG-NE 3.25Å; D429-R431 PolarHBondContact O-N 3.18Å; D429-R431 WeakPolarHBondContact OD1-CB 3.36Å; D429-R431 VanDerWaalsContact OD1-CG 3.26Å; D429-R431 WeakPolarHBondContact OD1-CG 3.44Å; D429-R431 PolarHBondContact OD1-N 3.4Å; D429-R431 IonicContact OD1-NE 2.6Å; D429-R431 PolarHBondContact OD1-NE 2.66Å; D429-R431 IonicContact OD2-CZ 3.93Å; D429-R431 IonicContact OD2-NE 2.67Å; D429-R431 PolarHBondContact OD2-NE 2.98Å; D429-R431 IonicContact OD2-NH2 2.7Å; D429-R431 PolarHBondContact OD2-NH2 2.75Å; R431-R433 VanDerWaalsContact C-N 3.29Å; R431-R433 PolarHBondContact O-N 3.38Å; R431-E434 PolarHBondContact O-N 3.06Å; R431-E434 VanDerWaalsContact O-N 3.12Å; R431-Q435 WeakPolarHBondContact O-CG 3.44Å; R431-Q435 PolarHBondContact O-N 2.84Å
432	F	89.6	Confident	87.8	Confident	20 Å²	20	60.1 Å²	60.1	9%	0.088	28%	0.284	C	S	.	.	H	α-helix	trans	-55.2	-40.6	-177.7	174.6	-117.5	0	0	0	113.5	L423 S426 I427 G430 K436 A471 T475	L423-F432 HydrophobicContact CD1-CD2 3.76Å; L423-F432 HydrophobicContact CD1-CE2 3.58Å; L423-F432 HydrophobicContact CD1-CZ 4.3Å; S426-F432 VanDerWaalsContact O-CB 3.23Å; S426-F432 WeakPolarHBondContact O-CB 2.86Å; S426-F432 PolarHBondContact O-N 2.81Å; I427-F432 HydrophobicContact CG1-CB 4.09Å; I427-F432 HydrophobicContact CG1-CD1 4Å; I427-F432 HydrophobicContact CG1-CG 3.99Å; G430-F432 VanDerWaalsContact C-N 3.28Å; G430-F432 PolarHBondContact O-N 3.38Å; F432-K436 HydrophobicContact CE2-CD 3.98Å; F432-K436 HydrophobicContact CZ-CD 4.04Å; F432-K436 VanDerWaalsContact CZ-CE 3.43Å; F432-K436 WeakPolarHBondContact O-CG 3.47Å; F432-K436 PolarHBondContact O-N 2.94Å; F432-A471 HydrophobicContact CE1-CB 3.99Å; F432-A471 HydrophobicContact CZ-CB 3.97Å; F432-T475 WeakPolarHBondContact CZ-OG1 3.44Å
433	R	86.9	Confident	87.6	Confident	207 Å²	207	57 Å²	57	78%	0.781	27%	0.269	S	S	*	.	H	α-helix	trans	-74.3	-39.6	178.2	-67.4	-178.9	-179.7	174.3	0.5	111.9	R431 F437	R431-R433 VanDerWaalsContact C-N 3.29Å; R431-R433 PolarHBondContact O-N 3.38Å; R433-F437 WeakPolarHBondContact O-CB 3.35Å; R433-F437 PolarHBondContact O-N 3.39Å
434	E	87	Confident	87.6	Confident	75 Å²	75	57.3 Å²	57.3	35%	0.35	27%	0.271	S	S	.	.	H	α-helix	trans	-63.7	-46.4	179	178.9	-112.1	148.5	0	0	111.6	R431 K436 F437 R438	R431-E434 PolarHBondContact O-N 3.06Å; R431-E434 VanDerWaalsContact O-N 3.12Å; E434-K436 PolarHBondContact O-N 2.95Å; E434-F437 WeakPolarHBondContact O-CB 3.28Å; E434-F437 PolarHBondContact O-N 2.88Å; E434-R438 WeakPolarHBondContact O-CG 3.43Å; E434-R438 PolarHBondContact O-N 2.86Å; E434-R438 WeakPolarHBondContact OE1-CD 3.06Å
435	Q	89.1	Confident	87.5	Confident	37 Å²	37	60.8 Å²	60.8	17%	0.173	28%	0.283	C	S	.	.	H	α-helix	trans	-57.7	-49.7	177.6	-71.3	-179.2	-42.6	0	0	111.8	R431 F437 R438 L439	R431-Q435 WeakPolarHBondContact O-CG 3.44Å; R431-Q435 PolarHBondContact O-N 2.84Å; Q435-F437 VanDerWaalsContact C-N 3.34Å; Q435-F437 PolarHBondContact O-N 3.45Å; Q435-R438 PolarHBondContact O-N 2.83Å; Q435-L439 PolarHBondContact O-N 3.06Å
436	K	90.9	Very high	87.7	Confident	12 Å²	12	65.4 Å²	65.4	5%	0.052	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-38.5	176.7	-68.7	-168.9	-65.5	176	0	112.9	F432 E434 R438 L439 K440 Y449 T475 D479 F481	F432-K436 HydrophobicContact CE2-CD 3.98Å; F432-K436 HydrophobicContact CZ-CD 4.04Å; F432-K436 VanDerWaalsContact CZ-CE 3.43Å; F432-K436 WeakPolarHBondContact O-CG 3.47Å; F432-K436 PolarHBondContact O-N 2.94Å; E434-K436 PolarHBondContact O-N 2.95Å; K436-R438 VanDerWaalsContact C-N 3.31Å; K436-R438 PolarHBondContact O-N 3.45Å; K436-L439 PolarHBondContact O-N 3.33Å; K436-K440 WeakPolarHBondContact O-CG 3.28Å; K436-K440 PolarHBondContact O-N 3.09Å; K436-Y449 HydrophobicContact CG-CE2 4.49Å; K436-T475 HydrophobicContact CD-CG2 3.76Å; K436-T475 PolarHBondContact NZ-OG1 3.43Å; K436-D479 WeakPolarHBondContact CE-OD2 3.36Å; K436-D479 IonicContact NZ-OD2 2.71Å; K436-D479 PolarHBondContact NZ-OD2 3.06Å; K436-F481 HydrophobicContact CB-CE2 4.34Å; K436-F481 HydrophobicContact CB-CZ 4.33Å; K436-F481 HydrophobicContact CG-CE2 4.13Å
437	F	88.6	Confident	88	Confident	117 Å²	117	66.2 Å²	66.2	51%	0.513	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-40.4	175.4	179.9	-100	0	0	0	111.9	R433 E434 Q435 K440 R441	R433-F437 WeakPolarHBondContact O-CB 3.35Å; R433-F437 PolarHBondContact O-N 3.39Å; E434-F437 WeakPolarHBondContact O-CB 3.28Å; E434-F437 PolarHBondContact O-N 2.88Å; Q435-F437 VanDerWaalsContact C-N 3.34Å; Q435-F437 PolarHBondContact O-N 3.45Å; F437-K440 PolarHBondContact O-N 3.2Å; F437-R441 HydrophobicContact CZ-CG 4.46Å; F437-R441 PolarHBondContact O-N 2.84Å
438	R	88.9	Confident	88.4	Confident	49 Å²	49	64.4 Å²	64.4	19%	0.185	29%	0.287	C	S	.	.	H	α-helix	trans	-66	-41.5	176.1	-70.4	179	65.5	-133.8	-3.2	111.9	N382 V383 E434 Q435 K436 R441 C442 A547 K549	N382-R438 PolarHBondContact O-NH2 3.07Å; V383-R438 HydrophobicContact CG2-CB 4.19Å; E434-R438 WeakPolarHBondContact O-CG 3.43Å; E434-R438 PolarHBondContact O-N 2.86Å; E434-R438 WeakPolarHBondContact OE1-CD 3.06Å; Q435-R438 PolarHBondContact O-N 2.83Å; K436-R438 VanDerWaalsContact C-N 3.31Å; K436-R438 PolarHBondContact O-N 3.45Å; R438-R441 PolarHBondContact O-N 2.8Å; R438-C442 PolarHBondContact O-N 2.68Å; R438-A547 PolarHBondContact NH2-O 3.48Å; R438-K549 VanDerWaalsContact NH2-CG 3.33Å
439	L	91.8	Very high	88.9	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-60	-45.3	173.7	-75	158.9	0	0	0	111.7	V383 I414 E416 Q435 K436 R441 C442 F481	V383-L439 HydrophobicContact CG2-CD2 3.93Å; V383-L439 HydrophobicContact CG2-CG 4.08Å; I414-L439 HydrophobicContact CD1-CD2 3.7Å; I414-L439 HydrophobicContact CG1-CD2 3.98Å; I414-L439 HydrophobicContact CG2-CD2 4.31Å; E416-L439 HydrophobicContact CB-CD1 3.69Å; E416-L439 HydrophobicContact CG-CD1 4.03Å; Q435-L439 PolarHBondContact O-N 3.06Å; K436-L439 PolarHBondContact O-N 3.33Å; L439-R441 PolarHBondContact O-N 2.81Å; L439-C442 PolarHBondContact O-N 3.22Å; L439-C442 PolarHBondContact O-SG 3.35Å; L439-F481 HydrophobicContact CB-CE2 4Å; L439-F481 HydrophobicContact CB-CZ 3.8Å; L439-F481 HydrophobicContact CD1-CE2 3.87Å
440	K	88.8	Confident	89.6	Confident	98 Å²	98	56.1 Å²	56.1	43%	0.426	24%	0.244	S	C	.	.	H	α-helix	trans	-60.2	-28.5	177.1	-74.9	-174.5	-176.2	-173.8	0	114	K436 F437 D479 F481	K436-K440 WeakPolarHBondContact O-CG 3.28Å; K436-K440 PolarHBondContact O-N 3.09Å; F437-K440 PolarHBondContact O-N 3.2Å; K440-D479 WeakPolarHBondContact CE-O 3.44Å; K440-D479 VanDerWaalsContact CE-OD1 3.25Å; K440-D479 WeakPolarHBondContact CE-OD1 3.47Å; K440-D479 IonicContact NZ-OD1 3.58Å; K440-D479 PolarHBondContact NZ-OD1 3.47Å; K440-F481 HydrophobicContact CD-CE1 4.37Å; K440-F481 HydrophobicContact CG-CE1 3.61Å; K440-F481 HydrophobicContact CG-CZ 3.87Å
441	R	86.2	Confident	90.3	Very high	135 Å²	135	54 Å²	54	51%	0.509	22%	0.222	S	C	.	.	H	α-helix	trans	-103.3	2.5	-176	-60.9	-169.9	78.4	-174.7	4.8	113.6	F437 R438 L439 G443 R517	F437-R441 HydrophobicContact CZ-CG 4.46Å; F437-R441 PolarHBondContact O-N 2.84Å; R438-R441 PolarHBondContact O-N 2.8Å; L439-R441 PolarHBondContact O-N 2.81Å; R441-G443 PolarHBondContact O-N 3.03Å; R441-R517 PolarHBondContact O-NH1 3.21Å; R441-R517 PolarHBondContact O-NH2 3.46Å
442	C	86.8	Confident	90.5	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.02	20%	0.202	C	C	.	.	S	Bend	trans	-71.6	-16.3	-178.1	77	0	0	0	0	113.7	V383 R438 L439 R517 F543	V383-C442 HydrophobicContact CG1-CB 3.63Å; V383-C442 HydrophobicContact CG2-CB 4.41Å; R438-C442 PolarHBondContact O-N 2.68Å; L439-C442 PolarHBondContact O-N 3.22Å; L439-C442 PolarHBondContact O-SG 3.35Å; C442-R517 PolarHBondContact O-NH1 3.39Å; C442-F543 HydrophobicContact CB-CE2 3.88Å
443	G	84.8	Confident	90.1	Very high	6 Å²	6	48.8 Å²	48.8	6%	0.062	21%	0.21	C	C	.	.	S	Bend	trans	95	-3.2	178.4	0	0	0	0	0	114.1	R441	R441-G443 PolarHBondContact O-N 3.03Å
444	L	89.8	Confident	89.1	Confident	8 Å²	8	41.2 Å²	41.2	4%	0.042	19%	0.189	C	C	.	.			trans	-93.1	129.5	172.7	-54.8	-176.9	0	0	0	109.9	V410 I414 I538 F543	V410-L444 HydrophobicContact CG1-CD2 3.86Å; V410-L444 HydrophobicContact CG2-CD1 3.93Å; V410-L444 HydrophobicContact CG2-CD2 4Å; I414-L444 HydrophobicContact CB-CB 4.45Å; I414-L444 HydrophobicContact CB-CD1 3.73Å; I414-L444 HydrophobicContact CD1-CD1 4.01Å; I414-L444 HydrophobicContact CG1-CD1 4.38Å; I414-L444 HydrophobicContact CG2-CB 3.99Å; I414-L444 HydrophobicContact CG2-CD1 4.17Å; L444-I538 HydrophobicContact CD2-CD1 4.24Å; L444-F543 HydrophobicContact CD1-CD2 3.93Å; L444-F543 HydrophobicContact CD1-CE2 3.39Å; L444-F543 HydrophobicContact CD1-CZ 3.83Å; L444-F543 HydrophobicContact CD2-CD2 4.17Å; L444-F543 HydrophobicContact CD2-CE2 4.42Å; L444-F543 HydrophobicContact CG-CD2 3.88Å; L444-F543 HydrophobicContact CG-CE2 3.66Å
445	R	87.8	Confident	87.8	Confident	76 Å²	76	41.6 Å²	41.6	29%	0.287	20%	0.2	S	C	.	.	S	Bend	trans	-88.2	-14.7	-167.5	-70.7	164.7	-72	-172.4	-6.5	114.4	D412 P447 E528 S534 S536	D412-R445 HydrophobicContact CB-CB 4.49Å; D412-R445 VanDerWaalsContact CG-NE 3.31Å; D412-R445 IonicContact OD1-CZ 2.81Å; D412-R445 VanDerWaalsContact OD1-CZ 3.24Å; D412-R445 IonicContact OD1-NE 2.65Å; D412-R445 PolarHBondContact OD1-NE 3.3Å; D412-R445 IonicContact OD1-NH2 3.25Å; D412-R445 PolarHBondContact OD1-NH2 3.04Å; D412-R445 IonicContact OD2-CZ 3.24Å; D412-R445 IonicContact OD2-NE 3.48Å; D412-R445 PolarHBondContact OD2-NE 2.94Å; D412-R445 IonicContact OD2-NH2 3.72Å; D412-R445 PolarHBondContact OD2-NH2 3.29Å; R445-P447 WeakPolarHBondContact O-CD 3.44Å; R445-E528 IonicContact CZ-OE1 2.72Å; R445-E528 IonicContact CZ-OE2 3.37Å; R445-E528 IonicContact NH1-OE1 2.66Å; R445-E528 PolarHBondContact NH1-OE1 2.86Å; R445-E528 IonicContact NH1-OE2 2.7Å; R445-E528 PolarHBondContact NH1-OE2 2.87Å; R445-S534 PolarHBondContact NH1-OG 3.37Å; R445-S534 PolarHBondContact NH2-OG 2.94Å; R445-S536 PolarHBondContact NH2-O 3.37Å
446	R	91.8	Very high	86.4	Confident	128 Å²	128	44.7 Å²	44.7	48%	0.483	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	69.4	-177.3	-59.1	-68.5	-171.9	167.3	-0.9	110.6	D412 Y413 I414	D412-R446 HydrophobicContact CB-CB 4.39Å; D412-R446 HydrophobicContact CB-CG 4.09Å; D412-R446 CarbonylContact O-C 3.47Å; D412-R446 WeakPolarHBondContact O-CA 3.33Å; D412-R446 WeakPolarHBondContact O-CB 3.44Å; D412-R446 PolarHBondContact O-N 3.24Å; Y413-R446 HydrophobicContact CD1-CB 3.62Å; Y413-R446 HydrophobicContact CD1-CG 4.15Å; Y413-R446 HydrophobicContact CE1-CB 3.92Å; Y413-R446 HydrophobicContact CE1-CG 3.95Å; Y413-R446 HydrophobicContact CG-CB 4.21Å; I414-R446 PolarHBondContact N-O 2.63Å
447	P	95.1	Very high	84.7	Confident	18 Å²	18	47.5 Å²	47.5	12%	0.117	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	130.2	173	30.8	-34.3	0	0	0	110.9	I414 R445 F481 F482	I414-P447 HydrophobicContact CG2-CB 4.16Å; I414-P447 CarbonylContact O-C 3.59Å; R445-P447 WeakPolarHBondContact O-CD 3.44Å; P447-F481 HydrophobicContact CB-CD1 3.91Å; P447-F481 HydrophobicContact CB-CD2 4.05Å; P447-F481 HydrophobicContact CB-CE1 3.89Å; P447-F481 HydrophobicContact CB-CE2 4.04Å; P447-F481 HydrophobicContact CB-CG 4Å; P447-F481 HydrophobicContact CB-CZ 3.96Å; P447-F481 HydrophobicContact CG-CD1 3.44Å; P447-F481 VanDerWaalsContact CG-CD1 3.44Å; P447-F481 HydrophobicContact CG-CD2 4.47Å; P447-F481 HydrophobicContact CG-CE1 3.55Å; P447-F481 HydrophobicContact CG-CG 3.95Å; P447-F481 HydrophobicContact CG-CZ 4.14Å; P447-F482 PolarHBondContact O-N 2.63Å
448	I	97.3	Very high	83.1	Confident	7 Å²	7	42.6 Å²	42.6	4%	0.036	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	135.1	178.2	-64	161.6	0	0	0	108	Y413 I414 I415 E416 F482 Y495 M499	Y413-I448 HydrophobicContact CD1-CD1 4.22Å; I414-I448 PolarHBondContact O-N 3.35Å; I415-I448 CarbonylContact C-O 3.43Å; I415-I448 WeakPolarHBondContact CA-O 3.42Å; I415-I448 HydrophobicContact CB-CB 4.5Å; I415-I448 HydrophobicContact CG1-CB 3.74Å; I415-I448 HydrophobicContact CG1-CD1 4.01Å; I415-I448 HydrophobicContact CG1-CG1 4.48Å; I415-I448 HydrophobicContact CG1-CG2 3.83Å; E416-I448 PolarHBondContact N-O 2.98Å; I448-F482 CarbonylContact C-O 3.58Å; I448-F482 VanDerWaalsContact CA-O 3.25Å; I448-F482 WeakPolarHBondContact CA-O 3.49Å; I448-F482 HydrophobicContact CG1-CB 4.08Å; I448-F482 HydrophobicContact CG1-CD1 4.28Å; I448-F482 HydrophobicContact CG2-CD1 4.16Å; I448-Y495 HydrophobicContact CG2-CE1 4.42Å; I448-M499 HydrophobicContact CD1-CE 3.99Å
449	Y	96.9	Very high	81.5	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.008	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	106.5	175.7	-152.3	-95.6	0	0	0	108.8	E416 K418 K436 V451 T475 F481 F482 V483 K484	E416-Y449 HydrophobicContact CB-CD2 4.03Å; E416-Y449 HydrophobicContact CB-CE2 4.18Å; E416-Y449 HydrophobicContact CG-CD2 4.3Å; E416-Y449 HydrophobicContact CG-CE2 3.92Å; K418-Y449 HydrophobicContact CB-CE1 3.71Å; K418-Y449 WeakPolarHBondContact CD-OH 3.31Å; K418-Y449 HydrophobicContact CG-CE1 4.3Å; K418-Y449 VanDerWaalsContact CG-OH 3.31Å; K418-Y449 WeakPolarHBondContact CG-OH 3.49Å; K436-Y449 HydrophobicContact CG-CE2 4.49Å; Y449-V451 HydrophobicContact CD1-CG2 3.56Å; Y449-V451 HydrophobicContact CE1-CG2 3.91Å; Y449-T475 HydrophobicContact CD1-CG2 4.39Å; Y449-T475 HydrophobicContact CD2-CG2 4.06Å; Y449-T475 HydrophobicContact CG-CG2 3.94Å; Y449-F481 HydrophobicContact CD2-CD2 4.19Å; Y449-F482 PolarHBondContact N-O 2.66Å; Y449-V483 WeakPolarHBondContact O-CA 3.46Å; Y449-K484 PolarHBondContact O-N 3.31Å
450	L	96.8	Very high	80.1	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	101.7	-177.6	-177.7	66.2	0	0	0	109.5	I415 E416 R417 K418 K484 V486 Y495	I415-L450 HydrophobicContact CG2-CB 3.63Å; I415-L450 HydrophobicContact CG2-CD2 4.27Å; E416-L450 PolarHBondContact O-N 3.01Å; R417-L450 CarbonylContact C-O 3.4Å; R417-L450 WeakPolarHBondContact CA-O 3.13Å; R417-L450 HydrophobicContact CB-CB 4.48Å; R417-L450 HydrophobicContact CB-CD2 4.48Å; R417-L450 HydrophobicContact CG-CD2 4.43Å; K418-L450 PolarHBondContact N-O 3.27Å; L450-K484 CarbonylContact C-O 3.59Å; L450-K484 WeakPolarHBondContact CA-O 3.36Å; L450-K484 HydrophobicContact CD1-CB 3.83Å; L450-K484 HydrophobicContact CD1-CG 3.58Å; L450-V486 HydrophobicContact CD1-CB 4.39Å; L450-V486 HydrophobicContact CD1-CG1 3.71Å; L450-V486 HydrophobicContact CD1-CG2 3.72Å; L450-V486 HydrophobicContact CG-CG2 4.07Å; L450-Y495 HydrophobicContact CD1-CD1 3.94Å; L450-Y495 HydrophobicContact CD1-CE1 4.36Å; L450-Y495 HydrophobicContact CD2-CD1 4.5Å
451	V	94.6	Very high	79.3	Confident	3 Å²	3	50 Å²	50	2%	0.018	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	115.7	-178.3	-174.4	0	0	0	0	109.8	K418 M420 Y449 I472 V483 K484 R485 V486	K418-V451 WeakPolarHBondContact O-CA 3.44Å; M420-V451 HydrophobicContact CE-CG1 3.96Å; Y449-V451 HydrophobicContact CD1-CG2 3.56Å; Y449-V451 HydrophobicContact CE1-CG2 3.91Å; V451-I472 HydrophobicContact CG1-CD1 3.93Å; V451-I472 HydrophobicContact CG2-CD1 4.36Å; V451-I472 HydrophobicContact CG2-CG1 4.21Å; V451-I472 HydrophobicContact CG2-CG2 4.29Å; V451-V483 HydrophobicContact CG2-CG1 4.27Å; V451-K484 PolarHBondContact N-O 3.26Å; V451-R485 HydrophobicContact CB-CG 4.48Å; V451-R485 WeakPolarHBondContact O-CA 3.46Å; V451-V486 WeakPolarHBondContact O-CG2 3.47Å; V451-V486 PolarHBondContact O-N 3.25Å
452	E	90.3	Very high	79	Confident	16 Å²	16	47.9 Å²	47.9	8%	0.075	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.8	178.9	-173.4	-176.2	109.9	0	0	111.5	R417 K418 R419 M420 V486 V489 S492	R417-E452 IonicContact CZ-OE1 3.12Å; R417-E452 IonicContact CZ-OE2 3.11Å; R417-E452 IonicContact NE-OE2 3.39Å; R417-E452 PolarHBondContact NE-OE2 3.44Å; R417-E452 IonicContact NH2-OE1 3.82Å; R417-E452 PolarHBondContact NH2-OE1 3.18Å; R417-E452 IonicContact NH2-OE2 3.78Å; R417-E452 PolarHBondContact NH2-OE2 3.48Å; K418-E452 PolarHBondContact O-N 3.18Å; R419-E452 WeakPolarHBondContact CA-O 3.48Å; R419-E452 HydrophobicContact CG-CB 4.33Å; M420-E452 PolarHBondContact N-O 3.42Å; M420-E452 VanDerWaalsContact N-O 3.07Å; E452-V486 WeakPolarHBondContact CA-O 3.47Å; E452-V486 HydrophobicContact CB-CG2 4.02Å; E452-V486 HydrophobicContact CG-CG2 4.32Å; E452-V489 WeakPolarHBondContact OE2-CA 3.33Å; E452-S492 PolarHBondContact OE2-OG 3Å; E452-S492 VanDerWaalsContact OE2-OG 3.12Å
453	G	82.8	Confident	78.7	Confident	25 Å²	25	49.4 Å²	49.4	26%	0.258	30%	0.295	S	S	.	.			trans	140	149.5	170.3	0	0	0	0	0	113.1	V486 Q487	G453-V486 PolarHBondContact N-O 3.02Å; G453-Q487 WeakPolarHBondContact CA-O 3.35Å
454	S	65.6	Low	78.8	Confident	48 Å²	48	53.1 Å²	53.1	34%	0.336	32%	0.318	S	S	.	.			trans	-82.8	146.6	171.5	176.7	0	0	0	0	110.8	S456 S457	S454-S456 PolarHBondContact O-N 3.42Å; S454-S456 PolarHBondContact OG-N 3.22Å; S454-S456 PolarHBondContact OG-OG 3.03Å; S454-S457 WeakPolarHBondContact O-CB 3.49Å; S454-S457 PolarHBondContact O-N 2.93Å; S454-S457 PolarHBondContact O-OG 3.45Å
455	S	60.2	Low	78.6	Confident	83 Å²	83	55.1 Å²	55.1	58%	0.58	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-54.2	-23.8	172.5	-56.3	0	0	0	0	112.8	S457 A458	S455-S457 VanDerWaalsContact C-N 3.25Å; S455-S457 PolarHBondContact O-N 3.43Å; S455-A458 WeakPolarHBondContact O-CB 3.43Å; S455-A458 PolarHBondContact O-N 3.42Å
456	S	58.5	Low	78.7	Confident	102 Å²	102	55.2 Å²	55.2	71%	0.713	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-67.7	-22.7	176.2	-46.9	0	0	0	0	113.6	S454 A458	S454-S456 PolarHBondContact O-N 3.42Å; S454-S456 PolarHBondContact OG-N 3.22Å; S454-S456 PolarHBondContact OG-OG 3.03Å; S456-A458 PolarHBondContact O-N 3.16Å
457	S	55.6	Low	78.6	Confident	71 Å²	71	52 Å²	52	50%	0.497	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-78.6	-6.8	178.6	-50.6	0	0	0	0	113.2	S454 S455 A459	S454-S457 WeakPolarHBondContact O-CB 3.49Å; S454-S457 PolarHBondContact O-N 2.93Å; S454-S457 PolarHBondContact O-OG 3.45Å; S455-S457 VanDerWaalsContact C-N 3.25Å; S455-S457 PolarHBondContact O-N 3.43Å; S457-A459 VanDerWaalsContact C-N 3.35Å; S457-A459 PolarHBondContact O-N 3.21Å
458	A	54.4	Low	78.4	Confident	13 Å²	13	51.1 Å²	51.1	11%	0.107	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-76.9	-16.1	-176.2	0	0	0	0	0	114.6	S455 S456 H460 L461 E465	S455-A458 WeakPolarHBondContact O-CB 3.43Å; S455-A458 PolarHBondContact O-N 3.42Å; S456-A458 PolarHBondContact O-N 3.16Å; A458-H460 PolarHBondContact O-N 2.74Å; A458-H460 VanDerWaalsContact O-N 3.12Å; A458-L461 HydrophobicContact CB-CD1 4.29Å; A458-L461 PolarHBondContact O-N 2.83Å; A458-L461 VanDerWaalsContact O-N 3.17Å; A458-E465 HydrophobicContact CB-CB 4.17Å; A458-E465 HydrophobicContact CB-CG 4.33Å; A458-E465 WeakPolarHBondContact CB-OE2 3.35Å
459	A	55.8	Low	78.1	Confident	88 Å²	88	53.2 Å²	53.2	73%	0.727	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-64.3	-18.3	-175.8	0	0	0	0	0	114.4	S457	S457-A459 VanDerWaalsContact C-N 3.35Å; S457-A459 PolarHBondContact O-N 3.21Å
460	H	62.1	Low	77.9	Confident	182 Å²	182	58.2 Å²	58.2	84%	0.843	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-111	8.6	178.9	-67.1	-63.4	0	0	0	113.9	A458	A458-H460 PolarHBondContact O-N 2.74Å; A458-H460 VanDerWaalsContact O-N 3.12Å
461	L	72.9	Confident	77.7	Confident	37 Å²	37	58.6 Å²	58.6	19%	0.194	37%	0.369	C	S	.	.	S	Bend	trans	-85.8	145.1	-179.2	-64	177.2	0	0	0	111.3	M420 D421 C424 A458 L463 L468	M420-L461 HydrophobicContact CB-CD1 4.09Å; M420-L461 HydrophobicContact CG-CD1 3.39Å; D421-L461 HydrophobicContact CB-CD2 3.94Å; C424-L461 HydrophobicContact CB-CD2 4.33Å; A458-L461 HydrophobicContact CB-CD1 4.29Å; A458-L461 PolarHBondContact O-N 2.83Å; A458-L461 VanDerWaalsContact O-N 3.17Å; L461-L463 PolarHBondContact O-N 3.17Å; L461-L463 VanDerWaalsContact O-N 3.15Å; L461-L468 HydrophobicContact CD1-CD1 3.54Å
462	S	79.1	Confident	77.7	Confident	89 Å²	89	58.5 Å²	58.5	62%	0.622	37%	0.369	S	S	*	.	S	Bend	trans	-67.3	-10.4	-179.8	-49.8	0	0	0	0	114.5
463	L	81.6	Confident	77.9	Confident	35 Å²	35	60.4 Å²	60.4	18%	0.183	38%	0.381	C	S	.	.	S	Bend	trans	-118.8	145.6	178.1	-70.1	177.1	0	0	0	110.9	I427 I428 L461 L468	I427-L463 HydrophobicContact CB-CD1 3.73Å; I427-L463 HydrophobicContact CD1-CD1 4.18Å; I427-L463 HydrophobicContact CG2-CD1 3.59Å; I428-L463 HydrophobicContact CD1-CG 4.17Å; I428-L463 HydrophobicContact CG1-CD1 4.06Å; I428-L463 HydrophobicContact CG1-CD2 4.27Å; I428-L463 HydrophobicContact CG1-CG 4.1Å; L461-L463 PolarHBondContact O-N 3.17Å; L461-L463 VanDerWaalsContact O-N 3.15Å; L463-L468 HydrophobicContact CB-CD2 4.37Å; L463-L468 HydrophobicContact CB-CG 4.49Å; L463-L468 HydrophobicContact CD1-CD2 4.29Å
464	P	86.6	Confident	78.5	Confident	85 Å²	85	62.2 Å²	62.2	55%	0.552	39%	0.385	S	S	*	.			trans	-60.1	142.2	173.6	-20.3	31.5	0	0	0	111.9	A466 T467 L468	P464-A466 PolarHBondContact O-N 3.14Å; P464-T467 WeakPolarHBondContact O-CA 3.34Å; P464-T467 VanDerWaalsContact O-CB 3.28Å; P464-T467 WeakPolarHBondContact O-CB 3.5Å; P464-T467 PolarHBondContact O-N 3.26Å; P464-L468 PolarHBondContact O-N 3.41Å
465	E	85.9	Confident	79.9	Confident	50 Å²	50	59.9 Å²	59.9	23%	0.234	37%	0.369	C	S	.	.	H	α-helix	trans	-55.1	-38.3	179.1	178.3	58.5	-167.5	0	0	112.6	A458 T467 L468 Q469	A458-E465 HydrophobicContact CB-CB 4.17Å; A458-E465 HydrophobicContact CB-CG 4.33Å; A458-E465 WeakPolarHBondContact CB-OE2 3.35Å; E465-T467 PolarHBondContact O-N 3.15Å; E465-L468 PolarHBondContact O-N 3.35Å; E465-L468 VanDerWaalsContact O-N 3.1Å; E465-Q469 HydrophobicContact CG-CG 4.33Å; E465-Q469 WeakPolarHBondContact O-CG 3.4Å; E465-Q469 PolarHBondContact O-N 3.19Å; E465-Q469 WeakPolarHBondContact OE1-CG 3.46Å; E465-Q469 PolarHBondContact OE1-NE2 3.43Å
466	A	88.6	Confident	81.5	Confident	77 Å²	77	60.3 Å²	60.3	64%	0.636	36%	0.362	S	S	*	.	H	α-helix	trans	-58.1	-34.5	175.5	0	0	0	0	0	112.8	P464 Q470	P464-A466 PolarHBondContact O-N 3.14Å; A466-Q470 VanDerWaalsContact O-CB 3.3Å; A466-Q470 WeakPolarHBondContact O-CB 3.36Å; A466-Q470 PolarHBondContact O-N 3.3Å
467	T	90.4	Very high	83.3	Confident	60 Å²	60	60.8 Å²	60.8	37%	0.368	36%	0.36	S	S	.	.	H	α-helix	trans	-70.7	-40.3	177.1	-57.9	0	0	0	0	111.1	P464 E465 Q470 A471	P464-T467 WeakPolarHBondContact O-CA 3.34Å; P464-T467 VanDerWaalsContact O-CB 3.28Å; P464-T467 WeakPolarHBondContact O-CB 3.5Å; P464-T467 PolarHBondContact O-N 3.26Å; E465-T467 PolarHBondContact O-N 3.15Å; T467-Q470 PolarHBondContact O-N 2.92Å; T467-A471 WeakPolarHBondContact O-CB 3.42Å; T467-A471 PolarHBondContact O-N 3.46Å
468	L	90.4	Very high	85	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-66.1	-46.4	177	-61.6	174.3	0	0	0	110.7	M420 L423 C424 I427 L461 L463 P464 E465 Q470 A471 I472	M420-L468 HydrophobicContact CG-CD1 3.92Å; M420-L468 HydrophobicContact SD-CB 4.11Å; M420-L468 HydrophobicContact SD-CD1 3.85Å; M420-L468 HydrophobicContact SD-CG 4.45Å; L423-L468 HydrophobicContact CD2-CB 4.49Å; L423-L468 HydrophobicContact CD2-CD2 4.17Å; L423-L468 HydrophobicContact CG-CD2 4.1Å; C424-L468 HydrophobicContact CB-CD2 4.15Å; I427-L468 HydrophobicContact CD1-CD2 3.87Å; L461-L468 HydrophobicContact CD1-CD1 3.54Å; L463-L468 HydrophobicContact CB-CD2 4.37Å; L463-L468 HydrophobicContact CB-CG 4.49Å; L463-L468 HydrophobicContact CD1-CD2 4.29Å; P464-L468 PolarHBondContact O-N 3.41Å; E465-L468 PolarHBondContact O-N 3.35Å; E465-L468 VanDerWaalsContact O-N 3.1Å; L468-Q470 PolarHBondContact O-N 3.2Å; L468-A471 WeakPolarHBondContact O-CB 3.22Å; L468-A471 PolarHBondContact O-N 3.08Å; L468-A471 VanDerWaalsContact O-N 3.14Å; L468-I472 VanDerWaalsContact O-CG1 3.28Å; L468-I472 WeakPolarHBondContact O-CG1 3.37Å; L468-I472 PolarHBondContact O-N 3.25Å
469	Q	91.1	Very high	86.7	Confident	52 Å²	52	63.5 Å²	63.5	24%	0.243	37%	0.371	C	S	.	.	H	α-helix	trans	-60.9	-43.5	175.3	-69	-57	-30.4	0	0	111.9	E465 A471 I472 V473	E465-Q469 HydrophobicContact CG-CG 4.33Å; E465-Q469 WeakPolarHBondContact O-CG 3.4Å; E465-Q469 PolarHBondContact O-N 3.19Å; E465-Q469 WeakPolarHBondContact OE1-CG 3.46Å; E465-Q469 PolarHBondContact OE1-NE2 3.43Å; Q469-A471 VanDerWaalsContact C-N 3.31Å; Q469-A471 PolarHBondContact O-N 3.37Å; Q469-I472 PolarHBondContact O-N 3.19Å; Q469-V473 WeakPolarHBondContact O-CB 3.23Å; Q469-V473 VanDerWaalsContact O-CG2 3.3Å; Q469-V473 WeakPolarHBondContact O-CG2 3.42Å; Q469-V473 PolarHBondContact O-N 3.43Å
470	Q	92.6	Very high	88.4	Confident	106 Å²	106	62.1 Å²	62.1	50%	0.495	37%	0.365	S	S	.	.	H	α-helix	trans	-61.2	-40.1	174.9	-171.1	63.3	54.4	0	0	111.8	A466 T467 L468 V473 N474	A466-Q470 VanDerWaalsContact O-CB 3.3Å; A466-Q470 WeakPolarHBondContact O-CB 3.36Å; A466-Q470 PolarHBondContact O-N 3.3Å; T467-Q470 PolarHBondContact O-N 2.92Å; L468-Q470 PolarHBondContact O-N 3.2Å; Q470-V473 PolarHBondContact O-N 2.92Å; Q470-N474 PolarHBondContact NE2-OD1 3.36Å; Q470-N474 VanDerWaalsContact O-CB 3.3Å; Q470-N474 WeakPolarHBondContact O-CB 3.5Å; Q470-N474 PolarHBondContact O-N 2.62Å; Q470-N474 PolarHBondContact O-ND2 3.23Å; Q470-N474 PolarHBondContact O-OD1 3.41Å
471	A	93.2	Very high	90	Very high	9 Å²	9	53.7 Å²	53.7	7%	0.074	33%	0.326	C	S	.	.	H	α-helix	trans	-64.1	-39.7	176.8	0	0	0	0	0	112.2	I427 F432 T467 L468 Q469 T475	I427-A471 HydrophobicContact CD1-CB 3.75Å; F432-A471 HydrophobicContact CE1-CB 3.99Å; F432-A471 HydrophobicContact CZ-CB 3.97Å; T467-A471 WeakPolarHBondContact O-CB 3.42Å; T467-A471 PolarHBondContact O-N 3.46Å; L468-A471 WeakPolarHBondContact O-CB 3.22Å; L468-A471 PolarHBondContact O-N 3.08Å; L468-A471 VanDerWaalsContact O-N 3.14Å; Q469-A471 VanDerWaalsContact C-N 3.31Å; Q469-A471 PolarHBondContact O-N 3.37Å; A471-T475 PolarHBondContact O-N 3.13Å; A471-T475 PolarHBondContact O-OG1 3.45Å
472	I	93.7	Very high	91.1	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-66.6	-47.1	175.7	-63.8	163.4	0	0	0	110.4	M420 L423 V451 L468 Q469 N474 T475 Q476 V483 R485	M420-I472 HydrophobicContact CE-CD1 4.3Å; L423-I472 HydrophobicContact CD2-CD1 4.04Å; L423-I472 HydrophobicContact CD2-CG1 3.84Å; V451-I472 HydrophobicContact CG1-CD1 3.93Å; V451-I472 HydrophobicContact CG2-CD1 4.36Å; V451-I472 HydrophobicContact CG2-CG1 4.21Å; V451-I472 HydrophobicContact CG2-CG2 4.29Å; L468-I472 VanDerWaalsContact O-CG1 3.28Å; L468-I472 WeakPolarHBondContact O-CG1 3.37Å; L468-I472 PolarHBondContact O-N 3.25Å; Q469-I472 PolarHBondContact O-N 3.19Å; I472-N474 PolarHBondContact O-N 3.2Å; I472-T475 WeakPolarHBondContact O-CA 3.42Å; I472-T475 WeakPolarHBondContact O-CB 3.16Å; I472-T475 PolarHBondContact O-N 3.46Å; I472-T475 VanDerWaalsContact O-N 3.09Å; I472-Q476 PolarHBondContact O-N 3.02Å; I472-V483 HydrophobicContact CG2-CG1 3.57Å; I472-V483 HydrophobicContact CG2-CG2 4.45Å; I472-R485 VanDerWaalsContact CG2-NH2 3.33Å
473	V	95.3	Very high	92	Very high	56 Å²	56	54.3 Å²	54.3	34%	0.339	32%	0.317	S	S	.	.	H	α-helix	trans	-62.3	-42.5	177.6	171.8	0	0	0	0	111.3	Q469 Q470 T475 Q476 V477	Q469-V473 WeakPolarHBondContact O-CB 3.23Å; Q469-V473 VanDerWaalsContact O-CG2 3.3Å; Q469-V473 WeakPolarHBondContact O-CG2 3.42Å; Q469-V473 PolarHBondContact O-N 3.43Å; Q470-V473 PolarHBondContact O-N 2.92Å; V473-T475 PolarHBondContact O-N 3.11Å; V473-Q476 WeakPolarHBondContact O-CB 3.49Å; V473-Q476 PolarHBondContact O-N 3.08Å; V473-Q476 VanDerWaalsContact O-N 3.07Å; V473-V477 HydrophobicContact CG1-CG2 4.07Å; V473-V477 PolarHBondContact O-N 3.4Å
474	N	94.7	Very high	92.7	Very high	62 Å²	62	56.3 Å²	56.3	33%	0.332	33%	0.325	S	S	.	.	H	α-helix	trans	-60.4	-37.1	174.4	-71.9	-12	0	0	0	111.5	Q470 I472 Q476 V478 D479	Q470-N474 PolarHBondContact NE2-OD1 3.36Å; Q470-N474 VanDerWaalsContact O-CB 3.3Å; Q470-N474 WeakPolarHBondContact O-CB 3.5Å; Q470-N474 PolarHBondContact O-N 2.62Å; Q470-N474 PolarHBondContact O-ND2 3.23Å; Q470-N474 PolarHBondContact O-OD1 3.41Å; I472-N474 PolarHBondContact O-N 3.2Å; N474-Q476 VanDerWaalsContact C-N 3.29Å; N474-Q476 PolarHBondContact O-N 2.7Å; N474-V478 HydrophobicContact CB-CG2 4.4Å; N474-V478 WeakPolarHBondContact O-CA 3.49Å; N474-V478 VanDerWaalsContact O-CB 3.22Å; N474-V478 WeakPolarHBondContact O-CB 3.3Å; N474-V478 PolarHBondContact O-N 2.95Å; N474-D479 PolarHBondContact O-N 3.33Å
475	T	95.1	Very high	93.1	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65.5	-34.9	176.2	-55.4	0	0	0	0	111.7	F432 K436 Y449 A471 I472 V473 D479 G480 F481 V483	F432-T475 WeakPolarHBondContact CZ-OG1 3.44Å; K436-T475 HydrophobicContact CD-CG2 3.76Å; K436-T475 PolarHBondContact NZ-OG1 3.43Å; Y449-T475 HydrophobicContact CD1-CG2 4.39Å; Y449-T475 HydrophobicContact CD2-CG2 4.06Å; Y449-T475 HydrophobicContact CG-CG2 3.94Å; A471-T475 PolarHBondContact O-N 3.13Å; A471-T475 PolarHBondContact O-OG1 3.45Å; I472-T475 WeakPolarHBondContact O-CA 3.42Å; I472-T475 WeakPolarHBondContact O-CB 3.16Å; I472-T475 PolarHBondContact O-N 3.46Å; I472-T475 VanDerWaalsContact O-N 3.09Å; V473-T475 PolarHBondContact O-N 3.11Å; T475-D479 WeakPolarHBondContact CA-OD2 3.33Å; T475-D479 WeakPolarHBondContact O-CB 3.29Å; T475-G480 PolarHBondContact O-N 3.47Å; T475-F481 HydrophobicContact CG2-CB 3.94Å; T475-F481 HydrophobicContact CG2-CD2 3.84Å; T475-F481 HydrophobicContact CG2-CG 4.07Å; T475-F481 WeakPolarHBondContact O-CB 3.45Å; T475-F481 PolarHBondContact O-N 3.25Å; T475-F481 VanDerWaalsContact O-N 3.1Å; T475-V483 HydrophobicContact CG2-CG2 4.48Å
476	Q	94.8	Very high	93.5	Very high	92 Å²	92	55.4 Å²	55.4	43%	0.43	31%	0.309	S	S	.	.	H	α-helix	trans	-74.8	-50.6	175.5	-167.8	173.6	-23.8	0	0	112.8	I472 V473 N474 G480 F481 V483	I472-Q476 PolarHBondContact O-N 3.02Å; V473-Q476 WeakPolarHBondContact O-CB 3.49Å; V473-Q476 PolarHBondContact O-N 3.08Å; V473-Q476 VanDerWaalsContact O-N 3.07Å; N474-Q476 VanDerWaalsContact C-N 3.29Å; N474-Q476 PolarHBondContact O-N 2.7Å; Q476-G480 WeakPolarHBondContact O-CA 3.31Å; Q476-G480 PolarHBondContact O-N 3.41Å; Q476-F481 WeakPolarHBondContact CA-O 3.44Å; Q476-V483 HydrophobicContact CB-CB 4.35Å; Q476-V483 HydrophobicContact CB-CG2 3.66Å; Q476-V483 HydrophobicContact CG-CB 4.48Å; Q476-V483 HydrophobicContact CG-CG2 4.21Å
477	V	94.9	Very high	93.5	Very high	111 Å²	111	57.8 Å²	57.8	67%	0.673	31%	0.307	S	S	*	.	H	α-helix	trans	-88.2	-44.6	-168.2	179.1	0	0	0	0	112.4	V473	V473-V477 HydrophobicContact CG1-CG2 4.07Å; V473-V477 PolarHBondContact O-N 3.4Å
478	V	92	Very high	93.4	Very high	105 Å²	105	57.3 Å²	57.3	64%	0.636	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-42.8	-175.9	-176.7	0	0	0	0	110.7	N474	N474-V478 HydrophobicContact CB-CG2 4.4Å; N474-V478 WeakPolarHBondContact O-CA 3.49Å; N474-V478 VanDerWaalsContact O-CB 3.22Å; N474-V478 WeakPolarHBondContact O-CB 3.3Å; N474-V478 PolarHBondContact O-N 2.95Å
479	D	90.3	Very high	93.3	Very high	37 Å²	37	57.7 Å²	57.7	20%	0.198	30%	0.304	C	S	.	.	S	Bend	trans	-85.5	-16.5	-178.8	-61.4	-61	0	0	0	114	K436 K440 N474 T475 F481	K436-D479 WeakPolarHBondContact CE-OD2 3.36Å; K436-D479 IonicContact NZ-OD2 2.71Å; K436-D479 PolarHBondContact NZ-OD2 3.06Å; K440-D479 WeakPolarHBondContact CE-O 3.44Å; K440-D479 VanDerWaalsContact CE-OD1 3.25Å; K440-D479 WeakPolarHBondContact CE-OD1 3.47Å; K440-D479 IonicContact NZ-OD1 3.58Å; K440-D479 PolarHBondContact NZ-OD1 3.47Å; N474-D479 PolarHBondContact O-N 3.33Å; T475-D479 WeakPolarHBondContact CA-OD2 3.33Å; T475-D479 WeakPolarHBondContact O-CB 3.29Å; D479-F481 VanDerWaalsContact C-N 3.31Å; D479-F481 HydrophobicContact CB-CD1 4Å; D479-F481 HydrophobicContact CB-CE1 4.2Å; D479-F481 HydrophobicContact CB-CG 4.48Å; D479-F481 WeakPolarHBondContact O-CD1 3.4Å
480	G	91.8	Very high	93.3	Very high	59 Å²	59	61.7 Å²	61.7	61%	0.608	32%	0.317	S	S	*	.			trans	74.4	17.6	178.5	0	0	0	0	0	114.1	T475 Q476	T475-G480 PolarHBondContact O-N 3.47Å; Q476-G480 WeakPolarHBondContact O-CA 3.31Å; Q476-G480 PolarHBondContact O-N 3.41Å
481	F	95.5	Very high	93.3	Very high	5 Å²	5	60.1 Å²	60.1	2%	0.022	31%	0.31	C	S	.	.			trans	-80.6	147.3	-178.8	-71.4	18.3	0	0	0	110	K436 L439 K440 P447 Y449 T475 Q476 D479 V483	K436-F481 HydrophobicContact CB-CE2 4.34Å; K436-F481 HydrophobicContact CB-CZ 4.33Å; K436-F481 HydrophobicContact CG-CE2 4.13Å; L439-F481 HydrophobicContact CB-CE2 4Å; L439-F481 HydrophobicContact CB-CZ 3.8Å; L439-F481 HydrophobicContact CD1-CE2 3.87Å; K440-F481 HydrophobicContact CD-CE1 4.37Å; K440-F481 HydrophobicContact CG-CE1 3.61Å; K440-F481 HydrophobicContact CG-CZ 3.87Å; P447-F481 HydrophobicContact CB-CD1 3.91Å; P447-F481 HydrophobicContact CB-CD2 4.05Å; P447-F481 HydrophobicContact CB-CE1 3.89Å; P447-F481 HydrophobicContact CB-CE2 4.04Å; P447-F481 HydrophobicContact CB-CG 4Å; P447-F481 HydrophobicContact CB-CZ 3.96Å; P447-F481 HydrophobicContact CG-CD1 3.44Å; P447-F481 VanDerWaalsContact CG-CD1 3.44Å; P447-F481 HydrophobicContact CG-CD2 4.47Å; P447-F481 HydrophobicContact CG-CE1 3.55Å; P447-F481 HydrophobicContact CG-CG 3.95Å; P447-F481 HydrophobicContact CG-CZ 4.14Å; Y449-F481 HydrophobicContact CD2-CD2 4.19Å; T475-F481 HydrophobicContact CG2-CB 3.94Å; T475-F481 HydrophobicContact CG2-CD2 3.84Å; T475-F481 HydrophobicContact CG2-CG 4.07Å; T475-F481 WeakPolarHBondContact O-CB 3.45Å; T475-F481 PolarHBondContact O-N 3.25Å; T475-F481 VanDerWaalsContact O-N 3.1Å; Q476-F481 WeakPolarHBondContact CA-O 3.44Å; D479-F481 VanDerWaalsContact C-N 3.31Å; D479-F481 HydrophobicContact CB-CD1 4Å; D479-F481 HydrophobicContact CB-CE1 4.2Å; D479-F481 HydrophobicContact CB-CG 4.48Å; D479-F481 WeakPolarHBondContact O-CD1 3.4Å; F481-V483 PolarHBondContact O-N 2.95Å
482	F	96.3	Very high	93.4	Very high	121 Å²	121	59.7 Å²	59.7	53%	0.531	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	113.8	169.8	-175.6	-93.3	0	0	0	109.4	P447 I448 Y449 K484	P447-F482 PolarHBondContact O-N 2.63Å; I448-F482 CarbonylContact C-O 3.58Å; I448-F482 VanDerWaalsContact CA-O 3.25Å; I448-F482 WeakPolarHBondContact CA-O 3.49Å; I448-F482 HydrophobicContact CG1-CB 4.08Å; I448-F482 HydrophobicContact CG1-CD1 4.28Å; I448-F482 HydrophobicContact CG2-CD1 4.16Å; Y449-F482 PolarHBondContact N-O 2.66Å; F482-K484 HydrophobicContact CE1-CB 4.22Å
483	V	96.8	Very high	93.4	Very high	17 Å²	17	59.7 Å²	59.7	10%	0.103	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	120.6	179.9	176.2	0	0	0	0	110.2	Y449 V451 I472 T475 Q476 F481 R485	Y449-V483 WeakPolarHBondContact O-CA 3.46Å; V451-V483 HydrophobicContact CG2-CG1 4.27Å; I472-V483 HydrophobicContact CG2-CG1 3.57Å; I472-V483 HydrophobicContact CG2-CG2 4.45Å; T475-V483 HydrophobicContact CG2-CG2 4.48Å; Q476-V483 HydrophobicContact CB-CB 4.35Å; Q476-V483 HydrophobicContact CB-CG2 3.66Å; Q476-V483 HydrophobicContact CG-CB 4.48Å; Q476-V483 HydrophobicContact CG-CG2 4.21Å; F481-V483 PolarHBondContact O-N 2.95Å; V483-R485 HydrophobicContact CG1-CG 4.39Å
484	K	96.8	Very high	93.3	Very high	78 Å²	78	59.1 Å²	59.1	34%	0.339	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	117.9	170.3	179	63.2	180	176.4	0	109	Y449 L450 V451 F482 V486 Y495	Y449-K484 PolarHBondContact O-N 3.31Å; L450-K484 CarbonylContact C-O 3.59Å; L450-K484 WeakPolarHBondContact CA-O 3.36Å; L450-K484 HydrophobicContact CD1-CB 3.83Å; L450-K484 HydrophobicContact CD1-CG 3.58Å; V451-K484 PolarHBondContact N-O 3.26Å; F482-K484 HydrophobicContact CE1-CB 4.22Å; K484-V486 HydrophobicContact CG-CG1 4.13Å; K484-Y495 HydrophobicContact CB-CE1 4.31Å; K484-Y495 HydrophobicContact CD-CD2 4.09Å; K484-Y495 HydrophobicContact CD-CE2 4.01Å; K484-Y495 HydrophobicContact CG-CD1 4.17Å; K484-Y495 HydrophobicContact CG-CD2 3.99Å; K484-Y495 HydrophobicContact CG-CE1 4.09Å; K484-Y495 HydrophobicContact CG-CE2 3.92Å; K484-Y495 HydrophobicContact CG-CG 4.11Å
485	R	94.9	Very high	93.4	Very high	109 Å²	109	57.8 Å²	57.8	41%	0.411	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	136.7	171.1	-65	176.9	177	84.1	-8.3	109.4	V451 I472 V483	V451-R485 HydrophobicContact CB-CG 4.48Å; V451-R485 WeakPolarHBondContact O-CA 3.46Å; I472-R485 VanDerWaalsContact CG2-NH2 3.33Å; V483-R485 HydrophobicContact CG1-CG 4.39Å
486	V	93.6	Very high	93.5	Very high	7 Å²	7	57.8 Å²	57.8	4%	0.042	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	147.8	177.7	-69.1	0	0	0	0	109.6	L450 V451 E452 G453 K484 E491 S492	L450-V486 HydrophobicContact CD1-CB 4.39Å; L450-V486 HydrophobicContact CD1-CG1 3.71Å; L450-V486 HydrophobicContact CD1-CG2 3.72Å; L450-V486 HydrophobicContact CG-CG2 4.07Å; V451-V486 WeakPolarHBondContact O-CG2 3.47Å; V451-V486 PolarHBondContact O-N 3.25Å; E452-V486 WeakPolarHBondContact CA-O 3.47Å; E452-V486 HydrophobicContact CB-CG2 4.02Å; E452-V486 HydrophobicContact CG-CG2 4.32Å; G453-V486 PolarHBondContact N-O 3.02Å; K484-V486 HydrophobicContact CG-CG1 4.13Å; V486-E491 WeakPolarHBondContact CA-OE2 3.33Å; V486-E491 HydrophobicContact CB-CB 3.9Å; V486-E491 HydrophobicContact CG1-CB 4.12Å; V486-S492 VanDerWaalsContact CG2-OG 3.23Å; V486-S492 WeakPolarHBondContact CG2-OG 3.44Å
487	Q	90.1	Very high	93.6	Very high	127 Å²	127	53.7 Å²	53.7	59%	0.593	28%	0.279	S	S	*	.	S	Bend	trans	-77.2	-43.3	-175.5	-65.2	-177.7	65.9	0	0	112.2	G453 E491	G453-Q487 WeakPolarHBondContact CA-O 3.35Å; Q487-E491 PolarHBondContact N-OE2 3.37Å; Q487-E491 PolarHBondContact NE2-OE1 2.8Å
488	D	87.4	Confident	93.6	Very high	49 Å²	49	52.9 Å²	52.9	26%	0.262	28%	0.275	S	S	.	.	S	Bend	trans	-145.3	-179.8	-173.5	71.2	15	0	0	0	112.5	R490 E491 S492	D488-R490 PolarHBondContact O-N 2.8Å; D488-R490 WeakPolarHBondContact OD1-CA 3.48Å; D488-R490 WeakPolarHBondContact OD1-CB 3.2Å; D488-R490 PolarHBondContact OD1-N 3.44Å; D488-R490 IonicContact OD2-CZ 3.23Å; D488-R490 IonicContact OD2-NE 2.7Å; D488-R490 PolarHBondContact OD2-NE 3.14Å; D488-R490 IonicContact OD2-NH2 3.19Å; D488-R490 PolarHBondContact OD2-NH2 2.81Å; D488-R490 VanDerWaalsContact OD2-NH2 3.11Å; D488-E491 PolarHBondContact O-N 2.64Å; D488-E491 PolarHBondContact OD1-N 3.48Å; D488-S492 PolarHBondContact O-N 3.33Å; D488-S492 PolarHBondContact O-OG 3.3Å; D488-S492 VanDerWaalsContact O-OG 3.06Å
489	V	88.8	Confident	93.8	Very high	8 Å²	8	49 Å²	49	5%	0.048	25%	0.25	C	C	.	.	H	α-helix	trans	-66.2	-26.8	179.2	68.2	0	0	0	0	112.5	E364 L365 E452 S492 A493	E364-V489 HydrophobicContact CB-CG1 4.22Å; E364-V489 HydrophobicContact CG-CG1 3.84Å; E364-V489 WeakPolarHBondContact OE2-CG1 3.38Å; L365-V489 HydrophobicContact CB-CG2 3.77Å; L365-V489 HydrophobicContact CD1-CG2 4.2Å; E452-V489 WeakPolarHBondContact OE2-CA 3.33Å; V489-S492 WeakPolarHBondContact O-CB 3.35Å; V489-S492 PolarHBondContact O-N 2.86Å; V489-A493 WeakPolarHBondContact O-CB 3.42Å; V489-A493 PolarHBondContact O-N 3.22Å
490	R	90.6	Very high	94.1	Very high	136 Å²	136	47.7 Å²	47.7	51%	0.513	24%	0.243	S	C	.	.	H	α-helix	trans	-73	-43	178.6	-62.3	-179.4	-67.3	-166.8	-4.6	110.5	E368 D488 S492 A493 A494	E368-R490 HydrophobicContact CG-CG 4.21Å; D488-R490 PolarHBondContact O-N 2.8Å; D488-R490 WeakPolarHBondContact OD1-CA 3.48Å; D488-R490 WeakPolarHBondContact OD1-CB 3.2Å; D488-R490 PolarHBondContact OD1-N 3.44Å; D488-R490 IonicContact OD2-CZ 3.23Å; D488-R490 IonicContact OD2-NE 2.7Å; D488-R490 PolarHBondContact OD2-NE 3.14Å; D488-R490 IonicContact OD2-NH2 3.19Å; D488-R490 PolarHBondContact OD2-NH2 2.81Å; D488-R490 VanDerWaalsContact OD2-NH2 3.11Å; R490-S492 VanDerWaalsContact C-N 3.29Å; R490-S492 PolarHBondContact O-N 3.05Å; R490-A493 PolarHBondContact O-N 2.81Å; R490-A494 WeakPolarHBondContact O-CB 3.28Å; R490-A494 PolarHBondContact O-N 3.48Å
491	E	93.6	Very high	94.3	Very high	74 Å²	74	51.5 Å²	51.5	35%	0.346	24%	0.239	S	C	.	.	H	α-helix	trans	-62.9	-36.9	170.5	-78.5	-167.4	180	0	0	111.9	V486 Q487 D488 A494 Y495	V486-E491 WeakPolarHBondContact CA-OE2 3.33Å; V486-E491 HydrophobicContact CB-CB 3.9Å; V486-E491 HydrophobicContact CG1-CB 4.12Å; Q487-E491 PolarHBondContact N-OE2 3.37Å; Q487-E491 PolarHBondContact NE2-OE1 2.8Å; D488-E491 PolarHBondContact O-N 2.64Å; D488-E491 PolarHBondContact OD1-N 3.48Å; E491-A494 PolarHBondContact O-N 3.07Å; E491-Y495 WeakPolarHBondContact O-CB 3.5Å; E491-Y495 PolarHBondContact O-N 3.31Å
492	S	93.6	Very high	94.2	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58.9	-49.4	171.7	-60.7	0	0	0	0	111.3	E452 V486 D488 V489 R490 A494 Y495 L496	E452-S492 PolarHBondContact OE2-OG 3Å; E452-S492 VanDerWaalsContact OE2-OG 3.12Å; V486-S492 VanDerWaalsContact CG2-OG 3.23Å; V486-S492 WeakPolarHBondContact CG2-OG 3.44Å; D488-S492 PolarHBondContact O-N 3.33Å; D488-S492 PolarHBondContact O-OG 3.3Å; D488-S492 VanDerWaalsContact O-OG 3.06Å; V489-S492 WeakPolarHBondContact O-CB 3.35Å; V489-S492 PolarHBondContact O-N 2.86Å; R490-S492 VanDerWaalsContact C-N 3.29Å; R490-S492 PolarHBondContact O-N 3.05Å; S492-A494 PolarHBondContact O-N 3.14Å; S492-Y495 PolarHBondContact O-N 2.9Å; S492-L496 WeakPolarHBondContact O-CG 3.26Å; S492-L496 PolarHBondContact O-N 2.87Å
493	A	93.8	Very high	94.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-40.8	177.7	0	0	0	0	0	112.3	L365 E368 L369 V489 R490 L496 T497	L365-A493 HydrophobicContact CD1-CB 3.84Å; E368-A493 HydrophobicContact CB-CB 3.66Å; L369-A493 HydrophobicContact CD2-CB 4.49Å; V489-A493 WeakPolarHBondContact O-CB 3.42Å; V489-A493 PolarHBondContact O-N 3.22Å; R490-A493 PolarHBondContact O-N 2.81Å; A493-L496 PolarHBondContact O-N 3.41Å; A493-T497 WeakPolarHBondContact O-CB 3.16Å; A493-T497 PolarHBondContact O-N 3.37Å; A493-T497 PolarHBondContact O-OG1 2.94Å
494	A	94.9	Very high	94	Very high	45 Å²	45	53 Å²	53	37%	0.372	25%	0.247	S	C	.	.	H	α-helix	trans	-63.1	-43.3	175.7	0	0	0	0	0	111.2	R490 E491 S492 T497 V498	R490-A494 WeakPolarHBondContact O-CB 3.28Å; R490-A494 PolarHBondContact O-N 3.48Å; E491-A494 PolarHBondContact O-N 3.07Å; S492-A494 PolarHBondContact O-N 3.14Å; A494-T497 WeakPolarHBondContact O-CB 3.05Å; A494-T497 PolarHBondContact O-N 3.42Å; A494-V498 WeakPolarHBondContact O-CG2 3.4Å; A494-V498 PolarHBondContact O-N 3.4Å
495	Y	96.7	Very high	93.8	Very high	33 Å²	33	56.9 Å²	56.9	13%	0.129	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-47.5	175.6	177.9	-108.6	0	0	0	111.9	I415 I448 L450 K484 E491 S492 T497 V498 M499	I415-Y495 HydrophobicContact CD1-CE1 4.05Å; I448-Y495 HydrophobicContact CG2-CE1 4.42Å; L450-Y495 HydrophobicContact CD1-CD1 3.94Å; L450-Y495 HydrophobicContact CD1-CE1 4.36Å; L450-Y495 HydrophobicContact CD2-CD1 4.5Å; K484-Y495 HydrophobicContact CB-CE1 4.31Å; K484-Y495 HydrophobicContact CD-CD2 4.09Å; K484-Y495 HydrophobicContact CD-CE2 4.01Å; K484-Y495 HydrophobicContact CG-CD1 4.17Å; K484-Y495 HydrophobicContact CG-CD2 3.99Å; K484-Y495 HydrophobicContact CG-CE1 4.09Å; K484-Y495 HydrophobicContact CG-CE2 3.92Å; K484-Y495 HydrophobicContact CG-CG 4.11Å; E491-Y495 WeakPolarHBondContact O-CB 3.5Å; E491-Y495 PolarHBondContact O-N 3.31Å; S492-Y495 PolarHBondContact O-N 2.9Å; Y495-T497 VanDerWaalsContact C-N 3.28Å; Y495-T497 PolarHBondContact O-N 3.06Å; Y495-V498 PolarHBondContact O-N 3.11Å; Y495-M499 HydrophobicContact CD1-CG 4.3Å; Y495-M499 HydrophobicContact CD2-CG 4.18Å; Y495-M499 HydrophobicContact CE1-CG 3.89Å; Y495-M499 HydrophobicContact CE2-CG 3.75Å; Y495-M499 HydrophobicContact CE2-SD 4.12Å; Y495-M499 HydrophobicContact CG-CG 4.45Å; Y495-M499 WeakPolarHBondContact O-CB 3.49Å; Y495-M499 VanDerWaalsContact O-CG 3.31Å; Y495-M499 WeakPolarHBondContact O-CG 3.44Å; Y495-M499 PolarHBondContact O-N 3.14Å
496	L	96.5	Very high	93.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.8	-39.3	175.8	-68.4	173.1	0	0	0	112	L347 L365 L369 F386 W388 I415 S492 A493 T500	L347-L496 HydrophobicContact CD1-CD2 4.44Å; L347-L496 HydrophobicContact CD2-CB 4.28Å; L365-L496 HydrophobicContact CD1-CD1 4.21Å; L369-L496 HydrophobicContact CD2-CB 4.13Å; F386-L496 HydrophobicContact CB-CD2 4.12Å; F386-L496 HydrophobicContact CD1-CD1 3.79Å; F386-L496 HydrophobicContact CD1-CD2 4.25Å; F386-L496 HydrophobicContact CD2-CD1 4.41Å; F386-L496 HydrophobicContact CD2-CD2 4.24Å; F386-L496 HydrophobicContact CE1-CD1 3.64Å; F386-L496 HydrophobicContact CE2-CD1 4.3Å; F386-L496 HydrophobicContact CG-CD1 4.18Å; F386-L496 HydrophobicContact CG-CD2 3.93Å; F386-L496 HydrophobicContact CZ-CD1 3.94Å; W388-L496 HydrophobicContact CH2-CD2 4.42Å; W388-L496 HydrophobicContact CZ2-CD2 4.44Å; I415-L496 HydrophobicContact CD1-CD2 3.44Å; I415-L496 VanDerWaalsContact CD1-CD2 3.44Å; S492-L496 WeakPolarHBondContact O-CG 3.26Å; S492-L496 PolarHBondContact O-N 2.87Å; A493-L496 PolarHBondContact O-N 3.41Å; L496-T500 WeakPolarHBondContact O-CB 3.46Å; L496-T500 PolarHBondContact O-N 2.94Å; L496-T500 PolarHBondContact O-OG1 2.95Å
497	T	95.8	Very high	93.5	Very high	6 Å²	6	53.1 Å²	53.1	4%	0.037	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-50.6	176.5	-62.6	0	0	0	0	111.6	N372 V374 A493 A494 Y495 T500 R501	N372-T497 HydrophobicContact CB-CG2 3.82Å; N372-T497 PolarHBondContact ND2-OG1 2.86Å; V374-T497 HydrophobicContact CG2-CG2 3.62Å; A493-T497 WeakPolarHBondContact O-CB 3.16Å; A493-T497 PolarHBondContact O-N 3.37Å; A493-T497 PolarHBondContact O-OG1 2.94Å; A494-T497 WeakPolarHBondContact O-CB 3.05Å; A494-T497 PolarHBondContact O-N 3.42Å; Y495-T497 VanDerWaalsContact C-N 3.28Å; Y495-T497 PolarHBondContact O-N 3.06Å; T497-T500 PolarHBondContact O-N 3.45Å; T497-R501 WeakPolarHBondContact O-CG 3.44Å; T497-R501 PolarHBondContact O-N 2.73Å
498	V	96.4	Very high	93.4	Very high	95 Å²	95	52.9 Å²	52.9	58%	0.576	25%	0.251	S	S	*	.	H	α-helix	trans	-63.3	-44.3	179.7	171.8	0	0	0	0	110.5	A494 Y495 T500 R501 Y502	A494-V498 WeakPolarHBondContact O-CG2 3.4Å; A494-V498 PolarHBondContact O-N 3.4Å; Y495-V498 PolarHBondContact O-N 3.11Å; V498-T500 PolarHBondContact O-N 3.23Å; V498-R501 PolarHBondContact O-N 3.38Å; V498-Y502 WeakPolarHBondContact O-CB 3.27Å; V498-Y502 PolarHBondContact O-N 3.4Å
499	M	96	Very high	93.4	Very high	24 Å²	24	57 Å²	57	12%	0.118	27%	0.273	C	S	.	.	H	α-helix	trans	-59.3	-46.1	175.8	-78	-65.9	-65.9	0	0	111.6	W388 Y413 I448 Y495 R501 Y502 L503	W388-M499 HydrophobicContact CH2-CB 3.8Å; W388-M499 HydrophobicContact CH2-CE 4.19Å; W388-M499 HydrophobicContact CH2-CG 4.38Å; W388-M499 HydrophobicContact CZ2-CB 3.55Å; Y413-M499 HydrophobicContact CD1-CE 4.32Å; I448-M499 HydrophobicContact CD1-CE 3.99Å; Y495-M499 HydrophobicContact CD1-CG 4.3Å; Y495-M499 HydrophobicContact CD2-CG 4.18Å; Y495-M499 HydrophobicContact CE1-CG 3.89Å; Y495-M499 HydrophobicContact CE2-CG 3.75Å; Y495-M499 HydrophobicContact CE2-SD 4.12Å; Y495-M499 HydrophobicContact CG-CG 4.45Å; Y495-M499 WeakPolarHBondContact O-CB 3.49Å; Y495-M499 VanDerWaalsContact O-CG 3.31Å; Y495-M499 WeakPolarHBondContact O-CG 3.44Å; Y495-M499 PolarHBondContact O-N 3.14Å; M499-R501 PolarHBondContact O-N 3.46Å; M499-Y502 PolarHBondContact O-N 3.03Å; M499-L503 HydrophobicContact CE-CD1 4.46Å; M499-L503 WeakPolarHBondContact O-CB 3.4Å; M499-L503 VanDerWaalsContact O-CG 3.27Å; M499-L503 WeakPolarHBondContact O-CG 3.39Å; M499-L503 PolarHBondContact O-N 2.61Å
500	T	95.8	Very high	93.5	Very high	8 Å²	8	60 Å²	60	5%	0.049	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-49.6	179	-54.5	0	0	0	0	110.9	V374 W388 L496 T497 V498 Y502 L503 S504	V374-T500 HydrophobicContact CG1-CG2 3.9Å; W388-T500 PolarHBondContact NE1-OG1 3.13Å; L496-T500 WeakPolarHBondContact O-CB 3.46Å; L496-T500 PolarHBondContact O-N 2.94Å; L496-T500 PolarHBondContact O-OG1 2.95Å; T497-T500 PolarHBondContact O-N 3.45Å; V498-T500 PolarHBondContact O-N 3.23Å; T500-Y502 VanDerWaalsContact C-N 3.32Å; T500-Y502 PolarHBondContact O-N 2.48Å; T500-L503 PolarHBondContact O-N 3.42Å; T500-S504 PolarHBondContact O-N 2.97Å; T500-S504 PolarHBondContact O-OG 3.5Å
501	R	95.7	Very high	93.4	Very high	139 Å²	139	56.4 Å²	56.4	53%	0.525	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-38.5	178.5	-68.2	175.5	-178.3	174.7	2.1	112.5	N372 T497 V498 M499 K505	N372-R501 PolarHBondContact O-NH2 2.62Å; T497-R501 WeakPolarHBondContact O-CG 3.44Å; T497-R501 PolarHBondContact O-N 2.73Å; V498-R501 PolarHBondContact O-N 3.38Å; M499-R501 PolarHBondContact O-N 3.46Å; R501-K505 WeakPolarHBondContact O-CG 3.31Å; R501-K505 PolarHBondContact O-N 3.3Å
502	Y	94.9	Very high	93.3	Very high	128 Å²	128	52.9 Å²	52.9	50%	0.502	26%	0.26	S	S	.	.	H	α-helix	trans	-64.4	-47.9	175.8	175.2	-103.5	0	0	0	111.3	V498 M499 T500 K505 L506	V498-Y502 WeakPolarHBondContact O-CB 3.27Å; V498-Y502 PolarHBondContact O-N 3.4Å; M499-Y502 PolarHBondContact O-N 3.03Å; T500-Y502 VanDerWaalsContact C-N 3.32Å; T500-Y502 PolarHBondContact O-N 2.48Å; Y502-K505 PolarHBondContact O-N 3.11Å; Y502-L506 HydrophobicContact CE1-CD2 4Å; Y502-L506 WeakPolarHBondContact O-CB 3.36Å; Y502-L506 PolarHBondContact O-N 2.87Å
503	L	94.1	Very high	93.1	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-41.3	178.6	-67.7	174.7	0	0	0	111.9	V345 W388 L411 Y413 M499 T500 K505 L506 Y507	V345-L503 HydrophobicContact CG1-CB 4.22Å; W388-L503 HydrophobicContact CB-CD1 4.28Å; W388-L503 HydrophobicContact CD2-CD1 3.4Å; W388-L503 VanDerWaalsContact CD2-CD1 3.4Å; W388-L503 HydrophobicContact CE3-CD1 3.69Å; W388-L503 HydrophobicContact CG-CD1 3.68Å; W388-L503 HydrophobicContact CH2-CD1 4.4Å; W388-L503 HydrophobicContact CZ2-CD1 4.21Å; W388-L503 HydrophobicContact CZ3-CD1 4.18Å; L411-L503 HydrophobicContact CD2-CB 4.25Å; L411-L503 HydrophobicContact CD2-CD1 4.21Å; L411-L503 HydrophobicContact CD2-CD2 4.37Å; Y413-L503 HydrophobicContact CD2-CD1 4.1Å; Y413-L503 HydrophobicContact CD2-CD2 3.56Å; Y413-L503 HydrophobicContact CE2-CD2 3.33Å; Y413-L503 HydrophobicContact CG-CD1 4.38Å; Y413-L503 HydrophobicContact CG-CD2 4.3Å; M499-L503 HydrophobicContact CE-CD1 4.46Å; M499-L503 WeakPolarHBondContact O-CB 3.4Å; M499-L503 VanDerWaalsContact O-CG 3.27Å; M499-L503 WeakPolarHBondContact O-CG 3.39Å; M499-L503 PolarHBondContact O-N 2.61Å; T500-L503 PolarHBondContact O-N 3.42Å; L503-K505 VanDerWaalsContact C-N 3.29Å; L503-K505 PolarHBondContact O-N 3.47Å; L503-L506 HydrophobicContact CD2-CD2 4.18Å; L503-L506 PolarHBondContact O-N 2.89Å; L503-Y507 HydrophobicContact CD2-CE2 4.22Å; L503-Y507 WeakPolarHBondContact O-CD2 3.11Å; L503-Y507 PolarHBondContact O-N 3.41Å
504	S	93.8	Very high	92.7	Very high	47 Å²	47	57.4 Å²	57.4	33%	0.329	29%	0.289	S	S	.	.	H	α-helix	trans	-56.8	-43.6	174	-56.1	0	0	0	0	111.8	T500 Q508	T500-S504 PolarHBondContact O-N 2.97Å; T500-S504 PolarHBondContact O-OG 3.5Å; S504-Q508 WeakPolarHBondContact O-CB 3.42Å; S504-Q508 PolarHBondContact O-N 3.48Å; S504-Q508 VanDerWaalsContact O-N 3.09Å
505	K	93.1	Very high	92.1	Very high	159 Å²	159	56.1 Å²	56.1	69%	0.691	27%	0.274	S	S	*	.	H	α-helix	trans	-68.6	-40.3	176	-72.1	179.3	179.6	-174.9	0	112.5	R501 Y502 L503 Y507 Q508	R501-K505 WeakPolarHBondContact O-CG 3.31Å; R501-K505 PolarHBondContact O-N 3.3Å; Y502-K505 PolarHBondContact O-N 3.11Å; L503-K505 VanDerWaalsContact C-N 3.29Å; L503-K505 PolarHBondContact O-N 3.47Å; K505-Y507 VanDerWaalsContact C-N 3.27Å; K505-Y507 PolarHBondContact O-N 2.71Å; K505-Q508 PolarHBondContact O-N 3.47Å
506	L	91.2	Very high	91.2	Very high	37 Å²	37	56.2 Å²	56.2	19%	0.194	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-35.5	-177.7	-174.3	65.3	0	0	0	112.4	Y502 L503 R510 P533	Y502-L506 HydrophobicContact CE1-CD2 4Å; Y502-L506 WeakPolarHBondContact O-CB 3.36Å; Y502-L506 PolarHBondContact O-N 2.87Å; L503-L506 HydrophobicContact CD2-CD2 4.18Å; L503-L506 PolarHBondContact O-N 2.89Å; L506-R510 WeakPolarHBondContact O-CD 3.48Å; L506-R510 PolarHBondContact O-NE 3.08Å; L506-R510 VanDerWaalsContact O-NE 3.08Å; L506-P533 HydrophobicContact CD1-CG 3.95Å; L506-P533 HydrophobicContact CD2-CB 3.79Å; L506-P533 HydrophobicContact CD2-CG 4.01Å; L506-P533 HydrophobicContact CG-CB 4.12Å; L506-P533 HydrophobicContact CG-CG 3.81Å
507	Y	91.1	Very high	90	Very high	1 Å²	1	59 Å²	59	0%	0.004	29%	0.29	C	S	.	.	H	α-helix	trans	-99.4	-9.5	-178.1	-73.4	-79.4	0	0	0	114.4	Y343 L411 L503 K505 N509 R510 L512 P533 S534	Y343-Y507 PolarHBondContact OH-O 2.87Å; L411-Y507 HydrophobicContact CD2-CD2 3.71Å; L411-Y507 HydrophobicContact CD2-CE2 3.42Å; L411-Y507 VanDerWaalsContact CD2-CE2 3.42Å; L411-Y507 HydrophobicContact CG-CD2 4.42Å; L411-Y507 HydrophobicContact CG-CE2 3.92Å; L503-Y507 HydrophobicContact CD2-CE2 4.22Å; L503-Y507 WeakPolarHBondContact O-CD2 3.11Å; L503-Y507 PolarHBondContact O-N 3.41Å; K505-Y507 VanDerWaalsContact C-N 3.27Å; K505-Y507 PolarHBondContact O-N 2.71Å; Y507-N509 PolarHBondContact O-N 3.04Å; Y507-R510 HydrophobicContact CD1-CB 4.42Å; Y507-R510 PolarHBondContact O-N 3.08Å; Y507-L512 HydrophobicContact CD1-CD2 3.58Å; Y507-L512 HydrophobicContact CE1-CD2 3.82Å; Y507-P533 HydrophobicContact CE1-CB 4.06Å; Y507-P533 HydrophobicContact CE2-CB 4.28Å; Y507-P533 WeakPolarHBondContact OH-CB 3.4Å; Y507-S534 WeakPolarHBondContact CE1-O 3.15Å; Y507-S534 PolarHBondContact OH-O 3.33Å
508	Q	88.3	Confident	88.5	Confident	122 Å²	122	66.9 Å²	66.9	57%	0.57	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	-40.8	-173.7	-170.8	171.7	11.4	0	0	115	S504 K505	S504-Q508 WeakPolarHBondContact O-CB 3.42Å; S504-Q508 PolarHBondContact O-N 3.48Å; S504-Q508 VanDerWaalsContact O-N 3.09Å; K505-Q508 PolarHBondContact O-N 3.47Å
509	N	87.5	Confident	86.7	Confident	136 Å²	136	69.7 Å²	69.7	73%	0.727	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	26.6	-176.7	-65	-24.1	0	0	0	113.3	Y507	Y507-N509 PolarHBondContact O-N 3.04Å
510	R	89.4	Confident	84.9	Confident	71 Å²	71	73.7 Å²	73.7	27%	0.268	36%	0.356	S	S	.	.			trans	-115	139.1	-177.3	-64.3	-175.5	179.9	-98.7	-1.3	111.9	Y343 L506 Y507 P533	Y343-R510 WeakPolarHBondContact CE1-O 3.45Å; Y343-R510 PolarHBondContact OH-O 3.31Å; L506-R510 WeakPolarHBondContact O-CD 3.48Å; L506-R510 PolarHBondContact O-NE 3.08Å; L506-R510 VanDerWaalsContact O-NE 3.08Å; Y507-R510 HydrophobicContact CD1-CB 4.42Å; Y507-R510 PolarHBondContact O-N 3.08Å; R510-P533 VanDerWaalsContact CZ-CG 3.43Å
511	T	90.1	Very high	83.2	Confident	59 Å²	59	74.8 Å²	74.8	36%	0.362	37%	0.369	S	S	.	.			trans	-83.3	124.9	168.5	-58.6	0	0	0	0	108.7	C337 L338 L339 P340 C535	C337-T511 HydrophobicContact CB-CG2 4.06Å; L338-T511 CarbonylContact O-C 3.57Å; L338-T511 WeakPolarHBondContact O-CA 3.33Å; L339-T511 HydrophobicContact CD2-CG2 3.96Å; P340-T511 WeakPolarHBondContact CD-OG1 3.28Å; T511-C535 WeakPolarHBondContact O-CB 3.3Å
512	L	90.7	Very high	81.5	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	138.4	176.1	-52.6	177.1	0	0	0	109.6	C337 L338 Y343 A390 L409 Y507 C535 L537	C337-L512 CarbonylContact C-O 3.4Å; C337-L512 WeakPolarHBondContact CA-O 3.49Å; C337-L512 WeakPolarHBondContact CB-O 3.49Å; L338-L512 HydrophobicContact CB-CB 4.22Å; L338-L512 HydrophobicContact CD1-CD1 4.49Å; L338-L512 PolarHBondContact N-O 3.49Å; L338-L512 PolarHBondContact O-N 3.46Å; Y343-L512 HydrophobicContact CD1-CD1 4.45Å; Y343-L512 HydrophobicContact CD2-CD1 4.06Å; Y343-L512 HydrophobicContact CE1-CD1 4.02Å; Y343-L512 HydrophobicContact CE1-CG 4.04Å; Y343-L512 HydrophobicContact CE2-CD1 3.59Å; Y343-L512 HydrophobicContact CE2-CG 4.29Å; Y343-L512 HydrophobicContact CG-CD1 4.45Å; A390-L512 HydrophobicContact CB-CD1 3.25Å; L409-L512 HydrophobicContact CD1-CB 3.77Å; Y507-L512 HydrophobicContact CD1-CD2 3.58Å; Y507-L512 HydrophobicContact CE1-CD2 3.82Å; L512-C535 CarbonylContact C-O 3.49Å; L512-C535 WeakPolarHBondContact CA-O 3.3Å; L512-L537 HydrophobicContact CB-CD1 4.46Å; L512-L537 HydrophobicContact CD1-CD1 4.05Å; L512-L537 HydrophobicContact CD2-CD1 3.95Å; L512-L537 HydrophobicContact CG-CD1 4.39Å
513	V	89	Confident	79.5	Confident	59 Å²	59	71.8 Å²	71.8	36%	0.358	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132.4	178.8	-175.4	0	0	0	0	108.2	R515 C535 L537	V513-R515 PolarHBondContact O-N 2.75Å; V513-C535 PolarHBondContact N-O 2.66Å; V513-L537 PolarHBondContact O-N 3.39Å
514	C	85	Confident	77.6	Confident	37 Å²	37	76 Å²	76	25%	0.25	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	119.2	171.2	-166.5	0	0	0	0	109.3	D336 L409 L537	D336-C514 VanDerWaalsContact O-CB 3.29Å; D336-C514 WeakPolarHBondContact O-CB 3.15Å; D336-C514 PolarHBondContact O-N 2.97Å; L409-C514 HydrophobicContact CD1-CB 4.48Å; L409-C514 HydrophobicContact CD2-CB 3.67Å; L409-C514 VanDerWaalsContact CD2-SG 3.57Å; C514-L537 CarbonylContact C-O 3.54Å; C514-L537 VanDerWaalsContact CA-O 3.31Å; C514-L537 WeakPolarHBondContact CA-O 3.21Å
515	R	82.4	Confident	75.7	Confident	17 Å²	17	76.1 Å²	76.1	6%	0.064	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-102.1	146.9	169.4	68.6	179.3	-170.8	103.2	-2.5	110.8	V513 E520 G521 D522 S536 L537 I538	V513-R515 PolarHBondContact O-N 2.75Å; R515-E520 WeakPolarHBondContact CB-OE2 3.32Å; R515-G521 PolarHBondContact NH1-O 3.34Å; R515-D522 IonicContact NH2-OD1 3.33Å; R515-S536 WeakPolarHBondContact CB-OG 3.37Å; R515-S536 VanDerWaalsContact CD-OG 3.3Å; R515-S536 WeakPolarHBondContact CD-OG 3.43Å; R515-L537 PolarHBondContact N-O 3.26Å; R515-I538 HydrophobicContact CG-CG2 3.83Å
516	S	77.9	Confident	73.5	Confident	35 Å²	35	75.3 Å²	75.3	25%	0.245	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-93.4	116.4	167.7	176.9	0	0	0	0	109.1	E518 L519 E520	S516-E518 PolarHBondContact O-N 3.35Å; S516-L519 PolarHBondContact O-N 3.25Å; S516-E520 WeakPolarHBondContact O-CB 3.27Å; S516-E520 PolarHBondContact O-N 2.94Å
517	R	71.2	Confident	71.5	Confident	58 Å²	58	79.8 Å²	79.8	22%	0.219	43%	0.427	C	S	.	.	H	α-helix	trans	-65.2	-30.7	178.6	-168.2	180	-174.9	-154.8	-8.4	112	R441 C442 G521 D522 I538 E542	R441-R517 PolarHBondContact O-NH1 3.21Å; R441-R517 PolarHBondContact O-NH2 3.46Å; C442-R517 PolarHBondContact O-NH1 3.39Å; R517-G521 WeakPolarHBondContact O-CA 3.32Å; R517-G521 PolarHBondContact O-N 3.21Å; R517-D522 IonicContact CZ-OD1 3.4Å; R517-D522 IonicContact CZ-OD2 3.76Å; R517-D522 IonicContact NE-OD1 2.8Å; R517-D522 PolarHBondContact NE-OD1 3.22Å; R517-D522 IonicContact NE-OD2 3.18Å; R517-D522 IonicContact NH2-OD1 3.48Å; R517-D522 IonicContact NH2-OD2 3.91Å; R517-D522 PolarHBondContact NH2-OD2 2.98Å; R517-I538 HydrophobicContact CB-CG2 4.14Å; R517-E542 WeakPolarHBondContact CA-OE1 3.37Å; R517-E542 WeakPolarHBondContact CB-OE1 3.3Å; R517-E542 PolarHBondContact N-OE1 3.48Å
518	E	64.3	Low	69.6	Low	172 Å²	172	81.4 Å²	81.4	80%	0.804	44%	0.435	S	S	*	.	H	α-helix	trans	-67.7	-37	-179.9	-64	-175.2	172.2	0	0	112.6	S516	S516-E518 PolarHBondContact O-N 3.35Å
519	L	58.8	Low	67.7	Low	154 Å²	154	84 Å²	84	81%	0.806	45%	0.447	S	S	*	.	H	α-helix	trans	-89.8	-38.1	-177.4	-64.2	173.8	0	0	0	112.7	S516	S516-L519 PolarHBondContact O-N 3.25Å
520	E	59.9	Low	65.8	Low	108 Å²	108	87.6 Å²	87.6	51%	0.505	45%	0.45	S	S	.	.	H	α-helix	trans	-101	-15.2	-171.7	-65.6	174.3	-163.4	0	0	113.2	R515 S516 V523	R515-E520 WeakPolarHBondContact CB-OE2 3.32Å; S516-E520 WeakPolarHBondContact O-CB 3.27Å; S516-E520 PolarHBondContact O-N 2.94Å; E520-V523 WeakPolarHBondContact O-CG2 3.49Å
521	G	59.8	Low	64.3	Low	31 Å²	31	86.8 Å²	86.8	32%	0.32	46%	0.464	S	S	.	.			trans	71.5	-167.3	-177.1	0	0	0	0	0	113.7	R515 R517 V523	R515-G521 PolarHBondContact NH1-O 3.34Å; R517-G521 WeakPolarHBondContact O-CA 3.32Å; R517-G521 PolarHBondContact O-N 3.21Å; G521-V523 VanDerWaalsContact C-N 3.31Å; G521-V523 PolarHBondContact O-N 3.18Å
522	D	58.9	Low	63.1	Low	98 Å²	98	87.1 Å²	87.1	52%	0.524	46%	0.463	S	S	.	.	S	Bend	trans	-93.3	55.9	175.2	-72.4	-25.6	0	0	0	109.8	R515 R517 P524	R515-D522 IonicContact NH2-OD1 3.33Å; R517-D522 IonicContact CZ-OD1 3.4Å; R517-D522 IonicContact CZ-OD2 3.76Å; R517-D522 IonicContact NE-OD1 2.8Å; R517-D522 PolarHBondContact NE-OD1 3.22Å; R517-D522 IonicContact NE-OD2 3.18Å; R517-D522 IonicContact NH2-OD1 3.48Å; R517-D522 IonicContact NH2-OD2 3.91Å; R517-D522 PolarHBondContact NH2-OD2 2.98Å; D522-P524 WeakPolarHBondContact O-CD 3.5Å
523	V	53.8	Low	62.1	Low	106 Å²	106	87.8 Å²	87.8	64%	0.642	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-76.1	119.3	179.2	-174.5	0	0	0	0	109	E520 G521 S525	E520-V523 WeakPolarHBondContact O-CG2 3.49Å; G521-V523 VanDerWaalsContact C-N 3.31Å; G521-V523 PolarHBondContact O-N 3.18Å; V523-S525 PolarHBondContact O-N 3.04Å
524	P	53.9	Low	61.6	Low	88 Å²	88	85.2 Å²	85.2	57%	0.571	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-69.1	128.4	168.3	-5.3	21.6	0	0	0	108.4	D522	D522-P524 WeakPolarHBondContact O-CD 3.5Å
525	S	53.6	Low	61.5	Low	50 Å²	50	85.2 Å²	85.2	35%	0.35	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-75.2	144.4	169.4	61.6	0	0	0	0	110.6	V523 E527 E528	V523-S525 PolarHBondContact O-N 3.04Å; S525-E527 PolarHBondContact O-N 3.32Å; S525-E528 WeakPolarHBondContact CB-OE1 3.26Å; S525-E528 PolarHBondContact N-OE1 2.97Å; S525-E528 VanDerWaalsContact O-CB 3.3Å; S525-E528 WeakPolarHBondContact O-CB 3.4Å; S525-E528 PolarHBondContact O-N 3.05Å; S525-E528 WeakPolarHBondContact OG-CG 3.06Å; S525-E528 PolarHBondContact OG-OE1 3.23Å
526	D	46.2	Very low	61.7	Low	143 Å²	143	86 Å²	86	77%	0.765	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-17.9	179.2	-68	-31.4	0	0	0	113.5
527	E	49.8	Very low	62.3	Low	130 Å²	130	84.4 Å²	84.4	61%	0.607	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-18.1	174.4	-63.7	-146.6	161.8	0	0	114	S525 R530	S525-E527 PolarHBondContact O-N 3.32Å; E527-R530 PolarHBondContact O-N 2.78Å
528	E	51.3	Low	63.2	Low	36 Å²	36	81.9 Å²	81.9	17%	0.168	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-29.5	178.6	-72.5	160.9	-139.1	0	0	112.7	R445 S525 R530 G531	R445-E528 IonicContact CZ-OE1 2.72Å; R445-E528 IonicContact CZ-OE2 3.37Å; R445-E528 IonicContact NH1-OE1 2.66Å; R445-E528 PolarHBondContact NH1-OE1 2.86Å; R445-E528 IonicContact NH1-OE2 2.7Å; R445-E528 PolarHBondContact NH1-OE2 2.87Å; S525-E528 WeakPolarHBondContact CB-OE1 3.26Å; S525-E528 PolarHBondContact N-OE1 2.97Å; S525-E528 VanDerWaalsContact O-CB 3.3Å; S525-E528 WeakPolarHBondContact O-CB 3.4Å; S525-E528 PolarHBondContact O-N 3.05Å; S525-E528 WeakPolarHBondContact OG-CG 3.06Å; S525-E528 PolarHBondContact OG-OE1 3.23Å; E528-R530 PolarHBondContact O-N 3.07Å; E528-G531 PolarHBondContact O-N 3.41Å; E528-G531 VanDerWaalsContact O-N 3.14Å
529	E	47.5	Very low	64.5	Low	176 Å²	176	75.1 Å²	75.1	82%	0.822	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-21.6	175.4	-69.2	-161.7	153.9	0	0	112.3	G531	E529-G531 VanDerWaalsContact C-N 3.3Å; E529-G531 PolarHBondContact O-N 3.1Å
530	R	48.9	Very low	66.1	Low	212 Å²	212	68.9 Å²	68.9	80%	0.8	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	3.5	175.6	-66.2	-177.6	-172.5	-96.5	-1.2	113.9	E527 E528 N532	E527-R530 PolarHBondContact O-N 2.78Å; E528-R530 PolarHBondContact O-N 3.07Å; R530-N532 VanDerWaalsContact C-N 3.33Å
531	G	57.4	Low	67.5	Low	54 Å²	54	67.1 Å²	67.1	56%	0.557	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	11.5	178.7	0	0	0	0	0	114.8	E528 E529	E528-G531 PolarHBondContact O-N 3.41Å; E528-G531 VanDerWaalsContact O-N 3.14Å; E529-G531 VanDerWaalsContact C-N 3.3Å; E529-G531 PolarHBondContact O-N 3.1Å
532	N	64.3	Low	69	Low	65 Å²	65	67.9 Å²	67.9	35%	0.348	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-74.7	147	175.3	-78.3	-27	0	0	0	111.6	R530	R530-N532 VanDerWaalsContact C-N 3.33Å
533	P	70	Confident	70.5	Confident	14 Å²	14	63.3 Å²	63.3	9%	0.091	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-65.5	133.7	173.2	28.1	-35	0	0	0	110.4	L506 Y507 R510 C535	L506-P533 HydrophobicContact CD1-CG 3.95Å; L506-P533 HydrophobicContact CD2-CB 3.79Å; L506-P533 HydrophobicContact CD2-CG 4.01Å; L506-P533 HydrophobicContact CG-CB 4.12Å; L506-P533 HydrophobicContact CG-CG 3.81Å; Y507-P533 HydrophobicContact CE1-CB 4.06Å; Y507-P533 HydrophobicContact CE2-CB 4.28Å; Y507-P533 WeakPolarHBondContact OH-CB 3.4Å; R510-P533 VanDerWaalsContact CZ-CG 3.43Å; P533-C535 PolarHBondContact O-N 3.04Å
534	S	77.9	Confident	72.3	Confident	6 Å²	6	59.5 Å²	59.5	4%	0.042	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-64.6	131	177.7	-175.3	0	0	0	0	110.6	D412 R445 Y507 S536	D412-S534 WeakPolarHBondContact OD2-CB 3.27Å; R445-S534 PolarHBondContact NH1-OG 3.37Å; R445-S534 PolarHBondContact NH2-OG 2.94Å; Y507-S534 WeakPolarHBondContact CE1-O 3.15Å; Y507-S534 PolarHBondContact OH-O 3.33Å; S534-S536 PolarHBondContact OG-N 3.37Å; S534-S536 VanDerWaalsContact OG-N 3.16Å; S534-S536 PolarHBondContact OG-O 3.07Å; S534-S536 VanDerWaalsContact OG-O 3.09Å
535	C	83.4	Confident	73.9	Confident	36 Å²	36	62.5 Å²	62.5	24%	0.243	34%	0.335	C	S	.	.			trans	-97	-4	171.3	-61.7	0	0	0	0	111.8	T511 L512 V513 P533	T511-C535 WeakPolarHBondContact O-CB 3.3Å; L512-C535 CarbonylContact C-O 3.49Å; L512-C535 WeakPolarHBondContact CA-O 3.3Å; V513-C535 PolarHBondContact N-O 2.66Å; P533-C535 PolarHBondContact O-N 3.04Å
536	S	86.9	Confident	75.3	Confident	35 Å²	35	61.5 Å²	61.5	25%	0.245	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	101.7	176.2	-167.6	0	0	0	0	109.5	R445 R515 S534	R445-S536 PolarHBondContact NH2-O 3.37Å; R515-S536 WeakPolarHBondContact CB-OG 3.37Å; R515-S536 VanDerWaalsContact CD-OG 3.3Å; R515-S536 WeakPolarHBondContact CD-OG 3.43Å; S534-S536 PolarHBondContact OG-N 3.37Å; S534-S536 VanDerWaalsContact OG-N 3.16Å; S534-S536 PolarHBondContact OG-O 3.07Å; S534-S536 VanDerWaalsContact OG-O 3.09Å
537	L	89.6	Confident	77.1	Confident	1 Å²	1	55 Å²	55	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	151.5	-167.1	-59.4	-178	0	0	0	111.1	L409 L411 L512 V513 C514 R515	L409-L537 HydrophobicContact CB-CB 4.01Å; L409-L537 HydrophobicContact CB-CD1 4.15Å; L409-L537 HydrophobicContact CD1-CB 4.5Å; L411-L537 HydrophobicContact CD1-CD1 4.21Å; L411-L537 HydrophobicContact CG-CD1 4.49Å; L512-L537 HydrophobicContact CB-CD1 4.46Å; L512-L537 HydrophobicContact CD1-CD1 4.05Å; L512-L537 HydrophobicContact CD2-CD1 3.95Å; L512-L537 HydrophobicContact CG-CD1 4.39Å; V513-L537 PolarHBondContact O-N 3.39Å; C514-L537 CarbonylContact C-O 3.54Å; C514-L537 VanDerWaalsContact CA-O 3.31Å; C514-L537 WeakPolarHBondContact CA-O 3.21Å; R515-L537 PolarHBondContact N-O 3.26Å
538	I	90.7	Very high	78.8	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	156.3	175.3	62.1	-176.4	0	0	0	110.3	L409 V410 L444 R515 R517 F543	L409-I538 WeakPolarHBondContact CA-O 3.23Å; V410-I538 HydrophobicContact CG1-CD1 4.09Å; V410-I538 HydrophobicContact CG1-CG1 3.37Å; V410-I538 WeakPolarHBondContact CG1-O 3.34Å; V410-I538 PolarHBondContact N-O 3.15Å; L444-I538 HydrophobicContact CD2-CD1 4.24Å; R515-I538 HydrophobicContact CG-CG2 3.83Å; R517-I538 HydrophobicContact CB-CG2 4.14Å; I538-F543 HydrophobicContact CD1-CB 3.72Å; I538-F543 HydrophobicContact CD1-CD2 4.17Å; I538-F543 HydrophobicContact CD1-CG 4.42Å; I538-F543 HydrophobicContact CG1-CB 4.11Å
539	S	92.2	Very high	79.6	Confident	30 Å²	30	56.4 Å²	56.4	21%	0.21	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	148.5	173.9	73.7	0	0	0	0	111.2	E408 A541 E542 F543	E408-S539 WeakPolarHBondContact O-CA 3.38Å; S539-A541 PolarHBondContact O-N 3.42Å; S539-E542 PolarHBondContact O-N 3.49Å; S539-E542 WeakPolarHBondContact OG-CB 3.46Å; S539-E542 PolarHBondContact OG-N 3.18Å; S539-E542 VanDerWaalsContact OG-N 3.14Å; S539-F543 WeakPolarHBondContact O-CB 3.47Å; S539-F543 PolarHBondContact O-N 3.17Å
540	F	92.2	Very high	80.6	Confident	24 Å²	24	55.1 Å²	55.1	11%	0.105	31%	0.305	C	S	.	.	H	α-helix	trans	-58.9	-37.6	176.1	175.8	-100.6	0	0	0	112.1	L381 L387 V389 E408 F543 N544	L381-F540 HydrophobicContact CD2-CE2 3.86Å; L381-F540 HydrophobicContact CD2-CZ 4.03Å; L387-F540 HydrophobicContact CD1-CD2 4.41Å; L387-F540 HydrophobicContact CD1-CE2 4.28Å; V389-F540 HydrophobicContact CG1-CB 4.33Å; V389-F540 HydrophobicContact CG1-CD2 3.77Å; V389-F540 HydrophobicContact CG1-CG 4.3Å; E408-F540 HydrophobicContact CB-CB 4.02Å; E408-F540 PolarHBondContact O-N 3.12Å; F540-F543 HydrophobicContact CD2-CD1 4.44Å; F540-F543 PolarHBondContact O-N 3.39Å; F540-N544 HydrophobicContact CE1-CB 4.47Å; F540-N544 HydrophobicContact CZ-CB 4.36Å; F540-N544 WeakPolarHBondContact O-CB 3.47Å; F540-N544 PolarHBondContact O-N 3.38Å
541	A	90.2	Very high	81.5	Confident	70 Å²	70	50.2 Å²	50.2	58%	0.579	29%	0.289	S	S	*	.	H	α-helix	trans	-62.9	-47.5	178.3	0	0	0	0	0	111.9	S539 N544 H545	S539-A541 PolarHBondContact O-N 3.42Å; A541-N544 PolarHBondContact O-N 3.32Å; A541-H545 VanDerWaalsContact O-CB 3.23Å; A541-H545 WeakPolarHBondContact O-CB 3.47Å; A541-H545 PolarHBondContact O-N 3.11Å
542	E	89.6	Confident	81.8	Confident	47 Å²	47	54 Å²	54	22%	0.22	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-45.7	177	-177.2	-178	164.6	0	0	111.6	R517 S539 G546	R517-E542 WeakPolarHBondContact CA-OE1 3.37Å; R517-E542 WeakPolarHBondContact CB-OE1 3.3Å; R517-E542 PolarHBondContact N-OE1 3.48Å; S539-E542 PolarHBondContact O-N 3.49Å; S539-E542 WeakPolarHBondContact OG-CB 3.46Å; S539-E542 PolarHBondContact OG-N 3.18Å; S539-E542 VanDerWaalsContact OG-N 3.14Å; E542-G546 PolarHBondContact O-N 3.48Å
543	F	91.4	Very high	82.4	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.009	32%	0.315	C	S	.	.	H	α-helix	trans	-55.8	-54.2	175	164.4	-100.8	0	0	0	111.8	V383 L387 V410 I414 C442 L444 I538 S539 F540 H545 G546 A547	V383-F543 HydrophobicContact CG1-CE1 4.4Å; V383-F543 HydrophobicContact CG1-CE2 3.85Å; V383-F543 HydrophobicContact CG1-CZ 3.48Å; V383-F543 VanDerWaalsContact CG1-CZ 3.48Å; L387-F543 HydrophobicContact CD2-CD1 4.19Å; L387-F543 HydrophobicContact CD2-CE1 3.35Å; L387-F543 HydrophobicContact CD2-CZ 3.75Å; V410-F543 HydrophobicContact CG1-CB 3.75Å; V410-F543 HydrophobicContact CG1-CG 4.07Å; I414-F543 HydrophobicContact CD1-CE2 4.36Å; I414-F543 HydrophobicContact CD1-CZ 3.95Å; C442-F543 HydrophobicContact CB-CE2 3.88Å; L444-F543 HydrophobicContact CD1-CD2 3.93Å; L444-F543 HydrophobicContact CD1-CE2 3.39Å; L444-F543 HydrophobicContact CD1-CZ 3.83Å; L444-F543 HydrophobicContact CD2-CD2 4.17Å; L444-F543 HydrophobicContact CD2-CE2 4.42Å; L444-F543 HydrophobicContact CG-CD2 3.88Å; L444-F543 HydrophobicContact CG-CE2 3.66Å; I538-F543 HydrophobicContact CD1-CB 3.72Å; I538-F543 HydrophobicContact CD1-CD2 4.17Å; I538-F543 HydrophobicContact CD1-CG 4.42Å; I538-F543 HydrophobicContact CG1-CB 4.11Å; S539-F543 WeakPolarHBondContact O-CB 3.47Å; S539-F543 PolarHBondContact O-N 3.17Å; F540-F543 HydrophobicContact CD2-CD1 4.44Å; F540-F543 PolarHBondContact O-N 3.39Å; F543-H545 PolarHBondContact O-N 3.37Å; F543-G546 PolarHBondContact O-N 3.27Å; F543-A547 WeakPolarHBondContact O-CB 3.28Å; F543-A547 PolarHBondContact O-N 3.43Å
544	N	91.3	Very high	83.1	Confident	27 Å²	27	59.3 Å²	59.3	14%	0.144	33%	0.332	C	S	.	.	H	α-helix	trans	-69.5	-37.8	-172.2	-156	24.4	0	0	0	110.8	K380 N382 F540 A541 A547	K380-N544 PolarHBondContact O-ND2 3.25Å; N382-N544 WeakPolarHBondContact CB-OD1 3.5Å; N382-N544 PolarHBondContact N-OD1 3.22Å; N382-N544 PolarHBondContact ND2-O 3.19Å; N382-N544 PolarHBondContact ND2-OD1 3.3Å; F540-N544 HydrophobicContact CE1-CB 4.47Å; F540-N544 HydrophobicContact CZ-CB 4.36Å; F540-N544 WeakPolarHBondContact O-CB 3.47Å; F540-N544 PolarHBondContact O-N 3.38Å; A541-N544 PolarHBondContact O-N 3.32Å; N544-A547 PolarHBondContact O-N 3.01Å
545	H	87.3	Confident	83.8	Confident	151 Å²	151	63.4 Å²	63.4	70%	0.699	36%	0.357	S	S	*	.	H	α-helix	trans	-64.2	-46	173.1	-169.2	78.7	0	0	0	111.8	A541 F543 A547 V548	A541-H545 VanDerWaalsContact O-CB 3.23Å; A541-H545 WeakPolarHBondContact O-CB 3.47Å; A541-H545 PolarHBondContact O-N 3.11Å; F543-H545 PolarHBondContact O-N 3.37Å; H545-A547 PolarHBondContact O-N 2.63Å; H545-A547 VanDerWaalsContact O-N 3.16Å; H545-V548 WeakPolarHBondContact O-CB 3.07Å; H545-V548 WeakPolarHBondContact O-CG2 3.33Å; H545-V548 PolarHBondContact O-N 3.38Å
546	G	82.4	Confident	84.2	Confident	29 Å²	29	67 Å²	67	30%	0.299	37%	0.365	S	S	.	.	H	α-helix	trans	-65.4	-15.2	176.5	0	0	0	0	0	114.2	E542 F543 K551	E542-G546 PolarHBondContact O-N 3.48Å; F543-G546 PolarHBondContact O-N 3.27Å; G546-K551 WeakPolarHBondContact O-CE 3.37Å; G546-K551 PolarHBondContact O-NZ 3.02Å
547	A	85.4	Confident	84.3	Confident	6 Å²	6	69.6 Å²	69.6	5%	0.05	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-5.2	178.9	0	0	0	0	0	114.8	N382 V383 R438 F543 N544 H545 K549	N382-A547 HydrophobicContact CB-CB 3.84Å; V383-A547 HydrophobicContact CB-CB 3.92Å; V383-A547 HydrophobicContact CG1-CB 3.33Å; R438-A547 PolarHBondContact NH2-O 3.48Å; F543-A547 WeakPolarHBondContact O-CB 3.28Å; F543-A547 PolarHBondContact O-N 3.43Å; N544-A547 PolarHBondContact O-N 3.01Å; H545-A547 PolarHBondContact O-N 2.63Å; H545-A547 VanDerWaalsContact O-N 3.16Å; A547-K549 PolarHBondContact O-N 3.22Å
548	V	84.2	Confident	84.3	Confident	52 Å²	52	71.6 Å²	71.6	32%	0.315	39%	0.386	S	S	.	.			trans	-54.4	132.1	178.9	175.2	0	0	0	0	110.3	N382 H545 N550 K551	N382-V548 WeakPolarHBondContact ND2-CG2 3.34Å; H545-V548 WeakPolarHBondContact O-CB 3.07Å; H545-V548 WeakPolarHBondContact O-CG2 3.33Å; H545-V548 PolarHBondContact O-N 3.38Å; V548-N550 VanDerWaalsContact C-N 3.26Å; V548-N550 PolarHBondContact O-N 3.27Å; V548-K551 WeakPolarHBondContact O-CG 3.1Å
549	K	69.4	Low	84.5	Confident	144 Å²	144	71.5 Å²	71.5	63%	0.626	39%	0.385	S	S	*	.	S	Bend	trans	-55.8	-40.3	-178.5	-79.1	-173.2	173.7	-174.5	0	112.7	R438 A547 K551	R438-K549 VanDerWaalsContact NH2-CG 3.33Å; A547-K549 PolarHBondContact O-N 3.22Å; K549-K551 PolarHBondContact O-N 3.42Å
550	N	67.5	Low	84.6	Confident	149 Å²	149	71.1 Å²	71.1	80%	0.797	38%	0.384	S	S	*	.	S	Bend	trans	-92.8	72.2	-179.4	-63	-16.4	0	0	0	110	V548	V548-N550 VanDerWaalsContact C-N 3.26Å; V548-N550 PolarHBondContact O-N 3.27Å
551	K	67.4	Low	84.5	Confident	108 Å²	108	75.2 Å²	75.2	47%	0.47	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-66.2	149.5	171.1	-62.4	-166.9	179.8	-156.3	0	110.2	G546 V548 K549 Q553	G546-K551 WeakPolarHBondContact O-CE 3.37Å; G546-K551 PolarHBondContact O-NZ 3.02Å; V548-K551 WeakPolarHBondContact O-CG 3.1Å; K549-K551 PolarHBondContact O-N 3.42Å; K551-Q553 WeakPolarHBondContact O-CG 3.48Å; K551-Q553 PolarHBondContact O-N 3.2Å
552	C	65.1	Low	84.6	Confident	133 Å²	133	76.2 Å²	76.2	90%	0.899	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-53.6	124	165.3	-70.1	0	0	0	0	108.5
553	Q	75.4	Confident	84.8	Confident	119 Å²	119	74 Å²	74	56%	0.556	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-98.3	134.5	-178.3	-52.7	-168.3	-55	0	0	108.4	K551 V558 R561	K551-Q553 WeakPolarHBondContact O-CG 3.48Å; K551-Q553 PolarHBondContact O-N 3.2Å; Q553-V558 HydrophobicContact CB-CG2 3.75Å; Q553-R561 VanDerWaalsContact NE2-CZ 3.28Å
554	T	85.8	Confident	84.9	Confident	73 Å²	73	78.2 Å²	78.2	45%	0.448	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-77.5	150.2	172.5	63.3	0	0	0	0	110	R556 E557 V558	T554-R556 PolarHBondContact O-N 3.16Å; T554-E557 PolarHBondContact N-OE2 3.14Å; T554-E557 PolarHBondContact O-N 3.19Å; T554-E557 WeakPolarHBondContact OG1-CB 3.36Å; T554-E557 VanDerWaalsContact OG1-CD 3.26Å; T554-E557 WeakPolarHBondContact OG1-CG 3.15Å; T554-E557 PolarHBondContact OG1-N 3.23Å; T554-E557 VanDerWaalsContact OG1-N 3.16Å; T554-E557 PolarHBondContact OG1-OE2 2.68Å; T554-V558 WeakPolarHBondContact O-CG2 3.23Å; T554-V558 PolarHBondContact O-N 2.99Å
555	V	92.3	Very high	85	Confident	92 Å²	92	84.6 Å²	84.6	56%	0.558	43%	0.431	S	S	*	.	H	α-helix	trans	-53.1	-38.5	173.9	176.3	0	0	0	0	110.5	V558 F559 T583	V555-V558 PolarHBondContact O-N 3.44Å; V555-F559 VanDerWaalsContact O-CB 3.24Å; V555-F559 WeakPolarHBondContact O-CB 3.21Å; V555-F559 PolarHBondContact O-N 3.34Å; V555-T583 HydrophobicContact CG1-CG2 4.01Å
556	R	92.1	Very high	85.2	Confident	112 Å²	112	78.6 Å²	78.6	42%	0.423	40%	0.403	S	S	.	.	H	α-helix	trans	-58.6	-49.9	175.3	-173.3	177.7	-178.4	85.9	1.7	112	T554 F559 A560 L578	T554-R556 PolarHBondContact O-N 3.16Å; R556-F559 PolarHBondContact O-N 3.23Å; R556-A560 PolarHBondContact O-N 3.07Å; R556-L578 HydrophobicContact CG-CD2 3.62Å; R556-L578 HydrophobicContact CG-CG 4.39Å; R556-L578 PolarHBondContact NH1-O 3.2Å; R556-L578 PolarHBondContact NH2-O 3.33Å; R556-L578 VanDerWaalsContact NH2-O 3.14Å; R556-L578 WeakPolarHBondContact O-CD2 3.34Å
557	E	88.7	Confident	85.6	Confident	88 Å²	88	82.9 Å²	82.9	41%	0.411	43%	0.429	S	S	.	.	H	α-helix	trans	-67.5	-37.5	179.7	-72.5	165	148.8	0	0	113.4	T554 F559 R561	T554-E557 PolarHBondContact N-OE2 3.14Å; T554-E557 PolarHBondContact O-N 3.19Å; T554-E557 WeakPolarHBondContact OG1-CB 3.36Å; T554-E557 VanDerWaalsContact OG1-CD 3.26Å; T554-E557 WeakPolarHBondContact OG1-CG 3.15Å; T554-E557 PolarHBondContact OG1-N 3.23Å; T554-E557 VanDerWaalsContact OG1-N 3.16Å; T554-E557 PolarHBondContact OG1-OE2 2.68Å; E557-F559 VanDerWaalsContact C-N 3.34Å; E557-R561 PolarHBondContact O-N 3.21Å
558	V	90.6	Very high	85.7	Confident	44 Å²	44	84.6 Å²	84.6	27%	0.267	45%	0.447	S	S	.	.	H	α-helix	trans	-63.9	-45.1	174.5	180	0	0	0	0	109.6	Q553 T554 V555 A560 R561 Q562	Q553-V558 HydrophobicContact CB-CG2 3.75Å; T554-V558 WeakPolarHBondContact O-CG2 3.23Å; T554-V558 PolarHBondContact O-N 2.99Å; V555-V558 PolarHBondContact O-N 3.44Å; V558-A560 PolarHBondContact O-N 3.48Å; V558-R561 PolarHBondContact O-N 3.05Å; V558-R561 VanDerWaalsContact O-N 3.15Å; V558-Q562 HydrophobicContact CG1-CG 4.44Å; V558-Q562 WeakPolarHBondContact O-CG 3.38Å; V558-Q562 PolarHBondContact O-N 3Å
559	F	94.8	Very high	86	Confident	1 Å²	1	82.5 Å²	82.5	0%	0.004	43%	0.434	C	S	.	.	H	α-helix	trans	-62.4	-41.1	178.9	-176.2	-147.3	0	0	0	112.4	V555 R556 E557 R561 Q562 L563 L578 Y581 P584 L587 Y628	V555-F559 VanDerWaalsContact O-CB 3.24Å; V555-F559 WeakPolarHBondContact O-CB 3.21Å; V555-F559 PolarHBondContact O-N 3.34Å; R556-F559 PolarHBondContact O-N 3.23Å; E557-F559 VanDerWaalsContact C-N 3.34Å; F559-R561 VanDerWaalsContact C-N 3.31Å; F559-R561 PolarHBondContact O-N 3.14Å; F559-Q562 WeakPolarHBondContact O-CB 3.33Å; F559-Q562 PolarHBondContact O-N 3.42Å; F559-L563 HydrophobicContact CD2-CD1 4.43Å; F559-L563 HydrophobicContact CD2-CG 4.1Å; F559-L563 HydrophobicContact CE1-CD1 4.43Å; F559-L563 HydrophobicContact CE2-CD1 4.05Å; F559-L563 HydrophobicContact CE2-CD2 3.83Å; F559-L563 HydrophobicContact CE2-CG 3.78Å; F559-L563 HydrophobicContact CZ-CD1 4.07Å; F559-L563 HydrophobicContact CZ-CD2 4.27Å; F559-L563 HydrophobicContact CZ-CG 4.28Å; F559-L563 WeakPolarHBondContact O-CG 3.34Å; F559-L563 PolarHBondContact O-N 3.42Å; F559-L578 HydrophobicContact CD1-CD1 3.89Å; F559-L578 HydrophobicContact CD1-CG 4.18Å; F559-L578 HydrophobicContact CE1-CD1 4.17Å; F559-L578 HydrophobicContact CG-CD1 4.41Å; F559-Y581 WeakPolarHBondContact CE1-O 3.48Å; F559-P584 HydrophobicContact CB-CG 4.08Å; F559-P584 HydrophobicContact CD1-CG 4.36Å; F559-P584 HydrophobicContact CD2-CB 4.35Å; F559-P584 HydrophobicContact CD2-CG 3.68Å; F559-P584 HydrophobicContact CE2-CB 4.37Å; F559-P584 HydrophobicContact CE2-CG 4.18Å; F559-P584 HydrophobicContact CG-CG 3.79Å; F559-L587 HydrophobicContact CE2-CD2 4.45Å; F559-L587 HydrophobicContact CZ-CB 4.22Å; F559-L587 HydrophobicContact CZ-CD2 3.82Å; F559-Y628 WeakPolarHBondContact CE2-OH 3.19Å
560	A	92.9	Very high	87	Confident	22 Å²	22	78.2 Å²	78.2	18%	0.182	42%	0.422	C	S	.	.	H	α-helix	trans	-55.2	-46.7	172.7	0	0	0	0	0	112.1	R556 V558 L563 M564 L578	R556-A560 PolarHBondContact O-N 3.07Å; V558-A560 PolarHBondContact O-N 3.48Å; A560-L563 PolarHBondContact O-N 3.46Å; A560-M564 VanDerWaalsContact O-CG 3.29Å; A560-M564 WeakPolarHBondContact O-CG 3.32Å; A560-M564 PolarHBondContact O-N 3.12Å; A560-L578 HydrophobicContact CB-CD1 4.4Å; A560-L578 HydrophobicContact CB-CD2 3.66Å
561	R	90.1	Very high	88.1	Confident	111 Å²	111	72.8 Å²	72.8	42%	0.419	40%	0.401	S	S	.	.	H	α-helix	trans	-68	-34.3	179.8	-73.1	-176.9	-65.3	141	5	112.9	Q553 E557 V558 F559 M564 Q565	Q553-R561 VanDerWaalsContact NE2-CZ 3.28Å; E557-R561 PolarHBondContact O-N 3.21Å; V558-R561 PolarHBondContact O-N 3.05Å; V558-R561 VanDerWaalsContact O-N 3.15Å; F559-R561 VanDerWaalsContact C-N 3.31Å; F559-R561 PolarHBondContact O-N 3.14Å; R561-M564 PolarHBondContact O-N 3.22Å; R561-Q565 WeakPolarHBondContact O-CG 3.49Å; R561-Q565 PolarHBondContact O-N 3.28Å; R561-Q565 PolarHBondContact O-NE2 3.41Å; R561-Q565 VanDerWaalsContact O-NE2 3.08Å
562	Q	93.1	Very high	89.2	Confident	90 Å²	90	72.6 Å²	72.6	42%	0.421	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-47.6	173.3	-72.4	171.5	-22.5	0	0	110.9	V558 F559 M564 Q565	V558-Q562 HydrophobicContact CG1-CG 4.44Å; V558-Q562 WeakPolarHBondContact O-CG 3.38Å; V558-Q562 PolarHBondContact O-N 3Å; F559-Q562 WeakPolarHBondContact O-CB 3.33Å; F559-Q562 PolarHBondContact O-N 3.42Å; Q562-M564 VanDerWaalsContact C-N 3.3Å; Q562-M564 PolarHBondContact O-N 3.27Å; Q562-Q565 WeakPolarHBondContact O-CB 3.31Å; Q562-Q565 PolarHBondContact O-N 3.48Å; Q562-Q565 VanDerWaalsContact O-N 3.08Å
563	L	93.4	Very high	90.6	Very high	1 Å²	1	67.8 Å²	67.8	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-59.8	-40.9	176.3	-69.5	177.2	0	0	0	111.9	F559 A560 Q565 I566 L569 A574 I577 L578 Y628	F559-L563 HydrophobicContact CD2-CD1 4.43Å; F559-L563 HydrophobicContact CD2-CG 4.1Å; F559-L563 HydrophobicContact CE1-CD1 4.43Å; F559-L563 HydrophobicContact CE2-CD1 4.05Å; F559-L563 HydrophobicContact CE2-CD2 3.83Å; F559-L563 HydrophobicContact CE2-CG 3.78Å; F559-L563 HydrophobicContact CZ-CD1 4.07Å; F559-L563 HydrophobicContact CZ-CD2 4.27Å; F559-L563 HydrophobicContact CZ-CG 4.28Å; F559-L563 WeakPolarHBondContact O-CG 3.34Å; F559-L563 PolarHBondContact O-N 3.42Å; A560-L563 PolarHBondContact O-N 3.46Å; L563-Q565 PolarHBondContact O-N 2.93Å; L563-Q565 VanDerWaalsContact O-N 3.11Å; L563-I566 WeakPolarHBondContact O-CB 3.3Å; L563-I566 PolarHBondContact O-N 2.9Å; L563-L569 HydrophobicContact CB-CD1 4.13Å; L563-L569 HydrophobicContact CD2-CD1 4.36Å; L563-L569 WeakPolarHBondContact O-CB 3.47Å; L563-L569 WeakPolarHBondContact O-CD1 3.3Å; L563-A574 HydrophobicContact CB-CB 4.2Å; L563-A574 HydrophobicContact CD1-CB 4.42Å; L563-I577 HydrophobicContact CD1-CB 4.02Å; L563-I577 HydrophobicContact CD1-CD1 4.17Å; L563-I577 HydrophobicContact CD1-CG2 3.78Å; L563-L578 HydrophobicContact CD1-CD1 3.42Å; L563-L578 VanDerWaalsContact CD1-CD1 3.42Å; L563-Y628 HydrophobicContact CD2-CE2 4.38Å
564	M	93.1	Very high	91.4	Very high	90 Å²	90	62.2 Å²	62.2	44%	0.443	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-7.3	178.4	-68.9	173.8	64.4	0	0	114.5	A560 R561 Q562 A574	A560-M564 VanDerWaalsContact O-CG 3.29Å; A560-M564 WeakPolarHBondContact O-CG 3.32Å; A560-M564 PolarHBondContact O-N 3.12Å; R561-M564 PolarHBondContact O-N 3.22Å; Q562-M564 VanDerWaalsContact C-N 3.3Å; Q562-M564 PolarHBondContact O-N 3.27Å; M564-A574 HydrophobicContact CG-CB 3.93Å
565	Q	93.6	Very high	91.8	Very high	161 Å²	161	61 Å²	61	75%	0.752	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-18.8	169.4	-58.7	-48.7	-62.7	0	0	112.4	R561 Q562 L563 S567	R561-Q565 WeakPolarHBondContact O-CG 3.49Å; R561-Q565 PolarHBondContact O-N 3.28Å; R561-Q565 PolarHBondContact O-NE2 3.41Å; R561-Q565 VanDerWaalsContact O-NE2 3.08Å; Q562-Q565 WeakPolarHBondContact O-CB 3.31Å; Q562-Q565 PolarHBondContact O-N 3.48Å; Q562-Q565 VanDerWaalsContact O-N 3.08Å; L563-Q565 PolarHBondContact O-N 2.93Å; L563-Q565 VanDerWaalsContact O-N 3.11Å; Q565-S567 PolarHBondContact O-N 3.22Å
566	I	92.8	Very high	91.8	Very high	25 Å²	25	57 Å²	57	13%	0.128	32%	0.317	C	S	.	.	S	Bend	trans	-80.6	121.1	177.3	-54.8	175.5	0	0	0	108.6	L563 G568 L569 T623 V624 L627	L563-I566 WeakPolarHBondContact O-CB 3.3Å; L563-I566 PolarHBondContact O-N 2.9Å; I566-G568 PolarHBondContact O-N 3.43Å; I566-L569 HydrophobicContact CB-CB 4.46Å; I566-L569 HydrophobicContact CB-CD1 3.94Å; I566-L569 HydrophobicContact CB-CG 4.25Å; I566-L569 HydrophobicContact CD1-CD1 3.91Å; I566-L569 HydrophobicContact CG1-CD1 4.37Å; I566-L569 HydrophobicContact CG2-CD1 4.38Å; I566-L569 HydrophobicContact CG2-CG 4.48Å; I566-L569 PolarHBondContact O-N 3.41Å; I566-T623 HydrophobicContact CG2-CG2 3.67Å; I566-V624 HydrophobicContact CD1-CG2 3.83Å; I566-L627 HydrophobicContact CD1-CD2 3.75Å; I566-L627 HydrophobicContact CG1-CD2 4.32Å
567	S	89.9	Confident	91.9	Very high	119 Å²	119	51.6 Å²	51.6	83%	0.832	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	125.7	178.3	-173.4	0	0	0	0	111	Q565	Q565-S567 PolarHBondContact O-N 3.22Å
568	G	87.9	Confident	92.2	Very high	42 Å²	42	47.8 Å²	47.8	43%	0.433	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-7.7	-177.2	0	0	0	0	0	115.3	I566 K573	I566-G568 PolarHBondContact O-N 3.43Å; G568-K573 WeakPolarHBondContact O-CD 3.29Å; G568-K573 WeakPolarHBondContact O-CE 3.4Å; G568-K573 PolarHBondContact O-NZ 3.44Å
569	L	90.9	Very high	92.3	Very high	8 Å²	8	52 Å²	52	4%	0.042	30%	0.296	C	S	.	.			trans	-90	95.6	167.2	-73.7	-175.4	0	0	0	111.1	L563 I566 K573 I577 L616 L620 V624	L563-L569 HydrophobicContact CB-CD1 4.13Å; L563-L569 HydrophobicContact CD2-CD1 4.36Å; L563-L569 WeakPolarHBondContact O-CB 3.47Å; L563-L569 WeakPolarHBondContact O-CD1 3.3Å; I566-L569 HydrophobicContact CB-CB 4.46Å; I566-L569 HydrophobicContact CB-CD1 3.94Å; I566-L569 HydrophobicContact CB-CG 4.25Å; I566-L569 HydrophobicContact CD1-CD1 3.91Å; I566-L569 HydrophobicContact CG1-CD1 4.37Å; I566-L569 HydrophobicContact CG2-CD1 4.38Å; I566-L569 HydrophobicContact CG2-CG 4.48Å; I566-L569 PolarHBondContact O-N 3.41Å; L569-K573 HydrophobicContact CD2-CB 3.84Å; L569-K573 HydrophobicContact CD2-CD 4.13Å; L569-I577 HydrophobicContact CD1-CD1 4.32Å; L569-I577 HydrophobicContact CD2-CD1 4.08Å; L569-L616 HydrophobicContact CD2-CD1 3.98Å; L569-L620 HydrophobicContact CD2-CD1 4.25Å; L569-V624 HydrophobicContact CD1-CG2 3.85Å
570	S	90.3	Very high	92.2	Very high	54 Å²	54	58.1 Å²	58.1	38%	0.378	33%	0.325	S	S	.	.			trans	-76.8	169.2	171.8	62.8	0	0	0	0	111.9	D572 K573 A574	S570-D572 VanDerWaalsContact C-N 3.26Å; S570-D572 PolarHBondContact O-N 2.99Å; S570-K573 WeakPolarHBondContact O-CB 3.44Å; S570-K573 PolarHBondContact O-N 2.98Å; S570-A574 PolarHBondContact O-N 2.92Å
571	G	90.5	Very high	92.4	Very high	35 Å²	35	59 Å²	59	36%	0.361	32%	0.324	S	S	.	.	H	α-helix	trans	-53.2	-41.3	176.3	0	0	0	0	0	113.4	K573 A574 A575	G571-K573 VanDerWaalsContact C-N 3.33Å; G571-K573 PolarHBondContact O-N 3.1Å; G571-A574 PolarHBondContact O-N 3.03Å; G571-A575 WeakPolarHBondContact O-CB 3.45Å; G571-A575 PolarHBondContact O-N 3.26Å
572	D	90.8	Very high	92.4	Very high	105 Å²	105	54.9 Å²	54.9	56%	0.561	32%	0.315	S	S	*	.	H	α-helix	trans	-63.2	-37.6	176.8	-64.8	-19.5	0	0	0	112.8	S570 A576 Y609	S570-D572 VanDerWaalsContact C-N 3.26Å; S570-D572 PolarHBondContact O-N 2.99Å; D572-A576 PolarHBondContact O-N 3.35Å; D572-A576 VanDerWaalsContact O-N 3.16Å; D572-Y609 HydrophobicContact CB-CD2 4.22Å
573	K	92.9	Very high	92.5	Very high	32 Å²	32	53 Å²	53	14%	0.139	31%	0.31	C	S	.	.	H	α-helix	trans	-72.4	-42.9	177.9	-67.5	179.4	-177.9	-175.4	0	111.1	G568 L569 S570 G571 A576 I577 Y609 L616 L620	G568-K573 WeakPolarHBondContact O-CD 3.29Å; G568-K573 WeakPolarHBondContact O-CE 3.4Å; G568-K573 PolarHBondContact O-NZ 3.44Å; L569-K573 HydrophobicContact CD2-CB 3.84Å; L569-K573 HydrophobicContact CD2-CD 4.13Å; S570-K573 WeakPolarHBondContact O-CB 3.44Å; S570-K573 PolarHBondContact O-N 2.98Å; G571-K573 VanDerWaalsContact C-N 3.33Å; G571-K573 PolarHBondContact O-N 3.1Å; K573-A576 PolarHBondContact O-N 3.4Å; K573-I577 WeakPolarHBondContact O-CG1 3.11Å; K573-I577 PolarHBondContact O-N 2.98Å; K573-I577 VanDerWaalsContact O-N 3.08Å; K573-Y609 HydrophobicContact CD-CE1 4.39Å; K573-Y609 HydrophobicContact CD-CE2 4.34Å; K573-Y609 VanDerWaalsContact CE-OH 3.31Å; K573-Y609 WeakPolarHBondContact CE-OH 3.17Å; K573-Y609 HydrophobicContact CG-CD1 3.93Å; K573-Y609 HydrophobicContact CG-CD2 3.57Å; K573-Y609 HydrophobicContact CG-CE1 4.03Å; K573-Y609 HydrophobicContact CG-CE2 3.69Å; K573-Y609 HydrophobicContact CG-CG 3.71Å; K573-L616 HydrophobicContact CB-CD1 4Å; K573-L616 HydrophobicContact CD-CD1 4.49Å; K573-L616 HydrophobicContact CG-CD1 4.31Å; K573-L620 HydrophobicContact CD-CD1 4.03Å; K573-L620 VanDerWaalsContact NZ-CD1 3.27Å
574	A	93.6	Very high	92.5	Very high	2 Å²	2	54.5 Å²	54.5	2%	0.017	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-46	174.9	0	0	0	0	0	110.8	L563 M564 S570 G571 A576 I577 L578	L563-A574 HydrophobicContact CB-CB 4.2Å; L563-A574 HydrophobicContact CD1-CB 4.42Å; M564-A574 HydrophobicContact CG-CB 3.93Å; S570-A574 PolarHBondContact O-N 2.92Å; G571-A574 PolarHBondContact O-N 3.03Å; A574-A576 VanDerWaalsContact C-N 3.31Å; A574-A576 PolarHBondContact O-N 3.28Å; A574-I577 PolarHBondContact O-N 3.46Å; A574-L578 WeakPolarHBondContact O-CB 3.33Å; A574-L578 WeakPolarHBondContact O-CD1 3.42Å; A574-L578 PolarHBondContact O-N 3.37Å
575	A	92.8	Very high	92.6	Very high	48 Å²	48	56.9 Å²	56.9	40%	0.397	33%	0.33	S	S	.	.	H	α-helix	trans	-56.7	-44	176.4	0	0	0	0	0	112.2	G571 I577 L578 E579	G571-A575 WeakPolarHBondContact O-CB 3.45Å; G571-A575 PolarHBondContact O-N 3.26Å; A575-I577 PolarHBondContact O-N 3.08Å; A575-L578 CarbonylContact O-C 3.52Å; A575-L578 WeakPolarHBondContact O-CB 3.4Å; A575-L578 PolarHBondContact O-N 2.8Å; A575-L578 VanDerWaalsContact O-N 3.17Å; A575-E579 WeakPolarHBondContact O-CG 3.22Å; A575-E579 PolarHBondContact O-N 3.31Å
576	A	94.1	Very high	92.7	Very high	6 Å²	6	50.9 Å²	50.9	5%	0.05	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-37.2	177.8	0	0	0	0	0	113.3	D572 K573 A574 L578 I607 Y609	D572-A576 PolarHBondContact O-N 3.35Å; D572-A576 VanDerWaalsContact O-N 3.16Å; K573-A576 PolarHBondContact O-N 3.4Å; A574-A576 VanDerWaalsContact C-N 3.31Å; A574-A576 PolarHBondContact O-N 3.28Å; A576-L578 VanDerWaalsContact C-N 3.35Å; A576-I607 HydrophobicContact CB-CG2 3.68Å; A576-Y609 VanDerWaalsContact CB-CB 3.49Å
577	I	93.9	Very high	92.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-43.4	172.1	-65.9	167.5	0	0	0	109.8	L563 L569 K573 A574 A575 E579 Q580 Y581 I607 L616	L563-I577 HydrophobicContact CD1-CB 4.02Å; L563-I577 HydrophobicContact CD1-CD1 4.17Å; L563-I577 HydrophobicContact CD1-CG2 3.78Å; L569-I577 HydrophobicContact CD1-CD1 4.32Å; L569-I577 HydrophobicContact CD2-CD1 4.08Å; K573-I577 WeakPolarHBondContact O-CG1 3.11Å; K573-I577 PolarHBondContact O-N 2.98Å; K573-I577 VanDerWaalsContact O-N 3.08Å; A574-I577 PolarHBondContact O-N 3.46Å; A575-I577 PolarHBondContact O-N 3.08Å; I577-E579 VanDerWaalsContact C-N 3.3Å; I577-E579 PolarHBondContact O-N 2.75Å; I577-Q580 PolarHBondContact O-N 3.04Å; I577-Q580 VanDerWaalsContact O-N 3.15Å; I577-Y581 HydrophobicContact CG2-CD2 4.46Å; I577-Y581 PolarHBondContact O-N 2.79Å; I577-I607 HydrophobicContact CG1-CD1 4.18Å; I577-L616 HydrophobicContact CD1-CD1 3.98Å; I577-L616 HydrophobicContact CG1-CD1 4.15Å
578	L	94.1	Very high	93	Very high	8 Å²	8	46.8 Å²	46.8	4%	0.042	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-25.9	-179	-93.8	70.8	0	0	0	114.1	R556 F559 A560 L563 A574 A575 A576 Q580 Y581	R556-L578 HydrophobicContact CG-CD2 3.62Å; R556-L578 HydrophobicContact CG-CG 4.39Å; R556-L578 PolarHBondContact NH1-O 3.2Å; R556-L578 PolarHBondContact NH2-O 3.33Å; R556-L578 VanDerWaalsContact NH2-O 3.14Å; R556-L578 WeakPolarHBondContact O-CD2 3.34Å; F559-L578 HydrophobicContact CD1-CD1 3.89Å; F559-L578 HydrophobicContact CD1-CG 4.18Å; F559-L578 HydrophobicContact CE1-CD1 4.17Å; F559-L578 HydrophobicContact CG-CD1 4.41Å; A560-L578 HydrophobicContact CB-CD1 4.4Å; A560-L578 HydrophobicContact CB-CD2 3.66Å; L563-L578 HydrophobicContact CD1-CD1 3.42Å; L563-L578 VanDerWaalsContact CD1-CD1 3.42Å; A574-L578 WeakPolarHBondContact O-CB 3.33Å; A574-L578 WeakPolarHBondContact O-CD1 3.42Å; A574-L578 PolarHBondContact O-N 3.37Å; A575-L578 CarbonylContact O-C 3.52Å; A575-L578 WeakPolarHBondContact O-CB 3.4Å; A575-L578 PolarHBondContact O-N 2.8Å; A575-L578 VanDerWaalsContact O-N 3.17Å; A576-L578 VanDerWaalsContact C-N 3.35Å; L578-Q580 VanDerWaalsContact C-N 3.28Å; L578-Y581 WeakPolarHBondContact CA-O 3.42Å; L578-Y581 CarbonylContact O-C 3.56Å
579	E	93.8	Very high	93.4	Very high	131 Å²	131	45.9 Å²	45.9	61%	0.612	26%	0.263	S	S	*	.	H	α-helix	trans	-63.4	-35.2	171.8	-78.7	178.4	-175.6	0	0	111.8	A575 I577	A575-E579 WeakPolarHBondContact O-CG 3.22Å; A575-E579 PolarHBondContact O-N 3.31Å; I577-E579 VanDerWaalsContact C-N 3.3Å; I577-E579 PolarHBondContact O-N 2.75Å
580	Q	92.8	Very high	93.5	Very high	130 Å²	130	46.4 Å²	46.4	61%	0.607	27%	0.268	S	S	*	.	H	α-helix	trans	-88.5	-40.5	177.2	-61	-61.7	-30.1	0	0	111.9	I577 L578 I607	I577-Q580 PolarHBondContact O-N 3.04Å; I577-Q580 VanDerWaalsContact O-N 3.15Å; L578-Q580 VanDerWaalsContact C-N 3.28Å; Q580-I607 HydrophobicContact CG-CD1 4.45Å
581	Y	95.2	Very high	93.7	Very high	42 Å²	42	44 Å²	44	17%	0.165	25%	0.251	C	S	.	.			trans	-128.7	91.9	-174.5	-53.7	-68.3	0	0	0	109.9	F559 I577 L578 T583 S586 L587 A590 L604 I607	F559-Y581 WeakPolarHBondContact CE1-O 3.48Å; I577-Y581 HydrophobicContact CG2-CD2 4.46Å; I577-Y581 PolarHBondContact O-N 2.79Å; L578-Y581 WeakPolarHBondContact CA-O 3.42Å; L578-Y581 CarbonylContact O-C 3.56Å; Y581-T583 PolarHBondContact O-N 3.03Å; Y581-S586 VanDerWaalsContact C-OG 3.27Å; Y581-S586 VanDerWaalsContact CA-OG 3.31Å; Y581-S586 WeakPolarHBondContact CA-OG 3.43Å; Y581-S586 WeakPolarHBondContact CB-OG 3.43Å; Y581-L587 HydrophobicContact CD2-CD1 3.84Å; Y581-L587 HydrophobicContact CE2-CD1 4.16Å; Y581-L587 HydrophobicContact CG-CB 4.28Å; Y581-L587 HydrophobicContact CG-CD1 4.07Å; Y581-A590 HydrophobicContact CD1-CB 4.07Å; Y581-A590 HydrophobicContact CE1-CB 3.34Å; Y581-L604 HydrophobicContact CD2-CD2 3.94Å; Y581-L604 HydrophobicContact CE2-CD2 3.52Å; Y581-I607 HydrophobicContact CE2-CD1 4.37Å
582	G	90.8	Very high	93.8	Very high	23 Å²	23	49.5 Å²	49.5	24%	0.237	27%	0.267	C	S	.	.	S	Bend	trans	-69.1	-15.3	-173.7	0	0	0	0	0	115.2	S586	G582-S586 PolarHBondContact N-OG 3.27Å
583	T	94.8	Very high	93.8	Very high	50 Å²	50	53.2 Å²	53.2	31%	0.307	28%	0.278	S	S	.	.	S	Bend	trans	-141.8	157.9	-177.9	68	0	0	0	0	111.8	V555 Y581 H585 S586 L587	V555-T583 HydrophobicContact CG1-CG2 4.01Å; Y581-T583 PolarHBondContact O-N 3.03Å; T583-H585 PolarHBondContact O-N 3.24Å; T583-S586 PolarHBondContact N-OG 2.91Å; T583-S586 VanDerWaalsContact N-OG 3.08Å; T583-S586 PolarHBondContact O-N 2.81Å; T583-S586 VanDerWaalsContact O-N 3.11Å; T583-S586 PolarHBondContact O-OG 3.42Å; T583-S586 PolarHBondContact OG1-N 3.2Å; T583-S586 VanDerWaalsContact OG1-N 3.1Å; T583-S586 PolarHBondContact OG1-OG 2.98Å; T583-L587 PolarHBondContact O-N 3.21Å
584	P	94.8	Very high	93.7	Very high	33 Å²	33	52.3 Å²	52.3	21%	0.214	28%	0.276	C	S	.	.	H	α-helix	trans	-56.7	-38.6	174.1	-23.3	32.4	0	0	0	112.4	F559 S586 L587 L588	F559-P584 HydrophobicContact CB-CG 4.08Å; F559-P584 HydrophobicContact CD1-CG 4.36Å; F559-P584 HydrophobicContact CD2-CB 4.35Å; F559-P584 HydrophobicContact CD2-CG 3.68Å; F559-P584 HydrophobicContact CE2-CB 4.37Å; F559-P584 HydrophobicContact CE2-CG 4.18Å; F559-P584 HydrophobicContact CG-CG 3.79Å; P584-S586 PolarHBondContact O-N 3.42Å; P584-L587 PolarHBondContact O-N 3.47Å; P584-L588 WeakPolarHBondContact O-CG 3.28Å; P584-L588 PolarHBondContact O-N 3.32Å
585	H	94.8	Very high	93.4	Very high	141 Å²	141	55.8 Å²	55.8	65%	0.653	31%	0.312	S	S	*	.	H	α-helix	trans	-63.3	-41.7	176.9	-179.2	69.4	0	0	0	112.1	T583 L587 L588 A589	T583-H585 PolarHBondContact O-N 3.24Å; H585-L587 VanDerWaalsContact C-N 3.25Å; H585-L587 PolarHBondContact O-N 3.3Å; H585-L588 PolarHBondContact O-N 3.1Å; H585-A589 WeakPolarHBondContact O-CB 3.42Å; H585-A589 PolarHBondContact O-N 2.94Å
586	S	95.9	Very high	93.3	Very high	35 Å²	35	56.2 Å²	56.2	25%	0.245	31%	0.312	C	S	.	.	H	α-helix	trans	-62.2	-34.4	176.5	67.1	0	0	0	0	112.7	Y581 G582 T583 P584 A590	Y581-S586 VanDerWaalsContact C-OG 3.27Å; Y581-S586 VanDerWaalsContact CA-OG 3.31Å; Y581-S586 WeakPolarHBondContact CA-OG 3.43Å; Y581-S586 WeakPolarHBondContact CB-OG 3.43Å; G582-S586 PolarHBondContact N-OG 3.27Å; T583-S586 PolarHBondContact N-OG 2.91Å; T583-S586 VanDerWaalsContact N-OG 3.08Å; T583-S586 PolarHBondContact O-N 2.81Å; T583-S586 VanDerWaalsContact O-N 3.11Å; T583-S586 PolarHBondContact O-OG 3.42Å; T583-S586 PolarHBondContact OG1-N 3.2Å; T583-S586 VanDerWaalsContact OG1-N 3.1Å; T583-S586 PolarHBondContact OG1-OG 2.98Å; P584-S586 PolarHBondContact O-N 3.42Å; S586-A590 WeakPolarHBondContact O-CB 3.4Å; S586-A590 PolarHBondContact O-N 3.44Å
587	L	94.9	Very high	93	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-71.5	-43.7	175.4	178.4	61.1	0	0	0	111.6	F559 Y581 T583 P584 H585 A590 Y591 L604 V624 Y628	F559-L587 HydrophobicContact CE2-CD2 4.45Å; F559-L587 HydrophobicContact CZ-CB 4.22Å; F559-L587 HydrophobicContact CZ-CD2 3.82Å; Y581-L587 HydrophobicContact CD2-CD1 3.84Å; Y581-L587 HydrophobicContact CE2-CD1 4.16Å; Y581-L587 HydrophobicContact CG-CB 4.28Å; Y581-L587 HydrophobicContact CG-CD1 4.07Å; T583-L587 PolarHBondContact O-N 3.21Å; P584-L587 PolarHBondContact O-N 3.47Å; H585-L587 VanDerWaalsContact C-N 3.25Å; H585-L587 PolarHBondContact O-N 3.3Å; L587-A590 WeakPolarHBondContact O-CB 3.22Å; L587-A590 PolarHBondContact O-N 3.16Å; L587-Y591 HydrophobicContact CD1-CD2 4.23Å; L587-Y591 HydrophobicContact CD1-CE2 3.66Å; L587-Y591 HydrophobicContact CD2-CE2 4.1Å; L587-Y591 HydrophobicContact CG-CD2 4.08Å; L587-Y591 HydrophobicContact CG-CE2 3.62Å; L587-Y591 VanDerWaalsContact O-CD2 3.29Å; L587-Y591 WeakPolarHBondContact O-CD2 3.46Å; L587-Y591 PolarHBondContact O-N 3.3Å; L587-L604 HydrophobicContact CD1-CD1 4.3Å; L587-L604 HydrophobicContact CD1-CD2 3.86Å; L587-V624 HydrophobicContact CD2-CG1 4.09Å; L587-Y628 HydrophobicContact CD2-CD2 3.91Å; L587-Y628 HydrophobicContact CD2-CE2 3.9Å; L587-Y628 HydrophobicContact CD2-CG 4.44Å
588	L	94.4	Very high	92.7	Very high	58 Å²	58	63.4 Å²	63.4	30%	0.304	35%	0.351	S	S	.	.	H	α-helix	trans	-62.1	-45.8	176	-74.3	168.9	0	0	0	111.9	P584 H585 A590 Y591 E592 Y628	P584-L588 WeakPolarHBondContact O-CG 3.28Å; P584-L588 PolarHBondContact O-N 3.32Å; H585-L588 PolarHBondContact O-N 3.1Å; L588-A590 PolarHBondContact O-N 3.37Å; L588-Y591 WeakPolarHBondContact O-CB 3.32Å; L588-Y591 PolarHBondContact O-N 3.05Å; L588-E592 WeakPolarHBondContact O-CG 3.33Å; L588-E592 PolarHBondContact O-N 3.12Å; L588-Y628 HydrophobicContact CD2-CD1 4.02Å; L588-Y628 HydrophobicContact CD2-CG 4.41Å; L588-Y628 HydrophobicContact CG-CD1 4.29Å
589	A	94.7	Very high	92.5	Very high	23 Å²	23	67.7 Å²	67.7	19%	0.19	37%	0.371	C	S	.	.	H	α-helix	trans	-61.2	-31.4	176	0	0	0	0	0	112.3	H585 K593	H585-A589 WeakPolarHBondContact O-CB 3.42Å; H585-A589 PolarHBondContact O-N 2.94Å; A589-K593 VanDerWaalsContact O-CG 3.26Å; A589-K593 WeakPolarHBondContact O-CG 3.49Å; A589-K593 PolarHBondContact O-N 3.48Å
590	A	93.8	Very high	92.3	Very high	18 Å²	18	63.2 Å²	63.2	15%	0.149	35%	0.35	C	S	.	.	H	α-helix	trans	-70.5	-40.3	173.7	0	0	0	0	0	111.8	Y581 S586 L587 L588 K593 C594 L603	Y581-A590 HydrophobicContact CD1-CB 4.07Å; Y581-A590 HydrophobicContact CE1-CB 3.34Å; S586-A590 WeakPolarHBondContact O-CB 3.4Å; S586-A590 PolarHBondContact O-N 3.44Å; L587-A590 WeakPolarHBondContact O-CB 3.22Å; L587-A590 PolarHBondContact O-N 3.16Å; L588-A590 PolarHBondContact O-N 3.37Å; A590-K593 PolarHBondContact O-N 3.44Å; A590-C594 PolarHBondContact O-N 3.25Å; A590-C594 PolarHBondContact O-SG 2.88Å; A590-C594 VanDerWaalsContact O-SG 3.33Å; A590-L603 HydrophobicContact CB-CD2 3.99Å
591	Y	94.6	Very high	92.3	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.016	33%	0.331	C	S	.	.	H	α-helix	trans	-64.5	-40.2	173.3	-73.5	-55	0	0	0	112.6	L587 L588 K593 C594 K600 L603 L604 Y625 C629	L587-Y591 HydrophobicContact CD1-CD2 4.23Å; L587-Y591 HydrophobicContact CD1-CE2 3.66Å; L587-Y591 HydrophobicContact CD2-CE2 4.1Å; L587-Y591 HydrophobicContact CG-CD2 4.08Å; L587-Y591 HydrophobicContact CG-CE2 3.62Å; L587-Y591 VanDerWaalsContact O-CD2 3.29Å; L587-Y591 WeakPolarHBondContact O-CD2 3.46Å; L587-Y591 PolarHBondContact O-N 3.3Å; L588-Y591 WeakPolarHBondContact O-CB 3.32Å; L588-Y591 PolarHBondContact O-N 3.05Å; Y591-K593 VanDerWaalsContact C-N 3.25Å; Y591-K593 PolarHBondContact O-N 3.45Å; Y591-C594 WeakPolarHBondContact O-CB 3.31Å; Y591-C594 PolarHBondContact O-N 3.49Å; Y591-K600 HydrophobicContact CD1-CB 3.86Å; Y591-K600 HydrophobicContact CD1-CG 4.12Å; Y591-K600 HydrophobicContact CE1-CB 4.33Å; Y591-K600 WeakPolarHBondContact CE1-O 3.16Å; Y591-K600 WeakPolarHBondContact O-CE 3.43Å; Y591-L603 HydrophobicContact CD1-CB 4.44Å; Y591-L603 HydrophobicContact CD1-CD2 3.5Å; Y591-L603 VanDerWaalsContact CD1-CD2 3.5Å; Y591-L603 HydrophobicContact CE1-CB 3.94Å; Y591-L603 HydrophobicContact CE1-CD2 3.48Å; Y591-L603 VanDerWaalsContact CE1-CD2 3.48Å; Y591-L603 HydrophobicContact CE1-CG 4.33Å; Y591-L603 HydrophobicContact CG-CD2 4.14Å; Y591-L604 WeakPolarHBondContact OH-CD1 3.36Å; Y591-Y625 HydrophobicContact CD1-CD2 4.37Å; Y591-Y625 HydrophobicContact CE1-CD2 4.21Å; Y591-Y625 PolarHBondContact OH-N 3.46Å; Y591-C629 VanDerWaalsContact CG-SG 3.51Å
592	E	91.9	Very high	92.2	Very high	151 Å²	151	62.9 Å²	62.9	71%	0.706	35%	0.348	S	S	*	.	H	α-helix	trans	-63.5	-30.7	177.4	-73.2	173.3	-179.4	0	0	112.9	L588 C594	L588-E592 WeakPolarHBondContact O-CG 3.33Å; L588-E592 PolarHBondContact O-N 3.12Å; E592-C594 VanDerWaalsContact C-N 3.32Å
593	K	92.2	Very high	92.3	Very high	182 Å²	182	63.9 Å²	63.9	79%	0.791	35%	0.347	S	S	*	.	H	α-helix	trans	-75.2	-17.6	177	-74.5	172.8	-176.2	-177.8	0	113.9	A589 A590 Y591	A589-K593 VanDerWaalsContact O-CG 3.26Å; A589-K593 WeakPolarHBondContact O-CG 3.49Å; A589-K593 PolarHBondContact O-N 3.48Å; A590-K593 PolarHBondContact O-N 3.44Å; Y591-K593 VanDerWaalsContact C-N 3.25Å; Y591-K593 PolarHBondContact O-N 3.45Å
594	C	90.9	Very high	92.2	Very high	13 Å²	13	61.5 Å²	61.5	9%	0.088	33%	0.332	C	S	.	.			trans	-72.6	134.5	179	-65.9	0	0	0	0	111	A590 Y591 E592 E599 K600	A590-C594 PolarHBondContact O-N 3.25Å; A590-C594 PolarHBondContact O-SG 2.88Å; A590-C594 VanDerWaalsContact O-SG 3.33Å; Y591-C594 WeakPolarHBondContact O-CB 3.31Å; Y591-C594 PolarHBondContact O-N 3.49Å; E592-C594 VanDerWaalsContact C-N 3.32Å; C594-E599 HydrophobicContact CB-CB 4.32Å; C594-E599 HydrophobicContact CB-CG 4.13Å; C594-K600 HydrophobicContact CB-CD 4.45Å; C594-K600 HydrophobicContact CB-CG 3.46Å; C594-K600 VanDerWaalsContact CB-CG 3.46Å
595	G	85.6	Confident	92.1	Very high	76 Å²	76	60.8 Å²	60.8	78%	0.784	33%	0.328	S	S	*	.	S	Bend	trans	-82.1	-15	-176.6	0	0	0	0	0	114.3	E599	G595-E599 PolarHBondContact N-OE2 3.23Å
596	S	90.4	Very high	91.9	Very high	56 Å²	56	58.4 Å²	58.4	39%	0.392	33%	0.327	S	S	.	.	S	Bend	trans	-140.1	151.6	-178.7	72.1	0	0	0	0	113.2	S598 E599 K600	S596-S598 VanDerWaalsContact C-N 3.27Å; S596-S598 PolarHBondContact O-N 3.48Å; S596-E599 WeakPolarHBondContact O-CB 3.22Å; S596-E599 PolarHBondContact O-N 2.86Å; S596-E599 VanDerWaalsContact OG-CB 3.29Å; S596-E599 WeakPolarHBondContact OG-CB 3.29Å; S596-E599 PolarHBondContact OG-N 3.45Å; S596-K600 PolarHBondContact O-N 3.38Å; S596-K600 VanDerWaalsContact O-N 3.15Å
597	E	88.3	Confident	91.7	Very high	98 Å²	98	57.7 Å²	57.7	46%	0.458	32%	0.32	S	S	.	.	H	α-helix	trans	-63.9	-31	176.8	-64.5	-56.5	126.7	0	0	112.6	E599 K600 E601 Y625	E597-E599 VanDerWaalsContact C-N 3.34Å; E597-E599 PolarHBondContact O-N 3.39Å; E597-K600 PolarHBondContact O-N 3.14Å; E597-K600 WeakPolarHBondContact OE1-CE 3.35Å; E597-K600 IonicContact OE1-NZ 2.68Å; E597-K600 PolarHBondContact OE1-NZ 3.22Å; E597-E601 PolarHBondContact O-N 2.9Å; E597-Y625 WeakPolarHBondContact OE2-CE2 3.21Å; E597-Y625 PolarHBondContact OE2-OH 2.97Å
598	S	87.9	Confident	91.6	Very high	59 Å²	59	65.5 Å²	65.5	41%	0.413	35%	0.349	S	S	.	.	H	α-helix	trans	-68.8	-33.1	175.9	-167.6	0	0	0	0	112.6	S596 K602	S596-S598 VanDerWaalsContact C-N 3.27Å; S596-S598 PolarHBondContact O-N 3.48Å; S598-K602 WeakPolarHBondContact O-CG 3.44Å; S598-K602 PolarHBondContact O-N 3.22Å
599	E	90.1	Very high	91.4	Very high	98 Å²	98	64.9 Å²	64.9	46%	0.458	34%	0.343	S	S	.	.	H	α-helix	trans	-69.4	-43.9	174.9	-174.1	-178.6	-167.9	0	0	110.8	C594 G595 S596 E597 E601 K602 L603	C594-E599 HydrophobicContact CB-CB 4.32Å; C594-E599 HydrophobicContact CB-CG 4.13Å; G595-E599 PolarHBondContact N-OE2 3.23Å; S596-E599 WeakPolarHBondContact O-CB 3.22Å; S596-E599 PolarHBondContact O-N 2.86Å; S596-E599 VanDerWaalsContact OG-CB 3.29Å; S596-E599 WeakPolarHBondContact OG-CB 3.29Å; S596-E599 PolarHBondContact OG-N 3.45Å; E597-E599 VanDerWaalsContact C-N 3.34Å; E597-E599 PolarHBondContact O-N 3.39Å; E599-E601 VanDerWaalsContact C-N 3.33Å; E599-E601 PolarHBondContact O-N 3.46Å; E599-K602 CarbonylContact O-C 3.56Å; E599-K602 PolarHBondContact O-N 2.98Å; E599-K602 VanDerWaalsContact O-N 3.13Å; E599-L603 PolarHBondContact O-N 3.06Å
600	K	90.5	Very high	91	Very high	38 Å²	38	65.3 Å²	65.3	17%	0.165	35%	0.35	C	S	.	.	H	α-helix	trans	-57.6	-46.3	173	-64	178.1	-170.2	172.3	0	111.2	Y591 C594 S596 E597 K602 L603 Y625	Y591-K600 HydrophobicContact CD1-CB 3.86Å; Y591-K600 HydrophobicContact CD1-CG 4.12Å; Y591-K600 HydrophobicContact CE1-CB 4.33Å; Y591-K600 WeakPolarHBondContact CE1-O 3.16Å; Y591-K600 WeakPolarHBondContact O-CE 3.43Å; C594-K600 HydrophobicContact CB-CD 4.45Å; C594-K600 HydrophobicContact CB-CG 3.46Å; C594-K600 VanDerWaalsContact CB-CG 3.46Å; S596-K600 PolarHBondContact O-N 3.38Å; S596-K600 VanDerWaalsContact O-N 3.15Å; E597-K600 PolarHBondContact O-N 3.14Å; E597-K600 WeakPolarHBondContact OE1-CE 3.35Å; E597-K600 IonicContact OE1-NZ 2.68Å; E597-K600 PolarHBondContact OE1-NZ 3.22Å; K600-K602 PolarHBondContact O-N 3.29Å; K600-L603 WeakPolarHBondContact O-CB 3.39Å; K600-L603 PolarHBondContact O-N 2.89Å; K600-Y625 HydrophobicContact CB-CD2 3.5Å; K600-Y625 HydrophobicContact CB-CE2 3.52Å; K600-Y625 HydrophobicContact CB-CG 4.45Å; K600-Y625 HydrophobicContact CD-CE2 3.95Å; K600-Y625 HydrophobicContact CG-CE2 4.38Å
601	E	92.8	Very high	90.5	Very high	48 Å²	48	74.6 Å²	74.6	22%	0.224	39%	0.387	C	S	.	.	H	α-helix	trans	-58	-34.7	178.4	-173.3	177.9	175.8	0	0	112.6	E597 E599 S621 R622 Y625	E597-E601 PolarHBondContact O-N 2.9Å; E599-E601 VanDerWaalsContact C-N 3.33Å; E599-E601 PolarHBondContact O-N 3.46Å; E601-S621 CarbonylContact O-C 3.6Å; E601-S621 WeakPolarHBondContact O-CB 3.43Å; E601-S621 PolarHBondContact O-OG 3.49Å; E601-R622 HydrophobicContact CG-CB 3.68Å; E601-R622 HydrophobicContact CG-CG 3.78Å; E601-R622 PolarHBondContact O-N 3.04Å; E601-R622 WeakPolarHBondContact OE1-CD 3.46Å; E601-R622 VanDerWaalsContact OE1-CG 3.26Å; E601-R622 WeakPolarHBondContact OE1-CG 3.3Å; E601-R622 IonicContact OE1-CZ 2.78Å; E601-R622 IonicContact OE1-NE 3.81Å; E601-R622 PolarHBondContact OE1-NE 3.45Å; E601-R622 IonicContact OE1-NH1 3.07Å; E601-R622 PolarHBondContact OE1-NH1 2.93Å; E601-R622 IonicContact OE2-NH1 2.66Å; E601-Y625 HydrophobicContact CB-CD1 4.3Å
602	K	92.9	Very high	90.1	Very high	117 Å²	117	80.8 Å²	80.8	51%	0.509	42%	0.419	S	S	.	.	H	α-helix	trans	-97.4	-2.8	-176.7	-67.7	172.8	-175.4	165.1	0	114.2	S598 E599 K600 L604 S605	S598-K602 WeakPolarHBondContact O-CG 3.44Å; S598-K602 PolarHBondContact O-N 3.22Å; E599-K602 CarbonylContact O-C 3.56Å; E599-K602 PolarHBondContact O-N 2.98Å; E599-K602 VanDerWaalsContact O-N 3.13Å; K600-K602 PolarHBondContact O-N 3.29Å; K602-L604 PolarHBondContact O-N 3.32Å; K602-L604 VanDerWaalsContact O-N 3.11Å; K602-S605 VanDerWaalsContact O-CB 3.28Å; K602-S605 WeakPolarHBondContact O-CB 3.39Å; K602-S605 PolarHBondContact O-N 3.06Å; K602-S605 PolarHBondContact O-OG 3.18Å
603	L	92.3	Very high	89.9	Confident	43 Å²	43	79.4 Å²	79.4	23%	0.225	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-40.8	-172.8	-176.6	65.4	0	0	0	113.3	A590 Y591 E599 K600	A590-L603 HydrophobicContact CB-CD2 3.99Å; Y591-L603 HydrophobicContact CD1-CB 4.44Å; Y591-L603 HydrophobicContact CD1-CD2 3.5Å; Y591-L603 VanDerWaalsContact CD1-CD2 3.5Å; Y591-L603 HydrophobicContact CE1-CB 3.94Å; Y591-L603 HydrophobicContact CE1-CD2 3.48Å; Y591-L603 VanDerWaalsContact CE1-CD2 3.48Å; Y591-L603 HydrophobicContact CE1-CG 4.33Å; Y591-L603 HydrophobicContact CG-CD2 4.14Å; E599-L603 PolarHBondContact O-N 3.06Å; K600-L603 WeakPolarHBondContact O-CB 3.39Å; K600-L603 PolarHBondContact O-N 2.89Å
604	L	92.9	Very high	89.8	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-4.9	-177.7	-51.6	-179.2	0	0	0	113.1	Y581 L587 Y591 K602 C606 I607 L616 S621 V624	Y581-L604 HydrophobicContact CD2-CD2 3.94Å; Y581-L604 HydrophobicContact CE2-CD2 3.52Å; L587-L604 HydrophobicContact CD1-CD1 4.3Å; L587-L604 HydrophobicContact CD1-CD2 3.86Å; Y591-L604 WeakPolarHBondContact OH-CD1 3.36Å; K602-L604 PolarHBondContact O-N 3.32Å; K602-L604 VanDerWaalsContact O-N 3.11Å; L604-C606 VanDerWaalsContact C-N 3.29Å; L604-C606 PolarHBondContact O-N 3.46Å; L604-I607 HydrophobicContact CB-CD1 3.99Å; L604-I607 HydrophobicContact CD2-CD1 3.52Å; L604-I607 HydrophobicContact CG-CD1 4.34Å; L604-I607 WeakPolarHBondContact O-CB 3.38Å; L604-I607 PolarHBondContact O-N 3.39Å; L604-L616 HydrophobicContact CB-CD2 4.04Å; L604-L616 WeakPolarHBondContact O-CB 3.39Å; L604-S621 PolarHBondContact N-OG 3.44Å; L604-V624 HydrophobicContact CD1-CB 3.81Å; L604-V624 HydrophobicContact CD1-CG1 3.51Å; L604-V624 HydrophobicContact CD1-CG2 4.28Å
605	S	92.9	Very high	89.9	Confident	18 Å²	18	81.9 Å²	81.9	13%	0.126	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-32.4	-169.9	68	0	0	0	0	113.5	K602 G617 S621	K602-S605 VanDerWaalsContact O-CB 3.28Å; K602-S605 WeakPolarHBondContact O-CB 3.39Å; K602-S605 PolarHBondContact O-N 3.06Å; K602-S605 PolarHBondContact O-OG 3.18Å; S605-G617 PolarHBondContact O-N 2.93Å; S605-S621 PolarHBondContact N-OG 3.06Å
606	C	90.6	Very high	90.1	Very high	92 Å²	92	78.8 Å²	78.8	62%	0.622	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	2.1	-179.1	-65.6	0	0	0	0	114	L604 R608	L604-C606 VanDerWaalsContact C-N 3.29Å; L604-C606 PolarHBondContact O-N 3.46Å; C606-R608 PolarHBondContact O-N 2.92Å
607	I	92.1	Very high	90.1	Very high	20 Å²	20	77 Å²	77	10%	0.103	38%	0.376	C	S	.	.			trans	-66	124.9	178.5	-66.9	-178.9	0	0	0	109.3	A576 I577 Q580 Y581 L604 N615 L616	A576-I607 HydrophobicContact CB-CG2 3.68Å; I577-I607 HydrophobicContact CG1-CD1 4.18Å; Q580-I607 HydrophobicContact CG-CD1 4.45Å; Y581-I607 HydrophobicContact CE2-CD1 4.37Å; L604-I607 HydrophobicContact CB-CD1 3.99Å; L604-I607 HydrophobicContact CD2-CD1 3.52Å; L604-I607 HydrophobicContact CG-CD1 4.34Å; L604-I607 WeakPolarHBondContact O-CB 3.38Å; L604-I607 PolarHBondContact O-N 3.39Å; I607-N615 CarbonylContact O-C 3.57Å; I607-N615 WeakPolarHBondContact O-CA 3.5Å; I607-L616 HydrophobicContact CB-CB 4.45Å; I607-L616 PolarHBondContact O-N 3.17Å
608	R	91.5	Very high	90.3	Very high	163 Å²	163	76.5 Å²	76.5	62%	0.615	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	127.3	-179.8	-63.1	-173.4	-174.6	-177.3	1	110.5	C606 K613 R614	C606-R608 PolarHBondContact O-N 2.92Å; R608-K613 HydrophobicContact CB-CB 4.21Å; R608-K613 HydrophobicContact CB-CD 4.2Å; R608-R614 CarbonylContact C-O 3.6Å; R608-R614 VanDerWaalsContact CA-O 3.28Å; R608-R614 WeakPolarHBondContact CA-O 3.35Å
609	Y	90.9	Very high	90.5	Very high	46 Å²	46	77.1 Å²	77.1	18%	0.18	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	157.7	-178.5	74.6	-89.1	0	0	0	113.1	D572 K573 A576 K613 R614 N615	D572-Y609 HydrophobicContact CB-CD2 4.22Å; K573-Y609 HydrophobicContact CD-CE1 4.39Å; K573-Y609 HydrophobicContact CD-CE2 4.34Å; K573-Y609 VanDerWaalsContact CE-OH 3.31Å; K573-Y609 WeakPolarHBondContact CE-OH 3.17Å; K573-Y609 HydrophobicContact CG-CD1 3.93Å; K573-Y609 HydrophobicContact CG-CD2 3.57Å; K573-Y609 HydrophobicContact CG-CE1 4.03Å; K573-Y609 HydrophobicContact CG-CE2 3.69Å; K573-Y609 HydrophobicContact CG-CG 3.71Å; A576-Y609 VanDerWaalsContact CB-CB 3.49Å; Y609-K613 WeakPolarHBondContact O-CA 3.48Å; Y609-K613 PolarHBondContact O-N 2.98Å; Y609-R614 WeakPolarHBondContact CD1-O 3.46Å; Y609-R614 HydrophobicContact CE1-CB 3.97Å; Y609-R614 WeakPolarHBondContact CE1-O 3.47Å; Y609-R614 PolarHBondContact N-O 2.93Å; Y609-R614 PolarHBondContact O-N 3.47Å; Y609-N615 WeakPolarHBondContact CE1-O 3.31Å
610	G	86.4	Confident	90.6	Very high	31 Å²	31	73.7 Å²	73.7	32%	0.32	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	-175.3	177	0	0	0	0	0	114.6	L612 K613	G610-L612 VanDerWaalsContact C-N 3.35Å; G610-L612 PolarHBondContact O-N 2.69Å; G610-K613 PolarHBondContact O-N 3.04Å
611	K	83.5	Confident	90.8	Very high	214 Å²	214	71.9 Å²	71.9	93%	0.93	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-34.7	-177.6	-63.7	-173.8	179.5	-175.5	0	113.3	K613	K611-K613 PolarHBondContact O-N 3.3Å
612	L	85.8	Confident	90.9	Very high	134 Å²	134	75.3 Å²	75.3	70%	0.702	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	2.7	179.5	-72.1	88.7	0	0	0	113.3	G610 R614	G610-L612 VanDerWaalsContact C-N 3.35Å; G610-L612 PolarHBondContact O-N 2.69Å; L612-R614 HydrophobicContact CB-CG 4.17Å; L612-R614 PolarHBondContact O-N 3.1Å; L612-R614 VanDerWaalsContact O-N 3.12Å
613	K	87.9	Confident	90.9	Very high	122 Å²	122	72.5 Å²	72.5	53%	0.53	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	43.4	178.9	-64.9	-65.9	-174.3	-179.8	0	113.1	R608 Y609 G610 K611	R608-K613 HydrophobicContact CB-CB 4.21Å; R608-K613 HydrophobicContact CB-CD 4.2Å; Y609-K613 WeakPolarHBondContact O-CA 3.48Å; Y609-K613 PolarHBondContact O-N 2.98Å; G610-K613 PolarHBondContact O-N 3.04Å; K611-K613 PolarHBondContact O-N 3.3Å
614	R	89.7	Confident	91	Very high	157 Å²	157	70.5 Å²	70.5	59%	0.592	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	147	178.5	-75.7	179	156.4	163.3	-5.9	110.5	R608 Y609 L612	R608-R614 CarbonylContact C-O 3.6Å; R608-R614 VanDerWaalsContact CA-O 3.28Å; R608-R614 WeakPolarHBondContact CA-O 3.35Å; Y609-R614 WeakPolarHBondContact CD1-O 3.46Å; Y609-R614 HydrophobicContact CE1-CB 3.97Å; Y609-R614 WeakPolarHBondContact CE1-O 3.47Å; Y609-R614 PolarHBondContact N-O 2.93Å; Y609-R614 PolarHBondContact O-N 3.47Å; L612-R614 HydrophobicContact CB-CG 4.17Å; L612-R614 PolarHBondContact O-N 3.1Å; L612-R614 VanDerWaalsContact O-N 3.12Å
615	N	92.5	Very high	91.1	Very high	90 Å²	90	72.3 Å²	72.3	48%	0.481	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	140.9	174.8	-67.7	-7.5	0	0	0	110.8	I607 Y609 G617	I607-N615 CarbonylContact O-C 3.57Å; I607-N615 WeakPolarHBondContact O-CA 3.5Å; Y609-N615 WeakPolarHBondContact CE1-O 3.31Å; N615-G617 PolarHBondContact O-N 3.28Å
616	L	90	Very high	91.1	Very high	10 Å²	10	75.4 Å²	75.4	5%	0.052	38%	0.38	C	S	.	.			trans	-56.4	-37.8	174.7	-163	104.4	0	0	0	111.6	L569 K573 I577 L604 I607 L620	L569-L616 HydrophobicContact CD2-CD1 3.98Å; K573-L616 HydrophobicContact CB-CD1 4Å; K573-L616 HydrophobicContact CD-CD1 4.49Å; K573-L616 HydrophobicContact CG-CD1 4.31Å; I577-L616 HydrophobicContact CD1-CD1 3.98Å; I577-L616 HydrophobicContact CG1-CD1 4.15Å; L604-L616 HydrophobicContact CB-CD2 4.04Å; L604-L616 WeakPolarHBondContact O-CB 3.39Å; I607-L616 HydrophobicContact CB-CB 4.45Å; I607-L616 PolarHBondContact O-N 3.17Å; L616-L620 HydrophobicContact CD2-CB 3.68Å; L616-L620 HydrophobicContact CG-CB 4.09Å; L616-L620 HydrophobicContact CG-CD1 4.36Å
617	G	91.6	Very high	91.2	Very high	18 Å²	18	74.3 Å²	74.3	19%	0.186	37%	0.367	C	S	.	.			trans	91.5	157	176.8	0	0	0	0	0	113.5	S605 N615 A619 S621	S605-G617 PolarHBondContact O-N 2.93Å; N615-G617 PolarHBondContact O-N 3.28Å; G617-A619 VanDerWaalsContact C-N 3.35Å; G617-A619 PolarHBondContact O-N 2.94Å; G617-S621 PolarHBondContact O-N 3.25Å
618	P	91.3	Very high	91.3	Very high	88 Å²	88	75.8 Å²	75.8	57%	0.571	37%	0.372	S	S	*	.	H	α-helix	trans	-67.5	-32.6	-172.9	26.3	-34.5	0	0	0	113	S621 R622	P618-S621 PolarHBondContact O-N 2.98Å; P618-R622 WeakPolarHBondContact O-CB 3.49Å; P618-R622 PolarHBondContact O-N 2.84Å
619	A	92	Very high	91.3	Very high	73 Å²	73	69.7 Å²	69.7	60%	0.603	35%	0.354	S	S	*	.	H	α-helix	trans	-62.7	-48.5	-179.1	0	0	0	0	0	112.3	G617 R622 T623	G617-A619 VanDerWaalsContact C-N 3.35Å; G617-A619 PolarHBondContact O-N 2.94Å; A619-R622 PolarHBondContact O-N 2.97Å; A619-T623 PolarHBondContact O-N 3.24Å; A619-T623 VanDerWaalsContact O-N 3.08Å; A619-T623 PolarHBondContact O-OG1 3.23Å; A619-T623 VanDerWaalsContact O-OG1 3.08Å
620	L	93	Very high	91.3	Very high	26 Å²	26	70.7 Å²	70.7	14%	0.136	37%	0.365	C	S	.	.	H	α-helix	trans	-70	-36.3	178.4	-71.1	174	0	0	0	111.7	L569 K573 L616 T623 V624	L569-L620 HydrophobicContact CD2-CD1 4.25Å; K573-L620 HydrophobicContact CD-CD1 4.03Å; K573-L620 VanDerWaalsContact NZ-CD1 3.27Å; L616-L620 HydrophobicContact CD2-CB 3.68Å; L616-L620 HydrophobicContact CG-CB 4.09Å; L616-L620 HydrophobicContact CG-CD1 4.36Å; L620-T623 PolarHBondContact O-N 3.49Å; L620-V624 WeakPolarHBondContact O-CG2 3.38Å; L620-V624 PolarHBondContact O-N 2.84Å
621	S	94.9	Very high	91.2	Very high	0 Å²	0	76 Å²	76	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-58.4	-47.4	173.6	-172.4	0	0	0	0	111.3	E601 L604 S605 G617 P618 T623 V624 Y625	E601-S621 CarbonylContact O-C 3.6Å; E601-S621 WeakPolarHBondContact O-CB 3.43Å; E601-S621 PolarHBondContact O-OG 3.49Å; L604-S621 PolarHBondContact N-OG 3.44Å; S605-S621 PolarHBondContact N-OG 3.06Å; G617-S621 PolarHBondContact O-N 3.25Å; P618-S621 PolarHBondContact O-N 2.98Å; S621-T623 PolarHBondContact O-N 3.41Å; S621-V624 PolarHBondContact O-N 3.01Å; S621-Y625 WeakPolarHBondContact O-CB 3.45Å; S621-Y625 PolarHBondContact O-N 2.96Å
622	R	93.4	Very high	91.4	Very high	119 Å²	119	68 Å²	68	45%	0.449	37%	0.373	S	S	.	.	H	α-helix	trans	-58.8	-46.2	175	-177	-173.3	-171.1	124	-6.2	112.4	E601 P618 A619 V624 Y625 Q626	E601-R622 HydrophobicContact CG-CB 3.68Å; E601-R622 HydrophobicContact CG-CG 3.78Å; E601-R622 PolarHBondContact O-N 3.04Å; E601-R622 WeakPolarHBondContact OE1-CD 3.46Å; E601-R622 VanDerWaalsContact OE1-CG 3.26Å; E601-R622 WeakPolarHBondContact OE1-CG 3.3Å; E601-R622 IonicContact OE1-CZ 2.78Å; E601-R622 IonicContact OE1-NE 3.81Å; E601-R622 PolarHBondContact OE1-NE 3.45Å; E601-R622 IonicContact OE1-NH1 3.07Å; E601-R622 PolarHBondContact OE1-NH1 2.93Å; E601-R622 IonicContact OE2-NH1 2.66Å; P618-R622 WeakPolarHBondContact O-CB 3.49Å; P618-R622 PolarHBondContact O-N 2.84Å; A619-R622 PolarHBondContact O-N 2.97Å; R622-V624 PolarHBondContact O-N 3.43Å; R622-Y625 PolarHBondContact O-N 3.26Å; R622-Q626 HydrophobicContact CG-CG 4.42Å; R622-Q626 WeakPolarHBondContact O-CB 3.26Å; R622-Q626 WeakPolarHBondContact O-CG 3.47Å; R622-Q626 PolarHBondContact O-N 2.91Å
623	T	94.1	Very high	91.5	Very high	59 Å²	59	65.9 Å²	65.9	36%	0.362	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-42.7	-179.6	-56.2	0	0	0	0	112.1	I566 A619 L620 S621 Q626 L627	I566-T623 HydrophobicContact CG2-CG2 3.67Å; A619-T623 PolarHBondContact O-N 3.24Å; A619-T623 VanDerWaalsContact O-N 3.08Å; A619-T623 PolarHBondContact O-OG1 3.23Å; A619-T623 VanDerWaalsContact O-OG1 3.08Å; L620-T623 PolarHBondContact O-N 3.49Å; S621-T623 PolarHBondContact O-N 3.41Å; T623-Q626 PolarHBondContact O-N 3.25Å; T623-L627 PolarHBondContact O-N 3.48Å; T623-L627 VanDerWaalsContact O-N 3.11Å
624	V	93.9	Very high	91.3	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-67.2	-42.9	176.7	178.8	0	0	0	0	110.5	I566 L569 L587 L604 L620 S621 R622 Q626 L627 Y628	I566-V624 HydrophobicContact CD1-CG2 3.83Å; L569-V624 HydrophobicContact CD1-CG2 3.85Å; L587-V624 HydrophobicContact CD2-CG1 4.09Å; L604-V624 HydrophobicContact CD1-CB 3.81Å; L604-V624 HydrophobicContact CD1-CG1 3.51Å; L604-V624 HydrophobicContact CD1-CG2 4.28Å; L620-V624 WeakPolarHBondContact O-CG2 3.38Å; L620-V624 PolarHBondContact O-N 2.84Å; S621-V624 PolarHBondContact O-N 3.01Å; R622-V624 PolarHBondContact O-N 3.43Å; V624-Q626 PolarHBondContact O-N 3.31Å; V624-L627 WeakPolarHBondContact O-CB 3.48Å; V624-L627 PolarHBondContact O-N 2.66Å; V624-Y628 HydrophobicContact CG1-CD2 3.71Å; V624-Y628 HydrophobicContact CG1-CE2 3.89Å; V624-Y628 VanDerWaalsContact O-CD2 3.31Å; V624-Y628 WeakPolarHBondContact O-CD2 3.42Å; V624-Y628 PolarHBondContact O-N 3.12Å; V624-Y628 VanDerWaalsContact O-N 3.14Å
625	Y	94.3	Very high	89.9	Confident	39 Å²	39	67.6 Å²	67.6	15%	0.153	41%	0.408	C	S	.	.	H	α-helix	trans	-56.9	-48.3	174.7	154.3	-101.1	0	0	0	111.7	Y591 E597 K600 E601 S621 R622 L627 Y628 C629	Y591-Y625 HydrophobicContact CD1-CD2 4.37Å; Y591-Y625 HydrophobicContact CE1-CD2 4.21Å; Y591-Y625 PolarHBondContact OH-N 3.46Å; E597-Y625 WeakPolarHBondContact OE2-CE2 3.21Å; E597-Y625 PolarHBondContact OE2-OH 2.97Å; K600-Y625 HydrophobicContact CB-CD2 3.5Å; K600-Y625 HydrophobicContact CB-CE2 3.52Å; K600-Y625 HydrophobicContact CB-CG 4.45Å; K600-Y625 HydrophobicContact CD-CE2 3.95Å; K600-Y625 HydrophobicContact CG-CE2 4.38Å; E601-Y625 HydrophobicContact CB-CD1 4.3Å; S621-Y625 WeakPolarHBondContact O-CB 3.45Å; S621-Y625 PolarHBondContact O-N 2.96Å; R622-Y625 PolarHBondContact O-N 3.26Å; Y625-L627 VanDerWaalsContact C-N 3.27Å; Y625-L627 PolarHBondContact O-N 3.36Å; Y625-Y628 PolarHBondContact O-N 3.26Å; Y625-Y628 VanDerWaalsContact O-N 3.17Å; Y625-C629 HydrophobicContact CD2-CB 3.62Å; Y625-C629 VanDerWaalsContact CD2-SG 3.58Å; Y625-C629 HydrophobicContact CE2-CB 3.42Å; Y625-C629 VanDerWaalsContact CE2-CB 3.42Å; Y625-C629 VanDerWaalsContact O-CB 3.3Å; Y625-C629 WeakPolarHBondContact O-CB 3.38Å; Y625-C629 PolarHBondContact O-N 3.01Å
626	Q	92.8	Very high	89.8	Confident	82 Å²	82	66.5 Å²	66.5	38%	0.383	40%	0.404	S	S	.	.	H	α-helix	trans	-58.5	-39.3	177.4	-74.5	175.5	-28.9	0	0	112	R622 T623 V624 T630	R622-Q626 HydrophobicContact CG-CG 4.42Å; R622-Q626 WeakPolarHBondContact O-CB 3.26Å; R622-Q626 WeakPolarHBondContact O-CG 3.47Å; R622-Q626 PolarHBondContact O-N 2.91Å; T623-Q626 PolarHBondContact O-N 3.25Å; V624-Q626 PolarHBondContact O-N 3.31Å; Q626-T630 VanDerWaalsContact O-CB 3.32Å; Q626-T630 WeakPolarHBondContact O-CB 3.46Å; Q626-T630 PolarHBondContact O-N 3.34Å; Q626-T630 PolarHBondContact O-OG1 3.24Å
627	L	94.3	Very high	89.7	Confident	70 Å²	70	69.4 Å²	69.4	37%	0.366	42%	0.423	S	S	.	.	H	α-helix	trans	-63.4	-41.4	177.7	179.8	64.5	0	0	0	112.7	I566 T623 V624 Y625 L634	I566-L627 HydrophobicContact CD1-CD2 3.75Å; I566-L627 HydrophobicContact CG1-CD2 4.32Å; T623-L627 PolarHBondContact O-N 3.48Å; T623-L627 VanDerWaalsContact O-N 3.11Å; V624-L627 WeakPolarHBondContact O-CB 3.48Å; V624-L627 PolarHBondContact O-N 2.66Å; Y625-L627 VanDerWaalsContact C-N 3.27Å; Y625-L627 PolarHBondContact O-N 3.36Å; L627-L634 HydrophobicContact CD1-CD1 3.53Å; L627-L634 HydrophobicContact CD1-CD2 4.37Å
628	Y	93	Very high	89.6	Confident	51 Å²	51	72.3 Å²	72.3	20%	0.2	44%	0.436	C	S	.	.	H	α-helix	trans	-95.1	-22.5	-172.3	-76.8	-75.8	0	0	0	114.7	F559 L563 L587 L588 V624 Y625	F559-Y628 WeakPolarHBondContact CE2-OH 3.19Å; L563-Y628 HydrophobicContact CD2-CE2 4.38Å; L587-Y628 HydrophobicContact CD2-CD2 3.91Å; L587-Y628 HydrophobicContact CD2-CE2 3.9Å; L587-Y628 HydrophobicContact CD2-CG 4.44Å; L588-Y628 HydrophobicContact CD2-CD1 4.02Å; L588-Y628 HydrophobicContact CD2-CG 4.41Å; L588-Y628 HydrophobicContact CG-CD1 4.29Å; V624-Y628 HydrophobicContact CG1-CD2 3.71Å; V624-Y628 HydrophobicContact CG1-CE2 3.89Å; V624-Y628 VanDerWaalsContact O-CD2 3.31Å; V624-Y628 WeakPolarHBondContact O-CD2 3.42Å; V624-Y628 PolarHBondContact O-N 3.12Å; V624-Y628 VanDerWaalsContact O-N 3.14Å; Y625-Y628 PolarHBondContact O-N 3.26Å; Y625-Y628 VanDerWaalsContact O-N 3.17Å
629	C	91.9	Very high	89.5	Confident	34 Å²	34	71.4 Å²	71.4	23%	0.23	43%	0.428	C	S	.	.	H	α-helix	trans	-112.7	-1.1	-172.1	-63	0	0	0	0	114.5	Y591 Y625 P631	Y591-C629 VanDerWaalsContact CG-SG 3.51Å; Y625-C629 HydrophobicContact CD2-CB 3.62Å; Y625-C629 VanDerWaalsContact CD2-SG 3.58Å; Y625-C629 HydrophobicContact CE2-CB 3.42Å; Y625-C629 VanDerWaalsContact CE2-CB 3.42Å; Y625-C629 VanDerWaalsContact O-CB 3.3Å; Y625-C629 WeakPolarHBondContact O-CB 3.38Å; Y625-C629 PolarHBondContact O-N 3.01Å; C629-P631 VanDerWaalsContact O-CD 3.27Å; C629-P631 WeakPolarHBondContact O-CD 3.24Å
630	T	91.9	Very high	89.4	Confident	67 Å²	67	71.3 Å²	71.3	41%	0.411	42%	0.417	S	S	.	.			trans	-73.6	117.3	176.5	-62.1	0	0	0	0	109.8	Q626 G632	Q626-T630 VanDerWaalsContact O-CB 3.32Å; Q626-T630 WeakPolarHBondContact O-CB 3.46Å; Q626-T630 PolarHBondContact O-N 3.34Å; Q626-T630 PolarHBondContact O-OG1 3.24Å; T630-G632 PolarHBondContact O-N 3.16Å
631	P	83.4	Confident	89.2	Confident	142 Å²	142	74.3 Å²	74.3	92%	0.922	44%	0.436	S	S	*	.	S	Bend	trans	-77.1	14.7	-175.4	31.5	-35	0	0	0	114.1	C629	C629-P631 VanDerWaalsContact O-CD 3.27Å; C629-P631 WeakPolarHBondContact O-CD 3.24Å
632	G	88.3	Confident	88.7	Confident	48 Å²	48	79.6 Å²	79.6	50%	0.495	47%	0.467	S	S	.	.	S	Bend	trans	-143.1	-171.9	-175.5	0	0	0	0	0	112.6	T630 L634	T630-G632 PolarHBondContact O-N 3.16Å; G632-L634 PolarHBondContact O-N 2.98Å
633	A	86.6	Confident	88.4	Confident	88 Å²	88	76.5 Å²	76.5	73%	0.727	47%	0.468	S	S	*	.			trans	-60.5	133.1	178.4	0	0	0	0	0	111.2	T635	A633-T635 PolarHBondContact O-N 3.12Å
634	L	84.9	Confident	87.9	Confident	109 Å²	109	78 Å²	78	57%	0.571	48%	0.477	S	S	*	.			trans	-71.7	111.5	171.1	-61.1	167.3	0	0	0	107.8	L627 G632	L627-L634 HydrophobicContact CD1-CD1 3.53Å; L627-L634 HydrophobicContact CD1-CD2 4.37Å; G632-L634 PolarHBondContact O-N 2.98Å
635	T	59.6	Low	87.4	Confident	206 Å²	206	85.1 Å²	85.1	100%	1.264	52%	0.52	S	S	*	.			trans	-92.6	0	-179.7	54.5	0	0	0	0	113.1	A633	A633-T635 PolarHBondContact O-N 3.12Å

Retrieved 635 of 635 residues in 450.4 ms (Link to these results)

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