A0A087YN57_POEFO Loading...

hypoxia-inducible factor-proline dioxygenase

AlphaFold DB , UniProt , Accession A0A087YN57, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 357 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	P	45.9	Very low	44.4	Very low	172 Å²	172	124 Å²	124	100%	1.117	64%	0.644	S	S	*	*				0	-12.3	0	7.7	15.1	0	0	0	116
2	N	52.8	Low	44.8	Very low	114 Å²	114	128 Å²	128	61%	0.61	65%	0.645	S	S	*	*			trans	-108.2	-3.4	-171.1	-147.8	22.6	0	0	0	115.6
3	M	44.3	Very low	45.5	Very low	164 Å²	164	128.6 Å²	128.6	81%	0.808	65%	0.651	S	S	*	*	H	α-helix	trans	-85.6	-37.8	179.7	-70.7	-169	-160.3	0	0	113.1	K5 Q6 Q7	M3-K5 VanDerWaalsContact C-N 3.28Å; M3-K5 PolarHBondContact O-N 3.2Å; M3-Q6 PolarHBondContact O-N 3.43Å; M3-Q7 PolarHBondContact O-N 2.79Å
4	E	41.3	Very low	46.8	Very low	166 Å²	166	130.1 Å²	130.1	78%	0.776	65%	0.645	S	S	*	*	H	α-helix	trans	-66.7	-31.2	179.5	-71.6	175.2	145.8	0	0	112.3	Q7 S8	E4-Q7 PolarHBondContact O-N 3.38Å; E4-S8 WeakPolarHBondContact O-CB 3.2Å; E4-S8 PolarHBondContact O-N 3.25Å
5	K	41.8	Very low	49.3	Very low	143 Å²	143	129.1 Å²	129.1	62%	0.622	64%	0.638	S	S	*	*	H	α-helix	trans	-70.4	-41.3	177.5	-147.8	175	-177	-174.7	0	111.6	M3 S8 D9	M3-K5 VanDerWaalsContact C-N 3.28Å; M3-K5 PolarHBondContact O-N 3.2Å; K5-S8 PolarHBondContact O-N 3.43Å; K5-S8 PolarHBondContact O-OG 2.96Å; K5-D9 PolarHBondContact O-N 3.07Å
6	Q	43.7	Very low	51.9	Low	128 Å²	128	122.4 Å²	122.4	60%	0.598	61%	0.607	S	S	*	*	H	α-helix	trans	-65.8	-36.4	174	-103	172.5	-5.4	0	0	113	M3 L10	M3-Q6 PolarHBondContact O-N 3.43Å; Q6-L10 WeakPolarHBondContact O-CG 3.23Å; Q6-L10 PolarHBondContact O-N 2.91Å
7	Q	41.8	Very low	54.3	Low	123 Å²	123	115.3 Å²	115.3	58%	0.575	57%	0.571	S	S	*	*	H	α-helix	trans	-67.2	-38.6	173.2	-159.9	70.5	31.9	0	0	111.5	M3 E4 L10 D11	M3-Q7 PolarHBondContact O-N 2.79Å; E4-Q7 PolarHBondContact O-N 3.38Å; Q7-L10 PolarHBondContact O-N 3.28Å; Q7-D11 PolarHBondContact O-N 3.01Å
8	S	44.4	Very low	56.3	Low	64 Å²	64	114.1 Å²	114.1	45%	0.448	56%	0.564	S	S	.	*	H	α-helix	trans	-71.5	-28.3	179.1	78.4	0	0	0	0	114.2	E4 K5	E4-S8 WeakPolarHBondContact O-CB 3.2Å; E4-S8 PolarHBondContact O-N 3.25Å; K5-S8 PolarHBondContact O-N 3.43Å; K5-S8 PolarHBondContact O-OG 2.96Å
9	D	41	Very low	58	Low	69 Å²	69	111.8 Å²	111.8	37%	0.369	55%	0.554	S	S	.	*	H	α-helix	trans	-79	-29.1	176.5	-76.3	-41.4	0	0	0	111.9	K5 R12	K5-D9 PolarHBondContact O-N 3.07Å; D9-R12 IonicContact OD1-CZ 2.88Å; D9-R12 IonicContact OD1-NH1 3.29Å; D9-R12 PolarHBondContact OD1-NH1 3.42Å; D9-R12 IonicContact OD1-NH2 3.74Å
10	L	46.4	Very low	59.6	Low	127 Å²	127	108.7 Å²	108.7	67%	0.665	54%	0.543	S	S	*	.	H	α-helix	trans	-77.9	-30.1	175.9	-70.6	171.4	0	0	0	113.8	Q6 Q7 R12	Q6-L10 WeakPolarHBondContact O-CG 3.23Å; Q6-L10 PolarHBondContact O-N 2.91Å; Q7-L10 PolarHBondContact O-N 3.28Å; L10-R12 VanDerWaalsContact C-N 3.33Å
11	D	45.5	Very low	60.9	Low	94 Å²	94	105.6 Å²	105.6	50%	0.503	54%	0.538	S	S	.	.	H	α-helix	trans	-76.7	-20	173.5	-94.4	-27	0	0	0	112.7	Q7 D13 R14	Q7-D11 PolarHBondContact O-N 3.01Å; D11-D13 VanDerWaalsContact C-N 3.33Å; D11-D13 PolarHBondContact O-N 3.04Å; D11-R14 PolarHBondContact O-N 2.82Å
12	R	48.3	Very low	62.9	Low	172 Å²	172	104.7 Å²	104.7	65%	0.649	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-20.2	-177.1	-150	176.2	68.3	-132.8	-7.2	114	D9 L10	D9-R12 IonicContact OD1-CZ 2.88Å; D9-R12 IonicContact OD1-NH1 3.29Å; D9-R12 PolarHBondContact OD1-NH1 3.42Å; D9-R12 IonicContact OD1-NH2 3.74Å; L10-R12 VanDerWaalsContact C-N 3.33Å
13	D	54.2	Low	64.6	Low	136 Å²	136	104.3 Å²	104.3	73%	0.727	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	0.5	177.8	-82	-14	0	0	0	113.4	D11 Q15	D11-D13 VanDerWaalsContact C-N 3.33Å; D11-D13 PolarHBondContact O-N 3.04Å; D13-Q15 PolarHBondContact O-N 3.28Å
14	R	63.9	Low	66.2	Low	149 Å²	149	102.9 Å²	102.9	56%	0.562	50%	0.499	S	S	*	.			trans	-78.6	103.9	176.5	-140.6	176	-166.8	174.2	1.7	109.1	D11 V16	D11-R14 PolarHBondContact O-N 2.82Å; R14-V16 VanDerWaalsContact C-N 3.26Å; R14-V16 HydrophobicContact CB-CG2 4.44Å; R14-V16 HydrophobicContact CG-CG1 4.05Å; R14-V16 PolarHBondContact O-N 3.28Å
15	Q	84.9	Confident	68.3	Low	115 Å²	115	101.5 Å²	101.5	54%	0.537	50%	0.497	S	S	.	.			trans	-74.1	82.8	173.3	-56.9	-172.6	11.2	0	0	109.6	D13 L26 F36	D13-Q15 PolarHBondContact O-N 3.28Å; Q15-L26 VanDerWaalsContact C-CD1 3.47Å; Q15-L26 HydrophobicContact CB-CD1 4.27Å; Q15-L26 WeakPolarHBondContact O-CD1 3.32Å; Q15-F36 HydrophobicContact CB-CD1 4.29Å; Q15-F36 HydrophobicContact CB-CD2 4.38Å; Q15-F36 HydrophobicContact CB-CE1 4.12Å; Q15-F36 HydrophobicContact CB-CE2 4.27Å; Q15-F36 HydrophobicContact CB-CG 4.42Å; Q15-F36 HydrophobicContact CB-CZ 4.14Å; Q15-F36 HydrophobicContact CG-CD2 4.41Å; Q15-F36 HydrophobicContact CG-CE1 3.87Å; Q15-F36 HydrophobicContact CG-CE2 3.81Å; Q15-F36 HydrophobicContact CG-CZ 3.51Å
16	V	90	Very high	70.6	Confident	23 Å²	23	96.6 Å²	96.6	14%	0.139	48%	0.478	C	S	.	.			trans	-124.3	156.8	176.1	-69.9	0	0	0	0	109.6	R14 E18 R22 M23 F36	R14-V16 VanDerWaalsContact C-N 3.26Å; R14-V16 HydrophobicContact CB-CG2 4.44Å; R14-V16 HydrophobicContact CG-CG1 4.05Å; R14-V16 PolarHBondContact O-N 3.28Å; V16-E18 PolarHBondContact O-N 3.46Å; V16-R22 CarbonylContact C-O 3.56Å; V16-R22 WeakPolarHBondContact CA-O 3.45Å; V16-M23 HydrophobicContact CG1-CE 3.52Å; V16-M23 HydrophobicContact CG1-CG 3.6Å; V16-M23 HydrophobicContact CG1-SD 4.44Å; V16-F36 WeakPolarHBondContact O-CB 3.4Å
17	C	92.6	Very high	72.8	Confident	1 Å²	1	94.4 Å²	94.4	1%	0.007	47%	0.47	C	S	.	.	B	Isolated β-bridge	trans	-62.9	119.9	168.3	-179	0	0	0	0	109.6	L19 C20 G21 R22 L26 F36 C38 H42	C17-L19 PolarHBondContact O-N 2.82Å; C17-C20 VanDerWaalsContact CB-SG 3.51Å; C17-C20 PolarHBondContact O-N 3.48Å; C17-G21 WeakPolarHBondContact O-CA 3.18Å; C17-G21 PolarHBondContact O-N 2.96Å; C17-R22 PolarHBondContact N-O 3.02Å; C17-L26 HydrophobicContact CB-CD2 3.82Å; C17-F36 VanDerWaalsContact CA-O 3.29Å; C17-F36 WeakPolarHBondContact CA-O 3.46Å; C17-C38 HydrophobicContact CB-CB 4.2Å; C17-C38 PolarHBondContact SG-N 3.37Å; C17-C38 VanDerWaalsContact SG-N 3.43Å; C17-H42 PolarHBondContact SG-ND1 2.77Å; C17-H42 VanDerWaalsContact SG-ND1 3.36Å
18	E	91	Very high	75.1	Confident	94 Å²	94	94.4 Å²	94.4	44%	0.439	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-19.8	-178.7	-59.2	-70.8	-179.1	0	0	113.5	V16 S35 F36 Y37	V16-E18 PolarHBondContact O-N 3.46Å; E18-S35 WeakPolarHBondContact OE1-CB 3.36Å; E18-S35 PolarHBondContact OE1-OG 3.01Å; E18-F36 PolarHBondContact N-O 3.5Å; E18-Y37 HydrophobicContact CB-CD1 4.34Å; E18-Y37 HydrophobicContact CB-CE1 3.7Å; E18-Y37 HydrophobicContact CG-CE1 3.98Å
19	L	88.5	Confident	77.3	Confident	70 Å²	70	91.4 Å²	91.4	37%	0.366	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-41.3	-178.8	-166.6	70.9	0	0	0	113.8	C17 H42 Q45 D46	C17-L19 PolarHBondContact O-N 2.82Å; L19-H42 HydrophobicContact CB-CB 4.15Å; L19-H42 HydrophobicContact CD2-CB 3.81Å; L19-Q45 HydrophobicContact CD2-CB 3.78Å; L19-D46 HydrophobicContact CD1-CB 4.41Å
20	C	90.3	Very high	79.4	Confident	50 Å²	50	91.5 Å²	91.5	34%	0.338	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	-1	-170	72.8	0	0	0	0	114.8	C17 R22 H42	C17-C20 VanDerWaalsContact CB-SG 3.51Å; C17-C20 PolarHBondContact O-N 3.48Å; C20-R22 PolarHBondContact O-N 3.43Å; C20-R22 VanDerWaalsContact O-N 3.13Å; C20-R22 VanDerWaalsContact SG-CG 3.59Å; C20-H42 PolarHBondContact SG-CE1 3.48Å; C20-H42 PolarHBondContact SG-ND1 3.05Å
21	G	86.5	Confident	81.3	Confident	43 Å²	43	91.6 Å²	91.6	44%	0.443	46%	0.455	S	S	.	.			trans	71.8	-0.4	177.1	0	0	0	0	0	116	C17	C17-G21 WeakPolarHBondContact O-CA 3.18Å; C17-G21 PolarHBondContact O-N 2.96Å
22	R	87.6	Confident	83.2	Confident	154 Å²	154	87.5 Å²	87.5	58%	0.581	43%	0.434	S	S	*	.			trans	-64	144.7	177.1	-67.7	-177	-145.3	170.3	6.2	111	V16 C17 C20	V16-R22 CarbonylContact C-O 3.56Å; V16-R22 WeakPolarHBondContact CA-O 3.45Å; C17-R22 PolarHBondContact N-O 3.02Å; C20-R22 PolarHBondContact O-N 3.43Å; C20-R22 VanDerWaalsContact O-N 3.13Å; C20-R22 VanDerWaalsContact SG-CG 3.59Å
23	M	87.8	Confident	85.1	Confident	106 Å²	106	86.7 Å²	86.7	52%	0.522	43%	0.431	S	S	.	.			trans	-100.7	-1.4	-179.9	-67.9	175.3	177.9	0	0	113.4	V16	V16-M23 HydrophobicContact CG1-CE 3.52Å; V16-M23 HydrophobicContact CG1-CG 3.6Å; V16-M23 HydrophobicContact CG1-SD 4.44Å
24	E	79.4	Confident	86.6	Confident	133 Å²	133	83.8 Å²	83.8	62%	0.621	42%	0.422	S	S	*	.	S	Bend	trans	-107	152.9	-174.4	-62.3	179.4	-178.4	0	0	112.5	L26	E24-L26 VanDerWaalsContact C-N 3.26Å; E24-L26 PolarHBondContact O-N 3.42Å
25	N	84.9	Confident	87.8	Confident	137 Å²	137	77.1 Å²	77.1	73%	0.733	40%	0.398	S	S	*	.	S	Bend	trans	54	38.6	175.2	-61.3	-54.5	0	0	0	114	L27 C38	N25-L27 PolarHBondContact O-N 3.24Å; N25-C38 WeakPolarHBondContact O-CA 3.4Å
26	L	89.6	Confident	88.3	Confident	41 Å²	41	72.5 Å²	72.5	22%	0.215	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-78.7	122.9	-174.7	-64.2	179.7	0	0	0	112.5	Q15 C17 E24 F36 C38	Q15-L26 VanDerWaalsContact C-CD1 3.47Å; Q15-L26 HydrophobicContact CB-CD1 4.27Å; Q15-L26 WeakPolarHBondContact O-CD1 3.32Å; C17-L26 HydrophobicContact CB-CD2 3.82Å; E24-L26 VanDerWaalsContact C-N 3.26Å; E24-L26 PolarHBondContact O-N 3.42Å; L26-F36 HydrophobicContact CB-CB 4.19Å; L26-F36 HydrophobicContact CB-CD1 4.18Å; L26-F36 HydrophobicContact CD1-CB 4.04Å; L26-F36 HydrophobicContact CD1-CD1 4.4Å; L26-F36 HydrophobicContact CD1-CG 4.47Å; L26-F36 HydrophobicContact CD2-CB 4.33Å; L26-F36 HydrophobicContact CG-CB 4.42Å; L26-C38 HydrophobicContact CD2-CB 4.11Å
27	L	89.4	Confident	88.5	Confident	81 Å²	81	71.5 Å²	71.5	42%	0.424	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131	169	-55.9	172.5	0	0	0	108.6	N25 F36 Y37 K40	N25-L27 PolarHBondContact O-N 3.24Å; L27-F36 CarbonylContact O-C 3.04Å; L27-F36 WeakPolarHBondContact O-CA 3.32Å; L27-Y37 WeakPolarHBondContact CB-O 3.4Å; L27-Y37 PolarHBondContact N-O 3.07Å; L27-Y37 PolarHBondContact O-N 2.98Å; L27-K40 HydrophobicContact CD1-CG 4.13Å
28	K	91.5	Very high	88.5	Confident	123 Å²	123	72.4 Å²	72.4	54%	0.535	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	144.2	172.4	-64.8	-178.9	-178.8	-179.8	0	110.1	G30 S35 F36	K28-G30 PolarHBondContact O-N 2.83Å; K28-S35 WeakPolarHBondContact CA-O 3.29Å; K28-F36 HydrophobicContact CD-CE1 4.1Å; K28-F36 VanDerWaalsContact CE-CE1 3.45Å; K28-F36 HydrophobicContact CG-CD1 3.85Å; K28-F36 HydrophobicContact CG-CE1 3.66Å; K28-F36 HydrophobicContact CG-CZ 4.39Å
29	C	90.1	Very high	88.6	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.014	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-56.9	123.4	168.7	-180	0	0	0	0	109.8	R31 R33 S35 Y37 H50	C29-R31 PolarHBondContact O-N 3.34Å; C29-R31 VanDerWaalsContact O-N 3.08Å; C29-R33 VanDerWaalsContact O-CA 3.25Å; C29-R33 WeakPolarHBondContact O-CA 3.07Å; C29-R33 PolarHBondContact O-N 2.99Å; C29-S35 PolarHBondContact N-O 2.93Å; C29-Y37 HydrophobicContact CB-CE2 4.4Å; C29-H50 PolarHBondContact SG-NE2 3.48Å; C29-H50 VanDerWaalsContact SG-NE2 3.35Å
30	G	85.6	Confident	88.7	Confident	70 Å²	70	73.6 Å²	73.6	72%	0.722	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-19	-175.8	0	0	0	0	0	114.7	K28	K28-G30 PolarHBondContact O-N 2.83Å
31	R	84.9	Confident	88.9	Confident	129 Å²	129	75.9 Å²	75.9	49%	0.487	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-58.5	-179.2	-169.4	179.4	-168.1	-169.2	2.3	112.9	C29 E56 A57	C29-R31 PolarHBondContact O-N 3.34Å; C29-R31 VanDerWaalsContact O-N 3.08Å; R31-E56 HydrophobicContact CG-CG 3.8Å; R31-E56 IonicContact CZ-OE1 3.84Å; R31-E56 IonicContact NE-OE1 3.77Å; R31-E56 PolarHBondContact NE-OE1 2.98Å; R31-E56 IonicContact NH2-OE1 2.69Å; R31-E56 PolarHBondContact NH2-OE1 3.21Å; R31-A57 PolarHBondContact O-N 2.87Å
32	C	86.4	Confident	89.3	Confident	9 Å²	9	75.4 Å²	75.4	6%	0.061	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-19.8	-175.4	69.4	0	0	0	0	114.9	S34 H50 K55	C32-S34 PolarHBondContact O-N 2.92Å; C32-S34 PolarHBondContact SG-OG 3.35Å; C32-H50 PolarHBondContact SG-CE1 3.34Å; C32-H50 PolarHBondContact SG-NE2 3.31Å; C32-K55 WeakPolarHBondContact CA-O 3.45Å; C32-K55 WeakPolarHBondContact CB-O 3.46Å
33	R	88	Confident	89.5	Confident	155 Å²	155	70.3 Å²	70.3	59%	0.585	36%	0.356	S	S	*	.	S	Bend	trans	55.1	4.5	-176.1	-58.8	179.4	170.5	-173.2	-6	116	C29 A57	C29-R33 VanDerWaalsContact O-CA 3.25Å; C29-R33 WeakPolarHBondContact O-CA 3.07Å; C29-R33 PolarHBondContact O-N 2.99Å; R33-A57 HydrophobicContact CB-CB 4.38Å; R33-A57 HydrophobicContact CG-CB 4.36Å
34	S	86.3	Confident	89.8	Confident	75 Å²	75	72.3 Å²	72.3	52%	0.524	36%	0.362	S	S	.	.	S	Bend	trans	-99.5	-14.3	-176.2	59	0	0	0	0	114.5	C32	C32-S34 PolarHBondContact O-N 2.92Å; C32-S34 PolarHBondContact SG-OG 3.35Å
35	S	88.8	Confident	90.4	Very high	9 Å²	9	71.1 Å²	71.1	6%	0.063	36%	0.356	C	S	.	.			trans	-113.9	149.5	174.7	-67.9	0	0	0	0	111.3	E18 K28 C29 H50	E18-S35 WeakPolarHBondContact OE1-CB 3.36Å; E18-S35 PolarHBondContact OE1-OG 3.01Å; K28-S35 WeakPolarHBondContact CA-O 3.29Å; C29-S35 PolarHBondContact N-O 2.93Å; S35-H50 VanDerWaalsContact CB-CE1 3.41Å; S35-H50 WeakPolarHBondContact CB-CE1 3.3Å; S35-H50 PolarHBondContact OG-CE1 3.3Å; S35-H50 PolarHBondContact OG-ND1 2.93Å
36	F	94.4	Very high	90.6	Very high	18 Å²	18	65.6 Å²	65.6	8%	0.079	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	143	-169.8	-60.7	-101.2	0	0	0	111.7	Q15 V16 C17 E18 L26 L27 K28	Q15-F36 HydrophobicContact CB-CD1 4.29Å; Q15-F36 HydrophobicContact CB-CD2 4.38Å; Q15-F36 HydrophobicContact CB-CE1 4.12Å; Q15-F36 HydrophobicContact CB-CE2 4.27Å; Q15-F36 HydrophobicContact CB-CG 4.42Å; Q15-F36 HydrophobicContact CB-CZ 4.14Å; Q15-F36 HydrophobicContact CG-CD2 4.41Å; Q15-F36 HydrophobicContact CG-CE1 3.87Å; Q15-F36 HydrophobicContact CG-CE2 3.81Å; Q15-F36 HydrophobicContact CG-CZ 3.51Å; V16-F36 WeakPolarHBondContact O-CB 3.4Å; C17-F36 VanDerWaalsContact CA-O 3.29Å; C17-F36 WeakPolarHBondContact CA-O 3.46Å; E18-F36 PolarHBondContact N-O 3.5Å; L26-F36 HydrophobicContact CB-CB 4.19Å; L26-F36 HydrophobicContact CB-CD1 4.18Å; L26-F36 HydrophobicContact CD1-CB 4.04Å; L26-F36 HydrophobicContact CD1-CD1 4.4Å; L26-F36 HydrophobicContact CD1-CG 4.47Å; L26-F36 HydrophobicContact CD2-CB 4.33Å; L26-F36 HydrophobicContact CG-CB 4.42Å; L27-F36 CarbonylContact O-C 3.04Å; L27-F36 WeakPolarHBondContact O-CA 3.32Å; K28-F36 HydrophobicContact CD-CE1 4.1Å; K28-F36 VanDerWaalsContact CE-CE1 3.45Å; K28-F36 HydrophobicContact CG-CD1 3.85Å; K28-F36 HydrophobicContact CG-CE1 3.66Å; K28-F36 HydrophobicContact CG-CZ 4.39Å
37	Y	93.9	Very high	90.7	Very high	1 Å²	1	68.8 Å²	68.8	0%	0.004	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	132.9	-179	-57.7	-80.6	0	0	0	111.2	E18 L27 C29 S39 H42 Q43 D46 H50	E18-Y37 HydrophobicContact CB-CD1 4.34Å; E18-Y37 HydrophobicContact CB-CE1 3.7Å; E18-Y37 HydrophobicContact CG-CE1 3.98Å; L27-Y37 WeakPolarHBondContact CB-O 3.4Å; L27-Y37 PolarHBondContact N-O 3.07Å; L27-Y37 PolarHBondContact O-N 2.98Å; C29-Y37 HydrophobicContact CB-CE2 4.4Å; Y37-S39 WeakPolarHBondContact CB-O 3.5Å; Y37-S39 PolarHBondContact O-N 3.01Å; Y37-S39 VanDerWaalsContact O-N 3.16Å; Y37-H42 HydrophobicContact CD1-CB 4.28Å; Y37-Q43 HydrophobicContact CD1-CB 4.13Å; Y37-Q43 HydrophobicContact CD2-CB 3.65Å; Y37-Q43 HydrophobicContact CD2-CG 3.71Å; Y37-Q43 HydrophobicContact CE1-CB 4.5Å; Y37-Q43 HydrophobicContact CE2-CB 4.06Å; Y37-Q43 HydrophobicContact CE2-CG 3.7Å; Y37-Q43 HydrophobicContact CG-CB 3.69Å; Y37-Q43 HydrophobicContact CG-CG 4.26Å; Y37-D46 HydrophobicContact CE1-CB 3.6Å; Y37-D46 VanDerWaalsContact CE1-OD2 3.32Å; Y37-D46 WeakPolarHBondContact CE1-OD2 3.24Å; Y37-D46 PolarHBondContact OH-OD2 3.36Å; Y37-H50 WeakPolarHBondContact OH-CB 3.31Å
38	C	93.2	Very high	90.7	Very high	21 Å²	21	72.9 Å²	72.9	14%	0.142	35%	0.35	C	S	.	.	S	Bend	trans	-72.6	-5.1	178.1	70.3	0	0	0	0	113.8	C17 N25 L26 H42	C17-C38 HydrophobicContact CB-CB 4.2Å; C17-C38 PolarHBondContact SG-N 3.37Å; C17-C38 VanDerWaalsContact SG-N 3.43Å; N25-C38 WeakPolarHBondContact O-CA 3.4Å; L26-C38 HydrophobicContact CD2-CB 4.11Å; C38-H42 PolarHBondContact SG-CE1 2.79Å; C38-H42 PolarHBondContact SG-ND1 2.67Å
39	S	93	Very high	90.5	Very high	35 Å²	35	74.7 Å²	74.7	25%	0.245	36%	0.358	C	S	.	.	S	Bend	trans	-160.4	158.7	174.2	72.1	0	0	0	0	111.4	Y37 E41 H42 Q43	Y37-S39 WeakPolarHBondContact CB-O 3.5Å; Y37-S39 PolarHBondContact O-N 3.01Å; Y37-S39 VanDerWaalsContact O-N 3.16Å; S39-E41 PolarHBondContact O-N 3.5Å; S39-E41 PolarHBondContact OG-N 3.06Å; S39-H42 PolarHBondContact O-N 2.81Å; S39-H42 PolarHBondContact OG-CD2 3.29Å; S39-H42 PolarHBondContact OG-N 2.86Å; S39-H42 VanDerWaalsContact OG-N 3.11Å; S39-Q43 PolarHBondContact O-N 3.17Å
40	K	92.1	Very high	90.6	Very high	154 Å²	154	74.7 Å²	74.7	67%	0.67	36%	0.358	S	S	*	.	H	α-helix	trans	-60.8	-27.6	171.1	-69.5	-175	179.7	177.3	0	112.3	L27 Q43 K44	L27-K40 HydrophobicContact CD1-CG 4.13Å; K40-Q43 PolarHBondContact O-N 3.19Å; K40-K44 WeakPolarHBondContact O-CG 3.47Å; K40-K44 PolarHBondContact O-N 3.23Å; K40-K44 VanDerWaalsContact O-N 3.1Å
41	E	94.5	Very high	90.7	Very high	98 Å²	98	76.8 Å²	76.8	46%	0.458	35%	0.347	S	S	.	.	H	α-helix	trans	-67.5	-44.1	177.5	-171.8	53.8	-145.2	0	0	110.9	S39 Q43 K44 Q45	S39-E41 PolarHBondContact O-N 3.5Å; S39-E41 PolarHBondContact OG-N 3.06Å; E41-Q43 VanDerWaalsContact C-N 3.31Å; E41-Q43 PolarHBondContact O-N 2.73Å; E41-K44 PolarHBondContact O-N 2.93Å; E41-K44 VanDerWaalsContact O-N 3.16Å; E41-Q45 WeakPolarHBondContact O-CG 3.47Å; E41-Q45 PolarHBondContact O-N 3.16Å; E41-Q45 PolarHBondContact OE1-NE2 3.34Å; E41-Q45 VanDerWaalsContact OE1-NE2 3.1Å
42	H	93.4	Very high	90.8	Very high	33 Å²	33	77.4 Å²	77.4	15%	0.153	36%	0.359	C	S	.	.	H	α-helix	trans	-65.2	-36.3	176.4	-74.3	-158.8	0	0	0	112.2	C17 L19 C20 Y37 C38 S39 Q45 D46	C17-H42 PolarHBondContact SG-ND1 2.77Å; C17-H42 VanDerWaalsContact SG-ND1 3.36Å; L19-H42 HydrophobicContact CB-CB 4.15Å; L19-H42 HydrophobicContact CD2-CB 3.81Å; C20-H42 PolarHBondContact SG-CE1 3.48Å; C20-H42 PolarHBondContact SG-ND1 3.05Å; Y37-H42 HydrophobicContact CD1-CB 4.28Å; C38-H42 PolarHBondContact SG-CE1 2.79Å; C38-H42 PolarHBondContact SG-ND1 2.67Å; S39-H42 PolarHBondContact O-N 2.81Å; S39-H42 PolarHBondContact OG-CD2 3.29Å; S39-H42 PolarHBondContact OG-N 2.86Å; S39-H42 VanDerWaalsContact OG-N 3.11Å; H42-Q45 PolarHBondContact O-N 2.86Å; H42-D46 WeakPolarHBondContact O-CB 3.43Å; H42-D46 PolarHBondContact O-N 3.4Å
43	Q	92.9	Very high	90.8	Very high	46 Å²	46	83 Å²	83	22%	0.215	39%	0.387	C	S	.	.	H	α-helix	trans	-61.8	-42.6	172.7	-174.3	-177.4	12.7	0	0	112	Y37 S39 K40 E41 W47	Y37-Q43 HydrophobicContact CD1-CB 4.13Å; Y37-Q43 HydrophobicContact CD2-CB 3.65Å; Y37-Q43 HydrophobicContact CD2-CG 3.71Å; Y37-Q43 HydrophobicContact CE1-CB 4.5Å; Y37-Q43 HydrophobicContact CE2-CB 4.06Å; Y37-Q43 HydrophobicContact CE2-CG 3.7Å; Y37-Q43 HydrophobicContact CG-CB 3.69Å; Y37-Q43 HydrophobicContact CG-CG 4.26Å; S39-Q43 PolarHBondContact O-N 3.17Å; K40-Q43 PolarHBondContact O-N 3.19Å; E41-Q43 VanDerWaalsContact C-N 3.31Å; E41-Q43 PolarHBondContact O-N 2.73Å; Q43-W47 WeakPolarHBondContact O-CA 3.21Å; Q43-W47 WeakPolarHBondContact O-CB 3.27Å; Q43-W47 PolarHBondContact O-N 2.91Å
44	K	93.2	Very high	90.8	Very high	149 Å²	149	76 Å²	76	65%	0.648	36%	0.362	S	S	*	.	H	α-helix	trans	-65.3	-40.6	178.3	-75.4	178.2	-177.4	178.8	0	112.3	K40 E41 W47	K40-K44 WeakPolarHBondContact O-CG 3.47Å; K40-K44 PolarHBondContact O-N 3.23Å; K40-K44 VanDerWaalsContact O-N 3.1Å; E41-K44 PolarHBondContact O-N 2.93Å; E41-K44 VanDerWaalsContact O-N 3.16Å; K44-W47 VanDerWaalsContact O-CB 3.27Å; K44-W47 WeakPolarHBondContact O-CB 3.32Å; K44-W47 PolarHBondContact O-N 3.12Å
45	Q	91.4	Very high	90.8	Very high	108 Å²	108	80.7 Å²	80.7	51%	0.505	37%	0.373	S	S	.	.	H	α-helix	trans	-66.7	-41	179.2	-70.1	178.5	21.9	0	0	111.4	L19 E41 H42 W47	L19-Q45 HydrophobicContact CD2-CB 3.78Å; E41-Q45 WeakPolarHBondContact O-CG 3.47Å; E41-Q45 PolarHBondContact O-N 3.16Å; E41-Q45 PolarHBondContact OE1-NE2 3.34Å; E41-Q45 VanDerWaalsContact OE1-NE2 3.1Å; H42-Q45 PolarHBondContact O-N 2.86Å; Q45-W47 VanDerWaalsContact C-N 3.33Å
46	D	91.1	Very high	90.3	Very high	20 Å²	20	87 Å²	87	11%	0.107	40%	0.402	C	S	.	.	H	α-helix	trans	-78.6	-15	175.8	-171.7	46.9	0	0	0	113.6	L19 Y37 H42 K48 K49 H50	L19-D46 HydrophobicContact CD1-CB 4.41Å; Y37-D46 HydrophobicContact CE1-CB 3.6Å; Y37-D46 VanDerWaalsContact CE1-OD2 3.32Å; Y37-D46 WeakPolarHBondContact CE1-OD2 3.24Å; Y37-D46 PolarHBondContact OH-OD2 3.36Å; H42-D46 WeakPolarHBondContact O-CB 3.43Å; H42-D46 PolarHBondContact O-N 3.4Å; D46-K48 PolarHBondContact O-N 3Å; D46-K49 PolarHBondContact O-N 3.46Å; D46-H50 PolarHBondContact O-N 3.26Å; D46-H50 WeakPolarHBondContact OD2-CB 3.26Å
47	W	91.2	Very high	89.2	Confident	108 Å²	108	88.1 Å²	88.1	41%	0.409	41%	0.414	S	S	.	.	H	α-helix	trans	-53.3	-34.5	-174.3	-173.3	-115.9	0	0	0	113.9	Q43 K44 Q45 K49 H50 K51	Q43-W47 WeakPolarHBondContact O-CA 3.21Å; Q43-W47 WeakPolarHBondContact O-CB 3.27Å; Q43-W47 PolarHBondContact O-N 2.91Å; K44-W47 VanDerWaalsContact O-CB 3.27Å; K44-W47 WeakPolarHBondContact O-CB 3.32Å; K44-W47 PolarHBondContact O-N 3.12Å; Q45-W47 VanDerWaalsContact C-N 3.33Å; W47-K49 PolarHBondContact O-N 3.18Å; W47-H50 AromaticContact CZ3-CD2 3.85Å; W47-K51 HydrophobicContact CD2-CB 4.21Å; W47-K51 HydrophobicContact CZ2-CB 4.16Å; W47-K51 WeakPolarHBondContact O-CB 3.44Å; W47-K51 WeakPolarHBondContact O-CD 3.36Å; W47-K51 WeakPolarHBondContact O-CG 3.3Å; W47-K51 PolarHBondContact O-N 3.21Å
48	K	89.3	Confident	87.4	Confident	167 Å²	167	96 Å²	96	73%	0.726	46%	0.456	S	S	*	.	H	α-helix	trans	-59.6	-34	177.5	-69.7	-177.7	-179.1	177.2	0	112.5	D46 K51	D46-K48 PolarHBondContact O-N 3Å; K48-K51 WeakPolarHBondContact O-CE 3.35Å
49	K	87.7	Confident	84.9	Confident	161 Å²	161	103.6 Å²	103.6	70%	0.7	49%	0.487	S	S	*	.	H	α-helix	trans	-90.5	-51	177.3	-64	179.7	-179.7	178	0	110.9	D46 W47 K51 L52	D46-K49 PolarHBondContact O-N 3.46Å; W47-K49 PolarHBondContact O-N 3.18Å; K49-K51 VanDerWaalsContact C-N 3.32Å; K49-K51 PolarHBondContact O-N 2.94Å; K49-L52 WeakPolarHBondContact O-CB 3.48Å; K49-L52 PolarHBondContact O-N 2.8Å
50	H	90.4	Very high	82.3	Confident	3 Å²	3	107.6 Å²	107.6	1%	0.014	51%	0.512	C	S	.	.	H	α-helix	trans	-60.7	-35.7	-175.8	179.1	70	0	0	0	113.8	C29 C32 S35 Y37 D46 W47 L52 I53 C54	C29-H50 PolarHBondContact SG-NE2 3.48Å; C29-H50 VanDerWaalsContact SG-NE2 3.35Å; C32-H50 PolarHBondContact SG-CE1 3.34Å; C32-H50 PolarHBondContact SG-NE2 3.31Å; S35-H50 VanDerWaalsContact CB-CE1 3.41Å; S35-H50 WeakPolarHBondContact CB-CE1 3.3Å; S35-H50 PolarHBondContact OG-CE1 3.3Å; S35-H50 PolarHBondContact OG-ND1 2.93Å; Y37-H50 WeakPolarHBondContact OH-CB 3.31Å; D46-H50 PolarHBondContact O-N 3.26Å; D46-H50 WeakPolarHBondContact OD2-CB 3.26Å; W47-H50 AromaticContact CZ3-CD2 3.85Å; H50-L52 PolarHBondContact O-N 3.04Å; H50-I53 VanDerWaalsContact O-CG1 3.31Å; H50-I53 WeakPolarHBondContact O-CG1 3.5Å; H50-I53 PolarHBondContact O-N 3.49Å; H50-C54 WeakPolarHBondContact NE2-CB 3.46Å; H50-C54 PolarHBondContact NE2-SG 3.47Å; H50-C54 WeakPolarHBondContact O-CB 3.35Å; H50-C54 PolarHBondContact O-N 2.97Å
51	K	89.6	Confident	79.6	Confident	113 Å²	113	110.1 Å²	110.1	49%	0.491	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.1	-179.6	71.6	-174.9	-179	172.1	0	114	W47 K48 K49 I53	W47-K51 HydrophobicContact CD2-CB 4.21Å; W47-K51 HydrophobicContact CZ2-CB 4.16Å; W47-K51 WeakPolarHBondContact O-CB 3.44Å; W47-K51 WeakPolarHBondContact O-CD 3.36Å; W47-K51 WeakPolarHBondContact O-CG 3.3Å; W47-K51 PolarHBondContact O-N 3.21Å; K48-K51 WeakPolarHBondContact O-CE 3.35Å; K49-K51 VanDerWaalsContact C-N 3.32Å; K49-K51 PolarHBondContact O-N 2.94Å; K51-I53 VanDerWaalsContact C-N 3.31Å
52	L	87	Confident	76.7	Confident	142 Å²	142	114.5 Å²	114.5	74%	0.743	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-23	178.9	-60	173.8	0	0	0	112.5	K49 H50	K49-L52 WeakPolarHBondContact O-CB 3.48Å; K49-L52 PolarHBondContact O-N 2.8Å; H50-L52 PolarHBondContact O-N 3.04Å
53	I	85.5	Confident	73.6	Confident	126 Å²	126	122.5 Å²	122.5	65%	0.646	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	-3.9	-176.1	60.3	170.8	0	0	0	113.4	H50 K51 K55	H50-I53 VanDerWaalsContact O-CG1 3.31Å; H50-I53 WeakPolarHBondContact O-CG1 3.5Å; H50-I53 PolarHBondContact O-N 3.49Å; K51-I53 VanDerWaalsContact C-N 3.31Å; I53-K55 PolarHBondContact O-N 3.29Å
54	C	87.4	Confident	70.9	Confident	10 Å²	10	126.4 Å²	126.4	7%	0.068	61%	0.608	C	S	.	*			trans	-74.5	100.7	-179.1	-169.3	0	0	0	0	112	H50	H50-C54 WeakPolarHBondContact NE2-CB 3.46Å; H50-C54 PolarHBondContact NE2-SG 3.47Å; H50-C54 WeakPolarHBondContact O-CB 3.35Å; H50-C54 PolarHBondContact O-N 2.97Å
55	K	87.3	Confident	67.9	Low	172 Å²	172	123.1 Å²	123.1	75%	0.748	62%	0.615	S	S	*	*			trans	-105.2	147.3	175.5	-62.6	-176.1	-178.8	-179.4	0	111.4	C32 I53	C32-K55 WeakPolarHBondContact CA-O 3.45Å; C32-K55 WeakPolarHBondContact CB-O 3.46Å; I53-K55 PolarHBondContact O-N 3.29Å
56	E	78.1	Confident	64.9	Low	142 Å²	142	126.6 Å²	126.6	66%	0.664	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-64	137.6	179.5	-75.8	175.8	-167.9	0	0	112	R31	R31-E56 HydrophobicContact CG-CG 3.8Å; R31-E56 IonicContact CZ-OE1 3.84Å; R31-E56 IonicContact NE-OE1 3.77Å; R31-E56 PolarHBondContact NE-OE1 2.98Å; R31-E56 IonicContact NH2-OE1 2.69Å; R31-E56 PolarHBondContact NH2-OE1 3.21Å
57	A	70.4	Confident	61.7	Low	42 Å²	42	128.9 Å²	128.9	35%	0.347	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-78.9	127.3	177.7	0	0	0	0	0	111	R31 R33 K59	R31-A57 PolarHBondContact O-N 2.87Å; R33-A57 HydrophobicContact CB-CB 4.38Å; R33-A57 HydrophobicContact CG-CB 4.36Å; A57-K59 PolarHBondContact O-N 3.03Å
58	D	57	Low	59.2	Low	166 Å²	166	129.6 Å²	129.6	89%	0.888	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-60.1	125.2	172.3	-86.1	-38.4	0	0	0	110.7
59	K	41.3	Very low	56.1	Low	180 Å²	180	127.3 Å²	127.3	78%	0.783	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-74.4	131.8	173.7	-76.2	-178.4	179.2	176.9	0	109.7	A57 K61	A57-K59 PolarHBondContact O-N 3.03Å; K59-K61 PolarHBondContact O-N 3.25Å
60	P	37.9	Very low	53.1	Low	120 Å²	120	124.7 Å²	124.7	78%	0.779	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-62.4	123.3	165.6	-16.5	28.8	0	0	0	110	Q62	P60-Q62 PolarHBondContact O-N 2.77Å
61	K	35.1	Very low	50	Low	207 Å²	207	128 Å²	128	90%	0.9	73%	0.733	S	S	*	*			trans	-65.6	115.3	172.4	-76.8	177.6	176.7	176.2	0	109.4	K59	K59-K61 PolarHBondContact O-N 3.25Å
62	Q	32.5	Very low	47	Very low	190 Å²	190	130 Å²	130	89%	0.888	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-65.9	128.2	167.7	-71.2	176.9	-21.6	0	0	109.4	P60	P60-Q62 PolarHBondContact O-N 2.77Å
63	K	29.6	Very low	44	Very low	201 Å²	201	127 Å²	127	87%	0.874	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-83.7	130.5	164.6	-81.9	-173.5	174.3	-176.1	0	108.7
64	P	35.1	Very low	41.2	Very low	128 Å²	128	131.5 Å²	131.5	83%	0.831	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-75.7	149	172.4	1.9	14.8	0	0	0	110.9
65	G	30.6	Very low	38.3	Very low	79 Å²	79	140.2 Å²	140.2	81%	0.814	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-74.7	168.4	-171.7	0	0	0	0	0	116.3
66	D	28.8	Very low	35.2	Very low	181 Å²	181	139.8 Å²	139.8	97%	0.968	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-90.7	137.5	178.6	-79	-50	0	0	0	113.1
67	G	24.9	Very low	33	Very low	68 Å²	68	139.1 Å²	139.1	70%	0.701	79%	0.794	S	S	*	*			trans	-173	147	163.4	0	0	0	0	0	109.2
68	P	36.8	Very low	30.9	Very low	124 Å²	124	144.5 Å²	144.5	81%	0.805	81%	0.812	S	S	*	*				-117.1	153.7	-111.5	37.2	-30.1	0	0	0	115.7
69	S	25	Very low	29.4	Very low	118 Å²	118	145.8 Å²	145.8	83%	0.825	81%	0.81	S	S	*	*				160.8	139.5	129.2	-81.6	0	0	0	0	116
70	A	25.4	Very low	28.7	Very low	107 Å²	107	143.6 Å²	143.6	88%	0.884	81%	0.805	S	S	*	*			trans	76.9	134.7	137.3	0	0	0	0	0	122.9
71	G	25.9	Very low	28	Very low	73 Å²	73	142.8 Å²	142.8	75%	0.753	80%	0.803	S	S	*	*			trans	110	84.2	156.2	0	0	0	0	0	114.5
72	D	24.9	Very low	27.4	Very low	155 Å²	155	138.8 Å²	138.8	83%	0.829	80%	0.796	S	S	*	*				83.6	130.8	87.2	-162.6	17.7	0	0	0	115.6
73	S	25.7	Very low	27.3	Very low	77 Å²	77	137.8 Å²	137.8	54%	0.538	79%	0.791	S	S	.	*			trans	84.6	104.5	151.4	-78.8	0	0	0	0	123
74	R	25.1	Very low	27.2	Very low	221 Å²	221	137.4 Å²	137.4	83%	0.834	79%	0.792	S	S	*	*				70.2	110.4	117	-79.2	178.1	179.4	-176.8	1.1	120.1
75	K	26.2	Very low	26.8	Very low	193 Å²	193	134.6 Å²	134.6	84%	0.839	79%	0.787	S	S	*	*				149.2	122.5	104.7	-96.4	170.9	179.3	-173.3	0	112.2
76	Q	24	Very low	26.7	Very low	163 Å²	163	138.5 Å²	138.5	76%	0.762	79%	0.789	S	S	*	*			trans	-78.8	168.2	147.2	-68.5	-176.5	-3.3	0	0	109.3
77	P	30.8	Very low	26.6	Very low	129 Å²	129	135 Å²	135	84%	0.838	78%	0.778	S	S	*	*				-144.6	168.2	84.5	30.8	-9.4	0	0	0	116.2
78	E	27.4	Very low	26.7	Very low	154 Å²	154	135.8 Å²	135.8	72%	0.72	78%	0.778	S	S	*	*			trans	-67.9	168.1	-179.1	-53.3	168.6	123.6	0	0	116.9
79	K	25.4	Very low	26.2	Very low	194 Å²	194	136.4 Å²	136.4	84%	0.843	78%	0.78	S	S	*	*				175.1	121.5	124.2	-95.9	179	179.8	-172.5	0	109.4
80	I	24.8	Very low	26.4	Very low	133 Å²	133	136.7 Å²	136.7	68%	0.682	78%	0.777	S	S	*	*				66.2	114.7	74.2	-61.2	173.5	0	0	0	115.2
81	S	24.3	Very low	27.6	Very low	104 Å²	104	136.8 Å²	136.8	73%	0.727	77%	0.768	S	S	*	*			trans	175.5	115.4	130.1	22.5	0	0	0	0	108.5
82	T	23.4	Very low	28.5	Very low	123 Å²	123	139.1 Å²	139.1	76%	0.755	77%	0.77	S	S	*	*				55.3	126.8	81.7	56.5	0	0	0	0	112.8
83	E	28.9	Very low	28.9	Very low	168 Å²	168	137.5 Å²	137.5	79%	0.785	77%	0.766	S	S	*	*				-168.8	137.2	59.3	-78.2	-169.8	151.7	0	0	109.3
84	Q	27.5	Very low	29.6	Very low	194 Å²	194	139.8 Å²	139.8	91%	0.907	78%	0.779	S	S	*	*				82	139.6	79	-92.6	-173.6	-3.8	0	0	118.3
85	G	26.5	Very low	29.7	Very low	69 Å²	69	136.2 Å²	136.2	71%	0.711	78%	0.776	S	S	*	*			trans	135.9	84.4	160.8	0	0	0	0	0	114.4
86	D	28.2	Very low	29.7	Very low	161 Å²	161	133 Å²	133	86%	0.861	77%	0.773	S	S	*	*				65.7	139.9	95.4	-100.1	-39.3	0	0	0	115.3
87	S	27.6	Very low	29.8	Very low	106 Å²	106	134.5 Å²	134.5	74%	0.741	78%	0.78	S	S	*	*			cis	-166.8	172.3	16.1	-138.7	0	0	0	0	112.1
88	A	27.6	Very low	29.6	Very low	85 Å²	85	132.6 Å²	132.6	70%	0.702	78%	0.775	S	S	*	*			trans	-65.8	171.4	-178.8	0	0	0	0	0	114.5
89	T	25.6	Very low	30.5	Very low	137 Å²	137	131.2 Å²	131.2	84%	0.84	78%	0.779	S	S	*	*				177.1	167	56.7	-35.9	0	0	0	0	109.6
90	V	29.6	Very low	30.6	Very low	125 Å²	125	125.9 Å²	125.9	76%	0.758	77%	0.772	S	S	*	*			trans	-117.4	-176.6	-177.2	-175.3	0	0	0	0	109
91	P	51.3	Low	30.8	Very low	109 Å²	109	127.7 Å²	127.7	71%	0.708	78%	0.783	S	S	*	*				-110.4	-155.9	-69.5	41.7	-23.9	0	0	0	111.6
92	P	44.3	Very low	31	Very low	121 Å²	121	126.6 Å²	126.6	79%	0.786	79%	0.787	S	S	*	*				-151.9	174.1	72	35.3	-10.7	0	0	0	118
93	T	32.6	Very low	31.3	Very low	122 Å²	122	129.3 Å²	129.3	75%	0.748	80%	0.798	S	S	*	*			trans	-75.7	176	169.9	45.9	0	0	0	0	113.3
94	P	39.8	Very low	31.3	Very low	125 Å²	125	124.6 Å²	124.6	81%	0.812	79%	0.794	S	S	*	*				-147.3	169.6	109.5	34.7	-15.6	0	0	0	117.5
95	N	28	Very low	32.1	Very low	145 Å²	145	122 Å²	122	78%	0.775	79%	0.794	S	S	*	*			trans	-63.4	171	-178.3	-54.8	-33.7	0	0	0	114.1
96	T	26.2	Very low	32.2	Very low	125 Å²	125	122.4 Å²	122.4	77%	0.767	80%	0.798	S	S	*	*				175.9	150.6	53.8	-48.9	0	0	0	0	107.9
97	E	25.5	Very low	32.4	Very low	195 Å²	195	123.5 Å²	123.5	91%	0.911	80%	0.798	S	S	*	*			trans	174.2	144.4	130.2	-96.3	-179.8	178.6	0	0	113.7
98	A	26.7	Very low	32.5	Very low	89 Å²	89	126.4 Å²	126.4	74%	0.736	80%	0.804	S	S	*	*			trans	-147.7	-179.8	173.1	0	0	0	0	0	106.6
99	P	46.9	Very low	32.7	Very low	125 Å²	125	125.8 Å²	125.8	81%	0.812	81%	0.806	S	S	*	*				-130.1	-166.3	-55.1	37.1	-19.2	0	0	0	112.8
100	A	28.1	Very low	33	Very low	82 Å²	82	124.8 Å²	124.8	68%	0.678	81%	0.805	S	S	*	*			trans	98.9	118.2	153.2	0	0	0	0	0	120.3
101	D	28.9	Very low	33	Very low	172 Å²	172	127 Å²	127	92%	0.92	81%	0.813	S	S	*	*				165.1	143.1	103.7	-91.4	-28.4	0	0	0	112.8
102	G	28.7	Very low	32.2	Very low	80 Å²	80	126.9 Å²	126.9	83%	0.825	81%	0.81	S	S	*	*			trans	155.2	85.2	165.4	0	0	0	0	0	116.6
103	D	29.4	Very low	31.7	Very low	181 Å²	181	127.4 Å²	127.4	97%	0.968	81%	0.813	S	S	*	*			trans	-65.8	151.5	170.2	-98.8	-58.9	0	0	0	115
104	G	29.1	Very low	31.5	Very low	69 Å²	69	127.5 Å²	127.5	71%	0.711	81%	0.814	S	S	*	*			trans	145.1	139	147	0	0	0	0	0	117.8
105	P	43.4	Very low	31.4	Very low	140 Å²	140	126.7 Å²	126.7	91%	0.909	81%	0.807	S	S	*	*			trans	-116.6	168.3	-144.7	39.1	-25.5	0	0	0	116.5
106	G	29.1	Very low	31.8	Very low	77 Å²	77	125.9 Å²	125.9	79%	0.794	81%	0.809	S	S	*	*			trans	170.9	111	162.6	0	0	0	0	0	114.9
107	E	31.1	Very low	32.2	Very low	184 Å²	184	126.8 Å²	126.8	86%	0.86	81%	0.81	S	S	*	*			trans	-60.4	149.2	174.6	-74	-170.2	95	0	0	114.7
108	L	30.4	Very low	32.7	Very low	167 Å²	167	121.6 Å²	121.6	87%	0.874	81%	0.808	S	S	*	*				171.1	112	113.8	-93.2	150.8	0	0	0	112.7
109	G	31	Very low	33.6	Very low	72 Å²	72	124.9 Å²	124.9	74%	0.742	81%	0.809	S	S	*	*			trans	52	103.7	139.3	0	0	0	0	0	122.2
110	S	32.6	Very low	33.6	Very low	115 Å²	115	125.4 Å²	125.4	80%	0.804	81%	0.81	S	S	*	*				-174.5	119.5	122.3	-93.5	0	0	0	0	112.1	T112	S110-T112 PolarHBondContact O-N 3.03Å
111	N	30.7	Very low	35.3	Very low	173 Å²	173	126.9 Å²	126.9	93%	0.925	82%	0.815	S	S	*	*			trans	-61.4	105.9	174	-71.7	-31.2	0	0	0	110.9
112	T	33.5	Very low	37.7	Very low	105 Å²	105	123 Å²	123	64%	0.644	79%	0.794	S	S	*	*			trans	-126.4	123.5	159.7	29.6	0	0	0	0	107.9	S110 T114	S110-T112 PolarHBondContact O-N 3.03Å; T112-T114 PolarHBondContact O-N 2.83Å
113	P	33.4	Very low	40.6	Very low	133 Å²	133	121.7 Å²	121.7	86%	0.864	77%	0.772	S	S	*	*			trans	-73.1	99.1	169.6	10.2	3.1	0	0	0	107.3	T115	P113-T115 PolarHBondContact O-N 3.29Å
114	T	28.7	Very low	43.5	Very low	123 Å²	123	114.9 Å²	114.9	76%	0.755	74%	0.738	S	S	*	*			trans	-83.1	108.2	172.5	-48.5	0	0	0	0	107.4	T112	T112-T114 PolarHBondContact O-N 2.83Å
115	T	37.2	Very low	46.5	Very low	109 Å²	109	117.1 Å²	117.1	67%	0.669	73%	0.729	S	S	*	*			trans	-86.7	142	166.1	43.3	0	0	0	0	109.7	P113 N117	P113-T115 PolarHBondContact O-N 3.29Å; T115-N117 VanDerWaalsContact C-N 3.26Å; T115-N117 PolarHBondContact O-N 2.97Å
116	P	36.4	Very low	48.9	Very low	128 Å²	128	115.5 Å²	115.5	83%	0.831	71%	0.708	S	S	*	*	S	Bend	trans	-82.3	74	-179.9	33.4	-31.9	0	0	0	109.9
117	N	35.8	Very low	52.1	Low	144 Å²	144	112.9 Å²	112.9	77%	0.77	68%	0.676	S	S	*	*	S	Bend	trans	177.9	101.7	153.6	-99.9	-11	0	0	0	107.7	T115 Q119	T115-N117 VanDerWaalsContact C-N 3.26Å; T115-N117 PolarHBondContact O-N 2.97Å; N117-Q119 PolarHBondContact O-N 3.49Å
118	G	36.5	Very low	55.1	Low	86 Å²	86	104.1 Å²	104.1	89%	0.887	64%	0.635	S	S	*	*			trans	-70.9	59.3	-172.6	0	0	0	0	0	115.5
119	Q	44.8	Very low	58.1	Low	158 Å²	158	98.2 Å²	98.2	74%	0.738	61%	0.606	S	S	*	*			trans	-101.4	98.9	159.6	-84.9	-179.6	-55.6	0	0	108.8	N117 S121	N117-Q119 PolarHBondContact O-N 3.49Å; Q119-S121 PolarHBondContact O-N 3.49Å
120	T	46.6	Very low	61.2	Low	136 Å²	136	100.5 Å²	100.5	83%	0.834	60%	0.597	S	S	*	*			trans	-68.8	100.7	170	-27.1	0	0	0	0	107.6	L122	T120-L122 PolarHBondContact O-N 3.44Å
121	S	65	Low	64.2	Low	113 Å²	113	97.2 Å²	97.2	79%	0.79	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-64	122.1	175.7	62.8	0	0	0	0	108.8	Q119 S123	Q119-S121 PolarHBondContact O-N 3.49Å; S121-S123 PolarHBondContact O-N 3.19Å
122	L	78.3	Confident	67.4	Low	90 Å²	90	89 Å²	89	47%	0.471	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-63.7	138.5	174.8	-67.6	176.4	0	0	0	108.6	T120 K126 L127	T120-L122 PolarHBondContact O-N 3.44Å; L122-K126 HydrophobicContact CB-CB 4.31Å; L122-K126 HydrophobicContact CD2-CB 4.34Å; L122-K126 HydrophobicContact CD2-CD 4.41Å; L122-L127 HydrophobicContact CB-CB 4.28Å
123	S	89.9	Confident	70.5	Confident	53 Å²	53	84.8 Å²	84.8	37%	0.371	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-59.1	150.5	168.7	71.9	0	0	0	0	109.5	S121 Q125 K126 L127	S121-S123 PolarHBondContact O-N 3.19Å; S123-Q125 PolarHBondContact O-N 3.36Å; S123-Q125 VanDerWaalsContact O-N 3.12Å; S123-K126 PolarHBondContact O-N 3.23Å; S123-K126 WeakPolarHBondContact OG-CG 3.39Å; S123-K126 PolarHBondContact OG-N 3.45Å; S123-L127 PolarHBondContact O-N 3.13Å
124	P	89.5	Confident	73.5	Confident	38 Å²	38	81.4 Å²	81.4	25%	0.247	48%	0.482	C	S	.	.	H	α-helix	trans	-54.1	-34.8	179.5	17.3	-31.2	0	0	0	113.2	A128 R209	P124-A128 VanDerWaalsContact O-CB 3.3Å; P124-A128 WeakPolarHBondContact O-CB 3.42Å; P124-A128 PolarHBondContact O-N 2.76Å; P124-R209 VanDerWaalsContact CG-NH2 3.33Å
125	Q	93.1	Very high	76.8	Confident	115 Å²	115	77.1 Å²	77.1	54%	0.537	46%	0.457	S	S	.	.	H	α-helix	trans	-64.5	-47.7	174.6	-176.3	178.6	-2.1	0	0	112.3	S123 A128 T129	S123-Q125 PolarHBondContact O-N 3.36Å; S123-Q125 VanDerWaalsContact O-N 3.12Å; Q125-A128 WeakPolarHBondContact O-CB 3.3Å; Q125-A128 PolarHBondContact O-N 3.3Å; Q125-T129 PolarHBondContact O-N 3.44Å; Q125-T129 PolarHBondContact O-OG1 2.73Å
126	K	94	Very high	79.7	Confident	106 Å²	106	72 Å²	72	46%	0.461	43%	0.425	S	S	.	.	H	α-helix	trans	-64	-44.7	178	-73.5	-173.2	174.5	-174	0	111.3	L122 S123 A128 T129 E130	L122-K126 HydrophobicContact CB-CB 4.31Å; L122-K126 HydrophobicContact CD2-CB 4.34Å; L122-K126 HydrophobicContact CD2-CD 4.41Å; S123-K126 PolarHBondContact O-N 3.23Å; S123-K126 WeakPolarHBondContact OG-CG 3.39Å; S123-K126 PolarHBondContact OG-N 3.45Å; K126-A128 VanDerWaalsContact C-N 3.28Å; K126-A128 PolarHBondContact O-N 3.42Å; K126-T129 PolarHBondContact O-N 3.45Å; K126-E130 VanDerWaalsContact O-CB 3.23Å; K126-E130 WeakPolarHBondContact O-CB 3.34Å; K126-E130 PolarHBondContact O-N 2.8Å
127	L	94.8	Very high	82.6	Confident	23 Å²	23	69.7 Å²	69.7	12%	0.12	41%	0.406	C	S	.	.	I	π-helix	trans	-56.2	-44.4	175.2	179.5	63.8	0	0	0	111.4	L122 S123 C131 I132 V144 F147 L213	L122-L127 HydrophobicContact CB-CB 4.28Å; S123-L127 PolarHBondContact O-N 3.13Å; L127-C131 HydrophobicContact CD1-CB 4.11Å; L127-C131 WeakPolarHBondContact O-CB 3.37Å; L127-C131 PolarHBondContact O-N 2.87Å; L127-I132 HydrophobicContact CG-CD1 4.11Å; L127-I132 HydrophobicContact CG-CG1 4.5Å; L127-I132 PolarHBondContact O-N 3.04Å; L127-V144 HydrophobicContact CD1-CG1 4.01Å; L127-V144 HydrophobicContact CD1-CG2 4.16Å; L127-V144 HydrophobicContact CD2-CG1 4.06Å; L127-F147 HydrophobicContact CD2-CD2 4.24Å; L127-F147 HydrophobicContact CD2-CE2 4.22Å; L127-L213 HydrophobicContact CB-CD1 4.31Å; L127-L213 HydrophobicContact CD2-CD1 3.85Å; L127-L213 HydrophobicContact CG-CD1 4.05Å
128	A	95.4	Very high	85.5	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	40%	0.402	C	S	.	.	I	π-helix	trans	-61.9	-54.3	176	0	0	0	0	0	112.5	P124 Q125 K126 I132 V133 L213 H216 C217	P124-A128 VanDerWaalsContact O-CB 3.3Å; P124-A128 WeakPolarHBondContact O-CB 3.42Å; P124-A128 PolarHBondContact O-N 2.76Å; Q125-A128 WeakPolarHBondContact O-CB 3.3Å; Q125-A128 PolarHBondContact O-N 3.3Å; K126-A128 VanDerWaalsContact C-N 3.28Å; K126-A128 PolarHBondContact O-N 3.42Å; A128-I132 PolarHBondContact O-N 2.82Å; A128-V133 WeakPolarHBondContact O-CB 3.31Å; A128-V133 WeakPolarHBondContact O-CG2 3.41Å; A128-V133 PolarHBondContact O-N 3.09Å; A128-L213 HydrophobicContact CB-CD1 4.14Å; A128-H216 HydrophobicContact CB-CB 3.5Å; A128-H216 VanDerWaalsContact CB-CB 3.5Å; A128-C217 WeakPolarHBondContact CB-SG 3.46Å
129	T	93.6	Very high	88.3	Confident	43 Å²	43	70.4 Å²	70.4	26%	0.264	38%	0.379	S	S	.	.	I	π-helix	trans	-81.3	-31.5	-169.8	55.3	0	0	0	0	114.3	Q125 K126 P134	Q125-T129 PolarHBondContact O-N 3.44Å; Q125-T129 PolarHBondContact O-OG1 2.73Å; K126-T129 PolarHBondContact O-N 3.45Å; T129-P134 WeakPolarHBondContact O-CD 3.45Å
130	E	94.8	Very high	90.8	Very high	119 Å²	119	63.2 Å²	63.2	56%	0.556	35%	0.347	S	S	*	.	I	π-helix	trans	-97.7	-23.9	-173.9	-59.2	174.9	-162.2	0	0	112.5	K126	K126-E130 VanDerWaalsContact O-CB 3.23Å; K126-E130 WeakPolarHBondContact O-CB 3.34Å; K126-E130 PolarHBondContact O-N 2.8Å
131	C	95.9	Very high	93.2	Very high	47 Å²	47	57.7 Å²	57.7	32%	0.318	31%	0.312	S	S	.	.	I	π-helix	trans	-115.7	-61.1	-178.9	-176.4	0	0	0	0	112.4	L127 P134 C135	L127-C131 HydrophobicContact CD1-CB 4.11Å; L127-C131 WeakPolarHBondContact O-CB 3.37Å; L127-C131 PolarHBondContact O-N 2.87Å; C131-P134 WeakPolarHBondContact O-CD 3.47Å; C131-C135 WeakPolarHBondContact O-CB 3.3Å; C131-C135 PolarHBondContact O-N 3.38Å
132	I	97.5	Very high	94.8	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.275	C	S	.	.	I	π-helix	trans	-68.9	-50.2	-168.1	-64.3	173.5	0	0	0	112.2	L127 A128 C135 M136 V144 L213 L299	L127-I132 HydrophobicContact CG-CD1 4.11Å; L127-I132 HydrophobicContact CG-CG1 4.5Å; L127-I132 PolarHBondContact O-N 3.04Å; A128-I132 PolarHBondContact O-N 2.82Å; I132-C135 PolarHBondContact O-N 3.02Å; I132-M136 HydrophobicContact CG2-CG 3.96Å; I132-M136 VanDerWaalsContact O-CB 3.29Å; I132-M136 WeakPolarHBondContact O-CB 3.31Å; I132-M136 VanDerWaalsContact O-CG 3.3Å; I132-M136 WeakPolarHBondContact O-CG 3.34Å; I132-M136 PolarHBondContact O-N 3.11Å; I132-V144 HydrophobicContact CD1-CG2 4.31Å; I132-V144 HydrophobicContact CG1-CG2 4.2Å; I132-L213 HydrophobicContact CD1-CD1 3.6Å; I132-L213 HydrophobicContact CD1-CD2 3.3Å; I132-L213 HydrophobicContact CD1-CG 3.48Å; I132-L213 VanDerWaalsContact CD1-CG 3.48Å; I132-L299 HydrophobicContact CD1-CD1 4.37Å; I132-L299 HydrophobicContact CG2-CD2 4.2Å
133	V	98.3	Very high	95.8	Very high	16 Å²	16	50.7 Å²	50.7	10%	0.097	27%	0.268	C	S	.	.	H	α-helix	trans	-58.1	-52.6	-179.3	161.7	0	0	0	0	111.5	A128 C135 N137 C217 K220 L221	A128-V133 WeakPolarHBondContact O-CB 3.31Å; A128-V133 WeakPolarHBondContact O-CG2 3.41Å; A128-V133 PolarHBondContact O-N 3.09Å; V133-C135 VanDerWaalsContact C-N 3.35Å; V133-C135 PolarHBondContact O-N 2.88Å; V133-N137 WeakPolarHBondContact O-CB 3.49Å; V133-N137 VanDerWaalsContact O-CG 3.3Å; V133-N137 PolarHBondContact O-N 2.94Å; V133-N137 PolarHBondContact O-ND2 3.01Å; V133-C217 HydrophobicContact CG2-CB 3.88Å; V133-K220 HydrophobicContact CB-CB 4.48Å; V133-K220 HydrophobicContact CG1-CB 3.75Å; V133-K220 HydrophobicContact CG2-CB 3.85Å; V133-K220 HydrophobicContact CG2-CD 4.49Å; V133-L221 HydrophobicContact CG2-CD2 4.21Å; V133-L221 HydrophobicContact CG2-CG 4.48Å
134	P	97.7	Very high	96.2	Very high	62 Å²	62	48.8 Å²	48.8	40%	0.403	26%	0.255	S	S	.	.	H	α-helix	trans	-59.6	-42.8	176	-25.5	35	0	0	0	113.1	T129 C131 K138	T129-P134 WeakPolarHBondContact O-CD 3.45Å; C131-P134 WeakPolarHBondContact O-CD 3.47Å; P134-K138 WeakPolarHBondContact O-CB 3.44Å; P134-K138 PolarHBondContact O-N 3.4Å
135	C	97.5	Very high	96.6	Very high	33 Å²	33	50.4 Å²	50.4	22%	0.223	26%	0.261	C	S	.	.	H	α-helix	trans	-67.1	-46	-177	-168	0	0	0	0	112.1	C131 I132 V133 K138 H139 I141 C142	C131-C135 WeakPolarHBondContact O-CB 3.3Å; C131-C135 PolarHBondContact O-N 3.38Å; I132-C135 PolarHBondContact O-N 3.02Å; V133-C135 VanDerWaalsContact C-N 3.35Å; V133-C135 PolarHBondContact O-N 2.88Å; C135-K138 PolarHBondContact O-N 2.88Å; C135-H139 WeakPolarHBondContact O-CA 3.45Å; C135-H139 WeakPolarHBondContact O-CB 3.04Å; C135-H139 PolarHBondContact O-N 2.79Å; C135-I141 PolarHBondContact SG-O 2.88Å; C135-C142 HydrophobicContact CB-CB 3.93Å
136	M	98.1	Very high	96.8	Very high	1 Å²	1	50 Å²	50	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-43.9	176.3	-73.9	-65.8	-67.2	0	0	112.1	I132 G140 C142 L221 V258 L299 W301	I132-M136 HydrophobicContact CG2-CG 3.96Å; I132-M136 VanDerWaalsContact O-CB 3.29Å; I132-M136 WeakPolarHBondContact O-CB 3.31Å; I132-M136 VanDerWaalsContact O-CG 3.3Å; I132-M136 WeakPolarHBondContact O-CG 3.34Å; I132-M136 PolarHBondContact O-N 3.11Å; M136-G140 WeakPolarHBondContact O-CA 3.26Å; M136-G140 PolarHBondContact O-N 2.95Å; M136-C142 HydrophobicContact CG-CB 3.95Å; M136-C142 HydrophobicContact SD-CB 3.9Å; M136-L221 HydrophobicContact CB-CD2 3.61Å; M136-L221 HydrophobicContact CG-CD2 4Å; M136-V258 HydrophobicContact CE-CG1 4.32Å; M136-V258 HydrophobicContact CE-CG2 4.5Å; M136-L299 HydrophobicContact CE-CB 4.37Å; M136-L299 HydrophobicContact SD-CB 3.75Å; M136-W301 HydrophobicContact CB-CH2 4.41Å; M136-W301 HydrophobicContact CB-CZ2 4.05Å; M136-W301 HydrophobicContact CE-CD2 3.76Å; M136-W301 HydrophobicContact CE-CE3 3.78Å; M136-W301 HydrophobicContact CE-CG 4.38Å; M136-W301 HydrophobicContact CE-CH2 4.07Å; M136-W301 HydrophobicContact CE-CZ2 4.05Å; M136-W301 HydrophobicContact CE-CZ3 3.94Å; M136-W301 PolarHBondContact O-NE1 2.99Å
137	N	97.4	Very high	97	Very high	81 Å²	81	46.3 Å²	46.3	43%	0.433	25%	0.246	S	C	.	.	H	α-helix	trans	-68.4	-36	179.7	-72	-22.6	0	0	0	112.5	V133 K220 G222	V133-N137 WeakPolarHBondContact O-CB 3.49Å; V133-N137 VanDerWaalsContact O-CG 3.3Å; V133-N137 PolarHBondContact O-N 2.94Å; V133-N137 PolarHBondContact O-ND2 3.01Å; N137-K220 PolarHBondContact ND2-O 2.91Å; N137-K220 PolarHBondContact OD1-O 2.91Å; N137-G222 PolarHBondContact OD1-N 3.47Å
138	K	95.9	Very high	97.1	Very high	159 Å²	159	46.6 Å²	46.6	69%	0.691	25%	0.248	S	C	*	.	H	α-helix	trans	-83.2	-42.1	-179.1	-175.1	175.3	175.5	-176	0	113.3	P134 C135	P134-K138 WeakPolarHBondContact O-CB 3.44Å; P134-K138 PolarHBondContact O-N 3.4Å; C135-K138 PolarHBondContact O-N 2.88Å
139	H	95.8	Very high	97.2	Very high	86 Å²	86	47.9 Å²	47.9	40%	0.398	26%	0.262	S	S	.	.	H	α-helix	trans	-111.9	-24.1	-168.5	-59.4	-67	0	0	0	113.8	C135 I141 K284	C135-H139 WeakPolarHBondContact O-CA 3.45Å; C135-H139 WeakPolarHBondContact O-CB 3.04Å; C135-H139 PolarHBondContact O-N 2.79Å; H139-I141 PolarHBondContact O-N 3.07Å; H139-K284 PolarHBondContact O-NZ 3.38Å; H139-K284 VanDerWaalsContact O-NZ 3.07Å
140	G	97.2	Very high	97.3	Very high	7 Å²	7	50.1 Å²	50.1	7%	0.072	28%	0.275	C	S	.	.	S	Bend	trans	74.1	6	-174.2	0	0	0	0	0	115.3	M136 F300 W301 N306	M136-G140 WeakPolarHBondContact O-CA 3.26Å; M136-G140 PolarHBondContact O-N 2.95Å; G140-F300 VanDerWaalsContact O-CA 3.3Å; G140-F300 WeakPolarHBondContact O-CA 3.38Å; G140-F300 WeakPolarHBondContact O-CB 3.45Å; G140-W301 VanDerWaalsContact CA-NE1 3.3Å; G140-W301 PolarHBondContact O-N 3.43Å; G140-N306 PolarHBondContact O-ND2 2.76Å
141	I	98.4	Very high	97.5	Very high	20 Å²	20	52.3 Å²	52.3	10%	0.103	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	133.5	-178.8	-56.9	171.2	0	0	0	106.7	C135 H139 I279 P281 A288 I290 L298 L299 F300	C135-I141 PolarHBondContact SG-O 2.88Å; H139-I141 PolarHBondContact O-N 3.07Å; I141-I279 HydrophobicContact CD1-CB 3.94Å; I141-I279 HydrophobicContact CD1-CD1 3.98Å; I141-I279 HydrophobicContact CD1-CG2 3.66Å; I141-I279 HydrophobicContact CG1-CD1 4.28Å; I141-I279 HydrophobicContact CG1-CG2 4.44Å; I141-I279 HydrophobicContact CG2-CD1 4.26Å; I141-P281 HydrophobicContact CD1-CG 3.75Å; I141-A288 HydrophobicContact CD1-CB 4.16Å; I141-I290 HydrophobicContact CG2-CD1 4.13Å; I141-L298 HydrophobicContact CG2-CD1 3.81Å; I141-L299 CarbonylContact C-O 3.56Å; I141-L299 WeakPolarHBondContact CA-O 3.3Å; I141-F300 HydrophobicContact CB-CB 4.44Å; I141-F300 HydrophobicContact CG1-CB 4.03Å
142	C	98.6	Very high	97.6	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.007	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	130.3	176.3	-176.5	0	0	0	0	110.8	C135 M136 L298 L299	C135-C142 HydrophobicContact CB-CB 3.93Å; M136-C142 HydrophobicContact CG-CB 3.95Å; M136-C142 HydrophobicContact SD-CB 3.9Å; C142-L298 WeakPolarHBondContact O-CA 3.33Å; C142-L299 HydrophobicContact CB-CB 4.49Å; C142-L299 PolarHBondContact N-O 3.04Å; C142-L299 PolarHBondContact O-N 3.29Å
143	V	98.7	Very high	97.6	Very high	54 Å²	54	51.3 Å²	51.3	33%	0.327	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.7	176.9	178.5	0	0	0	0	108.9	R296 L298	V143-R296 HydrophobicContact CG1-CG 3.86Å; V143-L298 HydrophobicContact CG2-CD1 3.93Å
144	V	98.2	Very high	97.6	Very high	14 Å²	14	52.5 Å²	52.5	9%	0.085	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	110.9	172.7	-177.2	0	0	0	0	108.1	L127 I132 F147 L297	L127-V144 HydrophobicContact CD1-CG1 4.01Å; L127-V144 HydrophobicContact CD1-CG2 4.16Å; L127-V144 HydrophobicContact CD2-CG1 4.06Å; I132-V144 HydrophobicContact CD1-CG2 4.31Å; I132-V144 HydrophobicContact CG1-CG2 4.2Å; V144-F147 HydrophobicContact CG1-CD2 4.43Å; V144-L297 HydrophobicContact CB-CB 4.27Å; V144-L297 PolarHBondContact N-O 2.94Å; V144-L297 PolarHBondContact O-N 3.5Å
145	D	98.1	Very high	97.6	Very high	71 Å²	71	50.1 Å²	50.1	38%	0.38	27%	0.269	S	S	.	.	S	Bend	trans	-86.9	153.1	174.2	-74.8	-41	0	0	0	111.1	R296	D145-R296 VanDerWaalsContact CG-NH2 3.35Å; D145-R296 WeakPolarHBondContact OD1-CB 3.44Å; D145-R296 WeakPolarHBondContact OD1-CG 3.46Å; D145-R296 IonicContact OD1-CZ 3.44Å; D145-R296 VanDerWaalsContact OD1-CZ 3.29Å; D145-R296 IonicContact OD1-NE 2.95Å; D145-R296 PolarHBondContact OD1-NE 3Å; D145-R296 IonicContact OD1-NH2 3.47Å; D145-R296 PolarHBondContact OD1-NH2 3.31Å; D145-R296 VanDerWaalsContact OD1-NH2 3.07Å; D145-R296 IonicContact OD2-CZ 3.6Å; D145-R296 IonicContact OD2-NE 3.24Å; D145-R296 IonicContact OD2-NH2 2.73Å; D145-R296 PolarHBondContact OD2-NH2 3.32Å
146	N	96.6	Very high	97.7	Very high	106 Å²	106	48.5 Å²	48.5	57%	0.567	26%	0.258	S	S	*	.	S	Bend	trans	57.8	44.5	-179.6	-46.6	-68.8	0	0	0	112.6	D295	N146-D295 WeakPolarHBondContact CA-OD2 3.45Å; N146-D295 PolarHBondContact N-O 3.34Å
147	F	98.1	Very high	97.7	Very high	29 Å²	29	48.9 Å²	48.9	13%	0.127	26%	0.26	C	S	.	.	S	Bend	trans	-65.8	-44.1	-170.2	175.1	-127.2	0	0	0	113.7	L127 V144 L206 R209 L213 Y262 D295 L297	L127-F147 HydrophobicContact CD2-CD2 4.24Å; L127-F147 HydrophobicContact CD2-CE2 4.22Å; V144-F147 HydrophobicContact CG1-CD2 4.43Å; F147-L206 HydrophobicContact CD1-CD1 4.4Å; F147-L206 HydrophobicContact CE1-CD1 4.17Å; F147-R209 HydrophobicContact CE1-CB 4.18Å; F147-R209 HydrophobicContact CZ-CB 3.99Å; F147-L213 HydrophobicContact CE2-CD2 4.11Å; F147-L213 HydrophobicContact CZ-CD2 4.31Å; F147-Y262 HydrophobicContact CB-CE2 4.32Å; F147-Y262 HydrophobicContact CD1-CD2 4.24Å; F147-Y262 HydrophobicContact CD1-CE2 4.11Å; F147-D295 PolarHBondContact N-O 2.89Å; F147-D295 PolarHBondContact N-OD1 2.97Å; F147-D295 PolarHBondContact N-OD2 2.76Å; F147-D295 VanDerWaalsContact N-OD2 3.15Å; F147-L297 HydrophobicContact CB-CB 4.06Å; F147-L297 HydrophobicContact CD1-CB 4.1Å; F147-L297 HydrophobicContact CD1-CD1 4.25Å; F147-L297 HydrophobicContact CD1-CD2 4.05Å; F147-L297 HydrophobicContact CD1-CG 4.38Å; F147-L297 HydrophobicContact CD2-CD2 4.07Å; F147-L297 HydrophobicContact CE1-CD1 4.34Å; F147-L297 HydrophobicContact CE1-CD2 3.99Å; F147-L297 HydrophobicContact CE2-CD2 4Å; F147-L297 HydrophobicContact CG-CB 4.01Å; F147-L297 HydrophobicContact CG-CD2 4.11Å; F147-L297 HydrophobicContact CZ-CD2 3.97Å
148	L	97.4	Very high	97.7	Very high	29 Å²	29	50.1 Å²	50.1	15%	0.152	26%	0.263	C	S	.	.	S	Bend	trans	-116.7	-7.8	-176.6	-61.4	-179.1	0	0	0	113.9	T152 I156 L206 R209 D295	L148-T152 HydrophobicContact CB-CG2 3.82Å; L148-T152 HydrophobicContact CD1-CG2 3.87Å; L148-T152 HydrophobicContact CG-CG2 4.41Å; L148-T152 WeakPolarHBondContact O-CB 3.49Å; L148-T152 PolarHBondContact O-OG1 2.87Å; L148-I156 HydrophobicContact CD1-CD1 3.61Å; L148-L206 HydrophobicContact CD1-CB 4.3Å; L148-L206 HydrophobicContact CD1-CD1 3.57Å; L148-R209 HydrophobicContact CD2-CB 3.98Å; L148-R209 HydrophobicContact CD2-CG 3.87Å; L148-D295 PolarHBondContact N-OD1 3.36Å; L148-D295 PolarHBondContact N-OD2 3.41Å
149	G	96.7	Very high	97.8	Very high	28 Å²	28	43.6 Å²	43.6	29%	0.289	24%	0.236	S	C	.	.			trans	82.9	163.7	-175.4	0	0	0	0	0	113.2	E151 T152 G153 D295	G149-E151 PolarHBondContact O-N 3.48Å; G149-T152 PolarHBondContact O-N 2.67Å; G149-G153 PolarHBondContact O-N 2.81Å; G149-D295 VanDerWaalsContact CA-OD2 3.29Å; G149-D295 WeakPolarHBondContact CA-OD2 3.48Å; G149-D295 PolarHBondContact N-OD2 2.96Å
150	T	96.9	Very high	97.8	Very high	89 Å²	89	39.5 Å²	39.5	55%	0.546	22%	0.217	S	C	.	.	H	α-helix	trans	-59.6	-43.6	-171.1	-59.7	0	0	0	0	113.7	Q154 F294	T150-Q154 WeakPolarHBondContact O-CB 3.3Å; T150-Q154 PolarHBondContact O-N 3.35Å; T150-F294 HydrophobicContact CG2-CE1 4.46Å
151	E	97.8	Very high	97.7	Very high	165 Å²	165	43.5 Å²	43.5	77%	0.771	23%	0.232	S	C	*	.	H	α-helix	trans	-63.4	-50.8	-178.2	-173.6	-171	165.6	0	0	111.5	G149 Q154 G155	G149-E151 PolarHBondContact O-N 3.48Å; E151-Q154 PolarHBondContact O-N 3.41Å; E151-G155 PolarHBondContact O-N 2.82Å; E151-G155 VanDerWaalsContact O-N 3.08Å
152	T	98.1	Very high	97.6	Very high	27 Å²	27	45.1 Å²	45.1	17%	0.166	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-47	179.2	-52.9	0	0	0	0	111.2	L148 G149 Q154 G155 I156 F205	L148-T152 HydrophobicContact CB-CG2 3.82Å; L148-T152 HydrophobicContact CD1-CG2 3.87Å; L148-T152 HydrophobicContact CG-CG2 4.41Å; L148-T152 WeakPolarHBondContact O-CB 3.49Å; L148-T152 PolarHBondContact O-OG1 2.87Å; G149-T152 PolarHBondContact O-N 2.67Å; T152-Q154 PolarHBondContact O-N 2.85Å; T152-G155 PolarHBondContact O-N 2.84Å; T152-I156 HydrophobicContact CG2-CD1 4.09Å; T152-I156 WeakPolarHBondContact O-CG1 3.44Å; T152-I156 PolarHBondContact O-N 2.81Å; T152-F205 HydrophobicContact CG2-CD1 3.79Å; T152-F205 HydrophobicContact CG2-CE1 3.84Å
153	G	98.4	Very high	97.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58	-37.2	177.5	0	0	0	0	0	112.6	G149 I156 L157 Y262	G149-G153 PolarHBondContact O-N 2.81Å; G153-I156 PolarHBondContact O-N 2.78Å; G153-L157 PolarHBondContact O-N 3.41Å; G153-Y262 WeakPolarHBondContact CA-OH 3.48Å
154	Q	98.4	Very high	96.9	Very high	41 Å²	41	46.4 Å²	46.4	19%	0.192	25%	0.245	C	C	.	.	H	α-helix	trans	-68.6	-43.9	178.4	-179.2	59.3	48.5	0	0	111.2	T150 E151 T152 I156 L157 E158 F294	T150-Q154 WeakPolarHBondContact O-CB 3.3Å; T150-Q154 PolarHBondContact O-N 3.35Å; E151-Q154 PolarHBondContact O-N 3.41Å; T152-Q154 PolarHBondContact O-N 2.85Å; Q154-I156 VanDerWaalsContact C-N 3.29Å; Q154-I156 PolarHBondContact O-N 3.22Å; Q154-L157 PolarHBondContact O-N 3.01Å; Q154-E158 WeakPolarHBondContact CG-OE1 3.16Å; Q154-E158 PolarHBondContact NE2-OE1 2.99Å; Q154-E158 WeakPolarHBondContact O-CG 3.37Å; Q154-E158 PolarHBondContact O-N 3.04Å; Q154-F294 HydrophobicContact CB-CZ 4.48Å
155	G	98.4	Very high	96.5	Very high	11 Å²	11	54.2 Å²	54.2	11%	0.113	28%	0.278	C	S	.	.	H	α-helix	trans	-60.7	-36.9	173.9	0	0	0	0	0	113	E151 T152 E158 N159	E151-G155 PolarHBondContact O-N 2.82Å; E151-G155 VanDerWaalsContact O-N 3.08Å; T152-G155 PolarHBondContact O-N 2.84Å; G155-E158 PolarHBondContact O-N 3.15Å; G155-N159 PolarHBondContact O-N 3.46Å; G155-N159 VanDerWaalsContact O-N 3.09Å
156	I	98.5	Very high	96.1	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.7	-45.4	174.2	-61.6	161.9	0	0	0	110.6	L148 T152 G153 Q154 E158 N159 V160 K202 I203 L206 Y262 L264 I320	L148-I156 HydrophobicContact CD1-CD1 3.61Å; T152-I156 HydrophobicContact CG2-CD1 4.09Å; T152-I156 WeakPolarHBondContact O-CG1 3.44Å; T152-I156 PolarHBondContact O-N 2.81Å; G153-I156 PolarHBondContact O-N 2.78Å; Q154-I156 VanDerWaalsContact C-N 3.29Å; Q154-I156 PolarHBondContact O-N 3.22Å; I156-E158 VanDerWaalsContact C-N 3.25Å; I156-E158 PolarHBondContact O-N 3.49Å; I156-N159 WeakPolarHBondContact O-CB 3.45Å; I156-N159 PolarHBondContact O-N 3.33Å; I156-V160 WeakPolarHBondContact O-CG2 3.29Å; I156-V160 PolarHBondContact O-N 3.48Å; I156-K202 HydrophobicContact CG1-CB 3.85Å; I156-K202 WeakPolarHBondContact CG1-O 3.31Å; I156-I203 HydrophobicContact CG2-CG1 4.19Å; I156-L206 HydrophobicContact CD1-CB 3.85Å; I156-L206 HydrophobicContact CD1-CD1 4.39Å; I156-L206 HydrophobicContact CD1-CD2 4.37Å; I156-L206 HydrophobicContact CD1-CG 4.43Å; I156-L206 HydrophobicContact CG1-CB 4.5Å; I156-L206 HydrophobicContact CG2-CD2 4.33Å; I156-Y262 HydrophobicContact CD1-CE1 3.79Å; I156-Y262 HydrophobicContact CG2-CE1 4.36Å; I156-L264 HydrophobicContact CB-CD2 3.99Å; I156-L264 HydrophobicContact CG2-CD1 4.17Å; I156-L264 HydrophobicContact CG2-CD2 3.68Å; I156-I320 HydrophobicContact CG2-CD1 3.62Å
157	L	98.4	Very high	95.6	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-37.5	177.2	177.3	58.9	0	0	0	111.7	G153 Q154 V160 K161 L264 Y318	G153-L157 PolarHBondContact O-N 3.41Å; Q154-L157 PolarHBondContact O-N 3.01Å; L157-V160 PolarHBondContact O-N 3.06Å; L157-K161 HydrophobicContact CD1-CD 4.29Å; L157-K161 HydrophobicContact CD1-CG 4.2Å; L157-K161 HydrophobicContact CG-CD 4.23Å; L157-K161 WeakPolarHBondContact O-CB 3.34Å; L157-K161 WeakPolarHBondContact O-CG 3.07Å; L157-K161 PolarHBondContact O-N 3.42Å; L157-L264 HydrophobicContact CB-CD2 4.26Å; L157-L264 HydrophobicContact CD1-CB 4.06Å; L157-Y318 HydrophobicContact CD1-CD2 3.97Å; L157-Y318 HydrophobicContact CD1-CE2 4.5Å
158	E	97.7	Very high	94.9	Very high	107 Å²	107	57 Å²	57	50%	0.5	30%	0.304	S	S	.	.	H	α-helix	trans	-66.1	-44.1	176.1	-75.7	165.8	-163.3	0	0	112.6	Q154 G155 I156 V160 K161 S162	Q154-E158 WeakPolarHBondContact CG-OE1 3.16Å; Q154-E158 PolarHBondContact NE2-OE1 2.99Å; Q154-E158 WeakPolarHBondContact O-CG 3.37Å; Q154-E158 PolarHBondContact O-N 3.04Å; G155-E158 PolarHBondContact O-N 3.15Å; I156-E158 VanDerWaalsContact C-N 3.25Å; I156-E158 PolarHBondContact O-N 3.49Å; E158-V160 VanDerWaalsContact C-N 3.34Å; E158-V160 PolarHBondContact O-N 3.27Å; E158-K161 PolarHBondContact O-N 3.17Å; E158-S162 WeakPolarHBondContact O-CB 3.41Å; E158-S162 PolarHBondContact O-N 3.11Å
159	N	96.4	Very high	94.6	Very high	22 Å²	22	56.7 Å²	56.7	12%	0.118	30%	0.301	C	S	.	.	H	α-helix	trans	-56.5	-48.1	171.5	-77.4	-170.7	0	0	0	110.9	G155 I156 K161 S162 L163 N199 C200 E201 K202 I203	G155-N159 PolarHBondContact O-N 3.46Å; G155-N159 VanDerWaalsContact O-N 3.09Å; I156-N159 WeakPolarHBondContact O-CB 3.45Å; I156-N159 PolarHBondContact O-N 3.33Å; N159-K161 PolarHBondContact O-N 3.47Å; N159-S162 WeakPolarHBondContact O-CB 3.44Å; N159-S162 PolarHBondContact O-N 3.36Å; N159-L163 WeakPolarHBondContact O-CG 3.49Å; N159-L163 PolarHBondContact O-N 3.11Å; N159-N199 PolarHBondContact ND2-O 2.86Å; N159-N199 PolarHBondContact OD1-O 3Å; N159-C200 VanDerWaalsContact OD1-C 3.23Å; N159-C200 WeakPolarHBondContact OD1-CA 3.39Å; N159-E201 PolarHBondContact OD1-N 3.42Å; N159-K202 WeakPolarHBondContact OD1-CB 3.29Å; N159-K202 PolarHBondContact OD1-N 2.87Å; N159-I203 HydrophobicContact CB-CD1 3.84Å; N159-I203 HydrophobicContact CB-CG1 3.91Å
160	V	96.9	Very high	94.4	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.9	-45	178.6	171.1	0	0	0	0	112.2	I156 L157 E158 S162 L163 Y164 I203 V234 L264 Y318 I320	I156-V160 WeakPolarHBondContact O-CG2 3.29Å; I156-V160 PolarHBondContact O-N 3.48Å; L157-V160 PolarHBondContact O-N 3.06Å; E158-V160 VanDerWaalsContact C-N 3.34Å; E158-V160 PolarHBondContact O-N 3.27Å; V160-S162 VanDerWaalsContact C-N 3.31Å; V160-S162 PolarHBondContact O-N 2.87Å; V160-L163 PolarHBondContact O-N 2.96Å; V160-Y164 PolarHBondContact O-N 3.01Å; V160-I203 HydrophobicContact CG2-CD1 3.98Å; V160-I203 HydrophobicContact CG2-CG1 4.49Å; V160-V234 HydrophobicContact CB-CG1 4.26Å; V160-V234 HydrophobicContact CG1-CG1 3.69Å; V160-V234 HydrophobicContact CG2-CG1 3.71Å; V160-L264 HydrophobicContact CB-CD1 4.29Å; V160-L264 HydrophobicContact CG2-CD1 3.7Å; V160-Y318 HydrophobicContact CG1-CD1 3.52Å; V160-Y318 HydrophobicContact CG1-CE1 3.97Å; V160-Y318 HydrophobicContact CG1-CG 3.92Å; V160-I320 HydrophobicContact CG2-CD1 3.83Å; V160-I320 HydrophobicContact CG2-CG1 4.26Å
161	K	95.8	Very high	94	Very high	91 Å²	91	58.2 Å²	58.2	40%	0.396	30%	0.302	S	S	.	.	H	α-helix	trans	-63.4	-37.7	176.6	-76.7	178.4	175.7	178	0	111.8	L157 E158 N159 Y164 K165 Y318	L157-K161 HydrophobicContact CD1-CD 4.29Å; L157-K161 HydrophobicContact CD1-CG 4.2Å; L157-K161 HydrophobicContact CG-CD 4.23Å; L157-K161 WeakPolarHBondContact O-CB 3.34Å; L157-K161 WeakPolarHBondContact O-CG 3.07Å; L157-K161 PolarHBondContact O-N 3.42Å; E158-K161 PolarHBondContact O-N 3.17Å; N159-K161 PolarHBondContact O-N 3.47Å; K161-Y164 PolarHBondContact O-N 3.22Å; K161-K165 WeakPolarHBondContact O-CG 3.45Å; K161-K165 PolarHBondContact O-N 3Å; K161-Y318 HydrophobicContact CG-CE2 4.33Å
162	S	94.4	Very high	93.1	Very high	55 Å²	55	50.4 Å²	50.4	39%	0.385	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-47.1	175.4	-170.8	0	0	0	0	111.5	E158 N159 V160 Y164 K165 T166	E158-S162 WeakPolarHBondContact O-CB 3.41Å; E158-S162 PolarHBondContact O-N 3.11Å; N159-S162 WeakPolarHBondContact O-CB 3.44Å; N159-S162 PolarHBondContact O-N 3.36Å; V160-S162 VanDerWaalsContact C-N 3.31Å; V160-S162 PolarHBondContact O-N 2.87Å; S162-Y164 VanDerWaalsContact C-N 3.25Å; S162-Y164 PolarHBondContact O-N 2.96Å; S162-K165 PolarHBondContact O-N 2.91Å; S162-T166 WeakPolarHBondContact O-CG2 3.37Å; S162-T166 PolarHBondContact O-N 3.31Å; S162-T166 VanDerWaalsContact O-N 3.12Å; S162-T166 PolarHBondContact O-OG1 2.89Å
163	L	92.2	Very high	92.1	Very high	8 Å²	8	56 Å²	56	4%	0.042	29%	0.291	C	S	.	.	H	α-helix	trans	-57.6	-38.8	173.6	-72.3	170.8	0	0	0	112.2	N159 V160 T166 F169 I193 I203	N159-L163 WeakPolarHBondContact O-CG 3.49Å; N159-L163 PolarHBondContact O-N 3.11Å; V160-L163 PolarHBondContact O-N 2.96Å; L163-T166 PolarHBondContact O-OG1 2.69Å; L163-F169 HydrophobicContact CB-CE2 3.8Å; L163-I193 HydrophobicContact CD1-CD1 3.73Å; L163-I193 HydrophobicContact CD1-CG1 3.99Å; L163-I193 HydrophobicContact CD2-CD1 4.09Å; L163-I203 HydrophobicContact CD1-CD1 3.69Å
164	Y	90.7	Very high	90.6	Very high	73 Å²	73	58.1 Å²	58.1	29%	0.286	30%	0.302	S	S	.	.	H	α-helix	trans	-66.8	-44	177.9	-170.1	-95.6	0	0	0	112	V160 K161 S162 T166 G167 F169 K189 C236 Y318	V160-Y164 PolarHBondContact O-N 3.01Å; K161-Y164 PolarHBondContact O-N 3.22Å; S162-Y164 VanDerWaalsContact C-N 3.25Å; S162-Y164 PolarHBondContact O-N 2.96Å; Y164-T166 VanDerWaalsContact C-N 3.28Å; Y164-T166 PolarHBondContact O-N 2.95Å; Y164-G167 PolarHBondContact O-N 3.28Å; Y164-F169 HydrophobicContact CD2-CB 4.43Å; Y164-F169 HydrophobicContact CD2-CD1 4.04Å; Y164-F169 AromaticContact CD2-CD2 3.95Å; Y164-F169 HydrophobicContact CD2-CD2 3.95Å; Y164-F169 HydrophobicContact CD2-CE1 4.25Å; Y164-F169 HydrophobicContact CD2-CE2 4.15Å; Y164-F169 AromaticContact CD2-CG 3.89Å; Y164-F169 HydrophobicContact CD2-CG 3.89Å; Y164-F169 HydrophobicContact CD2-CZ 4.29Å; Y164-F169 HydrophobicContact CE2-CG 4.48Å; Y164-K189 HydrophobicContact CE2-CD 4.26Å; Y164-C236 HydrophobicContact CD2-CB 3.97Å; Y164-C236 HydrophobicContact CE2-CB 3.92Å; Y164-C236 WeakPolarHBondContact CE2-SG 3.26Å; Y164-Y318 HydrophobicContact CD2-CE1 4.4Å
165	K	91.3	Very high	88.8	Confident	179 Å²	179	61.9 Å²	61.9	78%	0.778	33%	0.327	S	S	*	.	H	α-helix	trans	-64	-30.2	179	-73.5	175.5	-179	-177.3	0	113.4	K161 S162 G167	K161-K165 WeakPolarHBondContact O-CG 3.45Å; K161-K165 PolarHBondContact O-N 3Å; S162-K165 PolarHBondContact O-N 2.91Å; K165-G167 PolarHBondContact O-N 3.01Å
166	T	89.4	Confident	86.7	Confident	88 Å²	88	66.2 Å²	66.2	54%	0.54	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	0.7	178.7	54.7	0	0	0	0	113.8	S162 L163 Y164 R168	S162-T166 WeakPolarHBondContact O-CG2 3.37Å; S162-T166 PolarHBondContact O-N 3.31Å; S162-T166 VanDerWaalsContact O-N 3.12Å; S162-T166 PolarHBondContact O-OG1 2.89Å; L163-T166 PolarHBondContact O-OG1 2.69Å; Y164-T166 VanDerWaalsContact C-N 3.28Å; Y164-T166 PolarHBondContact O-N 2.95Å; T166-R168 VanDerWaalsContact C-N 3.27Å; T166-R168 PolarHBondContact O-N 2.88Å; T166-R168 WeakPolarHBondContact OG1-CG 3.47Å
167	G	84.8	Confident	84.5	Confident	61 Å²	61	70.3 Å²	70.3	63%	0.629	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	15.6	175.9	0	0	0	0	0	114.4	Y164 K165 F169	Y164-G167 PolarHBondContact O-N 3.28Å; K165-G167 PolarHBondContact O-N 3.01Å; G167-F169 PolarHBondContact O-N 3.03Å
168	R	84.5	Confident	81.9	Confident	115 Å²	115	80.5 Å²	80.5	43%	0.434	42%	0.419	S	S	.	.			trans	-77.4	-1.3	-178	-64.8	-171.3	70.8	-173.2	-1.1	114.7	T166 T191	T166-R168 VanDerWaalsContact C-N 3.27Å; T166-R168 PolarHBondContact O-N 2.88Å; T166-R168 WeakPolarHBondContact OG1-CG 3.47Å; R168-T191 WeakPolarHBondContact O-CB 3.41Å; R168-T191 PolarHBondContact O-OG1 2.86Å; R168-T191 VanDerWaalsContact O-OG1 3.05Å
169	F	91.4	Very high	79.5	Confident	22 Å²	22	78.9 Å²	78.9	10%	0.096	42%	0.419	C	S	.	.			trans	-88.3	134.8	-179.7	-83	-111.9	0	0	0	110.7	L163 Y164 G167 K189 I190 T191 V234 C236	L163-F169 HydrophobicContact CB-CE2 3.8Å; Y164-F169 HydrophobicContact CD2-CB 4.43Å; Y164-F169 HydrophobicContact CD2-CD1 4.04Å; Y164-F169 AromaticContact CD2-CD2 3.95Å; Y164-F169 HydrophobicContact CD2-CD2 3.95Å; Y164-F169 HydrophobicContact CD2-CE1 4.25Å; Y164-F169 HydrophobicContact CD2-CE2 4.15Å; Y164-F169 AromaticContact CD2-CG 3.89Å; Y164-F169 HydrophobicContact CD2-CG 3.89Å; Y164-F169 HydrophobicContact CD2-CZ 4.29Å; Y164-F169 HydrophobicContact CE2-CG 4.48Å; G167-F169 PolarHBondContact O-N 3.03Å; F169-K189 HydrophobicContact CB-CB 3.96Å; F169-K189 HydrophobicContact CD1-CB 3.95Å; F169-K189 WeakPolarHBondContact CD1-O 3.37Å; F169-K189 HydrophobicContact CG-CB 4.45Å; F169-I190 CarbonylContact C-O 3.55Å; F169-I190 WeakPolarHBondContact CA-O 3.32Å; F169-T191 HydrophobicContact CD2-CG2 4.09Å; F169-T191 HydrophobicContact CE1-CG2 4.44Å; F169-T191 HydrophobicContact CE2-CG2 3.79Å; F169-T191 HydrophobicContact CZ-CG2 3.99Å; F169-V234 HydrophobicContact CE1-CG1 4.21Å; F169-V234 HydrophobicContact CZ-CB 4.32Å; F169-V234 HydrophobicContact CZ-CG1 3.7Å; F169-C236 HydrophobicContact CD1-CB 4.02Å; F169-C236 HydrophobicContact CE1-CB 3.72Å
170	T	91.7	Very high	77.4	Confident	83 Å²	83	86.3 Å²	86.3	51%	0.509	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	158.5	175	57.7	0	0	0	0	110.7	G172 K189 I190	T170-G172 PolarHBondContact O-N 3.1Å; T170-K189 CarbonylContact O-C 3.58Å; T170-K189 WeakPolarHBondContact O-CA 3.27Å; T170-I190 PolarHBondContact N-O 3.01Å; T170-I190 PolarHBondContact O-N 3.18Å; T170-I190 PolarHBondContact OG1-O 3.43Å
171	D	88.9	Confident	75.5	Confident	66 Å²	66	88.6 Å²	88.6	35%	0.353	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	138	175.4	-71.9	-9.4	0	0	0	110.4	Q173 K183	D171-Q173 PolarHBondContact O-N 3.43Å; D171-K183 WeakPolarHBondContact OD2-CE 3.18Å; D171-K183 IonicContact OD2-NZ 3.68Å
172	G	78.9	Confident	74	Confident	1 Å²	1	85.4 Å²	85.4	1%	0.01	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-57.5	128.5	-178.3	0	0	0	0	0	112.7	T170 D188	T170-G172 PolarHBondContact O-N 3.1Å; G172-D188 PolarHBondContact N-O 3.23Å
173	Q	76.6	Confident	72.4	Confident	146 Å²	146	89.7 Å²	89.7	68%	0.682	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-101.5	160.5	-179.1	-65.4	-174.9	-15.1	0	0	112.3	D171 R186	D171-Q173 PolarHBondContact O-N 3.43Å; Q173-R186 PolarHBondContact O-NH1 3.38Å
174	L	68.1	Low	71.4	Confident	44 Å²	44	95.4 Å²	95.4	23%	0.23	51%	0.505	C	S	.	.			trans	-109.1	151.3	175.3	-61.6	170.1	0	0	0	110.7	S176 Q177 I185 Y244	L174-S176 PolarHBondContact O-N 3.16Å; L174-Q177 HydrophobicContact CB-CG 4.33Å; L174-Q177 HydrophobicContact CD1-CG 4.31Å; L174-I185 HydrophobicContact CD1-CB 4.11Å; L174-I185 HydrophobicContact CD1-CD1 3.33Å; L174-I185 HydrophobicContact CD1-CG1 4.28Å; L174-I185 HydrophobicContact CD1-CG2 3.88Å; L174-I185 HydrophobicContact CD2-CG2 3.81Å; L174-I185 HydrophobicContact CG-CG2 4.41Å; L174-Y244 WeakPolarHBondContact CD2-OH 3.14Å
175	V	60.5	Low	70.8	Confident	120 Å²	120	94.6 Å²	94.6	73%	0.727	51%	0.506	S	S	*	.	S	Bend	trans	-67.1	-20.3	-178.6	179.8	0	0	0	0	112.7
176	S	53.3	Low	70.6	Confident	102 Å²	102	87 Å²	87	71%	0.713	47%	0.472	S	S	*	.	S	Bend	trans	-136.8	117.1	172.6	67.5	0	0	0	0	110.7	L174	L174-S176 PolarHBondContact O-N 3.16Å
177	Q	53.1	Low	70.6	Confident	85 Å²	85	83.9 Å²	83.9	40%	0.397	46%	0.457	S	S	.	.			trans	-129.9	138.5	166.2	-92.5	-158.2	-30.3	0	0	113.5	L174 S179 T182	L174-Q177 HydrophobicContact CB-CG 4.33Å; L174-Q177 HydrophobicContact CD1-CG 4.31Å; Q177-S179 PolarHBondContact NE2-O 3.1Å; Q177-S179 VanDerWaalsContact NE2-O 3.13Å; Q177-S179 PolarHBondContact OE1-O 3.16Å; Q177-T182 VanDerWaalsContact CD-CG2 3.47Å
178	K	42.5	Very low	70.9	Confident	223 Å²	223	81.1 Å²	81.1	97%	0.97	43%	0.428	S	S	*	.	S	Bend	trans	-124.5	15.2	164.1	-72.8	-173.4	175.9	-178.1	0	111.4
179	S	47.6	Very low	71.5	Confident	72 Å²	72	79 Å²	79	50%	0.503	42%	0.422	S	S	.	.	S	Bend	trans	-145.8	146.4	-176.1	65.4	0	0	0	0	113.1	Q177 S181	Q177-S179 PolarHBondContact NE2-O 3.1Å; Q177-S179 VanDerWaalsContact NE2-O 3.13Å; Q177-S179 PolarHBondContact OE1-O 3.16Å; S179-S181 PolarHBondContact O-N 3.2Å
180	D	51.7	Low	71.7	Confident	178 Å²	178	78.4 Å²	78.4	95%	0.952	42%	0.419	S	S	*	.	S	Bend	trans	-78.7	-0.9	-165.6	-63.9	-37.6	0	0	0	117
181	S	57	Low	71.9	Confident	49 Å²	49	75 Å²	75	34%	0.343	40%	0.399	S	S	.	.			trans	-116.2	95.7	-178.5	177.7	0	0	0	0	112.3	S179 D184	S179-S181 PolarHBondContact O-N 3.2Å; S181-D184 WeakPolarHBondContact CB-OD2 3.31Å; S181-D184 VanDerWaalsContact OG-CG 3.28Å; S181-D184 PolarHBondContact OG-OD2 2.64Å
182	T	64.8	Low	72.2	Confident	24 Å²	24	77.5 Å²	77.5	15%	0.147	40%	0.403	C	S	.	.			trans	-76.6	-24	169.9	48.9	0	0	0	0	113	Q177 D184 I185 R186	Q177-T182 VanDerWaalsContact CD-CG2 3.47Å; T182-D184 VanDerWaalsContact C-N 3.28Å; T182-D184 PolarHBondContact O-N 3.3Å; T182-I185 PolarHBondContact O-N 3.48Å; T182-I185 VanDerWaalsContact O-N 3.13Å; T182-R186 PolarHBondContact O-N 3.24Å
183	K	61.3	Low	73	Confident	144 Å²	144	77.4 Å²	77.4	63%	0.626	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-22.8	-171	-66.4	-175	179.3	179.5	0	114.1	D171 I185	D171-K183 WeakPolarHBondContact OD2-CE 3.18Å; D171-K183 IonicContact OD2-NZ 3.68Å; K183-I185 PolarHBondContact O-N 3.41Å
184	D	71.3	Confident	73.8	Confident	128 Å²	128	73.8 Å²	73.8	68%	0.684	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-17.2	176.3	-62.6	-39.1	0	0	0	112.7	S181 T182	S181-D184 WeakPolarHBondContact CB-OD2 3.31Å; S181-D184 VanDerWaalsContact OG-CG 3.28Å; S181-D184 PolarHBondContact OG-OD2 2.64Å; T182-D184 VanDerWaalsContact C-N 3.28Å; T182-D184 PolarHBondContact O-N 3.3Å
185	I	77.4	Confident	74.7	Confident	57 Å²	57	72.5 Å²	72.5	29%	0.292	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-43.4	-175.6	-64.2	171.8	0	0	0	110.6	L174 T182 K183 Y244 V245	L174-I185 HydrophobicContact CD1-CB 4.11Å; L174-I185 HydrophobicContact CD1-CD1 3.33Å; L174-I185 HydrophobicContact CD1-CG1 4.28Å; L174-I185 HydrophobicContact CD1-CG2 3.88Å; L174-I185 HydrophobicContact CD2-CG2 3.81Å; L174-I185 HydrophobicContact CG-CG2 4.41Å; T182-I185 PolarHBondContact O-N 3.48Å; T182-I185 VanDerWaalsContact O-N 3.13Å; K183-I185 PolarHBondContact O-N 3.41Å; I185-Y244 HydrophobicContact CG2-CE2 3.96Å; I185-Y244 WeakPolarHBondContact O-CA 3.44Å; I185-Y244 WeakPolarHBondContact O-CD2 3.38Å; I185-V245 HydrophobicContact CB-CG2 4.34Å; I185-V245 HydrophobicContact CG2-CG2 3.66Å; I185-V245 WeakPolarHBondContact O-CG2 3.29Å; I185-V245 PolarHBondContact O-N 3.26Å
186	R	87.4	Confident	76.1	Confident	20 Å²	20	72.5 Å²	72.5	8%	0.075	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-144.3	136.7	176.9	63.6	-172.1	-66.5	-177.7	4.3	110.9	Q173 T182 D188 G243 Y244	Q173-R186 PolarHBondContact O-NH1 3.38Å; T182-R186 PolarHBondContact O-N 3.24Å; R186-D188 WeakPolarHBondContact CB-OD1 3.39Å; R186-D188 IonicContact CZ-OD1 2.71Å; R186-D188 IonicContact CZ-OD2 3.74Å; R186-D188 IonicContact NE-OD1 3.59Å; R186-D188 PolarHBondContact NE-OD1 3.11Å; R186-D188 IonicContact NE-OD2 3.22Å; R186-D188 VanDerWaalsContact NH2-CG 3.34Å; R186-D188 IonicContact NH2-OD1 2.69Å; R186-D188 PolarHBondContact NH2-OD1 3.28Å; R186-D188 IonicContact NH2-OD2 3.38Å; R186-D188 PolarHBondContact NH2-OD2 3.43Å; R186-G243 WeakPolarHBondContact CA-O 3.08Å; R186-Y244 HydrophobicContact CB-CD1 3.73Å; R186-Y244 HydrophobicContact CB-CD2 3.98Å; R186-Y244 HydrophobicContact CB-CE1 3.97Å; R186-Y244 HydrophobicContact CB-CE2 4.18Å; R186-Y244 HydrophobicContact CB-CG 3.76Å; R186-Y244 HydrophobicContact CG-CE1 4.48Å
187	G	89	Confident	77.8	Confident	22 Å²	22	69.6 Å²	69.6	23%	0.227	36%	0.361	C	S	.	.			trans	-105.2	11.6	-177.6	0	0	0	0	0	114.7	P238 T242 G243	G187-P238 WeakPolarHBondContact O-CD 3.37Å; G187-T242 WeakPolarHBondContact O-CG2 3.46Å; G187-G243 PolarHBondContact N-O 3.19Å
188	D	92.8	Very high	79.4	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.011	37%	0.372	C	S	.	.			trans	-90.5	159.2	-178.9	66.2	-44.2	0	0	0	113.5	G172 R186 I190 C236 Y237	G172-D188 PolarHBondContact N-O 3.23Å; R186-D188 WeakPolarHBondContact CB-OD1 3.39Å; R186-D188 IonicContact CZ-OD1 2.71Å; R186-D188 IonicContact CZ-OD2 3.74Å; R186-D188 IonicContact NE-OD1 3.59Å; R186-D188 PolarHBondContact NE-OD1 3.11Å; R186-D188 IonicContact NE-OD2 3.22Å; R186-D188 VanDerWaalsContact NH2-CG 3.34Å; R186-D188 IonicContact NH2-OD1 2.69Å; R186-D188 PolarHBondContact NH2-OD1 3.28Å; R186-D188 IonicContact NH2-OD2 3.38Å; R186-D188 PolarHBondContact NH2-OD2 3.43Å; D188-I190 WeakPolarHBondContact OD2-CG2 3.38Å; D188-C236 WeakPolarHBondContact CA-O 3.49Å; D188-Y237 HydrophobicContact CB-CD1 3.81Å; D188-Y237 HydrophobicContact CB-CD2 3.73Å; D188-Y237 HydrophobicContact CB-CE1 3.67Å; D188-Y237 HydrophobicContact CB-CE2 3.56Å; D188-Y237 HydrophobicContact CB-CG 3.82Å
189	K	95.2	Very high	81.5	Confident	72 Å²	72	63.9 Å²	63.9	31%	0.313	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	141.7	167.1	-52.3	-177	175.3	-174.3	0	109	Y164 F169 T170 A235 C236	Y164-K189 HydrophobicContact CE2-CD 4.26Å; F169-K189 HydrophobicContact CB-CB 3.96Å; F169-K189 HydrophobicContact CD1-CB 3.95Å; F169-K189 WeakPolarHBondContact CD1-O 3.37Å; F169-K189 HydrophobicContact CG-CB 4.45Å; T170-K189 CarbonylContact O-C 3.58Å; T170-K189 WeakPolarHBondContact O-CA 3.27Å; K189-A235 CarbonylContact O-C 3.4Å; K189-A235 WeakPolarHBondContact O-CA 3.41Å; K189-C236 PolarHBondContact N-O 2.69Å; K189-C236 PolarHBondContact O-N 3.31Å
190	I	96.1	Very high	83.7	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.041	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	159	-177.5	67.6	172.8	0	0	0	112.8	F169 T170 D188 M233 V234 A235	F169-I190 CarbonylContact C-O 3.55Å; F169-I190 WeakPolarHBondContact CA-O 3.32Å; T170-I190 PolarHBondContact N-O 3.01Å; T170-I190 PolarHBondContact O-N 3.18Å; T170-I190 PolarHBondContact OG1-O 3.43Å; D188-I190 WeakPolarHBondContact OD2-CG2 3.38Å; I190-M233 HydrophobicContact CB-CG 4.02Å; I190-M233 HydrophobicContact CB-SD 4.39Å; I190-M233 HydrophobicContact CD1-CG 4.22Å; I190-M233 HydrophobicContact CD1-SD 3.95Å; I190-M233 HydrophobicContact CG2-CE 4.38Å; I190-M233 HydrophobicContact CG2-CG 4.09Å; I190-M233 HydrophobicContact CG2-SD 3.97Å; I190-V234 CarbonylContact C-O 3.5Å; I190-V234 WeakPolarHBondContact CA-O 3.46Å; I190-A235 HydrophobicContact CG2-CB 4.01Å
191	T	96.3	Very high	85.8	Confident	13 Å²	13	57.3 Å²	57.3	8%	0.08	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	150.3	162	-163.3	0	0	0	0	109.3	R168 F169 I193 V234	R168-T191 WeakPolarHBondContact O-CB 3.41Å; R168-T191 PolarHBondContact O-OG1 2.86Å; R168-T191 VanDerWaalsContact O-OG1 3.05Å; F169-T191 HydrophobicContact CD2-CG2 4.09Å; F169-T191 HydrophobicContact CE1-CG2 4.44Å; F169-T191 HydrophobicContact CE2-CG2 3.79Å; F169-T191 HydrophobicContact CZ-CG2 3.99Å; T191-I193 HydrophobicContact CG2-CD1 4.04Å; T191-I193 HydrophobicContact CG2-CG1 4.23Å; T191-V234 HydrophobicContact CG2-CB 3.99Å; T191-V234 HydrophobicContact CG2-CG2 4.48Å; T191-V234 PolarHBondContact N-O 3.29Å; T191-V234 PolarHBondContact O-N 3.26Å
192	W	96.2	Very high	87.7	Confident	117 Å²	117	59 Å²	59	44%	0.443	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.1	179.9	-68.9	93.9	0	0	0	109.8	K231 A232 M233 W323	W192-K231 HydrophobicContact CE3-CB 4Å; W192-K231 WeakPolarHBondContact CZ3-O 3.27Å; W192-A232 CarbonylContact C-O 3.52Å; W192-A232 WeakPolarHBondContact CA-O 3.19Å; W192-M233 HydrophobicContact CD2-CB 4.26Å; W192-M233 HydrophobicContact CD2-CG 4.45Å; W192-M233 HydrophobicContact CE3-CB 3.89Å; W192-M233 HydrophobicContact CH2-CB 3.91Å; W192-M233 HydrophobicContact CH2-CG 4.32Å; W192-M233 HydrophobicContact CH2-SD 4.4Å; W192-M233 HydrophobicContact CZ2-CB 4.23Å; W192-M233 HydrophobicContact CZ2-CG 4.16Å; W192-M233 HydrophobicContact CZ2-SD 4.14Å; W192-M233 HydrophobicContact CZ3-CB 3.72Å; W192-W323 HydrophobicContact CH2-CE3 4.24Å; W192-W323 HydrophobicContact CH2-CH2 4.42Å; W192-W323 AromaticContact CH2-CZ3 3.57Å; W192-W323 HydrophobicContact CH2-CZ3 3.57Å; W192-W323 HydrophobicContact CZ3-CE3 4.44Å; W192-W323 AromaticContact CZ3-CZ3 3.95Å; W192-W323 HydrophobicContact CZ3-CZ3 3.95Å
193	I	95.9	Very high	89.3	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.9	-176.2	-57.2	-59	0	0	0	109.2	L163 T191 E197 C200 I203 K231 A232 V234	L163-I193 HydrophobicContact CD1-CD1 3.73Å; L163-I193 HydrophobicContact CD1-CG1 3.99Å; L163-I193 HydrophobicContact CD2-CD1 4.09Å; T191-I193 HydrophobicContact CG2-CD1 4.04Å; T191-I193 HydrophobicContact CG2-CG1 4.23Å; I193-E197 WeakPolarHBondContact CA-OE1 3.47Å; I193-E197 WeakPolarHBondContact CG2-OE2 3.45Å; I193-C200 HydrophobicContact CG2-CB 4.11Å; I193-I203 HydrophobicContact CG2-CG2 4.08Å; I193-K231 WeakPolarHBondContact O-CB 3.44Å; I193-A232 HydrophobicContact CB-CB 4.49Å; I193-A232 PolarHBondContact N-O 3.35Å; I193-A232 PolarHBondContact O-N 3.42Å; I193-V234 HydrophobicContact CB-CG2 4.48Å; I193-V234 HydrophobicContact CG1-CG2 3.71Å
194	D	92.5	Very high	91	Very high	69 Å²	69	52.5 Å²	52.5	37%	0.369	28%	0.282	S	S	.	.			trans	-76.5	-32.7	174.5	-150.6	-16.3	0	0	0	111.5	E197 M207 K231	D194-E197 PolarHBondContact N-OE1 3.16Å; D194-E197 PolarHBondContact N-OE2 2.87Å; D194-M207 VanDerWaalsContact O-CE 3.29Å; D194-M207 WeakPolarHBondContact O-CE 3.15Å; D194-K231 HydrophobicContact CB-CD 4.04Å; D194-K231 VanDerWaalsContact CG-NZ 3.29Å; D194-K231 WeakPolarHBondContact OD2-CE 3.4Å; D194-K231 IonicContact OD2-NZ 3.81Å; D194-K231 PolarHBondContact OD2-NZ 2.96Å
195	G	86.3	Confident	92.3	Very high	18 Å²	18	50.8 Å²	50.8	19%	0.186	27%	0.268	C	S	.	.	S	Bend	trans	98.8	9.5	-174	0	0	0	0	0	113.1	E197 S204	G195-E197 PolarHBondContact N-OE2 3.18Å; G195-S204 WeakPolarHBondContact CA-OG 3.4Å; G195-S204 WeakPolarHBondContact O-CB 3.06Å; G195-S204 PolarHBondContact O-OG 2.82Å
196	T	89.6	Confident	93.3	Very high	120 Å²	120	48 Å²	48	74%	0.736	25%	0.254	S	S	*	.			trans	-109.6	-7.2	175.4	58.6	0	0	0	0	112.3
197	E	89	Confident	93.8	Very high	40 Å²	40	47.2 Å²	47.2	19%	0.187	25%	0.251	C	S	.	.	S	Bend	trans	-67.3	145.6	176.2	-58.7	88.4	159.3	0	0	111.3	I193 D194 G195 C200	I193-E197 WeakPolarHBondContact CA-OE1 3.47Å; I193-E197 WeakPolarHBondContact CG2-OE2 3.45Å; D194-E197 PolarHBondContact N-OE1 3.16Å; D194-E197 PolarHBondContact N-OE2 2.87Å; G195-E197 PolarHBondContact N-OE2 3.18Å; E197-C200 HydrophobicContact CB-CB 4.33Å; E197-C200 WeakPolarHBondContact O-CB 3.42Å; E197-C200 PolarHBondContact O-N 2.8Å
198	S	87.5	Confident	94.2	Very high	89 Å²	89	48.5 Å²	48.5	62%	0.622	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	146	173.5	54.8	0	0	0	0	111.7	C200	S198-C200 PolarHBondContact O-N 3.27Å
199	N	86.9	Confident	94.5	Very high	100 Å²	100	51.3 Å²	51.3	54%	0.535	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	24.1	-179.5	-51.1	-68.7	0	0	0	114.1	N159 E201	N159-N199 PolarHBondContact ND2-O 2.86Å; N159-N199 PolarHBondContact OD1-O 3Å; N199-E201 VanDerWaalsContact C-OE2 3.27Å; N199-E201 WeakPolarHBondContact CA-OE2 3.5Å; N199-E201 PolarHBondContact N-OE1 2.92Å
200	C	92.7	Very high	94.6	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.252	C	S	.	.			trans	-118.8	13.8	175.8	-63.8	0	0	0	0	112.5	N159 I193 E197 S198 K202 I203 S204	N159-C200 VanDerWaalsContact OD1-C 3.23Å; N159-C200 WeakPolarHBondContact OD1-CA 3.39Å; I193-C200 HydrophobicContact CG2-CB 4.11Å; E197-C200 HydrophobicContact CB-CB 4.33Å; E197-C200 WeakPolarHBondContact O-CB 3.42Å; E197-C200 PolarHBondContact O-N 2.8Å; S198-C200 PolarHBondContact O-N 3.27Å; C200-K202 VanDerWaalsContact C-N 3.26Å; C200-K202 PolarHBondContact O-N 3.37Å; C200-I203 WeakPolarHBondContact O-CA 3.39Å; C200-I203 WeakPolarHBondContact O-CB 3.47Å; C200-I203 PolarHBondContact O-N 2.86Å; C200-S204 PolarHBondContact O-N 3.03Å; C200-S204 PolarHBondContact O-OG 2.89Å
201	E	95.7	Very high	94.7	Very high	111 Å²	111	49.4 Å²	49.4	52%	0.519	26%	0.26	S	S	.	.	H	α-helix	trans	-60.4	-34.8	-169.8	-56.3	76	-166	0	0	112.2	N159 N199 S204 F205	N159-E201 PolarHBondContact OD1-N 3.42Å; N199-E201 VanDerWaalsContact C-OE2 3.27Å; N199-E201 WeakPolarHBondContact CA-OE2 3.5Å; N199-E201 PolarHBondContact N-OE1 2.92Å; E201-S204 PolarHBondContact O-N 3.27Å; E201-F205 WeakPolarHBondContact O-CB 3.23Å; E201-F205 PolarHBondContact O-N 3.13Å
202	K	97.8	Very high	94.8	Very high	85 Å²	85	50.7 Å²	50.7	37%	0.37	27%	0.266	S	S	.	.	H	α-helix	trans	-74.8	-32.6	176.7	-63.6	-68.7	-174.2	175.6	0	111.8	I156 N159 C200 F205 L206	I156-K202 HydrophobicContact CG1-CB 3.85Å; I156-K202 WeakPolarHBondContact CG1-O 3.31Å; N159-K202 WeakPolarHBondContact OD1-CB 3.29Å; N159-K202 PolarHBondContact OD1-N 2.87Å; C200-K202 VanDerWaalsContact C-N 3.26Å; C200-K202 PolarHBondContact O-N 3.37Å; K202-F205 PolarHBondContact O-N 3.16Å; K202-L206 PolarHBondContact O-N 3.32Å
203	I	97.7	Very high	94.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.6	-43	171.3	-62	172.4	0	0	0	109.8	I156 N159 V160 L163 I193 C200 F205 L206 M207 V234 I320	I156-I203 HydrophobicContact CG2-CG1 4.19Å; N159-I203 HydrophobicContact CB-CD1 3.84Å; N159-I203 HydrophobicContact CB-CG1 3.91Å; V160-I203 HydrophobicContact CG2-CD1 3.98Å; V160-I203 HydrophobicContact CG2-CG1 4.49Å; L163-I203 HydrophobicContact CD1-CD1 3.69Å; I193-I203 HydrophobicContact CG2-CG2 4.08Å; C200-I203 WeakPolarHBondContact O-CA 3.39Å; C200-I203 WeakPolarHBondContact O-CB 3.47Å; C200-I203 PolarHBondContact O-N 2.86Å; I203-F205 VanDerWaalsContact C-N 3.29Å; I203-F205 PolarHBondContact O-N 3.04Å; I203-L206 WeakPolarHBondContact O-CB 3.48Å; I203-L206 PolarHBondContact O-N 2.81Å; I203-L206 VanDerWaalsContact O-N 3.16Å; I203-M207 HydrophobicContact CG2-SD 4.02Å; I203-M207 VanDerWaalsContact O-CG 3.32Å; I203-M207 WeakPolarHBondContact O-CG 3.34Å; I203-M207 PolarHBondContact O-N 3.41Å; I203-V234 HydrophobicContact CD1-CG2 4.36Å; I203-I320 HydrophobicContact CD1-CD1 4.5Å; I203-I320 HydrophobicContact CG1-CD1 4.1Å; I203-I320 HydrophobicContact CG2-CD1 4.29Å
204	S	97.6	Very high	94.9	Very high	32 Å²	32	45.5 Å²	45.5	22%	0.224	25%	0.248	C	C	.	.	H	α-helix	trans	-60.1	-40.6	174.7	-45.9	0	0	0	0	111.8	G195 C200 E201 M207 S208	G195-S204 WeakPolarHBondContact CA-OG 3.4Å; G195-S204 WeakPolarHBondContact O-CB 3.06Å; G195-S204 PolarHBondContact O-OG 2.82Å; C200-S204 PolarHBondContact O-N 3.03Å; C200-S204 PolarHBondContact O-OG 2.89Å; E201-S204 PolarHBondContact O-N 3.27Å; S204-M207 PolarHBondContact O-N 3.41Å; S204-S208 PolarHBondContact O-N 2.63Å
205	F	98.2	Very high	95.1	Very high	91 Å²	91	49.1 Å²	49.1	40%	0.399	26%	0.256	S	S	.	.	H	α-helix	trans	-62.8	-44.6	173.4	-176.3	-103.8	0	0	0	112.2	T152 E201 K202 I203 M207 S208 R209	T152-F205 HydrophobicContact CG2-CD1 3.79Å; T152-F205 HydrophobicContact CG2-CE1 3.84Å; E201-F205 WeakPolarHBondContact O-CB 3.23Å; E201-F205 PolarHBondContact O-N 3.13Å; K202-F205 PolarHBondContact O-N 3.16Å; I203-F205 VanDerWaalsContact C-N 3.29Å; I203-F205 PolarHBondContact O-N 3.04Å; F205-M207 VanDerWaalsContact C-N 3.29Å; F205-M207 PolarHBondContact O-N 3.18Å; F205-S208 PolarHBondContact O-N 3Å; F205-S208 PolarHBondContact O-OG 3.29Å; F205-R209 HydrophobicContact CD1-CG 4.25Å; F205-R209 HydrophobicContact CE1-CG 3.89Å; F205-R209 HydrophobicContact CE2-CG 4.34Å; F205-R209 HydrophobicContact CZ-CG 3.95Å; F205-R209 VanDerWaalsContact O-CG 3.3Å; F205-R209 WeakPolarHBondContact O-CG 3.45Å; F205-R209 PolarHBondContact O-N 3.41Å
206	L	98.6	Very high	95.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-55.5	-46.5	173	170.8	66.9	0	0	0	111.5	F147 L148 I156 K202 I203 S208 R209 M210 Y262 I320	F147-L206 HydrophobicContact CD1-CD1 4.4Å; F147-L206 HydrophobicContact CE1-CD1 4.17Å; L148-L206 HydrophobicContact CD1-CB 4.3Å; L148-L206 HydrophobicContact CD1-CD1 3.57Å; I156-L206 HydrophobicContact CD1-CB 3.85Å; I156-L206 HydrophobicContact CD1-CD1 4.39Å; I156-L206 HydrophobicContact CD1-CD2 4.37Å; I156-L206 HydrophobicContact CD1-CG 4.43Å; I156-L206 HydrophobicContact CG1-CB 4.5Å; I156-L206 HydrophobicContact CG2-CD2 4.33Å; K202-L206 PolarHBondContact O-N 3.32Å; I203-L206 WeakPolarHBondContact O-CB 3.48Å; I203-L206 PolarHBondContact O-N 2.81Å; I203-L206 VanDerWaalsContact O-N 3.16Å; L206-S208 PolarHBondContact O-N 3.38Å; L206-R209 PolarHBondContact O-N 2.78Å; L206-M210 HydrophobicContact CD1-CE 3.84Å; L206-M210 HydrophobicContact CD1-CG 4.34Å; L206-M210 HydrophobicContact CD1-SD 4.42Å; L206-M210 HydrophobicContact CD2-CE 4.15Å; L206-M210 HydrophobicContact CG-CE 3.98Å; L206-M210 HydrophobicContact CG-SD 4.22Å; L206-M210 WeakPolarHBondContact O-CG 3.31Å; L206-M210 PolarHBondContact O-N 3.34Å; L206-Y262 HydrophobicContact CD1-CD1 3.93Å; L206-Y262 HydrophobicContact CD1-CD2 3.93Å; L206-Y262 HydrophobicContact CD1-CE1 4.24Å; L206-Y262 HydrophobicContact CD1-CE2 4.27Å; L206-Y262 HydrophobicContact CD1-CG 3.74Å; L206-Y262 HydrophobicContact CD2-CD1 3.51Å; L206-Y262 HydrophobicContact CD2-CE1 4.21Å; L206-Y262 HydrophobicContact CD2-CG 3.86Å; L206-Y262 HydrophobicContact CG-CD1 4.39Å; L206-Y262 HydrophobicContact CG-CG 4.47Å; L206-I320 HydrophobicContact CD2-CB 4.19Å; L206-I320 HydrophobicContact CD2-CD1 3.76Å; L206-I320 HydrophobicContact CD2-CG2 4.23Å
207	M	98.3	Very high	96	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.015	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-43	-179.5	-67.5	164.2	68.4	0	0	111.5	D194 I203 S204 F205 R209 M210 D211 A232	D194-M207 VanDerWaalsContact O-CE 3.29Å; D194-M207 WeakPolarHBondContact O-CE 3.15Å; I203-M207 HydrophobicContact CG2-SD 4.02Å; I203-M207 VanDerWaalsContact O-CG 3.32Å; I203-M207 WeakPolarHBondContact O-CG 3.34Å; I203-M207 PolarHBondContact O-N 3.41Å; S204-M207 PolarHBondContact O-N 3.41Å; F205-M207 VanDerWaalsContact C-N 3.29Å; F205-M207 PolarHBondContact O-N 3.18Å; M207-R209 VanDerWaalsContact C-N 3.32Å; M207-R209 PolarHBondContact O-N 2.88Å; M207-M210 PolarHBondContact O-N 3.3Å; M207-D211 WeakPolarHBondContact O-CB 3.46Å; M207-D211 PolarHBondContact O-N 2.89Å; M207-A232 HydrophobicContact CE-CB 3.99Å; M207-A232 HydrophobicContact CG-CB 4.06Å; M207-A232 HydrophobicContact SD-CB 3.58Å; M207-A232 VanDerWaalsContact SD-CB 3.58Å
208	S	97.9	Very high	96.1	Very high	48 Å²	48	46.8 Å²	46.8	34%	0.336	23%	0.234	S	C	.	.	H	α-helix	trans	-64.2	-37.5	176.6	71.3	0	0	0	0	112.1	S204 F205 L206 D211 D212	S204-S208 PolarHBondContact O-N 2.63Å; F205-S208 PolarHBondContact O-N 3Å; F205-S208 PolarHBondContact O-OG 3.29Å; L206-S208 PolarHBondContact O-N 3.38Å; S208-D211 PolarHBondContact O-N 2.82Å; S208-D212 WeakPolarHBondContact O-CB 3.28Å; S208-D212 PolarHBondContact O-N 2.92Å
209	R	98.2	Very high	96.4	Very high	62 Å²	62	45.4 Å²	45.4	23%	0.234	23%	0.234	C	C	.	.	H	α-helix	trans	-66.9	-38.4	175.5	-64.6	-53	-59.2	163.4	-10.2	113.1	P124 F147 L148 F205 L206 M207 D212 L213	P124-R209 VanDerWaalsContact CG-NH2 3.33Å; F147-R209 HydrophobicContact CE1-CB 4.18Å; F147-R209 HydrophobicContact CZ-CB 3.99Å; L148-R209 HydrophobicContact CD2-CB 3.98Å; L148-R209 HydrophobicContact CD2-CG 3.87Å; F205-R209 HydrophobicContact CD1-CG 4.25Å; F205-R209 HydrophobicContact CE1-CG 3.89Å; F205-R209 HydrophobicContact CE2-CG 4.34Å; F205-R209 HydrophobicContact CZ-CG 3.95Å; F205-R209 VanDerWaalsContact O-CG 3.3Å; F205-R209 WeakPolarHBondContact O-CG 3.45Å; F205-R209 PolarHBondContact O-N 3.41Å; L206-R209 PolarHBondContact O-N 2.78Å; M207-R209 VanDerWaalsContact C-N 3.32Å; M207-R209 PolarHBondContact O-N 2.88Å; R209-D212 IonicContact NH1-OD2 3.98Å; R209-D212 PolarHBondContact NH1-OD2 3.48Å; R209-D212 VanDerWaalsContact NH1-OD2 3.11Å; R209-L213 WeakPolarHBondContact O-CB 3.38Å; R209-L213 PolarHBondContact O-N 3.01Å
210	M	98.4	Very high	96.9	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-64	-43.2	171.6	-68.9	172.8	163.7	0	0	111.2	L206 M207 L213 I214 Y262 L297 V322 Y324	L206-M210 HydrophobicContact CD1-CE 3.84Å; L206-M210 HydrophobicContact CD1-CG 4.34Å; L206-M210 HydrophobicContact CD1-SD 4.42Å; L206-M210 HydrophobicContact CD2-CE 4.15Å; L206-M210 HydrophobicContact CG-CE 3.98Å; L206-M210 HydrophobicContact CG-SD 4.22Å; L206-M210 WeakPolarHBondContact O-CG 3.31Å; L206-M210 PolarHBondContact O-N 3.34Å; M207-M210 PolarHBondContact O-N 3.3Å; M210-L213 WeakPolarHBondContact O-CB 3.27Å; M210-L213 PolarHBondContact O-N 3.47Å; M210-I214 WeakPolarHBondContact O-CG1 3.25Å; M210-I214 PolarHBondContact O-N 3.39Å; M210-Y262 VanDerWaalsContact CE-CB 3.49Å; M210-Y262 HydrophobicContact CE-CG 4.47Å; M210-L297 HydrophobicContact CE-CD1 3.37Å; M210-L297 HydrophobicContact CG-CD1 4.15Å; M210-V322 HydrophobicContact SD-CG1 4.49Å; M210-V322 HydrophobicContact SD-CG2 3.69Å; M210-Y324 VanDerWaalsContact CB-OH 3.31Å; M210-Y324 WeakPolarHBondContact CB-OH 3.48Å; M210-Y324 PolarHBondContact O-OH 3.33Å
211	D	97.9	Very high	97.1	Very high	38 Å²	38	45.8 Å²	45.8	20%	0.203	23%	0.231	C	C	.	.	H	α-helix	trans	-65.1	-40.9	179.5	-68.6	-20.8	0	0	0	112.3	M207 S208 L213 I214 R215 R229 Y324	M207-D211 WeakPolarHBondContact O-CB 3.46Å; M207-D211 PolarHBondContact O-N 2.89Å; S208-D211 PolarHBondContact O-N 2.82Å; D211-L213 VanDerWaalsContact C-N 3.32Å; D211-L213 PolarHBondContact O-N 2.93Å; D211-I214 PolarHBondContact O-N 3.45Å; D211-R215 WeakPolarHBondContact O-CB 3.49Å; D211-R215 PolarHBondContact O-N 3.37Å; D211-R229 WeakPolarHBondContact OD1-CD 3.39Å; D211-R229 IonicContact OD1-CZ 3.3Å; D211-R229 IonicContact OD1-NE 2.69Å; D211-R229 PolarHBondContact OD1-NE 2.65Å; D211-R229 IonicContact OD1-NH2 3.47Å; D211-R229 IonicContact OD2-CZ 3.11Å; D211-R229 VanDerWaalsContact OD2-CZ 3.28Å; D211-R229 IonicContact OD2-NE 2.96Å; D211-R229 PolarHBondContact OD2-NE 3.25Å; D211-R229 IonicContact OD2-NH2 3.42Å; D211-R229 PolarHBondContact OD2-NH2 3.26Å; D211-Y324 PolarHBondContact N-OH 2.65Å; D211-Y324 VanDerWaalsContact OD1-CE1 3.29Å; D211-Y324 WeakPolarHBondContact OD1-CE1 3.49Å; D211-Y324 PolarHBondContact OD1-OH 3.3Å
212	D	97.1	Very high	96.9	Very high	40 Å²	40	42.2 Å²	42.2	21%	0.214	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-43.8	174.3	-72.8	-13.5	0	0	0	112	S208 R209 R215 H216	S208-D212 WeakPolarHBondContact O-CB 3.28Å; S208-D212 PolarHBondContact O-N 2.92Å; R209-D212 IonicContact NH1-OD2 3.98Å; R209-D212 PolarHBondContact NH1-OD2 3.48Å; R209-D212 VanDerWaalsContact NH1-OD2 3.11Å; D212-R215 PolarHBondContact O-N 2.74Å; D212-R215 IonicContact OD1-CZ 3.28Å; D212-R215 VanDerWaalsContact OD1-CZ 3.3Å; D212-R215 IonicContact OD1-NH1 2.97Å; D212-R215 PolarHBondContact OD1-NH1 2.58Å; D212-R215 IonicContact OD1-NH2 3.79Å; D212-R215 PolarHBondContact OD1-NH2 2.78Å; D212-H216 PolarHBondContact O-CD2 3.35Å; D212-H216 PolarHBondContact O-N 3.08Å
213	L	97.1	Very high	96.7	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-48	178.7	-166	67.7	0	0	0	111.4	L127 A128 I132 F147 R209 M210 D211 R215 H216 C217 L297	L127-L213 HydrophobicContact CB-CD1 4.31Å; L127-L213 HydrophobicContact CD2-CD1 3.85Å; L127-L213 HydrophobicContact CG-CD1 4.05Å; A128-L213 HydrophobicContact CB-CD1 4.14Å; I132-L213 HydrophobicContact CD1-CD1 3.6Å; I132-L213 HydrophobicContact CD1-CD2 3.3Å; I132-L213 HydrophobicContact CD1-CG 3.48Å; I132-L213 VanDerWaalsContact CD1-CG 3.48Å; F147-L213 HydrophobicContact CE2-CD2 4.11Å; F147-L213 HydrophobicContact CZ-CD2 4.31Å; R209-L213 WeakPolarHBondContact O-CB 3.38Å; R209-L213 PolarHBondContact O-N 3.01Å; M210-L213 WeakPolarHBondContact O-CB 3.27Å; M210-L213 PolarHBondContact O-N 3.47Å; D211-L213 VanDerWaalsContact C-N 3.32Å; D211-L213 PolarHBondContact O-N 2.93Å; L213-R215 VanDerWaalsContact C-N 3.33Å; L213-R215 PolarHBondContact O-N 3.1Å; L213-H216 PolarHBondContact O-N 2.82Å; L213-C217 PolarHBondContact O-N 2.9Å; L213-C217 PolarHBondContact O-SG 3.23Å; L213-L297 HydrophobicContact CD2-CD2 3.55Å
214	I	97.7	Very high	96.7	Very high	7 Å²	7	47.9 Å²	47.9	4%	0.036	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-35.8	178	-68.7	-59.3	0	0	0	111.7	M210 D211 H216 C217 N218 L221 I226 L299 Y324	M210-I214 WeakPolarHBondContact O-CG1 3.25Å; M210-I214 PolarHBondContact O-N 3.39Å; D211-I214 PolarHBondContact O-N 3.45Å; I214-H216 VanDerWaalsContact C-N 3.28Å; I214-H216 PolarHBondContact O-N 2.96Å; I214-C217 CarbonylContact O-C 3.6Å; I214-C217 WeakPolarHBondContact O-CA 3.14Å; I214-C217 WeakPolarHBondContact O-CB 3.33Å; I214-C217 PolarHBondContact O-N 3.38Å; I214-N218 PolarHBondContact O-N 2.99Å; I214-L221 HydrophobicContact CD1-CD1 4.31Å; I214-I226 HydrophobicContact CG2-CB 4.28Å; I214-I226 HydrophobicContact CG2-CD1 3.79Å; I214-I226 HydrophobicContact CG2-CG2 3.82Å; I214-L299 HydrophobicContact CD1-CD2 3.76Å; I214-Y324 HydrophobicContact CB-CD1 4.3Å; I214-Y324 HydrophobicContact CB-CE1 3.95Å; I214-Y324 HydrophobicContact CD1-CD2 4.33Å; I214-Y324 HydrophobicContact CD1-CE2 4.3Å; I214-Y324 HydrophobicContact CG1-CD1 4.2Å; I214-Y324 HydrophobicContact CG1-CD2 3.9Å; I214-Y324 HydrophobicContact CG1-CE1 3.87Å; I214-Y324 HydrophobicContact CG1-CE2 3.53Å; I214-Y324 HydrophobicContact CG1-CG 4.23Å; I214-Y324 HydrophobicContact CG2-CD1 3.82Å; I214-Y324 HydrophobicContact CG2-CE1 3.95Å; I214-Y324 HydrophobicContact CG2-CG 4.25Å
215	R	97.4	Very high	96.7	Very high	145 Å²	145	50 Å²	50	55%	0.547	27%	0.267	S	S	.	.	H	α-helix	trans	-58.7	-41	174.9	-165.1	-176.9	-49.2	103.6	7.5	111.9	D211 D212 L213 C217 N218	D211-R215 WeakPolarHBondContact O-CB 3.49Å; D211-R215 PolarHBondContact O-N 3.37Å; D212-R215 PolarHBondContact O-N 2.74Å; D212-R215 IonicContact OD1-CZ 3.28Å; D212-R215 VanDerWaalsContact OD1-CZ 3.3Å; D212-R215 IonicContact OD1-NH1 2.97Å; D212-R215 PolarHBondContact OD1-NH1 2.58Å; D212-R215 IonicContact OD1-NH2 3.79Å; D212-R215 PolarHBondContact OD1-NH2 2.78Å; L213-R215 VanDerWaalsContact C-N 3.33Å; L213-R215 PolarHBondContact O-N 3.1Å; R215-C217 VanDerWaalsContact C-N 3.29Å; R215-C217 PolarHBondContact O-N 3.46Å; R215-N218 PolarHBondContact O-N 3.31Å
216	H	97.3	Very high	96.7	Very high	66 Å²	66	46.2 Å²	46.2	31%	0.306	25%	0.251	S	S	.	.	H	α-helix	trans	-72.4	-20.8	175.3	-69.2	-58.3	0	0	0	113.8	A128 D212 L213 I214	A128-H216 HydrophobicContact CB-CB 3.5Å; A128-H216 VanDerWaalsContact CB-CB 3.5Å; D212-H216 PolarHBondContact O-CD2 3.35Å; D212-H216 PolarHBondContact O-N 3.08Å; L213-H216 PolarHBondContact O-N 2.82Å; I214-H216 VanDerWaalsContact C-N 3.28Å; I214-H216 PolarHBondContact O-N 2.96Å
217	C	96.5	Very high	96.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-87.6	-19	174.4	-60.7	0	0	0	0	113.5	A128 V133 L213 I214 R215 K220 L221	A128-C217 WeakPolarHBondContact CB-SG 3.46Å; V133-C217 HydrophobicContact CG2-CB 3.88Å; L213-C217 PolarHBondContact O-N 2.9Å; L213-C217 PolarHBondContact O-SG 3.23Å; I214-C217 CarbonylContact O-C 3.6Å; I214-C217 WeakPolarHBondContact O-CA 3.14Å; I214-C217 WeakPolarHBondContact O-CB 3.33Å; I214-C217 PolarHBondContact O-N 3.38Å; R215-C217 VanDerWaalsContact C-N 3.29Å; R215-C217 PolarHBondContact O-N 3.46Å; C217-K220 WeakPolarHBondContact O-CA 3.27Å; C217-K220 WeakPolarHBondContact O-CB 3.43Å; C217-K220 PolarHBondContact O-N 2.82Å; C217-L221 HydrophobicContact CB-CD1 3.56Å; C217-L221 HydrophobicContact CB-CD2 4.44Å; C217-L221 HydrophobicContact CB-CG 3.79Å; C217-L221 PolarHBondContact O-N 3.08Å
218	N	92.7	Very high	96.5	Very high	63 Å²	63	52.1 Å²	52.1	34%	0.337	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	138.9	-169.9	-157.8	13.3	0	0	0	111.8	I214 R215 K220 I226	I214-N218 PolarHBondContact O-N 2.99Å; R215-N218 PolarHBondContact O-N 3.31Å; N218-K220 PolarHBondContact O-N 2.92Å; N218-I226 PolarHBondContact ND2-O 2.55Å; N218-I226 PolarHBondContact OD1-N 2.92Å
219	G	93	Very high	96.6	Very high	60 Å²	60	52.9 Å²	52.9	62%	0.619	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	1	-172.3	0	0	0	0	0	115.2
220	K	96.8	Very high	96.6	Very high	107 Å²	107	51 Å²	51	47%	0.465	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-5.6	176.6	-54.5	175.1	-176.7	170.5	0	113.5	V133 N137 C217 N218 G222	V133-K220 HydrophobicContact CB-CB 4.48Å; V133-K220 HydrophobicContact CG1-CB 3.75Å; V133-K220 HydrophobicContact CG2-CB 3.85Å; V133-K220 HydrophobicContact CG2-CD 4.49Å; N137-K220 PolarHBondContact ND2-O 2.91Å; N137-K220 PolarHBondContact OD1-O 2.91Å; C217-K220 WeakPolarHBondContact O-CA 3.27Å; C217-K220 WeakPolarHBondContact O-CB 3.43Å; C217-K220 PolarHBondContact O-N 2.82Å; N218-K220 PolarHBondContact O-N 2.92Å; K220-G222 PolarHBondContact O-N 2.9Å
221	L	96.4	Very high	96.5	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	30%	0.297	C	S	.	.	S	Bend	trans	-93.6	89.8	178	-76.1	180	0	0	0	109.5	V133 M136 I214 C217 N223 Y224 I226 V258 W301	V133-L221 HydrophobicContact CG2-CD2 4.21Å; V133-L221 HydrophobicContact CG2-CG 4.48Å; M136-L221 HydrophobicContact CB-CD2 3.61Å; M136-L221 HydrophobicContact CG-CD2 4Å; I214-L221 HydrophobicContact CD1-CD1 4.31Å; C217-L221 HydrophobicContact CB-CD1 3.56Å; C217-L221 HydrophobicContact CB-CD2 4.44Å; C217-L221 HydrophobicContact CB-CG 3.79Å; C217-L221 PolarHBondContact O-N 3.08Å; L221-N223 PolarHBondContact O-N 2.84Å; L221-Y224 WeakPolarHBondContact O-CD2 3.31Å; L221-Y224 PolarHBondContact O-N 2.76Å; L221-I226 HydrophobicContact CD1-CD1 4.08Å; L221-V258 HydrophobicContact CD1-CG2 4.49Å; L221-W301 HydrophobicContact CB-CH2 3.79Å; L221-W301 HydrophobicContact CB-CZ3 4.26Å; L221-W301 HydrophobicContact CD2-CH2 4.11Å; L221-W301 HydrophobicContact CG-CH2 4.45Å
222	G	93	Very high	96.6	Very high	35 Å²	35	53.6 Å²	53.6	36%	0.361	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	-134.4	-170.1	0	0	0	0	0	111.6	N137 K220	N137-G222 PolarHBondContact OD1-N 3.47Å; K220-G222 PolarHBondContact O-N 2.9Å
223	N	93.9	Very high	96.6	Very high	167 Å²	167	52.4 Å²	52.4	89%	0.893	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	24.4	177.6	-64	-2.5	0	0	0	112.3	L221	L221-N223 PolarHBondContact O-N 2.84Å
224	Y	97.3	Very high	96.7	Very high	38 Å²	38	52.3 Å²	52.3	15%	0.149	28%	0.281	C	S	.	.			trans	-86.6	141.6	-176.9	-65.8	-59.9	0	0	0	112.7	L221 C257 W301 D303 R305 D326	L221-Y224 WeakPolarHBondContact O-CD2 3.31Å; L221-Y224 PolarHBondContact O-N 2.76Å; Y224-C257 HydrophobicContact CD1-CB 3.81Å; Y224-C257 HydrophobicContact CD2-CB 4.16Å; Y224-C257 HydrophobicContact CE1-CB 3.76Å; Y224-C257 HydrophobicContact CE2-CB 4.12Å; Y224-C257 HydrophobicContact CG-CB 4Å; Y224-W301 HydrophobicContact CD2-CE3 4.21Å; Y224-W301 HydrophobicContact CD2-CH2 4.14Å; Y224-W301 AromaticContact CD2-CZ3 3.59Å; Y224-W301 HydrophobicContact CD2-CZ3 3.59Å; Y224-W301 AromaticContact CE2-CE3 3.78Å; Y224-W301 HydrophobicContact CE2-CE3 3.78Å; Y224-W301 HydrophobicContact CE2-CH2 4.27Å; Y224-W301 AromaticContact CE2-CZ3 3.62Å; Y224-W301 HydrophobicContact CE2-CZ3 3.62Å; Y224-D303 PolarHBondContact OH-OD2 2.84Å; Y224-R305 PolarHBondContact OH-NH2 3.22Å; Y224-D326 WeakPolarHBondContact CA-OD1 3.39Å; Y224-D326 HydrophobicContact CD1-CB 3.67Å; Y224-D326 HydrophobicContact CE1-CB 4.26Å
225	T	97.8	Very high	96.7	Very high	76 Å²	76	52.1 Å²	52.1	47%	0.466	28%	0.28	S	S	.	.			trans	-110.2	97.9	168.1	-60.4	0	0	0	0	108.5	N227 D326 A327	T225-N227 PolarHBondContact O-N 2.91Å; T225-D326 PolarHBondContact N-OD1 3.26Å; T225-A327 HydrophobicContact CG2-CB 4.32Å; T225-A327 WeakPolarHBondContact O-CB 3.49Å; T225-A327 PolarHBondContact O-N 3.47Å
226	I	98.1	Very high	96.7	Very high	12 Å²	12	45.2 Å²	45.2	6%	0.062	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	121.7	-176.3	-60.1	173	0	0	0	109.5	I214 N218 L221 V258 Y324 F325	I214-I226 HydrophobicContact CG2-CB 4.28Å; I214-I226 HydrophobicContact CG2-CD1 3.79Å; I214-I226 HydrophobicContact CG2-CG2 3.82Å; N218-I226 PolarHBondContact ND2-O 2.55Å; N218-I226 PolarHBondContact OD1-N 2.92Å; L221-I226 HydrophobicContact CD1-CD1 4.08Å; I226-V258 HydrophobicContact CD1-CG2 4.23Å; I226-Y324 HydrophobicContact CG2-CD1 3.77Å; I226-Y324 HydrophobicContact CG2-CG 4.19Å; I226-F325 WeakPolarHBondContact CA-O 3.3Å
227	N	96.9	Very high	96.7	Very high	104 Å²	104	42.6 Å²	42.6	56%	0.556	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	4.2	-177.2	74.8	-8.6	0	0	0	114.7	T225 F325 A327	T225-N227 PolarHBondContact O-N 2.91Å; N227-F325 PolarHBondContact N-O 3.27Å; N227-A327 HydrophobicContact CB-CB 4.22Å; N227-A327 VanDerWaalsContact ND2-CB 3.29Å; N227-A327 WeakPolarHBondContact ND2-CB 3.37Å
228	G	96.1	Very high	96.6	Very high	22 Å²	22	44.6 Å²	44.6	23%	0.227	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	177.3	178.3	0	0	0	0	0	112.2	Y324 F325	G228-Y324 WeakPolarHBondContact O-CA 3.42Å; G228-F325 PolarHBondContact O-N 3.29Å
229	R	98.4	Very high	96.7	Very high	65 Å²	65	41.6 Å²	41.6	25%	0.245	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	171.3	174.2	57.5	158.3	175.7	74.2	6	111.6	D211 W323 Y324 F325	D211-R229 WeakPolarHBondContact OD1-CD 3.39Å; D211-R229 IonicContact OD1-CZ 3.3Å; D211-R229 IonicContact OD1-NE 2.69Å; D211-R229 PolarHBondContact OD1-NE 2.65Å; D211-R229 IonicContact OD1-NH2 3.47Å; D211-R229 IonicContact OD2-CZ 3.11Å; D211-R229 VanDerWaalsContact OD2-CZ 3.28Å; D211-R229 IonicContact OD2-NE 2.96Å; D211-R229 PolarHBondContact OD2-NE 3.25Å; D211-R229 IonicContact OD2-NH2 3.42Å; D211-R229 PolarHBondContact OD2-NH2 3.26Å; R229-W323 CarbonylContact C-O 3.54Å; R229-W323 WeakPolarHBondContact CA-O 3.37Å; R229-W323 WeakPolarHBondContact CB-O 3.07Å; R229-Y324 HydrophobicContact CB-CD1 3.66Å; R229-Y324 HydrophobicContact CB-CE1 3.81Å; R229-Y324 HydrophobicContact CB-CG 4.12Å; R229-Y324 HydrophobicContact CG-CD1 4.31Å; R229-Y324 HydrophobicContact CG-CE1 3.98Å; R229-F325 VanDerWaalsContact C-CE2 3.49Å
230	T	98.1	Very high	96.8	Very high	23 Å²	23	46 Å²	46	14%	0.141	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-68.3	168.8	167.1	62.5	0	0	0	0	111.6	W323 F325	T230-W323 HydrophobicContact CG2-CB 4.03Å; T230-W323 HydrophobicContact CG2-CE3 4.16Å; T230-W323 PolarHBondContact N-O 3.39Å; T230-W323 PolarHBondContact OG1-N 3.42Å; T230-W323 VanDerWaalsContact OG1-N 3.08Å; T230-F325 HydrophobicContact CG2-CE1 4.48Å; T230-F325 HydrophobicContact CG2-CE2 3.92Å; T230-F325 HydrophobicContact CG2-CZ 3.56Å
231	K	97.8	Very high	96.8	Very high	93 Å²	93	42.1 Å²	42.1	40%	0.404	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-57.3	163.1	154.3	-67.3	-170.3	178.9	-158.5	0	110.4	W192 I193 D194 M233	W192-K231 HydrophobicContact CE3-CB 4Å; W192-K231 WeakPolarHBondContact CZ3-O 3.27Å; I193-K231 WeakPolarHBondContact O-CB 3.44Å; D194-K231 HydrophobicContact CB-CD 4.04Å; D194-K231 VanDerWaalsContact CG-NZ 3.29Å; D194-K231 WeakPolarHBondContact OD2-CE 3.4Å; D194-K231 IonicContact OD2-NZ 3.81Å; D194-K231 PolarHBondContact OD2-NZ 2.96Å; K231-M233 PolarHBondContact O-N 3.37Å
232	A	98.3	Very high	96.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122	175.7	0	0	0	0	0	110.4	W192 I193 M207 I320 V322	W192-A232 CarbonylContact C-O 3.52Å; W192-A232 WeakPolarHBondContact CA-O 3.19Å; I193-A232 HydrophobicContact CB-CB 4.49Å; I193-A232 PolarHBondContact N-O 3.35Å; I193-A232 PolarHBondContact O-N 3.42Å; M207-A232 HydrophobicContact CE-CB 3.99Å; M207-A232 HydrophobicContact CG-CB 4.06Å; M207-A232 HydrophobicContact SD-CB 3.58Å; M207-A232 VanDerWaalsContact SD-CB 3.58Å; A232-I320 HydrophobicContact CB-CG2 3.85Å; A232-V322 HydrophobicContact CB-CG1 3.97Å
233	M	98.1	Very high	96.8	Very high	15 Å²	15	42.7 Å²	42.7	7%	0.074	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	105.8	169.1	-171.5	-173.8	76.4	0	0	108.6	I190 W192 K231 A235 I320 T321 W323	I190-M233 HydrophobicContact CB-CG 4.02Å; I190-M233 HydrophobicContact CB-SD 4.39Å; I190-M233 HydrophobicContact CD1-CG 4.22Å; I190-M233 HydrophobicContact CD1-SD 3.95Å; I190-M233 HydrophobicContact CG2-CE 4.38Å; I190-M233 HydrophobicContact CG2-CG 4.09Å; I190-M233 HydrophobicContact CG2-SD 3.97Å; W192-M233 HydrophobicContact CD2-CB 4.26Å; W192-M233 HydrophobicContact CD2-CG 4.45Å; W192-M233 HydrophobicContact CE3-CB 3.89Å; W192-M233 HydrophobicContact CH2-CB 3.91Å; W192-M233 HydrophobicContact CH2-CG 4.32Å; W192-M233 HydrophobicContact CH2-SD 4.4Å; W192-M233 HydrophobicContact CZ2-CB 4.23Å; W192-M233 HydrophobicContact CZ2-CG 4.16Å; W192-M233 HydrophobicContact CZ2-SD 4.14Å; W192-M233 HydrophobicContact CZ3-CB 3.72Å; K231-M233 PolarHBondContact O-N 3.37Å; M233-A235 HydrophobicContact CE-CB 4.36Å; M233-I320 WeakPolarHBondContact O-CA 3.39Å; M233-T321 PolarHBondContact N-O 3.02Å; M233-T321 PolarHBondContact O-N 3.07Å; M233-W323 HydrophobicContact CB-CH2 4.22Å; M233-W323 HydrophobicContact CB-CZ3 3.87Å; M233-W323 HydrophobicContact CE-CH2 3.64Å; M233-W323 HydrophobicContact CE-CZ2 4.49Å; M233-W323 HydrophobicContact CE-CZ3 4.45Å; M233-W323 HydrophobicContact SD-CH2 3.75Å; M233-W323 HydrophobicContact SD-CZ3 4.22Å
234	V	98.2	Very high	97	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	121.7	172.2	-174.7	0	0	0	0	107.8	V160 F169 I190 T191 I193 I203 I320	V160-V234 HydrophobicContact CB-CG1 4.26Å; V160-V234 HydrophobicContact CG1-CG1 3.69Å; V160-V234 HydrophobicContact CG2-CG1 3.71Å; F169-V234 HydrophobicContact CE1-CG1 4.21Å; F169-V234 HydrophobicContact CZ-CB 4.32Å; F169-V234 HydrophobicContact CZ-CG1 3.7Å; I190-V234 CarbonylContact C-O 3.5Å; I190-V234 WeakPolarHBondContact CA-O 3.46Å; T191-V234 HydrophobicContact CG2-CB 3.99Å; T191-V234 HydrophobicContact CG2-CG2 4.48Å; T191-V234 PolarHBondContact N-O 3.29Å; T191-V234 PolarHBondContact O-N 3.26Å; I193-V234 HydrophobicContact CB-CG2 4.48Å; I193-V234 HydrophobicContact CG1-CG2 3.71Å; I203-V234 HydrophobicContact CD1-CG2 4.36Å; V234-I320 HydrophobicContact CG1-CG1 4.32Å; V234-I320 HydrophobicContact CG2-CD1 4.48Å; V234-I320 HydrophobicContact CG2-CG1 4.19Å; V234-I320 HydrophobicContact CG2-CG2 4.48Å
235	A	97.9	Very high	96.9	Very high	3 Å²	3	37.8 Å²	37.8	3%	0.025	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	143.7	-177.3	0	0	0	0	0	111.9	K189 I190 M233 Y237 Y318 A319	K189-A235 CarbonylContact O-C 3.4Å; K189-A235 WeakPolarHBondContact O-CA 3.41Å; I190-A235 HydrophobicContact CG2-CB 4.01Å; M233-A235 HydrophobicContact CE-CB 4.36Å; A235-Y237 HydrophobicContact CB-CE2 4.43Å; A235-Y318 WeakPolarHBondContact O-CA 3.45Å; A235-A319 PolarHBondContact N-O 2.96Å; A235-A319 PolarHBondContact O-N 2.93Å; A235-A319 VanDerWaalsContact O-N 3.1Å
236	C	98	Very high	96.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	114	175	177.2	0	0	0	0	109	Y164 F169 D188 K189 R317 Y318	Y164-C236 HydrophobicContact CD2-CB 3.97Å; Y164-C236 HydrophobicContact CE2-CB 3.92Å; Y164-C236 WeakPolarHBondContact CE2-SG 3.26Å; F169-C236 HydrophobicContact CD1-CB 4.02Å; F169-C236 HydrophobicContact CE1-CB 3.72Å; D188-C236 WeakPolarHBondContact CA-O 3.49Å; K189-C236 PolarHBondContact N-O 2.69Å; K189-C236 PolarHBondContact O-N 3.31Å; C236-R317 WeakPolarHBondContact CA-O 3.5Å; C236-Y318 HydrophobicContact CB-CD1 3.76Å; C236-Y318 HydrophobicContact CB-CE1 3.56Å; C236-Y318 WeakPolarHBondContact SG-CE1 3.02Å
237	Y	97.4	Very high	96.7	Very high	11 Å²	11	40.7 Å²	40.7	4%	0.043	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	113.5	165.4	-66.8	-106.4	0	0	0	106.6	D188 A235 G239 V310 T316 R317	D188-Y237 HydrophobicContact CB-CD1 3.81Å; D188-Y237 HydrophobicContact CB-CD2 3.73Å; D188-Y237 HydrophobicContact CB-CE1 3.67Å; D188-Y237 HydrophobicContact CB-CE2 3.56Å; D188-Y237 HydrophobicContact CB-CG 3.82Å; A235-Y237 HydrophobicContact CB-CE2 4.43Å; Y237-G239 PolarHBondContact O-N 2.95Å; Y237-V310 HydrophobicContact CD1-CG1 4.46Å; Y237-V310 HydrophobicContact CE1-CB 4.36Å; Y237-V310 HydrophobicContact CE1-CG1 4.07Å; Y237-T316 CarbonylContact O-C 3.56Å; Y237-T316 WeakPolarHBondContact O-CA 3.38Å; Y237-R317 PolarHBondContact N-O 3.38Å; Y237-R317 PolarHBondContact O-N 3.44Å
238	P	95.4	Very high	96.7	Very high	41 Å²	41	37.2 Å²	37.2	27%	0.266	20%	0.2	S	C	.	.			trans	-75.9	8.3	-169.3	31.4	-37.2	0	0	0	114.4	G187 T242	G187-P238 WeakPolarHBondContact O-CD 3.37Å; P238-T242 HydrophobicContact CG-CG2 4.23Å
239	G	94.8	Very high	96.8	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.01	19%	0.193	C	C	.	.	S	Bend	trans	88.3	-148.8	-171.8	0	0	0	0	0	112.1	Y237 G241 T242 A313	Y237-G239 PolarHBondContact O-N 2.95Å; G239-G241 PolarHBondContact O-N 3.05Å; G239-T242 WeakPolarHBondContact O-CB 3.35Å; G239-T242 VanDerWaalsContact O-CG2 3.3Å; G239-T242 WeakPolarHBondContact O-CG2 3.19Å; G239-T242 PolarHBondContact O-N 3.47Å; G239-T242 PolarHBondContact O-OG1 3.21Å; G239-A313 CarbonylContact C-O 3.57Å; G239-A313 WeakPolarHBondContact CA-O 3.41Å
240	N	94.3	Very high	96.7	Very high	151 Å²	151	34 Å²	34	81%	0.807	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	30.7	177.7	-58.1	-31.9	0	0	0	115.1	T242 A313	N240-T242 VanDerWaalsContact C-N 3.26Å; N240-T242 PolarHBondContact O-N 2.74Å; N240-A313 PolarHBondContact N-O 3.25Å
241	G	95.9	Very high	96.5	Very high	27 Å²	27	35 Å²	35	28%	0.278	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	11.7	-178.9	0	0	0	0	0	114	G239 P312 A313	G239-G241 PolarHBondContact O-N 3.05Å; G241-P312 WeakPolarHBondContact O-CB 3.45Å; G241-A313 WeakPolarHBondContact CA-O 3.08Å; G241-A313 PolarHBondContact N-O 2.92Å
242	T	95.8	Very high	96.3	Very high	32 Å²	32	36.9 Å²	36.9	20%	0.196	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	140.6	173.6	53.9	0	0	0	0	110.6	G187 P238 G239 N240 A313	G187-T242 WeakPolarHBondContact O-CG2 3.46Å; P238-T242 HydrophobicContact CG-CG2 4.23Å; G239-T242 WeakPolarHBondContact O-CB 3.35Å; G239-T242 VanDerWaalsContact O-CG2 3.3Å; G239-T242 WeakPolarHBondContact O-CG2 3.19Å; G239-T242 PolarHBondContact O-N 3.47Å; G239-T242 PolarHBondContact O-OG1 3.21Å; N240-T242 VanDerWaalsContact C-N 3.26Å; N240-T242 PolarHBondContact O-N 2.74Å; T242-A313 PolarHBondContact O-N 2.99Å
243	G	95.3	Very high	96.1	Very high	15 Å²	15	38.5 Å²	38.5	16%	0.155	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	-165.6	-179.6	0	0	0	0	0	111	R186 G187 V310	R186-G243 WeakPolarHBondContact CA-O 3.08Å; G187-G243 PolarHBondContact N-O 3.19Å; G243-V310 WeakPolarHBondContact CA-O 3.44Å
244	Y	96.5	Very high	95.9	Very high	31 Å²	31	39 Å²	39	12%	0.122	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	118.7	173.1	-160.6	148.9	0	0	0	107.5	L174 I185 R186 H247 E309 V310	L174-Y244 WeakPolarHBondContact CD2-OH 3.14Å; I185-Y244 HydrophobicContact CG2-CE2 3.96Å; I185-Y244 WeakPolarHBondContact O-CA 3.44Å; I185-Y244 WeakPolarHBondContact O-CD2 3.38Å; R186-Y244 HydrophobicContact CB-CD1 3.73Å; R186-Y244 HydrophobicContact CB-CD2 3.98Å; R186-Y244 HydrophobicContact CB-CE1 3.97Å; R186-Y244 HydrophobicContact CB-CE2 4.18Å; R186-Y244 HydrophobicContact CB-CG 3.76Å; R186-Y244 HydrophobicContact CG-CE1 4.48Å; Y244-H247 AromaticContact CD1-CE1 3.74Å; Y244-H247 AromaticContact CD2-CE1 3.52Å; Y244-H247 AromaticContact CD2-ND1 3.38Å; Y244-H247 WeakPolarHBondContact CD2-ND1 3.23Å; Y244-H247 AromaticContact CE1-CE1 3.75Å; Y244-H247 AromaticContact CE1-NE2 3.84Å; Y244-H247 HydrophobicContact CE2-CB 4.36Å; Y244-H247 AromaticContact CE2-CE1 3.56Å; Y244-H247 AromaticContact CE2-CG 3.75Å; Y244-H247 AromaticContact CE2-ND1 3.36Å; Y244-H247 WeakPolarHBondContact CE2-ND1 3.44Å; Y244-H247 AromaticContact CG-CE1 3.62Å; Y244-H247 AromaticContact CG-ND1 3.94Å; Y244-H247 AromaticContact CZ-CE1 3.67Å; Y244-H247 AromaticContact CZ-ND1 3.89Å; Y244-H247 AromaticContact CZ-NE2 3.72Å; Y244-E309 WeakPolarHBondContact O-CA 3.46Å; Y244-E309 WeakPolarHBondContact O-CB 3.37Å; Y244-V310 PolarHBondContact N-O 2.92Å; Y244-V310 PolarHBondContact O-N 3.34Å
245	V	95.4	Very high	95.8	Very high	71 Å²	71	39 Å²	39	43%	0.43	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53	157.2	175.2	-55.3	0	0	0	0	112.2	I185 H247	I185-V245 HydrophobicContact CB-CG2 4.34Å; I185-V245 HydrophobicContact CG2-CG2 3.66Å; I185-V245 WeakPolarHBondContact O-CG2 3.29Å; I185-V245 PolarHBondContact O-N 3.26Å; V245-H247 PolarHBondContact O-N 3.21Å; V245-H247 PolarHBondContact O-ND1 3.47Å
246	R	96.3	Very high	95.9	Very high	114 Å²	114	40.3 Å²	40.3	43%	0.43	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	127.1	177.9	-171.1	175	173.8	171.8	-0.3	112.5	F280 P307 H308 E309	R246-F280 HydrophobicContact CG-CD2 4.44Å; R246-F280 HydrophobicContact CG-CE2 4.33Å; R246-P307 HydrophobicContact CG-CB 4.5Å; R246-H308 CarbonylContact C-O 3.48Å; R246-H308 VanDerWaalsContact CA-O 3.28Å; R246-H308 WeakPolarHBondContact CA-O 3.4Å; R246-E309 HydrophobicContact CB-CB 4.04Å
247	H	96.1	Very high	95.9	Very high	36 Å²	36	40.4 Å²	40.4	17%	0.167	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	174.4	180	63.2	-75.5	0	0	0	111.7	Y244 V245 D249 P307 H308	Y244-H247 AromaticContact CD1-CE1 3.74Å; Y244-H247 AromaticContact CD2-CE1 3.52Å; Y244-H247 AromaticContact CD2-ND1 3.38Å; Y244-H247 WeakPolarHBondContact CD2-ND1 3.23Å; Y244-H247 AromaticContact CE1-CE1 3.75Å; Y244-H247 AromaticContact CE1-NE2 3.84Å; Y244-H247 HydrophobicContact CE2-CB 4.36Å; Y244-H247 AromaticContact CE2-CE1 3.56Å; Y244-H247 AromaticContact CE2-CG 3.75Å; Y244-H247 AromaticContact CE2-ND1 3.36Å; Y244-H247 WeakPolarHBondContact CE2-ND1 3.44Å; Y244-H247 AromaticContact CG-CE1 3.62Å; Y244-H247 AromaticContact CG-ND1 3.94Å; Y244-H247 AromaticContact CZ-CE1 3.67Å; Y244-H247 AromaticContact CZ-ND1 3.89Å; Y244-H247 AromaticContact CZ-NE2 3.72Å; V245-H247 PolarHBondContact O-N 3.21Å; V245-H247 PolarHBondContact O-ND1 3.47Å; H247-D249 IonicContact CD2-OD1 2.62Å; H247-D249 IonicContact NE2-OD1 2.74Å; H247-P307 CarbonylContact O-C 3.45Å; H247-P307 VanDerWaalsContact O-CA 3.26Å; H247-P307 WeakPolarHBondContact O-CA 3.49Å; H247-H308 AromaticContact CD2-NE2 3.99Å; H247-H308 AromaticContact CE1-CD2 3.81Å; H247-H308 AromaticContact CE1-NE2 3.61Å; H247-H308 PolarHBondContact N-O 2.92Å; H247-H308 PolarHBondContact ND1-O 2.88Å; H247-H308 AromaticContact NE2-CD2 3.99Å; H247-H308 AromaticContact NE2-CE1 3.97Å; H247-H308 AromaticContact NE2-NE2 3.32Å; H247-H308 PolarHBondContact NE2-NE2 2.84Å; H247-H308 PolarHBondContact O-N 3.1Å
248	V	97.4	Very high	95.9	Very high	31 Å²	31	39.9 Å²	39.9	19%	0.188	23%	0.226	C	C	.	.			trans	-118.3	135.8	168.7	172.8	0	0	0	0	106.3	P251 D303 R304 P307	V248-P251 HydrophobicContact CB-CB 4.25Å; V248-P251 HydrophobicContact CG1-CB 4.27Å; V248-P251 WeakPolarHBondContact O-CD 3.42Å; V248-D303 VanDerWaalsContact CG1-C 3.43Å; V248-D303 WeakPolarHBondContact CG1-O 3.31Å; V248-R304 HydrophobicContact CG1-CG 4.28Å; V248-P307 HydrophobicContact CG2-CB 4.03Å; V248-P307 HydrophobicContact CG2-CG 3.93Å
249	D	97.4	Very high	96.1	Very high	15 Å²	15	38 Å²	38	8%	0.08	21%	0.214	C	C	.	.	S	Bend	trans	-64.7	-51.8	-177.6	-89.2	-18.4	0	0	0	110.7	H247 P251 R256 T259 S302 H308 W323	H247-D249 IonicContact CD2-OD1 2.62Å; H247-D249 IonicContact NE2-OD1 2.74Å; D249-P251 VanDerWaalsContact O-CD 3.27Å; D249-P251 WeakPolarHBondContact O-CD 3.29Å; D249-R256 PolarHBondContact O-NH1 3.43Å; D249-R256 PolarHBondContact O-NH2 3.35Å; D249-T259 WeakPolarHBondContact OD2-CB 3.42Å; D249-T259 VanDerWaalsContact OD2-CG2 3.27Å; D249-T259 WeakPolarHBondContact OD2-CG2 3.5Å; D249-T259 PolarHBondContact OD2-OG1 2.95Å; D249-S302 WeakPolarHBondContact CB-O 3.47Å; D249-S302 PolarHBondContact N-O 3.13Å; D249-H308 IonicContact OD1-CE1 3.83Å; D249-H308 IonicContact OD1-NE2 2.79Å; D249-H308 IonicContact OD2-CE1 3.07Å; D249-W323 PolarHBondContact OD2-NE1 2.61Å
250	N	97.1	Very high	96.3	Very high	4 Å²	4	38 Å²	38	2%	0.021	21%	0.214	C	C	.	.	S	Bend	trans	-117.2	79.4	178.8	-178.8	12.7	0	0	0	111.4	G253 D254 R256 S302 E329	N250-G253 VanDerWaalsContact OD1-CA 3.25Å; N250-G253 WeakPolarHBondContact OD1-CA 3.45Å; N250-G253 PolarHBondContact OD1-N 2.92Å; N250-D254 PolarHBondContact OD1-N 2.74Å; N250-D254 PolarHBondContact OD1-OD1 3.49Å; N250-R256 HydrophobicContact CB-CB 4.18Å; N250-R256 WeakPolarHBondContact CB-O 3.21Å; N250-R256 PolarHBondContact ND2-N 2.88Å; N250-R256 PolarHBondContact ND2-O 2.88Å; N250-S302 PolarHBondContact N-O 3.45Å; N250-E329 PolarHBondContact ND2-OE1 3.05Å
251	P	93.4	Very high	96.5	Very high	45 Å²	45	31.5 Å²	31.5	29%	0.292	18%	0.179	S	C	.	.	S	Bend	trans	-77.6	-21.3	-177.8	29.4	-33.3	0	0	0	113.5	V248 D249 R304	V248-P251 HydrophobicContact CB-CB 4.25Å; V248-P251 HydrophobicContact CG1-CB 4.27Å; V248-P251 WeakPolarHBondContact O-CD 3.42Å; D249-P251 VanDerWaalsContact O-CD 3.27Å; D249-P251 WeakPolarHBondContact O-CD 3.29Å; P251-R304 VanDerWaalsContact O-CZ 3.31Å; P251-R304 PolarHBondContact O-NE 2.92Å; P251-R304 PolarHBondContact O-NH2 3.21Å
252	N	92.6	Very high	96.7	Very high	132 Å²	132	30.2 Å²	30.2	71%	0.706	17%	0.166	S	C	*	.	S	Bend	trans	-124.2	10.3	-164.4	-62.9	-36.2	0	0	0	114
253	G	94.1	Very high	96.8	Very high	33 Å²	33	28.7 Å²	28.7	34%	0.34	16%	0.156	S	C	.	.			trans	73.2	51.9	177.5	0	0	0	0	0	113.5	N250 G255 E329	N250-G253 VanDerWaalsContact OD1-CA 3.25Å; N250-G253 WeakPolarHBondContact OD1-CA 3.45Å; N250-G253 PolarHBondContact OD1-N 2.92Å; G253-G255 PolarHBondContact O-N 3.13Å; G253-E329 VanDerWaalsContact C-OE1 3.25Å; G253-E329 WeakPolarHBondContact CA-OE1 3.3Å
254	D	94.3	Very high	97	Very high	25 Å²	25	28 Å²	28	13%	0.134	15%	0.149	C	C	.	.			trans	-81	-0.9	177.2	71	21	0	0	0	114.2	N250 R256 R330	N250-D254 PolarHBondContact OD1-N 2.74Å; N250-D254 PolarHBondContact OD1-OD1 3.49Å; D254-R256 WeakPolarHBondContact OD1-CB 3.43Å; D254-R256 VanDerWaalsContact OD1-CG 3.31Å; D254-R256 WeakPolarHBondContact OD1-CG 2.92Å; D254-R256 PolarHBondContact OD1-N 3.02Å; D254-R256 IonicContact OD1-NE 3.93Å; D254-R256 PolarHBondContact OD1-NE 3.2Å; D254-R256 VanDerWaalsContact OD1-NE 3.1Å; D254-R256 IonicContact OD2-CZ 3.61Å; D254-R256 VanDerWaalsContact OD2-CZ 3.24Å; D254-R256 IonicContact OD2-NE 2.67Å; D254-R256 PolarHBondContact OD2-NE 2.87Å; D254-R256 IonicContact OD2-NH2 2.67Å; D254-R256 PolarHBondContact OD2-NH2 3.05Å; D254-R330 WeakPolarHBondContact O-CD 3.47Å; D254-R330 PolarHBondContact O-NH1 2.9Å
255	G	97.4	Very high	97.1	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	103	-13.8	179.1	0	0	0	0	0	114.9	G253 C257 F325 D326 E329	G253-G255 PolarHBondContact O-N 3.13Å; G255-C257 PolarHBondContact O-N 2.8Å; G255-F325 CarbonylContact O-C 3.51Å; G255-F325 VanDerWaalsContact O-CA 3.27Å; G255-F325 WeakPolarHBondContact O-CA 3.5Å; G255-D326 PolarHBondContact O-N 2.94Å; G255-E329 VanDerWaalsContact CA-OE1 3.3Å; G255-E329 WeakPolarHBondContact CA-OE1 3.38Å; G255-E329 PolarHBondContact N-OE1 3.35Å
256	R	98.4	Very high	97.2	Very high	32 Å²	32	29.5 Å²	29.5	12%	0.121	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	120.1	178.8	-67.3	178.7	-74.6	158	-6.3	110	D249 N250 D254 S302 W323 Y324 F325	D249-R256 PolarHBondContact O-NH1 3.43Å; D249-R256 PolarHBondContact O-NH2 3.35Å; N250-R256 HydrophobicContact CB-CB 4.18Å; N250-R256 WeakPolarHBondContact CB-O 3.21Å; N250-R256 PolarHBondContact ND2-N 2.88Å; N250-R256 PolarHBondContact ND2-O 2.88Å; D254-R256 WeakPolarHBondContact OD1-CB 3.43Å; D254-R256 VanDerWaalsContact OD1-CG 3.31Å; D254-R256 WeakPolarHBondContact OD1-CG 2.92Å; D254-R256 PolarHBondContact OD1-N 3.02Å; D254-R256 IonicContact OD1-NE 3.93Å; D254-R256 PolarHBondContact OD1-NE 3.2Å; D254-R256 VanDerWaalsContact OD1-NE 3.1Å; D254-R256 IonicContact OD2-CZ 3.61Å; D254-R256 VanDerWaalsContact OD2-CZ 3.24Å; D254-R256 IonicContact OD2-NE 2.67Å; D254-R256 PolarHBondContact OD2-NE 2.87Å; D254-R256 IonicContact OD2-NH2 2.67Å; D254-R256 PolarHBondContact OD2-NH2 3.05Å; R256-S302 WeakPolarHBondContact O-CB 3.45Å; R256-W323 HydrophobicContact CB-CB 4.19Å; R256-W323 VanDerWaalsContact CD-CB 3.48Å; R256-W323 VanDerWaalsContact CD-CG 3.48Å; R256-W323 HydrophobicContact CG-CB 3.7Å; R256-W323 HydrophobicContact CG-CG 4.2Å; R256-Y324 WeakPolarHBondContact CA-O 3.45Å; R256-F325 HydrophobicContact CG-CD1 3.86Å; R256-F325 HydrophobicContact CG-CE1 3.44Å; R256-F325 VanDerWaalsContact CG-CE1 3.44Å; R256-F325 HydrophobicContact CG-CZ 4.33Å
257	C	98.5	Very high	97.3	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.007	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	-35.8	-177.3	61.8	0	0	0	0	113.1	Y224 G255 W301 S302 Y324 D326	Y224-C257 HydrophobicContact CD1-CB 3.81Å; Y224-C257 HydrophobicContact CD2-CB 4.16Å; Y224-C257 HydrophobicContact CE1-CB 3.76Å; Y224-C257 HydrophobicContact CE2-CB 4.12Å; Y224-C257 HydrophobicContact CG-CB 4Å; G255-C257 PolarHBondContact O-N 2.8Å; C257-W301 WeakPolarHBondContact O-CA 3.43Å; C257-S302 PolarHBondContact O-N 3.18Å; C257-Y324 PolarHBondContact N-O 2.95Å; C257-Y324 PolarHBondContact SG-O 3Å; C257-Y324 VanDerWaalsContact SG-O 3.41Å; C257-D326 HydrophobicContact CB-CB 4.04Å; C257-D326 PolarHBondContact SG-N 3.13Å; C257-D326 VanDerWaalsContact SG-N 3.41Å
258	V	98.8	Very high	97.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	125.7	179.4	-179.8	0	0	0	0	110.1	M136 L221 I226 L299 W301 S302 W323 Y324	M136-V258 HydrophobicContact CE-CG1 4.32Å; M136-V258 HydrophobicContact CE-CG2 4.5Å; L221-V258 HydrophobicContact CD1-CG2 4.49Å; I226-V258 HydrophobicContact CD1-CG2 4.23Å; V258-L299 HydrophobicContact CG1-CB 4.4Å; V258-L299 HydrophobicContact CG1-CD2 4.21Å; V258-W301 HydrophobicContact CG2-CE3 3.79Å; V258-W301 HydrophobicContact CG2-CZ3 3.55Å; V258-S302 PolarHBondContact N-OG 2.84Å; V258-W323 WeakPolarHBondContact O-CA 3.44Å; V258-Y324 PolarHBondContact O-N 2.81Å
259	T	98.9	Very high	97.4	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	128.9	168.9	-55.6	0	0	0	0	108.1	D249 I261 L299 F300 S302 T321 W323	D249-T259 WeakPolarHBondContact OD2-CB 3.42Å; D249-T259 VanDerWaalsContact OD2-CG2 3.27Å; D249-T259 WeakPolarHBondContact OD2-CG2 3.5Å; D249-T259 PolarHBondContact OD2-OG1 2.95Å; T259-I261 HydrophobicContact CG2-CD1 4.21Å; T259-I261 HydrophobicContact CG2-CG1 3.94Å; T259-L299 VanDerWaalsContact O-CA 3.31Å; T259-L299 WeakPolarHBondContact O-CA 3.36Å; T259-F300 HydrophobicContact CG2-CD1 4.49Å; T259-F300 HydrophobicContact CG2-CE1 3.66Å; T259-F300 HydrophobicContact CG2-CE2 4.16Å; T259-F300 HydrophobicContact CG2-CZ 3.47Å; T259-F300 VanDerWaalsContact CG2-CZ 3.47Å; T259-F300 PolarHBondContact N-O 2.85Å; T259-F300 PolarHBondContact O-N 2.9Å; T259-S302 PolarHBondContact N-OG 2.67Å; T259-S302 PolarHBondContact OG1-OG 2.84Å; T259-T321 HydrophobicContact CG2-CG2 3.85Å; T259-W323 PolarHBondContact OG1-NE1 3.47Å
260	C	98.9	Very high	97.3	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.007	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.3	178.8	-170.8	0	0	0	0	109.3	L297 L298 T321 V322 Y324	C260-L297 VanDerWaalsContact SG-CD1 3.6Å; C260-L298 CarbonylContact C-O 3.56Å; C260-L298 VanDerWaalsContact CA-O 3.3Å; C260-L298 WeakPolarHBondContact CA-O 3.21Å; C260-T321 CarbonylContact O-C 3.52Å; C260-T321 WeakPolarHBondContact O-CA 3.44Å; C260-V322 HydrophobicContact CB-CG2 3.74Å; C260-V322 PolarHBondContact N-O 2.9Å; C260-V322 PolarHBondContact O-N 3.47Å; C260-Y324 HydrophobicContact CB-CD2 4.36Å; C260-Y324 HydrophobicContact CB-CE2 4Å
261	I	98.9	Very high	97.3	Very high	15 Å²	15	40.7 Å²	40.7	8%	0.077	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.4	-175.8	-51.4	-176.4	0	0	0	109.5	T259 Y263 L277 L297 L298 F300 A319 I320 T321	T259-I261 HydrophobicContact CG2-CD1 4.21Å; T259-I261 HydrophobicContact CG2-CG1 3.94Å; I261-Y263 HydrophobicContact CG2-CD1 4.12Å; I261-Y263 HydrophobicContact CG2-CE1 3.62Å; I261-Y263 HydrophobicContact CG2-CE2 4.21Å; I261-L277 HydrophobicContact CD1-CD2 4.48Å; I261-L297 CarbonylContact O-C 3.57Å; I261-L297 WeakPolarHBondContact O-CA 3.25Å; I261-L298 HydrophobicContact CB-CB 4.39Å; I261-L298 HydrophobicContact CD1-CD2 4.41Å; I261-L298 PolarHBondContact N-O 3.47Å; I261-L298 PolarHBondContact O-N 3.42Å; I261-F300 HydrophobicContact CD1-CE1 3.81Å; I261-F300 HydrophobicContact CD1-CZ 4.35Å; I261-F300 HydrophobicContact CG1-CE1 4.31Å; I261-A319 HydrophobicContact CG2-CB 3.97Å; I261-I320 CarbonylContact C-O 3.55Å; I261-I320 WeakPolarHBondContact CA-O 3.47Å; I261-T321 HydrophobicContact CG1-CG2 3.97Å
262	Y	98.9	Very high	97.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.9	169.9	-176.1	-106.8	0	0	0	110.9	F147 G153 I156 L206 M210 L264 D295 R296 L297 A319 I320	F147-Y262 HydrophobicContact CB-CE2 4.32Å; F147-Y262 HydrophobicContact CD1-CD2 4.24Å; F147-Y262 HydrophobicContact CD1-CE2 4.11Å; G153-Y262 WeakPolarHBondContact CA-OH 3.48Å; I156-Y262 HydrophobicContact CD1-CE1 3.79Å; I156-Y262 HydrophobicContact CG2-CE1 4.36Å; L206-Y262 HydrophobicContact CD1-CD1 3.93Å; L206-Y262 HydrophobicContact CD1-CD2 3.93Å; L206-Y262 HydrophobicContact CD1-CE1 4.24Å; L206-Y262 HydrophobicContact CD1-CE2 4.27Å; L206-Y262 HydrophobicContact CD1-CG 3.74Å; L206-Y262 HydrophobicContact CD2-CD1 3.51Å; L206-Y262 HydrophobicContact CD2-CE1 4.21Å; L206-Y262 HydrophobicContact CD2-CG 3.86Å; L206-Y262 HydrophobicContact CG-CD1 4.39Å; L206-Y262 HydrophobicContact CG-CG 4.47Å; M210-Y262 VanDerWaalsContact CE-CB 3.49Å; M210-Y262 HydrophobicContact CE-CG 4.47Å; Y262-L264 HydrophobicContact CD1-CD2 3.86Å; Y262-L264 HydrophobicContact CD1-CG 4.13Å; Y262-L264 HydrophobicContact CE1-CD2 3.44Å; Y262-L264 VanDerWaalsContact CE1-CD2 3.44Å; Y262-L264 HydrophobicContact CE1-CG 4.2Å; Y262-D295 VanDerWaalsContact CE2-OD1 3.23Å; Y262-D295 WeakPolarHBondContact CE2-OD1 3.38Å; Y262-D295 VanDerWaalsContact CZ-OD1 3.28Å; Y262-D295 PolarHBondContact OH-OD1 3.4Å; Y262-R296 WeakPolarHBondContact CA-O 3.02Å; Y262-L297 HydrophobicContact CD2-CB 4.48Å; Y262-L297 HydrophobicContact CD2-CD1 4.3Å; Y262-A319 CarbonylContact O-C 3.54Å; Y262-A319 WeakPolarHBondContact O-CA 3.41Å; Y262-I320 PolarHBondContact N-O 2.73Å; Y262-I320 PolarHBondContact O-N 3.2Å
263	Y	98.9	Very high	97.8	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	146.4	-175.2	-65.8	-64.4	0	0	0	112.4	I261 L277 I290 P292 K293 D295 R296 L298 R317 A319	I261-Y263 HydrophobicContact CG2-CD1 4.12Å; I261-Y263 HydrophobicContact CG2-CE1 3.62Å; I261-Y263 HydrophobicContact CG2-CE2 4.21Å; Y263-L277 VanDerWaalsContact OH-CD2 3.31Å; Y263-L277 WeakPolarHBondContact OH-CD2 3.35Å; Y263-I290 HydrophobicContact CE2-CG2 4.27Å; Y263-P292 HydrophobicContact CD1-CB 3.47Å; Y263-P292 VanDerWaalsContact CD1-CB 3.47Å; Y263-P292 HydrophobicContact CE1-CB 3.75Å; Y263-P292 HydrophobicContact CG-CB 3.94Å; Y263-K293 WeakPolarHBondContact CB-O 3.29Å; Y263-D295 PolarHBondContact O-N 2.86Å; Y263-R296 HydrophobicContact CD2-CB 4.03Å; Y263-R296 HydrophobicContact CD2-CG 3.9Å; Y263-R296 HydrophobicContact CE2-CG 4.47Å; Y263-R296 PolarHBondContact N-O 2.97Å; Y263-L298 HydrophobicContact CE2-CB 4.12Å; Y263-L298 HydrophobicContact CE2-CD2 4.18Å; Y263-R317 VanDerWaalsContact CE1-NH2 3.32Å; Y263-A319 HydrophobicContact CD1-CB 3.88Å; Y263-A319 HydrophobicContact CE1-CB 4.07Å
264	L	98.9	Very high	98	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	19%	0.19	C	C	.	.			trans	-128.3	16.7	-166.7	-67.8	165.8	0	0	0	113.4	I156 L157 V160 Y262 I320	I156-L264 HydrophobicContact CB-CD2 3.99Å; I156-L264 HydrophobicContact CG2-CD1 4.17Å; I156-L264 HydrophobicContact CG2-CD2 3.68Å; L157-L264 HydrophobicContact CB-CD2 4.26Å; L157-L264 HydrophobicContact CD1-CB 4.06Å; V160-L264 HydrophobicContact CB-CD1 4.29Å; V160-L264 HydrophobicContact CG2-CD1 3.7Å; Y262-L264 HydrophobicContact CD1-CD2 3.86Å; Y262-L264 HydrophobicContact CD1-CG 4.13Å; Y262-L264 HydrophobicContact CE1-CD2 3.44Å; Y262-L264 VanDerWaalsContact CE1-CD2 3.44Å; Y262-L264 HydrophobicContact CE1-CG 4.2Å; L264-I320 HydrophobicContact CD1-CD1 3.97Å; L264-I320 HydrophobicContact CD1-CG1 3.97Å
265	N	98.7	Very high	98.2	Very high	8 Å²	8	38.7 Å²	38.7	4%	0.043	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-100.7	99.8	-167.2	-44.4	-71.5	0	0	0	110.8	W268 P292 F294 R317 Y318	N265-W268 HydrophobicContact CB-CB 4.18Å; N265-W268 HydrophobicContact CB-CD2 4.11Å; N265-W268 HydrophobicContact CB-CE3 3.57Å; N265-W268 HydrophobicContact CB-CG 4.4Å; N265-W268 HydrophobicContact CB-CZ3 4.27Å; N265-P292 WeakPolarHBondContact CB-O 3.32Å; N265-P292 PolarHBondContact ND2-O 3.02Å; N265-F294 WeakPolarHBondContact O-CB 3.47Å; N265-F294 PolarHBondContact O-N 2.88Å; N265-R317 VanDerWaalsContact OD1-CA 3.31Å; N265-R317 WeakPolarHBondContact OD1-CA 3.47Å; N265-Y318 PolarHBondContact ND2-O 3.05Å; N265-Y318 PolarHBondContact OD1-N 2.75Å; N265-Y318 PolarHBondContact OD1-O 3.4Å
266	R	97.9	Very high	98.2	Very high	124 Å²	124	39.9 Å²	39.9	47%	0.468	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	143.6	179.3	-66	-174.8	68	164.6	1.5	110.4	W268 F294	R266-W268 PolarHBondContact O-N 2.97Å; R266-F294 HydrophobicContact CG-CB 4.03Å; R266-F294 HydrophobicContact CG-CD1 4.27Å; R266-F294 HydrophobicContact CG-CD2 3.5Å; R266-F294 HydrophobicContact CG-CE2 3.93Å; R266-F294 HydrophobicContact CG-CG 3.68Å; R266-F294 HydrophobicContact CG-CZ 4.45Å
267	D	97.2	Very high	98.3	Very high	142 Å²	142	38.5 Å²	38.5	76%	0.759	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	35.4	172.6	-47.1	-51.7	0	0	0	112.8	N269	D267-N269 PolarHBondContact O-N 3.27Å
268	W	98.2	Very high	98.3	Very high	22 Å²	22	41 Å²	41	8%	0.083	19%	0.194	C	C	.	.			trans	-73.6	117.3	-176.5	-169.5	-86.4	0	0	0	111.1	N265 R266 H273 G274 P292 R317	N265-W268 HydrophobicContact CB-CB 4.18Å; N265-W268 HydrophobicContact CB-CD2 4.11Å; N265-W268 HydrophobicContact CB-CE3 3.57Å; N265-W268 HydrophobicContact CB-CG 4.4Å; N265-W268 HydrophobicContact CB-CZ3 4.27Å; R266-W268 PolarHBondContact O-N 2.97Å; W268-H273 HydrophobicContact CD2-CB 3.98Å; W268-H273 HydrophobicContact CE3-CB 4.22Å; W268-H273 HydrophobicContact CH2-CB 3.78Å; W268-H273 HydrophobicContact CZ2-CB 3.47Å; W268-H273 VanDerWaalsContact CZ2-CB 3.47Å; W268-H273 WeakPolarHBondContact CZ2-O 3.36Å; W268-H273 HydrophobicContact CZ3-CB 4.15Å; W268-G274 WeakPolarHBondContact CZ2-O 3.38Å; W268-G274 PolarHBondContact NE1-O 3.02Å; W268-P292 HydrophobicContact CD2-CG 4.02Å; W268-P292 HydrophobicContact CG-CG 4.07Å; W268-P292 HydrophobicContact CZ2-CG 4.25Å; W268-R317 HydrophobicContact CH2-CB 3.67Å; W268-R317 HydrophobicContact CH2-CG 4.28Å; W268-R317 HydrophobicContact CZ2-CB 4.39Å; W268-R317 HydrophobicContact CZ3-CB 4.03Å
269	N	97.1	Very high	98.3	Very high	53 Å²	53	41 Å²	41	28%	0.283	19%	0.194	S	C	.	.			trans	-103.9	106.4	170.5	-179.3	-7.6	0	0	0	110.1	D267 K271 E272 H273	D267-N269 PolarHBondContact O-N 3.27Å; N269-K271 PolarHBondContact O-N 3.02Å; N269-K271 WeakPolarHBondContact OD1-CB 3.37Å; N269-K271 PolarHBondContact OD1-N 3.25Å; N269-E272 HydrophobicContact CB-CB 4.36Å; N269-E272 PolarHBondContact ND2-OE1 3.41Å; N269-E272 VanDerWaalsContact ND2-OE1 3.16Å; N269-E272 PolarHBondContact ND2-OE2 2.89Å; N269-E272 VanDerWaalsContact ND2-OE2 3.13Å; N269-E272 PolarHBondContact O-N 3.44Å; N269-E272 VanDerWaalsContact O-N 3.13Å; N269-H273 PolarHBondContact N-ND1 2.93Å; N269-H273 WeakPolarHBondContact O-CB 3.5Å; N269-H273 PolarHBondContact O-N 2.86Å
270	A	96.7	Very high	98.2	Very high	19 Å²	19	43 Å²	43	16%	0.157	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-21.9	-178.1	0	0	0	0	0	114.5	E272 G274 L276 E291	A270-E272 VanDerWaalsContact C-N 3.32Å; A270-G274 VanDerWaalsContact O-CA 3.23Å; A270-G274 WeakPolarHBondContact O-CA 3.44Å; A270-G274 PolarHBondContact O-N 3.25Å; A270-L276 HydrophobicContact CB-CD1 4.5Å; A270-L276 HydrophobicContact CB-CD2 3.63Å; A270-L276 HydrophobicContact CB-CG 3.95Å; A270-E291 HydrophobicContact CB-CG 3.97Å
271	K	97.1	Very high	98	Very high	200 Å²	200	43.6 Å²	43.6	87%	0.87	21%	0.206	S	C	*	.	H	α-helix	trans	-70.2	-32	176	-64.2	-179.4	178.8	177.1	0	112.2	N269	N269-K271 PolarHBondContact O-N 3.02Å; N269-K271 WeakPolarHBondContact OD1-CB 3.37Å; N269-K271 PolarHBondContact OD1-N 3.25Å
272	E	97.3	Very high	97.6	Very high	133 Å²	133	49.4 Å²	49.4	62%	0.621	23%	0.233	S	C	*	.	H	α-helix	trans	-97	-45.7	-178.3	-69.8	167.9	-175.1	0	0	111.2	N269 A270	N269-E272 HydrophobicContact CB-CB 4.36Å; N269-E272 PolarHBondContact ND2-OE1 3.41Å; N269-E272 VanDerWaalsContact ND2-OE1 3.16Å; N269-E272 PolarHBondContact ND2-OE2 2.89Å; N269-E272 VanDerWaalsContact ND2-OE2 3.13Å; N269-E272 PolarHBondContact O-N 3.44Å; N269-E272 VanDerWaalsContact O-N 3.13Å; A270-E272 VanDerWaalsContact C-N 3.32Å
273	H	98.5	Very high	97	Very high	48 Å²	48	53.5 Å²	53.5	22%	0.222	28%	0.275	C	S	.	.	H	α-helix	trans	-93.1	-11.3	-172.7	-55	153	0	0	0	113.7	W268 N269 A313 F314 S315	W268-H273 HydrophobicContact CD2-CB 3.98Å; W268-H273 HydrophobicContact CE3-CB 4.22Å; W268-H273 HydrophobicContact CH2-CB 3.78Å; W268-H273 HydrophobicContact CZ2-CB 3.47Å; W268-H273 VanDerWaalsContact CZ2-CB 3.47Å; W268-H273 WeakPolarHBondContact CZ2-O 3.36Å; W268-H273 HydrophobicContact CZ3-CB 4.15Å; N269-H273 PolarHBondContact N-ND1 2.93Å; N269-H273 WeakPolarHBondContact O-CB 3.5Å; N269-H273 PolarHBondContact O-N 2.86Å; H273-A313 WeakPolarHBondContact O-CA 3.38Å; H273-F314 PolarHBondContact O-N 2.9Å; H273-S315 PolarHBondContact CD2-OG 3.21Å
274	G	98.4	Very high	96.4	Very high	11 Å²	11	58.2 Å²	58.2	11%	0.113	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	62.2	-137.5	-174.8	0	0	0	0	0	112.6	W268 A270 L276 P312	W268-G274 WeakPolarHBondContact CZ2-O 3.38Å; W268-G274 PolarHBondContact NE1-O 3.02Å; A270-G274 VanDerWaalsContact O-CA 3.23Å; A270-G274 WeakPolarHBondContact O-CA 3.44Å; A270-G274 PolarHBondContact O-N 3.25Å; G274-L276 VanDerWaalsContact C-N 3.32Å; G274-L276 PolarHBondContact O-N 2.98Å; G274-P312 WeakPolarHBondContact CA-O 3.49Å
275	G	98.3	Very high	95.6	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.341	C	S	.	.			trans	70.8	18.6	167.2	0	0	0	0	0	116.4	Q311 P312 R317	G275-Q311 WeakPolarHBondContact CA-O 3.5Å; G275-P312 PolarHBondContact N-O 3.18Å; G275-R317 PolarHBondContact O-NE 3.09Å
276	L	98.7	Very high	95.2	Very high	26 Å²	26	71 Å²	71	14%	0.136	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-59.3	137.4	173.3	-70.6	173.1	0	0	0	110.5	A270 G274 D289 E291 Q311	A270-L276 HydrophobicContact CB-CD1 4.5Å; A270-L276 HydrophobicContact CB-CD2 3.63Å; A270-L276 HydrophobicContact CB-CG 3.95Å; G274-L276 VanDerWaalsContact C-N 3.32Å; G274-L276 PolarHBondContact O-N 2.98Å; L276-D289 HydrophobicContact CD1-CB 4.37Å; L276-E291 HydrophobicContact CD2-CB 4.32Å; L276-E291 HydrophobicContact CD2-CG 3.61Å; L276-Q311 HydrophobicContact CB-CB 4.39Å; L276-Q311 HydrophobicContact CB-CG 4.37Å; L276-Q311 PolarHBondContact O-N 2.89Å
277	L	98.8	Very high	95.1	Very high	2 Å²	2	69.9 Å²	69.9	1%	0.01	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	117	159.8	176	72	0	0	0	107.7	I261 Y263 I279 I290 L298 F300 H308 V310	I261-L277 HydrophobicContact CD1-CD2 4.48Å; Y263-L277 VanDerWaalsContact OH-CD2 3.31Å; Y263-L277 WeakPolarHBondContact OH-CD2 3.35Å; L277-I279 HydrophobicContact CD2-CD1 4Å; L277-I279 HydrophobicContact CD2-CG1 4.09Å; L277-I279 HydrophobicContact CG-CG1 4.06Å; L277-I290 HydrophobicContact CB-CB 4.37Å; L277-I290 HydrophobicContact CD2-CD1 4.32Å; L277-I290 PolarHBondContact N-O 3.08Å; L277-I290 PolarHBondContact O-N 3.29Å; L277-L298 HydrophobicContact CD2-CD2 3.33Å; L277-F300 HydrophobicContact CD2-CE1 4.48Å; L277-H308 HydrophobicContact CD1-CB 4.18Å; L277-V310 HydrophobicContact CD1-CG2 4.04Å
278	R	98.7	Very high	95.1	Very high	55 Å²	55	64.6 Å²	64.6	21%	0.208	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	118.6	174.1	178.2	168.4	-71.4	172.5	-3.3	109.5	F280 F287 A288 D289 H308 E309	R278-F280 HydrophobicContact CB-CE2 4.47Å; R278-F280 HydrophobicContact CG-CD2 4.4Å; R278-F280 HydrophobicContact CG-CE1 4.01Å; R278-F280 HydrophobicContact CG-CE2 3.79Å; R278-F280 HydrophobicContact CG-CZ 3.58Å; R278-F287 HydrophobicContact CG-CB 3.97Å; R278-F287 HydrophobicContact CG-CD2 3.89Å; R278-F287 HydrophobicContact CG-CG 4.04Å; R278-A288 WeakPolarHBondContact CA-O 3.42Å; R278-D289 WeakPolarHBondContact CB-OD1 3.2Å; R278-D289 VanDerWaalsContact CG-OD1 3.31Å; R278-D289 WeakPolarHBondContact CG-OD1 3.37Å; R278-D289 IonicContact CZ-OD1 3.61Å; R278-D289 IonicContact CZ-OD2 2.67Å; R278-D289 IonicContact NE-OD1 3.98Å; R278-D289 PolarHBondContact NE-OD1 2.62Å; R278-D289 IonicContact NE-OD2 3.1Å; R278-D289 IonicContact NH2-OD1 2.74Å; R278-D289 PolarHBondContact NH2-OD1 3.31Å; R278-D289 IonicContact NH2-OD2 3.85Å; R278-D289 PolarHBondContact NH2-OD2 2.95Å; R278-H308 CarbonylContact O-C 3.5Å; R278-H308 WeakPolarHBondContact O-CA 3.48Å; R278-H308 WeakPolarHBondContact O-CB 3.49Å; R278-E309 HydrophobicContact CB-CG 4.02Å; R278-E309 PolarHBondContact N-O 3.41Å; R278-E309 PolarHBondContact O-N 2.96Å
279	I	98.7	Very high	95.1	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	138	175.8	-50.4	-177.9	0	0	0	108.8	I141 L277 P281 F287 A288 I290 F300 N306 H308	I141-I279 HydrophobicContact CD1-CB 3.94Å; I141-I279 HydrophobicContact CD1-CD1 3.98Å; I141-I279 HydrophobicContact CD1-CG2 3.66Å; I141-I279 HydrophobicContact CG1-CD1 4.28Å; I141-I279 HydrophobicContact CG1-CG2 4.44Å; I141-I279 HydrophobicContact CG2-CD1 4.26Å; L277-I279 HydrophobicContact CD2-CD1 4Å; L277-I279 HydrophobicContact CD2-CG1 4.09Å; L277-I279 HydrophobicContact CG-CG1 4.06Å; I279-P281 VanDerWaalsContact O-CD 3.27Å; I279-P281 WeakPolarHBondContact O-CD 3.42Å; I279-F287 CarbonylContact O-C 3.59Å; I279-F287 WeakPolarHBondContact O-CA 3.4Å; I279-F287 VanDerWaalsContact O-CB 3.24Å; I279-F287 WeakPolarHBondContact O-CB 3.31Å; I279-A288 PolarHBondContact N-O 2.88Å; I279-A288 PolarHBondContact O-N 2.74Å; I279-I290 HydrophobicContact CD1-CD1 3.57Å; I279-I290 HydrophobicContact CG1-CD1 4.17Å; I279-F300 HydrophobicContact CD1-CB 4.4Å; I279-F300 HydrophobicContact CD1-CD1 4.06Å; I279-F300 HydrophobicContact CD1-CE1 4.49Å; I279-F300 HydrophobicContact CD1-CG 4.12Å; I279-N306 HydrophobicContact CG2-CB 3.74Å; I279-H308 HydrophobicContact CB-CB 4.22Å; I279-H308 HydrophobicContact CG1-CB 3.88Å; I279-H308 HydrophobicContact CG2-CB 4.29Å
280	F	97.9	Very high	95.1	Very high	43 Å²	43	64.5 Å²	64.5	19%	0.189	35%	0.351	C	S	.	.			trans	-114.2	78.2	179.8	-57.7	-90.2	0	0	0	110.2	R246 R278 E282 F287 P307 E309	R246-F280 HydrophobicContact CG-CD2 4.44Å; R246-F280 HydrophobicContact CG-CE2 4.33Å; R278-F280 HydrophobicContact CB-CE2 4.47Å; R278-F280 HydrophobicContact CG-CD2 4.4Å; R278-F280 HydrophobicContact CG-CE1 4.01Å; R278-F280 HydrophobicContact CG-CE2 3.79Å; R278-F280 HydrophobicContact CG-CZ 3.58Å; F280-E282 PolarHBondContact O-N 2.85Å; F280-F287 HydrophobicContact CD1-CB 3.78Å; F280-F287 HydrophobicContact CE1-CB 4.06Å; F280-F287 HydrophobicContact CE1-CD1 4.49Å; F280-F287 HydrophobicContact CE1-CG 4.48Å; F280-F287 HydrophobicContact CG-CB 4.44Å; F280-P307 WeakPolarHBondContact CD2-O 3.5Å; F280-P307 PolarHBondContact N-O 2.8Å; F280-P307 WeakPolarHBondContact O-CD 3.48Å; F280-E309 HydrophobicContact CE2-CG 4.03Å
281	P	94.9	Very high	95.2	Very high	12 Å²	12	66.3 Å²	66.3	8%	0.078	36%	0.356	C	S	.	.			trans	-56.2	130.4	-176.1	-20.9	30	0	0	0	111.9	I141 I279 K284 R305	I141-P281 HydrophobicContact CD1-CG 3.75Å; I279-P281 VanDerWaalsContact O-CD 3.27Å; I279-P281 WeakPolarHBondContact O-CD 3.42Å; P281-K284 HydrophobicContact CB-CB 4.27Å; P281-K284 HydrophobicContact CB-CD 3.8Å; P281-K284 HydrophobicContact CB-CG 4.09Å; P281-K284 HydrophobicContact CG-CD 4.21Å; P281-K284 PolarHBondContact O-N 3.47Å; P281-R305 CarbonylContact C-O 3.49Å; P281-R305 VanDerWaalsContact CA-O 3.32Å; P281-R305 WeakPolarHBondContact CA-O 3.17Å
282	E	90.8	Very high	95.3	Very high	137 Å²	137	56.8 Å²	56.8	64%	0.64	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	140.1	178	-171.9	174.7	-148.4	0	0	111	F280 K284 R305	F280-E282 PolarHBondContact O-N 2.85Å; E282-K284 PolarHBondContact O-N 2.98Å; E282-R305 PolarHBondContact N-O 3.05Å
283	G	86.3	Confident	95.4	Very high	86 Å²	86	54 Å²	54	89%	0.887	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	4.3	-179.2	0	0	0	0	0	115.1
284	K	85.8	Confident	95.4	Very high	101 Å²	101	53.4 Å²	53.4	44%	0.439	30%	0.297	S	S	.	.			trans	-108.8	139.8	173.3	-59.3	-169.7	-172.2	161.7	0	111.1	H139 P281 E282 Q286	H139-K284 PolarHBondContact O-NZ 3.38Å; H139-K284 VanDerWaalsContact O-NZ 3.07Å; P281-K284 HydrophobicContact CB-CB 4.27Å; P281-K284 HydrophobicContact CB-CD 3.8Å; P281-K284 HydrophobicContact CB-CG 4.09Å; P281-K284 HydrophobicContact CG-CD 4.21Å; P281-K284 PolarHBondContact O-N 3.47Å; E282-K284 PolarHBondContact O-N 2.98Å; K284-Q286 PolarHBondContact O-N 2.97Å
285	A	82.7	Confident	95.4	Very high	115 Å²	115	53 Å²	53	95%	0.95	29%	0.292	S	S	*	.	S	Bend	trans	-74.3	-12	176.4	0	0	0	0	0	113.3
286	Q	89.6	Confident	95.4	Very high	161 Å²	161	54.2 Å²	54.2	75%	0.752	30%	0.297	S	S	*	.	S	Bend	trans	-117.9	150.1	-175.2	-65.3	178.4	-10	0	0	110.9	K284	K284-Q286 PolarHBondContact O-N 2.97Å
287	F	94.8	Very high	95.5	Very high	101 Å²	101	53 Å²	53	44%	0.443	29%	0.29	S	S	.	.			trans	-95.4	162.2	169.3	57.8	-96.8	0	0	0	110.7	R278 I279 F280 D289	R278-F287 HydrophobicContact CG-CB 3.97Å; R278-F287 HydrophobicContact CG-CD2 3.89Å; R278-F287 HydrophobicContact CG-CG 4.04Å; I279-F287 CarbonylContact O-C 3.59Å; I279-F287 WeakPolarHBondContact O-CA 3.4Å; I279-F287 VanDerWaalsContact O-CB 3.24Å; I279-F287 WeakPolarHBondContact O-CB 3.31Å; F280-F287 HydrophobicContact CD1-CB 3.78Å; F280-F287 HydrophobicContact CE1-CB 4.06Å; F280-F287 HydrophobicContact CE1-CD1 4.49Å; F280-F287 HydrophobicContact CE1-CG 4.48Å; F280-F287 HydrophobicContact CG-CB 4.44Å; F287-D289 VanDerWaalsContact CD2-OD1 3.31Å; F287-D289 WeakPolarHBondContact CD2-OD1 3.38Å; F287-D289 WeakPolarHBondContact CE2-OD1 3.48Å; F287-D289 WeakPolarHBondContact CE2-OD2 3.34Å
288	A	97	Very high	95.5	Very high	31 Å²	31	52.9 Å²	52.9	26%	0.256	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	119.7	171.9	0	0	0	0	0	109.6	I141 R278 I279	I141-A288 HydrophobicContact CD1-CB 4.16Å; R278-A288 WeakPolarHBondContact CA-O 3.42Å; I279-A288 PolarHBondContact N-O 2.88Å; I279-A288 PolarHBondContact O-N 2.74Å
289	D	98.4	Very high	95.5	Very high	66 Å²	66	50.3 Å²	50.3	35%	0.353	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.4	172.2	-79.5	-7.5	0	0	0	110	L276 R278 F287	L276-D289 HydrophobicContact CD1-CB 4.37Å; R278-D289 WeakPolarHBondContact CB-OD1 3.2Å; R278-D289 VanDerWaalsContact CG-OD1 3.31Å; R278-D289 WeakPolarHBondContact CG-OD1 3.37Å; R278-D289 IonicContact CZ-OD1 3.61Å; R278-D289 IonicContact CZ-OD2 2.67Å; R278-D289 IonicContact NE-OD1 3.98Å; R278-D289 PolarHBondContact NE-OD1 2.62Å; R278-D289 IonicContact NE-OD2 3.1Å; R278-D289 IonicContact NH2-OD1 2.74Å; R278-D289 PolarHBondContact NH2-OD1 3.31Å; R278-D289 IonicContact NH2-OD2 3.85Å; R278-D289 PolarHBondContact NH2-OD2 2.95Å; F287-D289 VanDerWaalsContact CD2-OD1 3.31Å; F287-D289 WeakPolarHBondContact CD2-OD1 3.38Å; F287-D289 WeakPolarHBondContact CE2-OD1 3.48Å; F287-D289 WeakPolarHBondContact CE2-OD2 3.34Å
290	I	98.7	Very high	95.5	Very high	8 Å²	8	50.3 Å²	50.3	4%	0.041	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	111.2	-177	-57.5	162.3	0	0	0	108.3	I141 Y263 L277 I279 L298	I141-I290 HydrophobicContact CG2-CD1 4.13Å; Y263-I290 HydrophobicContact CE2-CG2 4.27Å; L277-I290 HydrophobicContact CB-CB 4.37Å; L277-I290 HydrophobicContact CD2-CD1 4.32Å; L277-I290 PolarHBondContact N-O 3.08Å; L277-I290 PolarHBondContact O-N 3.29Å; I279-I290 HydrophobicContact CD1-CD1 3.57Å; I279-I290 HydrophobicContact CG1-CD1 4.17Å; I290-L298 HydrophobicContact CD1-CD1 3.64Å; I290-L298 HydrophobicContact CD1-CD2 3.79Å; I290-L298 HydrophobicContact CD1-CG 4.38Å; I290-L298 HydrophobicContact CG2-CD2 4.38Å
291	E	98.7	Very high	95.5	Very high	56 Å²	56	48.8 Å²	48.8	26%	0.262	27%	0.273	S	S	.	.			trans	-65.4	137	170.2	-65.8	-174.5	-100.2	0	0	110.6	A270 L276 K293 R296	A270-E291 HydrophobicContact CB-CG 3.97Å; L276-E291 HydrophobicContact CD2-CB 4.32Å; L276-E291 HydrophobicContact CD2-CG 3.61Å; E291-K293 HydrophobicContact CB-CD 4.32Å; E291-K293 HydrophobicContact CB-CG 3.81Å; E291-K293 PolarHBondContact O-N 3.2Å; E291-K293 WeakPolarHBondContact OE1-CE 3.19Å; E291-K293 IonicContact OE1-NZ 2.76Å; E291-K293 PolarHBondContact OE1-NZ 2.96Å; E291-K293 WeakPolarHBondContact OE2-CE 3.33Å; E291-K293 IonicContact OE2-NZ 3.51Å; E291-R296 WeakPolarHBondContact O-CD 3.43Å; E291-R296 PolarHBondContact O-NH1 2.99Å
292	P	98.8	Very high	95.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.27	C	S	.	.			trans	-81	53.3	-178.8	37.7	-39.8	0	0	0	111.5	Y263 N265 W268 R317	Y263-P292 HydrophobicContact CD1-CB 3.47Å; Y263-P292 VanDerWaalsContact CD1-CB 3.47Å; Y263-P292 HydrophobicContact CE1-CB 3.75Å; Y263-P292 HydrophobicContact CG-CB 3.94Å; N265-P292 WeakPolarHBondContact CB-O 3.32Å; N265-P292 PolarHBondContact ND2-O 3.02Å; W268-P292 HydrophobicContact CD2-CG 4.02Å; W268-P292 HydrophobicContact CG-CG 4.07Å; W268-P292 HydrophobicContact CZ2-CG 4.25Å; P292-R317 HydrophobicContact CB-CG 4.33Å; P292-R317 HydrophobicContact CG-CG 4.29Å
293	K	98.8	Very high	96	Very high	76 Å²	76	43.5 Å²	43.5	33%	0.33	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-64.3	144.8	-173.7	-65.1	-173.5	178.9	172.3	0	112	Y263 E291 R296	Y263-K293 WeakPolarHBondContact CB-O 3.29Å; E291-K293 HydrophobicContact CB-CD 4.32Å; E291-K293 HydrophobicContact CB-CG 3.81Å; E291-K293 PolarHBondContact O-N 3.2Å; E291-K293 WeakPolarHBondContact OE1-CE 3.19Å; E291-K293 IonicContact OE1-NZ 2.76Å; E291-K293 PolarHBondContact OE1-NZ 2.96Å; E291-K293 WeakPolarHBondContact OE2-CE 3.33Å; E291-K293 IonicContact OE2-NZ 3.51Å; K293-R296 HydrophobicContact CB-CB 4.34Å; K293-R296 VanDerWaalsContact O-CB 3.26Å; K293-R296 WeakPolarHBondContact O-CB 3.2Å; K293-R296 PolarHBondContact O-N 3.16Å
294	F	98.9	Very high	96.6	Very high	34 Å²	34	45.5 Å²	45.5	15%	0.149	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	139.1	172.4	179.4	-100.2	0	0	0	112.4	T150 Q154 N265 R266 R296	T150-F294 HydrophobicContact CG2-CE1 4.46Å; Q154-F294 HydrophobicContact CB-CZ 4.48Å; N265-F294 WeakPolarHBondContact O-CB 3.47Å; N265-F294 PolarHBondContact O-N 2.88Å; R266-F294 HydrophobicContact CG-CB 4.03Å; R266-F294 HydrophobicContact CG-CD1 4.27Å; R266-F294 HydrophobicContact CG-CD2 3.5Å; R266-F294 HydrophobicContact CG-CE2 3.93Å; R266-F294 HydrophobicContact CG-CG 3.68Å; R266-F294 HydrophobicContact CG-CZ 4.45Å; F294-R296 PolarHBondContact O-N 3.28Å
295	D	98.8	Very high	97.1	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.016	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	24.2	179.4	-162.3	32.2	0	0	0	114.9	N146 F147 L148 G149 Y262 Y263	N146-D295 WeakPolarHBondContact CA-OD2 3.45Å; N146-D295 PolarHBondContact N-O 3.34Å; F147-D295 PolarHBondContact N-O 2.89Å; F147-D295 PolarHBondContact N-OD1 2.97Å; F147-D295 PolarHBondContact N-OD2 2.76Å; F147-D295 VanDerWaalsContact N-OD2 3.15Å; L148-D295 PolarHBondContact N-OD1 3.36Å; L148-D295 PolarHBondContact N-OD2 3.41Å; G149-D295 VanDerWaalsContact CA-OD2 3.29Å; G149-D295 WeakPolarHBondContact CA-OD2 3.48Å; G149-D295 PolarHBondContact N-OD2 2.96Å; Y262-D295 VanDerWaalsContact CE2-OD1 3.23Å; Y262-D295 WeakPolarHBondContact CE2-OD1 3.38Å; Y262-D295 VanDerWaalsContact CZ-OD1 3.28Å; Y262-D295 PolarHBondContact OH-OD1 3.4Å; Y263-D295 PolarHBondContact O-N 2.86Å
296	R	98.9	Very high	97.9	Very high	25 Å²	25	38.7 Å²	38.7	9%	0.094	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.4	170.4	175	174.2	-73.3	-163.4	-18.5	110.6	V143 D145 Y262 Y263 E291 K293 F294	V143-R296 HydrophobicContact CG1-CG 3.86Å; D145-R296 VanDerWaalsContact CG-NH2 3.35Å; D145-R296 WeakPolarHBondContact OD1-CB 3.44Å; D145-R296 WeakPolarHBondContact OD1-CG 3.46Å; D145-R296 IonicContact OD1-CZ 3.44Å; D145-R296 VanDerWaalsContact OD1-CZ 3.29Å; D145-R296 IonicContact OD1-NE 2.95Å; D145-R296 PolarHBondContact OD1-NE 3Å; D145-R296 IonicContact OD1-NH2 3.47Å; D145-R296 PolarHBondContact OD1-NH2 3.31Å; D145-R296 VanDerWaalsContact OD1-NH2 3.07Å; D145-R296 IonicContact OD2-CZ 3.6Å; D145-R296 IonicContact OD2-NE 3.24Å; D145-R296 IonicContact OD2-NH2 2.73Å; D145-R296 PolarHBondContact OD2-NH2 3.32Å; Y262-R296 WeakPolarHBondContact CA-O 3.02Å; Y263-R296 HydrophobicContact CD2-CB 4.03Å; Y263-R296 HydrophobicContact CD2-CG 3.9Å; Y263-R296 HydrophobicContact CE2-CG 4.47Å; Y263-R296 PolarHBondContact N-O 2.97Å; E291-R296 WeakPolarHBondContact O-CD 3.43Å; E291-R296 PolarHBondContact O-NH1 2.99Å; K293-R296 HydrophobicContact CB-CB 4.34Å; K293-R296 VanDerWaalsContact O-CB 3.26Å; K293-R296 WeakPolarHBondContact O-CB 3.2Å; K293-R296 PolarHBondContact O-N 3.16Å; F294-R296 PolarHBondContact O-N 3.28Å
297	L	98.9	Very high	98.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	135.8	164.4	-170.3	73.2	0	0	0	109.7	V144 F147 M210 L213 C260 I261 Y262 L299	V144-L297 HydrophobicContact CB-CB 4.27Å; V144-L297 PolarHBondContact N-O 2.94Å; V144-L297 PolarHBondContact O-N 3.5Å; F147-L297 HydrophobicContact CB-CB 4.06Å; F147-L297 HydrophobicContact CD1-CB 4.1Å; F147-L297 HydrophobicContact CD1-CD1 4.25Å; F147-L297 HydrophobicContact CD1-CD2 4.05Å; F147-L297 HydrophobicContact CD1-CG 4.38Å; F147-L297 HydrophobicContact CD2-CD2 4.07Å; F147-L297 HydrophobicContact CE1-CD1 4.34Å; F147-L297 HydrophobicContact CE1-CD2 3.99Å; F147-L297 HydrophobicContact CE2-CD2 4Å; F147-L297 HydrophobicContact CG-CB 4.01Å; F147-L297 HydrophobicContact CG-CD2 4.11Å; F147-L297 HydrophobicContact CZ-CD2 3.97Å; M210-L297 HydrophobicContact CE-CD1 3.37Å; M210-L297 HydrophobicContact CG-CD1 4.15Å; L213-L297 HydrophobicContact CD2-CD2 3.55Å; C260-L297 VanDerWaalsContact SG-CD1 3.6Å; I261-L297 CarbonylContact O-C 3.57Å; I261-L297 WeakPolarHBondContact O-CA 3.25Å; Y262-L297 HydrophobicContact CD2-CB 4.48Å; Y262-L297 HydrophobicContact CD2-CD1 4.3Å; L297-L299 HydrophobicContact CD2-CD1 3.92Å; L297-L299 HydrophobicContact CG-CD1 4.05Å
298	L	98.9	Very high	98.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	132.2	177	167	65	0	0	0	109.1	I141 C142 V143 C260 I261 Y263 L277 I290 F300	I141-L298 HydrophobicContact CG2-CD1 3.81Å; C142-L298 WeakPolarHBondContact O-CA 3.33Å; V143-L298 HydrophobicContact CG2-CD1 3.93Å; C260-L298 CarbonylContact C-O 3.56Å; C260-L298 VanDerWaalsContact CA-O 3.3Å; C260-L298 WeakPolarHBondContact CA-O 3.21Å; I261-L298 HydrophobicContact CB-CB 4.39Å; I261-L298 HydrophobicContact CD1-CD2 4.41Å; I261-L298 PolarHBondContact N-O 3.47Å; I261-L298 PolarHBondContact O-N 3.42Å; Y263-L298 HydrophobicContact CE2-CB 4.12Å; Y263-L298 HydrophobicContact CE2-CD2 4.18Å; L277-L298 HydrophobicContact CD2-CD2 3.33Å; I290-L298 HydrophobicContact CD1-CD1 3.64Å; I290-L298 HydrophobicContact CD1-CD2 3.79Å; I290-L298 HydrophobicContact CD1-CG 4.38Å; I290-L298 HydrophobicContact CG2-CD2 4.38Å; L298-F300 HydrophobicContact CD1-CD1 4.35Å; L298-F300 HydrophobicContact CD2-CD1 3.99Å; L298-F300 HydrophobicContact CD2-CE1 4.08Å; L298-F300 HydrophobicContact CG-CD1 3.96Å; L298-F300 HydrophobicContact CG-CE1 4.43Å
299	L	98.9	Very high	98.5	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	139.7	169.6	-59.9	92.2	0	0	0	109.8	I132 M136 I141 C142 I214 V258 T259 L297	I132-L299 HydrophobicContact CD1-CD1 4.37Å; I132-L299 HydrophobicContact CG2-CD2 4.2Å; M136-L299 HydrophobicContact CE-CB 4.37Å; M136-L299 HydrophobicContact SD-CB 3.75Å; I141-L299 CarbonylContact C-O 3.56Å; I141-L299 WeakPolarHBondContact CA-O 3.3Å; C142-L299 HydrophobicContact CB-CB 4.49Å; C142-L299 PolarHBondContact N-O 3.04Å; C142-L299 PolarHBondContact O-N 3.29Å; I214-L299 HydrophobicContact CD1-CD2 3.76Å; V258-L299 HydrophobicContact CG1-CB 4.4Å; V258-L299 HydrophobicContact CG1-CD2 4.21Å; T259-L299 VanDerWaalsContact O-CA 3.31Å; T259-L299 WeakPolarHBondContact O-CA 3.36Å; L297-L299 HydrophobicContact CD2-CD1 3.92Å; L297-L299 HydrophobicContact CG-CD1 4.05Å
300	F	98.8	Very high	98.5	Very high	0 Å²	0	26 Å²	26	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	157.7	169	62.1	-87.4	0	0	0	110.9	G140 I141 T259 I261 L277 I279 L298 S302 N306 H308	G140-F300 VanDerWaalsContact O-CA 3.3Å; G140-F300 WeakPolarHBondContact O-CA 3.38Å; G140-F300 WeakPolarHBondContact O-CB 3.45Å; I141-F300 HydrophobicContact CB-CB 4.44Å; I141-F300 HydrophobicContact CG1-CB 4.03Å; T259-F300 HydrophobicContact CG2-CD1 4.49Å; T259-F300 HydrophobicContact CG2-CE1 3.66Å; T259-F300 HydrophobicContact CG2-CE2 4.16Å; T259-F300 HydrophobicContact CG2-CZ 3.47Å; T259-F300 VanDerWaalsContact CG2-CZ 3.47Å; T259-F300 PolarHBondContact N-O 2.85Å; T259-F300 PolarHBondContact O-N 2.9Å; I261-F300 HydrophobicContact CD1-CE1 3.81Å; I261-F300 HydrophobicContact CD1-CZ 4.35Å; I261-F300 HydrophobicContact CG1-CE1 4.31Å; L277-F300 HydrophobicContact CD2-CE1 4.48Å; I279-F300 HydrophobicContact CD1-CB 4.4Å; I279-F300 HydrophobicContact CD1-CD1 4.06Å; I279-F300 HydrophobicContact CD1-CE1 4.49Å; I279-F300 HydrophobicContact CD1-CG 4.12Å; L298-F300 HydrophobicContact CD1-CD1 4.35Å; L298-F300 HydrophobicContact CD2-CD1 3.99Å; L298-F300 HydrophobicContact CD2-CE1 4.08Å; L298-F300 HydrophobicContact CG-CD1 3.96Å; L298-F300 HydrophobicContact CG-CE1 4.43Å; F300-S302 PolarHBondContact O-N 3.08Å; F300-N306 HydrophobicContact CD2-CB 3.83Å; F300-H308 AromaticContact CE2-CE1 3.53Å; F300-H308 AromaticContact CE2-ND1 3.66Å; F300-H308 AromaticContact CZ-CE1 3.69Å; F300-H308 AromaticContact CZ-NE2 3.89Å
301	W	98.7	Very high	98.5	Very high	12 Å²	12	27.8 Å²	27.8	5%	0.045	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	130.4	175.7	-57.1	125.7	0	0	0	111.1	M136 G140 L221 Y224 C257 V258 D303 R305 N306	M136-W301 HydrophobicContact CB-CH2 4.41Å; M136-W301 HydrophobicContact CB-CZ2 4.05Å; M136-W301 HydrophobicContact CE-CD2 3.76Å; M136-W301 HydrophobicContact CE-CE3 3.78Å; M136-W301 HydrophobicContact CE-CG 4.38Å; M136-W301 HydrophobicContact CE-CH2 4.07Å; M136-W301 HydrophobicContact CE-CZ2 4.05Å; M136-W301 HydrophobicContact CE-CZ3 3.94Å; M136-W301 PolarHBondContact O-NE1 2.99Å; G140-W301 VanDerWaalsContact CA-NE1 3.3Å; G140-W301 PolarHBondContact O-N 3.43Å; L221-W301 HydrophobicContact CB-CH2 3.79Å; L221-W301 HydrophobicContact CB-CZ3 4.26Å; L221-W301 HydrophobicContact CD2-CH2 4.11Å; L221-W301 HydrophobicContact CG-CH2 4.45Å; Y224-W301 HydrophobicContact CD2-CE3 4.21Å; Y224-W301 HydrophobicContact CD2-CH2 4.14Å; Y224-W301 AromaticContact CD2-CZ3 3.59Å; Y224-W301 HydrophobicContact CD2-CZ3 3.59Å; Y224-W301 AromaticContact CE2-CE3 3.78Å; Y224-W301 HydrophobicContact CE2-CE3 3.78Å; Y224-W301 HydrophobicContact CE2-CH2 4.27Å; Y224-W301 AromaticContact CE2-CZ3 3.62Å; Y224-W301 HydrophobicContact CE2-CZ3 3.62Å; C257-W301 WeakPolarHBondContact O-CA 3.43Å; V258-W301 HydrophobicContact CG2-CE3 3.79Å; V258-W301 HydrophobicContact CG2-CZ3 3.55Å; W301-D303 VanDerWaalsContact C-N 3.3Å; W301-D303 PolarHBondContact O-N 3.39Å; W301-R305 VanDerWaalsContact CD1-CZ 3.48Å; W301-R305 VanDerWaalsContact CD1-NH1 3.27Å; W301-N306 WeakPolarHBondContact CB-ND2 3.35Å; W301-N306 PolarHBondContact N-ND2 2.85Å; W301-N306 WeakPolarHBondContact O-CB 3.35Å; W301-N306 PolarHBondContact O-ND2 2.78Å
302	S	98.6	Very high	98.5	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.007	13%	0.13	C	C	.	.	S	Bend	trans	-74.2	-17.9	-175.7	-56.1	0	0	0	0	114.4	D249 N250 R256 C257 V258 T259 F300	D249-S302 WeakPolarHBondContact CB-O 3.47Å; D249-S302 PolarHBondContact N-O 3.13Å; N250-S302 PolarHBondContact N-O 3.45Å; R256-S302 WeakPolarHBondContact O-CB 3.45Å; C257-S302 PolarHBondContact O-N 3.18Å; V258-S302 PolarHBondContact N-OG 2.84Å; T259-S302 PolarHBondContact N-OG 2.67Å; T259-S302 PolarHBondContact OG1-OG 2.84Å; F300-S302 PolarHBondContact O-N 3.08Å
303	D	98	Very high	98.5	Very high	36 Å²	36	28.2 Å²	28.2	19%	0.193	13%	0.13	C	C	.	.	S	Bend	trans	-82.4	-167.6	-174.8	70.1	19	0	0	0	113.3	Y224 V248 W301 R305 N306	Y224-D303 PolarHBondContact OH-OD2 2.84Å; V248-D303 VanDerWaalsContact CG1-C 3.43Å; V248-D303 WeakPolarHBondContact CG1-O 3.31Å; W301-D303 VanDerWaalsContact C-N 3.3Å; W301-D303 PolarHBondContact O-N 3.39Å; D303-R305 VanDerWaalsContact CG-NE 3.3Å; D303-R305 VanDerWaalsContact CG-NH2 3.33Å; D303-R305 PolarHBondContact O-N 3.26Å; D303-R305 VanDerWaalsContact OD1-CB 3.26Å; D303-R305 WeakPolarHBondContact OD1-CB 3.33Å; D303-R305 VanDerWaalsContact OD1-CG 3.31Å; D303-R305 WeakPolarHBondContact OD1-CG 3.02Å; D303-R305 IonicContact OD1-CZ 3.56Å; D303-R305 PolarHBondContact OD1-N 3.2Å; D303-R305 IonicContact OD1-NE 2.77Å; D303-R305 PolarHBondContact OD1-NE 2.85Å; D303-R305 IonicContact OD1-NH2 2.67Å; D303-R305 PolarHBondContact OD1-NH2 3.21Å; D303-R305 IonicContact OD2-CZ 3.23Å; D303-R305 VanDerWaalsContact OD2-CZ 3.23Å; D303-R305 IonicContact OD2-NE 3.05Å; D303-R305 PolarHBondContact OD2-NE 2.67Å; D303-R305 IonicContact OD2-NH2 3.66Å; D303-R305 PolarHBondContact OD2-NH2 3.05Å; D303-N306 PolarHBondContact O-N 2.71Å; D303-N306 VanDerWaalsContact O-N 3.11Å
304	R	97.3	Very high	98.4	Very high	128 Å²	128	30.6 Å²	30.6	48%	0.483	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-9.3	-175.9	-65.2	-179.9	179.8	-98.4	-1.6	114.8	V248 P251 N306 P307	V248-R304 HydrophobicContact CG1-CG 4.28Å; P251-R304 VanDerWaalsContact O-CZ 3.31Å; P251-R304 PolarHBondContact O-NE 2.92Å; P251-R304 PolarHBondContact O-NH2 3.21Å; R304-N306 PolarHBondContact O-N 3.42Å; R304-P307 VanDerWaalsContact O-CD 3.3Å; R304-P307 WeakPolarHBondContact O-CD 3.39Å
305	R	97.8	Very high	98.4	Very high	72 Å²	72	30.9 Å²	30.9	27%	0.272	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.2	172.4	-70.5	173.1	-72.6	177.3	-4.1	112.6	Y224 P281 E282 W301 D303	Y224-R305 PolarHBondContact OH-NH2 3.22Å; P281-R305 CarbonylContact C-O 3.49Å; P281-R305 VanDerWaalsContact CA-O 3.32Å; P281-R305 WeakPolarHBondContact CA-O 3.17Å; E282-R305 PolarHBondContact N-O 3.05Å; W301-R305 VanDerWaalsContact CD1-CZ 3.48Å; W301-R305 VanDerWaalsContact CD1-NH1 3.27Å; D303-R305 VanDerWaalsContact CG-NE 3.3Å; D303-R305 VanDerWaalsContact CG-NH2 3.33Å; D303-R305 PolarHBondContact O-N 3.26Å; D303-R305 VanDerWaalsContact OD1-CB 3.26Å; D303-R305 WeakPolarHBondContact OD1-CB 3.33Å; D303-R305 VanDerWaalsContact OD1-CG 3.31Å; D303-R305 WeakPolarHBondContact OD1-CG 3.02Å; D303-R305 IonicContact OD1-CZ 3.56Å; D303-R305 PolarHBondContact OD1-N 3.2Å; D303-R305 IonicContact OD1-NE 2.77Å; D303-R305 PolarHBondContact OD1-NE 2.85Å; D303-R305 IonicContact OD1-NH2 2.67Å; D303-R305 PolarHBondContact OD1-NH2 3.21Å; D303-R305 IonicContact OD2-CZ 3.23Å; D303-R305 VanDerWaalsContact OD2-CZ 3.23Å; D303-R305 IonicContact OD2-NE 3.05Å; D303-R305 PolarHBondContact OD2-NE 2.67Å; D303-R305 IonicContact OD2-NH2 3.66Å; D303-R305 PolarHBondContact OD2-NH2 3.05Å
306	N	98.3	Very high	98.4	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.011	17%	0.165	C	C	.	.			trans	-131.2	67.6	-175.7	-65.7	-53.5	0	0	0	113.8	G140 I279 F300 W301 D303 R304 H308	G140-N306 PolarHBondContact O-ND2 2.76Å; I279-N306 HydrophobicContact CG2-CB 3.74Å; F300-N306 HydrophobicContact CD2-CB 3.83Å; W301-N306 WeakPolarHBondContact CB-ND2 3.35Å; W301-N306 PolarHBondContact N-ND2 2.85Å; W301-N306 WeakPolarHBondContact O-CB 3.35Å; W301-N306 PolarHBondContact O-ND2 2.78Å; D303-N306 PolarHBondContact O-N 2.71Å; D303-N306 VanDerWaalsContact O-N 3.11Å; R304-N306 PolarHBondContact O-N 3.42Å; N306-H308 PolarHBondContact O-N 2.83Å; N306-H308 PolarHBondContact O-ND1 3Å
307	P	98.4	Very high	98.3	Very high	22 Å²	22	33 Å²	33	14%	0.143	16%	0.162	C	C	.	.			trans	-56.5	135.1	162.5	-19.2	31.9	0	0	0	109.8	R246 H247 V248 F280 R304	R246-P307 HydrophobicContact CG-CB 4.5Å; H247-P307 CarbonylContact O-C 3.45Å; H247-P307 VanDerWaalsContact O-CA 3.26Å; H247-P307 WeakPolarHBondContact O-CA 3.49Å; V248-P307 HydrophobicContact CG2-CB 4.03Å; V248-P307 HydrophobicContact CG2-CG 3.93Å; F280-P307 WeakPolarHBondContact CD2-O 3.5Å; F280-P307 PolarHBondContact N-O 2.8Å; F280-P307 WeakPolarHBondContact O-CD 3.48Å; R304-P307 VanDerWaalsContact O-CD 3.3Å; R304-P307 WeakPolarHBondContact O-CD 3.39Å
308	H	98.7	Very high	98.3	Very high	8 Å²	8	34.1 Å²	34.1	4%	0.037	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	159.1	-175.1	60.2	-86.1	0	0	0	112.5	R246 H247 D249 L277 R278 I279 F300 N306	R246-H308 CarbonylContact C-O 3.48Å; R246-H308 VanDerWaalsContact CA-O 3.28Å; R246-H308 WeakPolarHBondContact CA-O 3.4Å; H247-H308 AromaticContact CD2-NE2 3.99Å; H247-H308 AromaticContact CE1-CD2 3.81Å; H247-H308 AromaticContact CE1-NE2 3.61Å; H247-H308 PolarHBondContact N-O 2.92Å; H247-H308 PolarHBondContact ND1-O 2.88Å; H247-H308 AromaticContact NE2-CD2 3.99Å; H247-H308 AromaticContact NE2-CE1 3.97Å; H247-H308 AromaticContact NE2-NE2 3.32Å; H247-H308 PolarHBondContact NE2-NE2 2.84Å; H247-H308 PolarHBondContact O-N 3.1Å; D249-H308 IonicContact OD1-CE1 3.83Å; D249-H308 IonicContact OD1-NE2 2.79Å; D249-H308 IonicContact OD2-CE1 3.07Å; L277-H308 HydrophobicContact CD1-CB 4.18Å; R278-H308 CarbonylContact O-C 3.5Å; R278-H308 WeakPolarHBondContact O-CA 3.48Å; R278-H308 WeakPolarHBondContact O-CB 3.49Å; I279-H308 HydrophobicContact CB-CB 4.22Å; I279-H308 HydrophobicContact CG1-CB 3.88Å; I279-H308 HydrophobicContact CG2-CB 4.29Å; F300-H308 AromaticContact CE2-CE1 3.53Å; F300-H308 AromaticContact CE2-ND1 3.66Å; F300-H308 AromaticContact CZ-CE1 3.69Å; F300-H308 AromaticContact CZ-NE2 3.89Å; N306-H308 PolarHBondContact O-N 2.83Å; N306-H308 PolarHBondContact O-ND1 3Å
309	E	98.3	Very high	98.3	Very high	50 Å²	50	34.3 Å²	34.3	23%	0.234	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.9	178.9	67.6	-168.7	-172.7	0	0	110.7	Y244 R246 R278 F280	Y244-E309 WeakPolarHBondContact O-CA 3.46Å; Y244-E309 WeakPolarHBondContact O-CB 3.37Å; R246-E309 HydrophobicContact CB-CB 4.04Å; R278-E309 HydrophobicContact CB-CG 4.02Å; R278-E309 PolarHBondContact N-O 3.41Å; R278-E309 PolarHBondContact O-N 2.96Å; F280-E309 HydrophobicContact CE2-CG 4.03Å
310	V	98.5	Very high	98.3	Very high	13 Å²	13	34.2 Å²	34.2	8%	0.079	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	111.5	168.5	-178.8	0	0	0	0	107.1	Y237 G243 Y244 L277	Y237-V310 HydrophobicContact CD1-CG1 4.46Å; Y237-V310 HydrophobicContact CE1-CB 4.36Å; Y237-V310 HydrophobicContact CE1-CG1 4.07Å; G243-V310 WeakPolarHBondContact CA-O 3.44Å; Y244-V310 PolarHBondContact N-O 2.92Å; Y244-V310 PolarHBondContact O-N 3.34Å; L277-V310 HydrophobicContact CD1-CG2 4.04Å
311	Q	98.4	Very high	98.3	Very high	44 Å²	44	34.7 Å²	34.7	21%	0.206	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	156.5	175.9	-69.3	-172	-3.7	0	0	111.2	G275 L276 A313	G275-Q311 WeakPolarHBondContact CA-O 3.5Å; L276-Q311 HydrophobicContact CB-CB 4.39Å; L276-Q311 HydrophobicContact CB-CG 4.37Å; L276-Q311 PolarHBondContact O-N 2.89Å; Q311-A313 PolarHBondContact O-N 3.4Å
312	P	98.1	Very high	98.3	Very high	65 Å²	65	34.1 Å²	34.1	42%	0.422	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-47.8	124.1	177	-30.8	37.6	0	0	0	112.5	G241 G274 G275 F314	G241-P312 WeakPolarHBondContact O-CB 3.45Å; G274-P312 WeakPolarHBondContact CA-O 3.49Å; G275-P312 PolarHBondContact N-O 3.18Å; P312-F314 HydrophobicContact CB-CE2 4.04Å; P312-F314 HydrophobicContact CB-CZ 3.95Å
313	A	98.1	Very high	98.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	133.5	172.7	0	0	0	0	0	109.6	G239 N240 G241 T242 H273 Q311 R317	G239-A313 CarbonylContact C-O 3.57Å; G239-A313 WeakPolarHBondContact CA-O 3.41Å; N240-A313 PolarHBondContact N-O 3.25Å; G241-A313 WeakPolarHBondContact CA-O 3.08Å; G241-A313 PolarHBondContact N-O 2.92Å; T242-A313 PolarHBondContact O-N 2.99Å; H273-A313 WeakPolarHBondContact O-CA 3.38Å; Q311-A313 PolarHBondContact O-N 3.4Å; A313-R317 HydrophobicContact CB-CB 4.44Å
314	F	97.9	Very high	98.4	Very high	126 Å²	126	33.5 Å²	33.5	55%	0.553	16%	0.163	S	C	*	.	S	Bend	trans	-106.9	-7.7	179.3	-61.7	-77.6	0	0	0	113.1	H273 P312	H273-F314 PolarHBondContact O-N 2.9Å; P312-F314 HydrophobicContact CB-CE2 4.04Å; P312-F314 HydrophobicContact CB-CZ 3.95Å
315	S	98.1	Very high	98.4	Very high	40 Å²	40	28.6 Å²	28.6	28%	0.28	15%	0.145	S	C	.	.	S	Bend	trans	-120.9	160.4	169.1	-64.8	0	0	0	0	110.5	H273 R317	H273-S315 PolarHBondContact CD2-OG 3.21Å; S315-R317 PolarHBondContact O-N 3.17Å
316	T	98.1	Very high	98.5	Very high	66 Å²	66	25.7 Å²	25.7	41%	0.405	14%	0.135	S	C	.	.			trans	-61	120.6	176.7	-56.8	0	0	0	0	110.8	Y237 Y318	Y237-T316 CarbonylContact O-C 3.56Å; Y237-T316 WeakPolarHBondContact O-CA 3.38Å; T316-Y318 HydrophobicContact CG2-CD2 4.24Å; T316-Y318 HydrophobicContact CG2-CE1 4.19Å; T316-Y318 HydrophobicContact CG2-CE2 3.54Å
317	R	98.6	Very high	98.4	Very high	7 Å²	7	26.4 Å²	26.4	3%	0.026	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.7	-177	175.3	-170.2	-178.6	-77.6	6.2	110.7	C236 Y237 Y263 N265 W268 G275 P292 A313 S315	C236-R317 WeakPolarHBondContact CA-O 3.5Å; Y237-R317 PolarHBondContact N-O 3.38Å; Y237-R317 PolarHBondContact O-N 3.44Å; Y263-R317 VanDerWaalsContact CE1-NH2 3.32Å; N265-R317 VanDerWaalsContact OD1-CA 3.31Å; N265-R317 WeakPolarHBondContact OD1-CA 3.47Å; W268-R317 HydrophobicContact CH2-CB 3.67Å; W268-R317 HydrophobicContact CH2-CG 4.28Å; W268-R317 HydrophobicContact CZ2-CB 4.39Å; W268-R317 HydrophobicContact CZ3-CB 4.03Å; G275-R317 PolarHBondContact O-NE 3.09Å; P292-R317 HydrophobicContact CB-CG 4.33Å; P292-R317 HydrophobicContact CG-CG 4.29Å; A313-R317 HydrophobicContact CB-CB 4.44Å; S315-R317 PolarHBondContact O-N 3.17Å
318	Y	98.7	Very high	98.4	Very high	23 Å²	23	30.1 Å²	30.1	9%	0.09	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	143.8	175.7	-63.2	-69.2	0	0	0	111.9	L157 V160 K161 Y164 A235 C236 N265 T316	L157-Y318 HydrophobicContact CD1-CD2 3.97Å; L157-Y318 HydrophobicContact CD1-CE2 4.5Å; V160-Y318 HydrophobicContact CG1-CD1 3.52Å; V160-Y318 HydrophobicContact CG1-CE1 3.97Å; V160-Y318 HydrophobicContact CG1-CG 3.92Å; K161-Y318 HydrophobicContact CG-CE2 4.33Å; Y164-Y318 HydrophobicContact CD2-CE1 4.4Å; A235-Y318 WeakPolarHBondContact O-CA 3.45Å; C236-Y318 HydrophobicContact CB-CD1 3.76Å; C236-Y318 HydrophobicContact CB-CE1 3.56Å; C236-Y318 WeakPolarHBondContact SG-CE1 3.02Å; N265-Y318 PolarHBondContact ND2-O 3.05Å; N265-Y318 PolarHBondContact OD1-N 2.75Å; N265-Y318 PolarHBondContact OD1-O 3.4Å; T316-Y318 HydrophobicContact CG2-CD2 4.24Å; T316-Y318 HydrophobicContact CG2-CE1 4.19Å; T316-Y318 HydrophobicContact CG2-CE2 3.54Å
319	A	98.8	Very high	98.3	Very high	4 Å²	4	31.2 Å²	31.2	3%	0.033	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	152.8	170.4	0	0	0	0	0	110.2	A235 I261 Y262 Y263	A235-A319 PolarHBondContact N-O 2.96Å; A235-A319 PolarHBondContact O-N 2.93Å; A235-A319 VanDerWaalsContact O-N 3.1Å; I261-A319 HydrophobicContact CG2-CB 3.97Å; Y262-A319 CarbonylContact O-C 3.54Å; Y262-A319 WeakPolarHBondContact O-CA 3.41Å; Y263-A319 HydrophobicContact CD1-CB 3.88Å; Y263-A319 HydrophobicContact CE1-CB 4.07Å
320	I	98.8	Very high	98.2	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	125	172.3	-57.3	179.4	0	0	0	107.6	I156 V160 I203 L206 A232 M233 V234 I261 Y262 L264	I156-I320 HydrophobicContact CG2-CD1 3.62Å; V160-I320 HydrophobicContact CG2-CD1 3.83Å; V160-I320 HydrophobicContact CG2-CG1 4.26Å; I203-I320 HydrophobicContact CD1-CD1 4.5Å; I203-I320 HydrophobicContact CG1-CD1 4.1Å; I203-I320 HydrophobicContact CG2-CD1 4.29Å; L206-I320 HydrophobicContact CD2-CB 4.19Å; L206-I320 HydrophobicContact CD2-CD1 3.76Å; L206-I320 HydrophobicContact CD2-CG2 4.23Å; A232-I320 HydrophobicContact CB-CG2 3.85Å; M233-I320 WeakPolarHBondContact O-CA 3.39Å; V234-I320 HydrophobicContact CG1-CG1 4.32Å; V234-I320 HydrophobicContact CG2-CD1 4.48Å; V234-I320 HydrophobicContact CG2-CG1 4.19Å; V234-I320 HydrophobicContact CG2-CG2 4.48Å; I261-I320 CarbonylContact C-O 3.55Å; I261-I320 WeakPolarHBondContact CA-O 3.47Å; Y262-I320 PolarHBondContact N-O 2.73Å; Y262-I320 PolarHBondContact O-N 3.2Å; L264-I320 HydrophobicContact CD1-CD1 3.97Å; L264-I320 HydrophobicContact CD1-CG1 3.97Å
321	T	98.9	Very high	98.1	Very high	9 Å²	9	34.2 Å²	34.2	6%	0.055	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	135.3	-178.5	-52.3	0	0	0	0	111	M233 T259 C260 I261 W323	M233-T321 PolarHBondContact N-O 3.02Å; M233-T321 PolarHBondContact O-N 3.07Å; T259-T321 HydrophobicContact CG2-CG2 3.85Å; C260-T321 CarbonylContact O-C 3.52Å; C260-T321 WeakPolarHBondContact O-CA 3.44Å; I261-T321 HydrophobicContact CG1-CG2 3.97Å; T321-W323 HydrophobicContact CG2-CD2 4.03Å; T321-W323 HydrophobicContact CG2-CE3 4.13Å; T321-W323 HydrophobicContact CG2-CH2 3.61Å; T321-W323 HydrophobicContact CG2-CZ2 3.48Å; T321-W323 VanDerWaalsContact CG2-CZ2 3.48Å; T321-W323 HydrophobicContact CG2-CZ3 3.91Å
322	V	98.8	Very high	98	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.7	165.6	-63.2	0	0	0	0	108.8	M210 A232 C260 Y324	M210-V322 HydrophobicContact SD-CG1 4.49Å; M210-V322 HydrophobicContact SD-CG2 3.69Å; A232-V322 HydrophobicContact CB-CG1 3.97Å; C260-V322 HydrophobicContact CB-CG2 3.74Å; C260-V322 PolarHBondContact N-O 2.9Å; C260-V322 PolarHBondContact O-N 3.47Å; V322-Y324 HydrophobicContact CG2-CD2 4.43Å; V322-Y324 HydrophobicContact CG2-CE2 3.69Å
323	W	98.8	Very high	97.7	Very high	18 Å²	18	36.1 Å²	36.1	7%	0.068	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.7	172.8	-64.9	-92.2	0	0	0	110.1	W192 R229 T230 M233 D249 R256 V258 T259 T321	W192-W323 HydrophobicContact CH2-CE3 4.24Å; W192-W323 HydrophobicContact CH2-CH2 4.42Å; W192-W323 AromaticContact CH2-CZ3 3.57Å; W192-W323 HydrophobicContact CH2-CZ3 3.57Å; W192-W323 HydrophobicContact CZ3-CE3 4.44Å; W192-W323 AromaticContact CZ3-CZ3 3.95Å; W192-W323 HydrophobicContact CZ3-CZ3 3.95Å; R229-W323 CarbonylContact C-O 3.54Å; R229-W323 WeakPolarHBondContact CA-O 3.37Å; R229-W323 WeakPolarHBondContact CB-O 3.07Å; T230-W323 HydrophobicContact CG2-CB 4.03Å; T230-W323 HydrophobicContact CG2-CE3 4.16Å; T230-W323 PolarHBondContact N-O 3.39Å; T230-W323 PolarHBondContact OG1-N 3.42Å; T230-W323 VanDerWaalsContact OG1-N 3.08Å; M233-W323 HydrophobicContact CB-CH2 4.22Å; M233-W323 HydrophobicContact CB-CZ3 3.87Å; M233-W323 HydrophobicContact CE-CH2 3.64Å; M233-W323 HydrophobicContact CE-CZ2 4.49Å; M233-W323 HydrophobicContact CE-CZ3 4.45Å; M233-W323 HydrophobicContact SD-CH2 3.75Å; M233-W323 HydrophobicContact SD-CZ3 4.22Å; D249-W323 PolarHBondContact OD2-NE1 2.61Å; R256-W323 HydrophobicContact CB-CB 4.19Å; R256-W323 VanDerWaalsContact CD-CB 3.48Å; R256-W323 VanDerWaalsContact CD-CG 3.48Å; R256-W323 HydrophobicContact CG-CB 3.7Å; R256-W323 HydrophobicContact CG-CG 4.2Å; V258-W323 WeakPolarHBondContact O-CA 3.44Å; T259-W323 PolarHBondContact OG1-NE1 3.47Å; T321-W323 HydrophobicContact CG2-CD2 4.03Å; T321-W323 HydrophobicContact CG2-CE3 4.13Å; T321-W323 HydrophobicContact CG2-CH2 3.61Å; T321-W323 HydrophobicContact CG2-CZ2 3.48Å; T321-W323 VanDerWaalsContact CG2-CZ2 3.48Å; T321-W323 HydrophobicContact CG2-CZ3 3.91Å
324	Y	98.8	Very high	97.4	Very high	6 Å²	6	41.6 Å²	41.6	2%	0.024	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	143.4	174.4	-70.2	-86.2	0	0	0	110.6	M210 D211 I214 I226 G228 R229 R256 C257 V258 C260 V322	M210-Y324 VanDerWaalsContact CB-OH 3.31Å; M210-Y324 WeakPolarHBondContact CB-OH 3.48Å; M210-Y324 PolarHBondContact O-OH 3.33Å; D211-Y324 PolarHBondContact N-OH 2.65Å; D211-Y324 VanDerWaalsContact OD1-CE1 3.29Å; D211-Y324 WeakPolarHBondContact OD1-CE1 3.49Å; D211-Y324 PolarHBondContact OD1-OH 3.3Å; I214-Y324 HydrophobicContact CB-CD1 4.3Å; I214-Y324 HydrophobicContact CB-CE1 3.95Å; I214-Y324 HydrophobicContact CD1-CD2 4.33Å; I214-Y324 HydrophobicContact CD1-CE2 4.3Å; I214-Y324 HydrophobicContact CG1-CD1 4.2Å; I214-Y324 HydrophobicContact CG1-CD2 3.9Å; I214-Y324 HydrophobicContact CG1-CE1 3.87Å; I214-Y324 HydrophobicContact CG1-CE2 3.53Å; I214-Y324 HydrophobicContact CG1-CG 4.23Å; I214-Y324 HydrophobicContact CG2-CD1 3.82Å; I214-Y324 HydrophobicContact CG2-CE1 3.95Å; I214-Y324 HydrophobicContact CG2-CG 4.25Å; I226-Y324 HydrophobicContact CG2-CD1 3.77Å; I226-Y324 HydrophobicContact CG2-CG 4.19Å; G228-Y324 WeakPolarHBondContact O-CA 3.42Å; R229-Y324 HydrophobicContact CB-CD1 3.66Å; R229-Y324 HydrophobicContact CB-CE1 3.81Å; R229-Y324 HydrophobicContact CB-CG 4.12Å; R229-Y324 HydrophobicContact CG-CD1 4.31Å; R229-Y324 HydrophobicContact CG-CE1 3.98Å; R256-Y324 WeakPolarHBondContact CA-O 3.45Å; C257-Y324 PolarHBondContact N-O 2.95Å; C257-Y324 PolarHBondContact SG-O 3Å; C257-Y324 VanDerWaalsContact SG-O 3.41Å; V258-Y324 PolarHBondContact O-N 2.81Å; C260-Y324 HydrophobicContact CB-CD2 4.36Å; C260-Y324 HydrophobicContact CB-CE2 4Å; V322-Y324 HydrophobicContact CG2-CD2 4.43Å; V322-Y324 HydrophobicContact CG2-CE2 3.69Å
325	F	98.6	Very high	97	Very high	26 Å²	26	41.5 Å²	41.5	11%	0.114	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	134.1	-178	-64.6	-65.5	0	0	0	111.4	I226 N227 G228 R229 T230 G255 R256 R330	I226-F325 WeakPolarHBondContact CA-O 3.3Å; N227-F325 PolarHBondContact N-O 3.27Å; G228-F325 PolarHBondContact O-N 3.29Å; R229-F325 VanDerWaalsContact C-CE2 3.49Å; T230-F325 HydrophobicContact CG2-CE1 4.48Å; T230-F325 HydrophobicContact CG2-CE2 3.92Å; T230-F325 HydrophobicContact CG2-CZ 3.56Å; G255-F325 CarbonylContact O-C 3.51Å; G255-F325 VanDerWaalsContact O-CA 3.27Å; G255-F325 WeakPolarHBondContact O-CA 3.5Å; R256-F325 HydrophobicContact CG-CD1 3.86Å; R256-F325 HydrophobicContact CG-CE1 3.44Å; R256-F325 VanDerWaalsContact CG-CE1 3.44Å; R256-F325 HydrophobicContact CG-CZ 4.33Å; F325-R330 HydrophobicContact CB-CB 4.2Å; F325-R330 HydrophobicContact CB-CG 4.27Å; F325-R330 HydrophobicContact CD1-CG 4.14Å; F325-R330 HydrophobicContact CG-CG 4.19Å
326	D	98.5	Very high	96.4	Very high	10 Å²	10	47 Å²	47	5%	0.053	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	133.1	159.7	175.9	68.4	0	0	0	109.7	Y224 T225 G255 C257 D328 E329 R330	Y224-D326 WeakPolarHBondContact CA-OD1 3.39Å; Y224-D326 HydrophobicContact CD1-CB 3.67Å; Y224-D326 HydrophobicContact CE1-CB 4.26Å; T225-D326 PolarHBondContact N-OD1 3.26Å; G255-D326 PolarHBondContact O-N 2.94Å; C257-D326 HydrophobicContact CB-CB 4.04Å; C257-D326 PolarHBondContact SG-N 3.13Å; C257-D326 VanDerWaalsContact SG-N 3.41Å; D326-D328 PolarHBondContact O-N 2.69Å; D326-D328 PolarHBondContact OD2-N 2.88Å; D326-E329 HydrophobicContact CB-CB 4.19Å; D326-E329 WeakPolarHBondContact OD2-CB 3.37Å; D326-E329 PolarHBondContact OD2-N 2.74Å; D326-R330 WeakPolarHBondContact O-CB 3.5Å; D326-R330 PolarHBondContact O-N 2.84Å
327	A	97.6	Very high	95.4	Very high	18 Å²	18	50.4 Å²	50.4	15%	0.149	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-48.8	-175.1	0	0	0	0	0	112.3	T225 N227 A331	T225-A327 HydrophobicContact CG2-CB 4.32Å; T225-A327 WeakPolarHBondContact O-CB 3.49Å; T225-A327 PolarHBondContact O-N 3.47Å; N227-A327 HydrophobicContact CB-CB 4.22Å; N227-A327 VanDerWaalsContact ND2-CB 3.29Å; N227-A327 WeakPolarHBondContact ND2-CB 3.37Å; A327-A331 WeakPolarHBondContact O-CB 3.45Å; A327-A331 PolarHBondContact O-N 3.37Å
328	D	97.2	Very high	94.4	Very high	100 Å²	100	55.7 Å²	55.7	54%	0.535	26%	0.262	S	S	.	.	H	α-helix	trans	-75.2	-45.5	-171.8	-65.4	-25.5	0	0	0	111.2	D326 R330 A331 R332	D326-D328 PolarHBondContact O-N 2.69Å; D326-D328 PolarHBondContact OD2-N 2.88Å; D328-R330 VanDerWaalsContact C-N 3.33Å; D328-R330 PolarHBondContact O-N 3.49Å; D328-A331 PolarHBondContact O-N 2.86Å; D328-R332 WeakPolarHBondContact O-CG 3.35Å; D328-R332 PolarHBondContact O-N 2.94Å; D328-R332 VanDerWaalsContact O-N 3.08Å; D328-R332 PolarHBondContact O-NH1 3.48Å
329	E	97.4	Very high	93.1	Very high	31 Å²	31	59.8 Å²	59.8	15%	0.145	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-42	176.8	-166.6	-172.2	127	0	0	111.3	N250 G253 G255 D326 A331 R332 A333	N250-E329 PolarHBondContact ND2-OE1 3.05Å; G253-E329 VanDerWaalsContact C-OE1 3.25Å; G253-E329 WeakPolarHBondContact CA-OE1 3.3Å; G255-E329 VanDerWaalsContact CA-OE1 3.3Å; G255-E329 WeakPolarHBondContact CA-OE1 3.38Å; G255-E329 PolarHBondContact N-OE1 3.35Å; D326-E329 HydrophobicContact CB-CB 4.19Å; D326-E329 WeakPolarHBondContact OD2-CB 3.37Å; D326-E329 PolarHBondContact OD2-N 2.74Å; E329-A331 VanDerWaalsContact C-N 3.35Å; E329-A331 PolarHBondContact O-N 2.87Å; E329-R332 VanDerWaalsContact CA-NH2 3.34Å; E329-R332 PolarHBondContact O-N 3.45Å; E329-A333 WeakPolarHBondContact O-CB 3.19Å; E329-A333 PolarHBondContact O-N 3.36Å
330	R	96.6	Very high	91	Very high	67 Å²	67	62.9 Å²	62.9	25%	0.253	32%	0.322	S	S	.	.	H	α-helix	trans	-66.7	-36.2	177.9	-172.7	58.2	174.4	161.2	5.1	112.3	D254 F325 D326 D328 A333 K334	D254-R330 WeakPolarHBondContact O-CD 3.47Å; D254-R330 PolarHBondContact O-NH1 2.9Å; F325-R330 HydrophobicContact CB-CB 4.2Å; F325-R330 HydrophobicContact CB-CG 4.27Å; F325-R330 HydrophobicContact CD1-CG 4.14Å; F325-R330 HydrophobicContact CG-CG 4.19Å; D326-R330 WeakPolarHBondContact O-CB 3.5Å; D326-R330 PolarHBondContact O-N 2.84Å; D328-R330 VanDerWaalsContact C-N 3.33Å; D328-R330 PolarHBondContact O-N 3.49Å; R330-A333 PolarHBondContact O-N 3.46Å; R330-K334 WeakPolarHBondContact O-CG 3.16Å; R330-K334 PolarHBondContact O-N 3.44Å
331	A	95.9	Very high	88.5	Confident	58 Å²	58	65.3 Å²	65.3	48%	0.479	34%	0.342	S	S	.	.	H	α-helix	trans	-61.9	-49.9	174.8	0	0	0	0	0	111.2	A327 D328 E329 A333 K334 E335	A327-A331 WeakPolarHBondContact O-CB 3.45Å; A327-A331 PolarHBondContact O-N 3.37Å; D328-A331 PolarHBondContact O-N 2.86Å; E329-A331 VanDerWaalsContact C-N 3.35Å; E329-A331 PolarHBondContact O-N 2.87Å; A331-A333 VanDerWaalsContact C-N 3.32Å; A331-A333 PolarHBondContact O-N 2.69Å; A331-K334 PolarHBondContact O-N 2.96Å; A331-E335 PolarHBondContact O-N 3.28Å
332	R	95.7	Very high	85.6	Confident	144 Å²	144	67.9 Å²	67.9	54%	0.543	37%	0.37	S	S	.	.	H	α-helix	trans	-59.7	-41	175.5	-68.9	-172.5	-62.9	-88.9	1.1	112.4	D328 E329 E335 K336	D328-R332 WeakPolarHBondContact O-CG 3.35Å; D328-R332 PolarHBondContact O-N 2.94Å; D328-R332 VanDerWaalsContact O-N 3.08Å; D328-R332 PolarHBondContact O-NH1 3.48Å; E329-R332 VanDerWaalsContact CA-NH2 3.34Å; E329-R332 PolarHBondContact O-N 3.45Å; R332-E335 PolarHBondContact O-N 3.24Å; R332-K336 WeakPolarHBondContact O-CB 3.36Å; R332-K336 PolarHBondContact O-N 2.89Å
333	A	92.7	Very high	83.1	Confident	6 Å²	6	75.9 Å²	75.9	5%	0.05	41%	0.407	C	S	.	.	H	α-helix	trans	-61.6	-47.6	177.4	0	0	0	0	0	111.4	E329 R330 A331 E335 K336 Y337	E329-A333 WeakPolarHBondContact O-CB 3.19Å; E329-A333 PolarHBondContact O-N 3.36Å; R330-A333 PolarHBondContact O-N 3.46Å; A331-A333 VanDerWaalsContact C-N 3.32Å; A331-A333 PolarHBondContact O-N 2.69Å; A333-E335 VanDerWaalsContact C-N 3.33Å; A333-E335 PolarHBondContact O-N 3.35Å; A333-K336 PolarHBondContact O-N 3.3Å; A333-Y337 WeakPolarHBondContact O-CD2 3.48Å; A333-Y337 PolarHBondContact O-N 3.35Å
334	K	90.4	Very high	80.5	Confident	114 Å²	114	84.5 Å²	84.5	50%	0.496	45%	0.446	S	S	.	.	H	α-helix	trans	-60.7	-41.8	177.3	-73.8	177.9	-179	177.5	0	112	R330 A331 Y337 L338	R330-K334 WeakPolarHBondContact O-CG 3.16Å; R330-K334 PolarHBondContact O-N 3.44Å; A331-K334 PolarHBondContact O-N 2.96Å; K334-Y337 PolarHBondContact O-N 3.2Å; K334-L338 WeakPolarHBondContact O-CG 3.44Å; K334-L338 PolarHBondContact O-N 3.27Å
335	E	90.2	Very high	77.5	Confident	125 Å²	125	87.3 Å²	87.3	58%	0.584	48%	0.476	S	S	*	.	H	α-helix	trans	-61.9	-44.6	175.9	-175.6	175.6	-162.1	0	0	111.6	A331 R332 A333 Y337 L338 T339	A331-E335 PolarHBondContact O-N 3.28Å; R332-E335 PolarHBondContact O-N 3.24Å; A333-E335 VanDerWaalsContact C-N 3.33Å; A333-E335 PolarHBondContact O-N 3.35Å; E335-Y337 VanDerWaalsContact C-N 3.31Å; E335-Y337 PolarHBondContact O-N 3.29Å; E335-L338 PolarHBondContact O-N 3.19Å; E335-T339 HydrophobicContact CG-CG2 4.34Å; E335-T339 WeakPolarHBondContact O-CB 3.2Å; E335-T339 WeakPolarHBondContact O-CG2 3.46Å; E335-T339 PolarHBondContact O-N 3.34Å; E335-T339 PolarHBondContact O-OG1 2.97Å
336	K	84.9	Confident	74.7	Confident	155 Å²	155	93.2 Å²	93.2	67%	0.674	51%	0.514	S	S	*	.	H	α-helix	trans	-61.6	-37.8	174.7	-172.7	179.2	179.8	-179	0	112.5	R332 A333 T339 G340	R332-K336 WeakPolarHBondContact O-CB 3.36Å; R332-K336 PolarHBondContact O-N 2.89Å; A333-K336 PolarHBondContact O-N 3.3Å; K336-T339 WeakPolarHBondContact CA-OG1 3.09Å; K336-T339 PolarHBondContact O-OG1 3.29Å; K336-G340 WeakPolarHBondContact O-CA 3.42Å; K336-G340 PolarHBondContact O-N 3.02Å
337	Y	78.4	Confident	71.8	Confident	137 Å²	137	100 Å²	100	54%	0.537	54%	0.543	S	S	.	.	H	α-helix	trans	-67.1	-42.8	173.6	-86.5	-75.1	0	0	0	111.8	A333 K334 E335 A341	A333-Y337 WeakPolarHBondContact O-CD2 3.48Å; A333-Y337 PolarHBondContact O-N 3.35Å; K334-Y337 PolarHBondContact O-N 3.2Å; E335-Y337 VanDerWaalsContact C-N 3.31Å; E335-Y337 PolarHBondContact O-N 3.29Å; Y337-A341 WeakPolarHBondContact O-CA 3.35Å; Y337-A341 WeakPolarHBondContact O-CB 3.46Å; Y337-A341 PolarHBondContact O-N 3.35Å
338	L	76.1	Confident	68.7	Low	118 Å²	118	105.9 Å²	105.9	62%	0.618	58%	0.577	S	S	*	*	H	α-helix	trans	-69.2	-39	179.6	-72.4	172.2	0	0	0	112.9	K334 E335 A341	K334-L338 WeakPolarHBondContact O-CG 3.44Å; K334-L338 PolarHBondContact O-N 3.27Å; E335-L338 PolarHBondContact O-N 3.19Å; L338-A341 CarbonylContact O-C 3.6Å
339	T	71.6	Confident	65.8	Low	110 Å²	110	107.6 Å²	107.6	68%	0.675	58%	0.581	S	S	*	*	H	α-helix	trans	-80.3	-29.1	179.3	54.3	0	0	0	0	112.4	E335 K336	E335-T339 HydrophobicContact CG-CG2 4.34Å; E335-T339 WeakPolarHBondContact O-CB 3.2Å; E335-T339 WeakPolarHBondContact O-CG2 3.46Å; E335-T339 PolarHBondContact O-N 3.34Å; E335-T339 PolarHBondContact O-OG1 2.97Å; K336-T339 WeakPolarHBondContact CA-OG1 3.09Å; K336-T339 PolarHBondContact O-OG1 3.29Å
340	G	54.8	Low	62.8	Low	68 Å²	68	113.2 Å²	113.2	70%	0.701	61%	0.612	S	S	*	*	H	α-helix	trans	-84.8	-27.8	174	0	0	0	0	0	114.4	K336	K336-G340 WeakPolarHBondContact O-CA 3.42Å; K336-G340 PolarHBondContact O-N 3.02Å
341	A	47.7	Very low	59.8	Low	52 Å²	52	118 Å²	118	43%	0.43	64%	0.642	S	S	.	*	S	Bend	trans	-104.2	61.6	172.3	0	0	0	0	0	109.8	Y337 L338 E343	Y337-A341 WeakPolarHBondContact O-CA 3.35Å; Y337-A341 WeakPolarHBondContact O-CB 3.46Å; Y337-A341 PolarHBondContact O-N 3.35Å; L338-A341 CarbonylContact O-C 3.6Å; A341-E343 PolarHBondContact O-N 2.9Å
342	G	37.6	Very low	57.1	Low	63 Å²	63	124.8 Å²	124.8	65%	0.649	66%	0.661	S	S	*	*			trans	-47.5	109.8	155.6	0	0	0	0	0	107.6
343	E	44.7	Very low	54.2	Low	167 Å²	167	123.2 Å²	123.2	78%	0.78	67%	0.672	S	S	*	*	S	Bend	trans	98	100.8	-173.9	-54.9	-174.7	174.3	0	0	117.2	A341	A341-E343 PolarHBondContact O-N 2.9Å
344	K	45.3	Very low	51.6	Low	200 Å²	200	128.4 Å²	128.4	87%	0.87	71%	0.708	S	S	*	*			trans	85.8	106.2	149.5	-56.5	175.6	-174.7	176.3	0	118
345	G	36	Very low	48.8	Very low	64 Å²	64	130.1 Å²	130.1	66%	0.66	72%	0.723	S	S	*	*			trans	-176.8	103.7	157	0	0	0	0	0	113.6
346	V	38.8	Very low	46.8	Very low	150 Å²	150	129.9 Å²	129.9	91%	0.909	73%	0.732	S	S	*	*			trans	-78.5	142.5	179.2	174.3	0	0	0	0	111.3
347	K	37.4	Very low	45.1	Very low	152 Å²	152	131.8 Å²	131.8	66%	0.661	77%	0.765	S	S	*	*			trans	-78.5	146.1	-174.6	-169.3	-174.8	-172	-170.6	0	112.6	E349	K347-E349 HydrophobicContact CD-CG 4.11Å; K347-E349 WeakPolarHBondContact CE-OE1 3.5Å; K347-E349 HydrophobicContact CG-CG 4.34Å; K347-E349 IonicContact NZ-OE1 3.57Å; K347-E349 PolarHBondContact NZ-OE1 3.12Å
348	V	33.5	Very low	43.4	Very low	143 Å²	143	131.6 Å²	131.6	87%	0.867	78%	0.776	S	S	*	*			trans	-123.9	130.1	160.7	-178.5	0	0	0	0	108.2
349	E	36.6	Very low	41.7	Very low	135 Å²	135	132.3 Å²	132.3	63%	0.631	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-100.2	157.7	-179.9	-69.6	-172.5	167.4	0	0	111.9	K347	K347-E349 HydrophobicContact CD-CG 4.11Å; K347-E349 WeakPolarHBondContact CE-OE1 3.5Å; K347-E349 HydrophobicContact CG-CG 4.34Å; K347-E349 IonicContact NZ-OE1 3.57Å; K347-E349 PolarHBondContact NZ-OE1 3.12Å
350	L	33.4	Very low	40	Very low	149 Å²	149	133.5 Å²	133.5	78%	0.78	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.3	132.5	175.5	-68.8	164.2	0	0	0	110	K352	L350-K352 PolarHBondContact O-N 3.32Å
351	N	34.7	Very low	39.1	Very low	167 Å²	167	137.4 Å²	137.4	89%	0.893	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-57.8	126	178.5	-71.2	-19.3	0	0	0	111.1
352	K	37.7	Very low	38.6	Very low	202 Å²	202	142.7 Å²	142.7	88%	0.878	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-89.2	145.5	164.8	-73.6	-179.2	176.9	177	0	109.4	L350 S354	L350-K352 PolarHBondContact O-N 3.32Å; K352-S354 PolarHBondContact O-N 3.32Å
353	S	35.5	Very low	38.7	Very low	110 Å²	110	148 Å²	148	77%	0.769	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-61.5	129.4	172.3	49.5	0	0	0	0	110.7
354	S	37.8	Very low	38.2	Very low	116 Å²	116	146.6 Å²	146.6	81%	0.811	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-77.4	118.2	169.9	34	0	0	0	0	110	K352	K352-S354 PolarHBondContact O-N 3.32Å
355	D	31.8	Very low	37.7	Very low	149 Å²	149	142.5 Å²	142.5	80%	0.797	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-76.2	139.1	165.7	-84.9	-34.1	0	0	0	110
356	P	48.7	Very low	37.8	Very low	121 Å²	121	149.1 Å²	149.1	79%	0.786	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-79.9	140.2	178.5	32.3	-31.8	0	0	0	111.1
357	S	47.9	Very low	37.7	Very low	195 Å²	195	149 Å²	149	100%	1.364	84%	0.84	S	S	*	*			trans	-82.3	0	169.1	-58.7	0	0	0	0	112.3

Retrieved 357 of 357 residues in 89.4 ms (Link to these results)

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