A0A096NNZ7_PAPAN Loading...

Lipoyl synthase, mitochondrial

Catalyzes the radical-mediated insertion of two sulfur atoms into the C-6 and C-8 positions of the octanoyl moiety bound to the lipoyl domains of lipoate-dependent enzymes, thereby converting the octanoylated domains into lipoylated derivatives.

AlphaFold DB , UniProt , Accession A0A096NNZ7, Species PAPAN (Papio anubis, Olive baboon), Gene LIAS, Length 372 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.3	Very low	30.8	Very low	251 Å²	251	157.4 Å²	157.4	100%	1.236	89%	0.887	S	S	*	*				0	120.7	0	-77.2	170.4	152.9	0	0	106.3
2	S	30.9	Very low	30.9	Very low	117 Å²	117	159.6 Å²	159.6	82%	0.818	89%	0.893	S	S	*	*			cis	-148.5	145.1	31.8	-173.9	0	0	0	0	110.4
3	L	28.8	Very low	30.7	Very low	158 Å²	158	152.4 Å²	152.4	83%	0.827	88%	0.877	S	S	*	*			trans	-65.2	151.4	163.8	-73.5	138.5	0	0	0	110.8
4	R	30	Very low	30.7	Very low	254 Å²	254	150.2 Å²	150.2	96%	0.958	87%	0.871	S	S	*	*			trans	-152.7	132.4	134.6	-104	176.3	-154	-122.5	4.1	110.4
5	C	29.2	Very low	30.7	Very low	133 Å²	133	156.3 Å²	156.3	90%	0.899	87%	0.874	S	S	*	*			trans	-92.9	158.1	-179.8	-154.6	0	0	0	0	109.4
6	G	28.9	Very low	30.7	Very low	68 Å²	68	155.2 Å²	155.2	70%	0.701	87%	0.871	S	S	*	*			trans	172.2	87	171.3	0	0	0	0	0	114.4
7	D	29.7	Very low	30.6	Very low	165 Å²	165	157.6 Å²	157.6	88%	0.882	87%	0.871	S	S	*	*			trans	32.4	118.7	146.8	-60.7	-41.3	0	0	0	121.4
8	A	31.3	Very low	30.4	Very low	105 Å²	105	152.1 Å²	152.1	87%	0.868	86%	0.855	S	S	*	*			trans	-124.3	110.5	155.8	0	0	0	0	0	110.1
9	A	31.1	Very low	30.2	Very low	95 Å²	95	157 Å²	157	79%	0.785	86%	0.859	S	S	*	*			trans	-64	143.1	176.7	0	0	0	0	0	112.3
10	R	33.1	Very low	30.3	Very low	247 Å²	247	160.7 Å²	160.7	93%	0.932	86%	0.861	S	S	*	*			trans	-63.1	127.4	169.3	-77.3	174.4	169.6	-178.9	-3.3	110.9
11	T	30.1	Very low	30.3	Very low	138 Å²	138	161 Å²	161	85%	0.847	86%	0.862	S	S	*	*			trans	-132.3	121.9	154.2	41.6	0	0	0	0	109.7	G13	T11-G13 PolarHBondContact O-N 3.42Å
12	L	32.2	Very low	30	Very low	184 Å²	184	155.3 Å²	155.3	96%	0.963	85%	0.846	S	S	*	*			trans	-70.7	114.1	174.7	-82.8	143.9	0	0	0	109.2
13	G	28.7	Very low	30	Very low	66 Å²	66	154.8 Å²	154.8	68%	0.68	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-85.5	143.3	169.2	0	0	0	0	0	111.8	T11	T11-G13 PolarHBondContact O-N 3.42Å
14	P	30.8	Very low	29.9	Very low	122 Å²	122	153.1 Å²	153.1	79%	0.792	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-74.7	144.3	-175.9	29.9	-32.9	0	0	0	112.4	V16	P14-V16 PolarHBondContact O-N 3.29Å
15	R	30.3	Very low	29.9	Very low	242 Å²	242	147.7 Å²	147.7	91%	0.913	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-59.1	119.4	173.3	-71.2	-179.4	179.8	-164.7	-0.5	110.2	F17	R15-F17 PolarHBondContact O-N 3.42Å
16	V	30.8	Very low	29.8	Very low	138 Å²	138	152.2 Å²	152.2	84%	0.836	83%	0.833	S	S	*	*			trans	-77.4	110.3	171.9	178.2	0	0	0	0	108.9	P14 G18	P14-V16 PolarHBondContact O-N 3.29Å; V16-G18 PolarHBondContact O-N 3.4Å
17	F	28.6	Very low	29.7	Very low	197 Å²	197	154.8 Å²	154.8	86%	0.864	84%	0.838	S	S	*	*			trans	-71.5	112.6	161.1	-98.2	-95.2	0	0	0	108.4	R15 R19	R15-F17 PolarHBondContact O-N 3.42Å; F17-R19 PolarHBondContact O-N 3.36Å
18	G	27.8	Very low	29.9	Very low	57 Å²	57	155.1 Å²	155.1	59%	0.588	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-70	119.5	173.6	0	0	0	0	0	111.1	V16 Y20	V16-G18 PolarHBondContact O-N 3.4Å; G18-Y20 PolarHBondContact O-N 3.46Å
19	R	27.2	Very low	30	Very low	246 Å²	246	155.7 Å²	155.7	93%	0.928	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-65.7	119.7	171.4	-72.7	175.3	171.1	-173.4	-3.7	109.8	F17	F17-R19 PolarHBondContact O-N 3.36Å
20	Y	31.9	Very low	30.3	Very low	230 Å²	230	156.2 Å²	156.2	90%	0.902	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-80.2	120.3	164.2	-76.5	-88.2	0	0	0	108.9	G18	G18-Y20 PolarHBondContact O-N 3.46Å
21	L	30.7	Very low	30.5	Very low	167 Å²	167	149 Å²	149	87%	0.874	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-70.8	128.8	171.4	-75.9	160.1	0	0	0	109.2	S23	L21-S23 PolarHBondContact O-N 3.29Å
22	C	28.8	Very low	31.1	Very low	133 Å²	133	146.1 Å²	146.1	90%	0.899	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-56.6	117.3	172.5	-101.8	0	0	0	0	111
23	S	29.7	Very low	31.4	Very low	105 Å²	105	142.6 Å²	142.6	73%	0.734	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-84.6	144.7	157.8	-78	0	0	0	0	109.5	L21 V25	L21-S23 PolarHBondContact O-N 3.29Å; S23-V25 PolarHBondContact O-N 3.26Å
24	P	27.8	Very low	31.6	Very low	124 Å²	124	146.9 Å²	146.9	81%	0.805	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-66.1	132.6	-178.9	25.7	-31.2	0	0	0	110.9	R26	P24-R26 PolarHBondContact O-N 3.42Å
25	V	29.5	Very low	32	Very low	140 Å²	140	146.3 Å²	146.3	85%	0.848	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-53.6	118.6	174.5	177.2	0	0	0	0	109.2	S23	S23-V25 PolarHBondContact O-N 3.26Å
26	R	27	Very low	32.5	Very low	227 Å²	227	139 Å²	139	86%	0.857	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-67.2	134	166.6	-83	-176.9	175.4	-169.7	-1.6	108.5	P24 L28	P24-R26 PolarHBondContact O-N 3.42Å; R26-L28 PolarHBondContact O-N 2.88Å
27	P	26.6	Very low	32.6	Very low	122 Å²	122	138.1 Å²	138.1	79%	0.792	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-64.9	133.6	176.8	26.4	-31.5	0	0	0	109.9	S29	P27-S29 PolarHBondContact O-N 3.36Å
28	L	34.4	Very low	32.9	Very low	172 Å²	172	135.2 Å²	135.2	90%	0.901	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-53.3	117.8	170.3	-132	81.3	0	0	0	108.1	R26 S30	R26-L28 PolarHBondContact O-N 2.88Å; L28-S30 PolarHBondContact O-N 3.49Å
29	S	33.1	Very low	33.4	Very low	117 Å²	117	136.3 Å²	136.3	82%	0.818	71%	0.713	S	S	*	*			trans	-69.4	103.5	175	61.1	0	0	0	0	109	P27	P27-S29 PolarHBondContact O-N 3.36Å
30	S	37.3	Very low	34	Very low	106 Å²	106	131.4 Å²	131.4	74%	0.741	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-71	132.5	171.3	48.5	0	0	0	0	109.9	L28	L28-S30 PolarHBondContact O-N 3.49Å
31	L	37.8	Very low	34.3	Very low	95 Å²	95	127.2 Å²	127.2	50%	0.497	69%	0.694	S	S	.	*	P	Polyproline II helix	trans	-66.8	136.7	170	-74.9	160.4	0	0	0	109.2	K36	L31-K36 WeakPolarHBondContact O-CE 3.45Å
32	P	41.9	Very low	34.8	Very low	78 Å²	78	121 Å²	121	51%	0.506	67%	0.67	S	S	.	*	P	Polyproline II helix	trans	-57.9	141.2	172.8	-22.3	32	0	0	0	111.7	E34 K35 K36	P32-E34 VanDerWaalsContact C-N 3.28Å; P32-E34 PolarHBondContact O-N 3.28Å; P32-K35 WeakPolarHBondContact O-CB 3.3Å; P32-K35 PolarHBondContact O-N 3.41Å; P32-K36 PolarHBondContact O-N 3.42Å
33	D	38.2	Very low	35	Very low	111 Å²	111	118.9 Å²	118.9	59%	0.594	66%	0.655	S	S	*	*	H	α-helix	trans	-62.2	-31.9	-170.4	-64	-45.3	0	0	0	113.6	K35 K36 E37	D33-K35 PolarHBondContact O-N 2.95Å; D33-K36 WeakPolarHBondContact O-CA 3.48Å; D33-K36 WeakPolarHBondContact O-CB 3.41Å; D33-K36 PolarHBondContact O-N 3.43Å; D33-K36 IonicContact OD1-NZ 2.81Å; D33-K36 PolarHBondContact OD1-NZ 3.2Å; D33-E37 PolarHBondContact O-N 3.41Å; D33-E37 VanDerWaalsContact O-N 3.13Å
34	E	33.7	Very low	35.5	Very low	155 Å²	155	117.7 Å²	117.7	72%	0.724	64%	0.64	S	S	*	*	H	α-helix	trans	-62.4	-28.1	174.3	-153.8	176.6	-152.1	0	0	112.8	P32	P32-E34 VanDerWaalsContact C-N 3.28Å; P32-E34 PolarHBondContact O-N 3.28Å
35	K	38.7	Very low	36.2	Very low	110 Å²	110	113 Å²	113	48%	0.478	61%	0.608	S	S	.	*	H	α-helix	trans	-85	-16.9	173.9	-70.9	-176.7	179	175.9	0	113	P32 D33 L39	P32-K35 WeakPolarHBondContact O-CB 3.3Å; P32-K35 PolarHBondContact O-N 3.41Å; D33-K35 PolarHBondContact O-N 2.95Å; K35-L39 WeakPolarHBondContact O-CD1 3.45Å; K35-L39 WeakPolarHBondContact O-CG 3.16Å
36	K	40.5	Very low	36.8	Very low	90 Å²	90	111.7 Å²	111.7	39%	0.391	59%	0.593	S	S	.	*	H	α-helix	trans	-76.7	-38.3	170.5	-65.7	178.1	-171.8	154.6	0	110.5	L31 P32 D33 L39 Q40	L31-K36 WeakPolarHBondContact O-CE 3.45Å; P32-K36 PolarHBondContact O-N 3.42Å; D33-K36 WeakPolarHBondContact O-CA 3.48Å; D33-K36 WeakPolarHBondContact O-CB 3.41Å; D33-K36 PolarHBondContact O-N 3.43Å; D33-K36 IonicContact OD1-NZ 2.81Å; D33-K36 PolarHBondContact OD1-NZ 3.2Å; K36-L39 PolarHBondContact O-N 3.43Å; K36-Q40 WeakPolarHBondContact O-CG 3.41Å; K36-Q40 PolarHBondContact O-N 3.11Å
37	E	33.9	Very low	37.4	Very low	118 Å²	118	105.7 Å²	105.7	55%	0.551	58%	0.578	S	S	*	*	H	α-helix	trans	-64.6	-40.5	176.5	-73.5	-178.8	157.3	0	0	112.4	D33 L39 Q40 N41	D33-E37 PolarHBondContact O-N 3.41Å; D33-E37 VanDerWaalsContact O-N 3.13Å; E37-L39 VanDerWaalsContact C-N 3.27Å; E37-L39 PolarHBondContact O-N 3Å; E37-Q40 PolarHBondContact O-N 3.43Å; E37-Q40 VanDerWaalsContact O-N 3.14Å; E37-N41 PolarHBondContact O-N 3.24Å; E37-N41 PolarHBondContact O-ND2 3.09Å; E37-N41 VanDerWaalsContact O-ND2 3.16Å
38	L	34.1	Very low	38	Very low	137 Å²	137	103.9 Å²	103.9	72%	0.717	56%	0.558	S	S	*	*	H	α-helix	trans	-65.9	-25.4	174	-95.1	153.5	0	0	0	114
39	L	38.4	Very low	38.4	Very low	79 Å²	79	97.8 Å²	97.8	41%	0.414	53%	0.528	S	S	.	.	H	α-helix	trans	-82.5	-24.4	173	-75.6	166.5	0	0	0	112.3	K35 K36 E37	K35-L39 WeakPolarHBondContact O-CD1 3.45Å; K35-L39 WeakPolarHBondContact O-CG 3.16Å; K36-L39 PolarHBondContact O-N 3.43Å; E37-L39 VanDerWaalsContact C-N 3.27Å; E37-L39 PolarHBondContact O-N 3Å
40	Q	39.6	Very low	38.8	Very low	144 Å²	144	94.4 Å²	94.4	67%	0.673	50%	0.504	S	S	*	.	H	α-helix	trans	-81.2	-22.7	177.8	-77.9	175.5	-9.9	0	0	113.4	K36 E37	K36-Q40 WeakPolarHBondContact O-CG 3.41Å; K36-Q40 PolarHBondContact O-N 3.11Å; E37-Q40 PolarHBondContact O-N 3.43Å; E37-Q40 VanDerWaalsContact O-N 3.14Å
41	N	38.8	Very low	39	Very low	141 Å²	141	92.5 Å²	92.5	75%	0.754	50%	0.501	S	S	*	.	S	Bend	trans	-101.3	4.8	-173.5	-65.9	-31.1	0	0	0	114.6	E37	E37-N41 PolarHBondContact O-N 3.24Å; E37-N41 PolarHBondContact O-ND2 3.09Å; E37-N41 VanDerWaalsContact O-ND2 3.16Å
42	G	40	Very low	39.2	Very low	37 Å²	37	94.5 Å²	94.5	38%	0.381	51%	0.512	S	S	.	.	S	Bend	trans	-93.4	156.7	166.7	0	0	0	0	0	110.6	D44	G42-D44 PolarHBondContact O-N 2.7Å
43	P	34	Very low	39.3	Very low	89 Å²	89	93 Å²	93	58%	0.578	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-57.6	126.7	177	23.7	-32.1	0	0	0	110.1	D47 F48	P43-D47 WeakPolarHBondContact CA-OD2 3.33Å; P43-D47 HydrophobicContact CB-CB 4.17Å; P43-F48 HydrophobicContact CB-CD2 4.48Å; P43-F48 HydrophobicContact CB-CE2 3.67Å; P43-F48 HydrophobicContact CB-CZ 4.3Å; P43-F48 HydrophobicContact CG-CE2 3.75Å; P43-F48 HydrophobicContact CG-CZ 4.09Å
44	D	40.8	Very low	39.4	Very low	79 Å²	79	92 Å²	92	42%	0.422	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-74.8	162.2	-177.2	-172.6	24.2	0	0	0	110	G42 Q46 D47 F48	G42-D44 PolarHBondContact O-N 2.7Å; D44-Q46 HydrophobicContact CB-CB 4.43Å; D44-Q46 PolarHBondContact O-N 3.39Å; D44-Q46 VanDerWaalsContact O-N 3.13Å; D44-Q46 PolarHBondContact OD2-NE2 3.05Å; D44-D47 PolarHBondContact N-OD2 2.97Å; D44-D47 WeakPolarHBondContact O-CB 3.33Å; D44-D47 PolarHBondContact O-N 3.36Å; D44-F48 WeakPolarHBondContact O-CD2 3.34Å
45	L	41.2	Very low	39.9	Very low	26 Å²	26	88.7 Å²	88.7	14%	0.136	49%	0.494	C	S	.	.	H	α-helix	trans	-52.1	-35	169.5	179.4	62.2	0	0	0	111.2	D47 F48 V49 A355	L45-D47 VanDerWaalsContact C-N 3.28Å; L45-D47 PolarHBondContact O-N 2.89Å; L45-F48 PolarHBondContact O-N 3.15Å; L45-V49 HydrophobicContact CD1-CG2 3.62Å; L45-V49 HydrophobicContact CG-CG2 3.79Å; L45-V49 VanDerWaalsContact O-CB 3.31Å; L45-V49 WeakPolarHBondContact O-CB 3.28Å; L45-V49 VanDerWaalsContact O-CG2 3.3Å; L45-V49 WeakPolarHBondContact O-CG2 3.32Å; L45-V49 PolarHBondContact O-N 3.49Å; L45-A355 HydrophobicContact CD1-CB 3.3Å
46	Q	42.6	Very low	40.4	Very low	113 Å²	113	92.5 Å²	92.5	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-57.1	-41.1	173.2	-77.4	168.3	70.4	0	0	111.5	D44 F48 V49 S50	D44-Q46 HydrophobicContact CB-CB 4.43Å; D44-Q46 PolarHBondContact O-N 3.39Å; D44-Q46 VanDerWaalsContact O-N 3.13Å; D44-Q46 PolarHBondContact OD2-NE2 3.05Å; Q46-F48 PolarHBondContact O-N 2.85Å; Q46-V49 PolarHBondContact O-N 2.86Å; Q46-S50 WeakPolarHBondContact O-CA 2.95Å; Q46-S50 WeakPolarHBondContact O-CB 3.42Å; Q46-S50 PolarHBondContact O-N 2.92Å; Q46-S50 PolarHBondContact O-OG 2.98Å
47	D	40.7	Very low	40.8	Very low	101 Å²	101	91.1 Å²	91.1	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-67.1	-22.1	-179.6	-58.9	-36.4	0	0	0	113.2	P43 D44 L45	P43-D47 WeakPolarHBondContact CA-OD2 3.33Å; P43-D47 HydrophobicContact CB-CB 4.17Å; D44-D47 PolarHBondContact N-OD2 2.97Å; D44-D47 WeakPolarHBondContact O-CB 3.33Å; D44-D47 PolarHBondContact O-N 3.36Å; L45-D47 VanDerWaalsContact C-N 3.28Å; L45-D47 PolarHBondContact O-N 2.89Å
48	F	38.6	Very low	41.7	Very low	84 Å²	84	88.7 Å²	88.7	37%	0.368	50%	0.501	S	S	.	.	H	α-helix	trans	-96.5	-32.4	176.6	-71	-84.7	0	0	0	113.7	P43 D44 L45 Q46 F358	P43-F48 HydrophobicContact CB-CD2 4.48Å; P43-F48 HydrophobicContact CB-CE2 3.67Å; P43-F48 HydrophobicContact CB-CZ 4.3Å; P43-F48 HydrophobicContact CG-CE2 3.75Å; P43-F48 HydrophobicContact CG-CZ 4.09Å; D44-F48 WeakPolarHBondContact O-CD2 3.34Å; L45-F48 PolarHBondContact O-N 3.15Å; Q46-F48 PolarHBondContact O-N 2.85Å; F48-F358 HydrophobicContact CZ-CE2 4.27Å
49	V	42.6	Very low	43	Very low	44 Å²	44	84 Å²	84	27%	0.267	47%	0.473	S	S	.	.	H	α-helix	trans	-81.3	-24.3	176.7	172.7	0	0	0	0	111.2	L45 Q46 G51 L53	L45-V49 HydrophobicContact CD1-CG2 3.62Å; L45-V49 HydrophobicContact CG-CG2 3.79Å; L45-V49 VanDerWaalsContact O-CB 3.31Å; L45-V49 WeakPolarHBondContact O-CB 3.28Å; L45-V49 VanDerWaalsContact O-CG2 3.3Å; L45-V49 WeakPolarHBondContact O-CG2 3.32Å; L45-V49 PolarHBondContact O-N 3.49Å; Q46-V49 PolarHBondContact O-N 2.86Å; V49-G51 VanDerWaalsContact C-N 3.29Å; V49-G51 PolarHBondContact O-N 3.38Å; V49-L53 HydrophobicContact CG1-CD1 3.47Å; V49-L53 VanDerWaalsContact CG1-CD1 3.47Å; V49-L53 WeakPolarHBondContact O-CD1 3.48Å
50	S	42	Very low	43.9	Very low	45 Å²	45	85.8 Å²	85.8	32%	0.315	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	7	-172.8	60.7	0	0	0	0	115.9	Q46 D52 L53	Q46-S50 WeakPolarHBondContact O-CA 2.95Å; Q46-S50 WeakPolarHBondContact O-CB 3.42Å; Q46-S50 PolarHBondContact O-N 2.92Å; Q46-S50 PolarHBondContact O-OG 2.98Å; S50-D52 WeakPolarHBondContact O-CA 3.33Å; S50-D52 PolarHBondContact O-N 3.29Å; S50-L53 PolarHBondContact O-N 3.42Å
51	G	40.5	Very low	45.1	Very low	66 Å²	66	86 Å²	86	68%	0.68	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-16.4	178.3	0	0	0	0	0	115.3	V49	V49-G51 VanDerWaalsContact C-N 3.29Å; V49-G51 PolarHBondContact O-N 3.38Å
52	D	42.3	Very low	46.9	Very low	138 Å²	138	81.8 Å²	81.8	74%	0.738	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-160.7	17.6	157.9	-97.5	-31.4	0	0	0	114.1	S50	S50-D52 WeakPolarHBondContact O-CA 3.33Å; S50-D52 PolarHBondContact O-N 3.29Å
53	L	43.8	Very low	48.5	Very low	47 Å²	47	89.8 Å²	89.8	25%	0.246	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-0.4	179.9	-73.9	172.6	0	0	0	113.7	V49 S50 D55 W59 W79	V49-L53 HydrophobicContact CG1-CD1 3.47Å; V49-L53 VanDerWaalsContact CG1-CD1 3.47Å; V49-L53 WeakPolarHBondContact O-CD1 3.48Å; S50-L53 PolarHBondContact O-N 3.42Å; L53-D55 VanDerWaalsContact C-N 3.26Å; L53-D55 PolarHBondContact O-N 3.26Å; L53-W59 HydrophobicContact CD2-CZ2 3.66Å; L53-W79 HydrophobicContact CD2-CB 3.95Å
54	A	39.9	Very low	50.6	Low	89 Å²	89	86.9 Å²	86.9	74%	0.736	47%	0.469	S	S	*	.			trans	-71.8	-14.9	-174.8	0	0	0	0	0	114.2	R56	A54-R56 PolarHBondContact O-N 3.42Å
55	D	45.9	Very low	52.6	Low	86 Å²	86	87.3 Å²	87.3	46%	0.46	47%	0.471	S	S	.	.			trans	-97.3	85.4	179.3	-155.3	-8.2	0	0	0	111.8	L53 S57 T58	L53-D55 VanDerWaalsContact C-N 3.26Å; L53-D55 PolarHBondContact O-N 3.26Å; D55-S57 PolarHBondContact O-N 3.41Å; D55-S57 VanDerWaalsContact OD1-CB 3.3Å; D55-S57 WeakPolarHBondContact OD1-CB 3.46Å; D55-S57 PolarHBondContact OD1-N 3.21Å; D55-S57 PolarHBondContact OD1-OG 3.44Å; D55-S57 PolarHBondContact OD2-OG 3Å; D55-T58 HydrophobicContact CB-CG2 4.08Å; D55-T58 PolarHBondContact O-N 3.35Å; D55-T58 PolarHBondContact O-OG1 3.47Å
56	R	48.5	Very low	55	Low	189 Å²	189	88.3 Å²	88.3	71%	0.713	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-45.6	-31.7	171.1	-92.5	179.5	163	179.6	-6.7	112.6	A54 T58 W59 D60	A54-R56 PolarHBondContact O-N 3.42Å; R56-T58 PolarHBondContact O-N 2.97Å; R56-W59 PolarHBondContact O-N 2.96Å; R56-D60 PolarHBondContact O-N 3.43Å
57	S	48.3	Very low	57.3	Low	61 Å²	61	89.2 Å²	89.2	43%	0.427	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-64.2	-23.9	-178.9	76	0	0	0	0	113.7	D55	D55-S57 PolarHBondContact O-N 3.41Å; D55-S57 VanDerWaalsContact OD1-CB 3.3Å; D55-S57 WeakPolarHBondContact OD1-CB 3.46Å; D55-S57 PolarHBondContact OD1-N 3.21Å; D55-S57 PolarHBondContact OD1-OG 3.44Å; D55-S57 PolarHBondContact OD2-OG 3Å
58	T	53	Low	59.7	Low	68 Å²	68	87.2 Å²	87.2	42%	0.417	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-83.1	-18.9	-176.4	58.7	0	0	0	0	114.3	D55 R56	D55-T58 HydrophobicContact CB-CG2 4.08Å; D55-T58 PolarHBondContact O-N 3.35Å; D55-T58 PolarHBondContact O-OG1 3.47Å; R56-T58 PolarHBondContact O-N 2.97Å
59	W	60.5	Low	62	Low	37 Å²	37	88.5 Å²	88.5	14%	0.14	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-37.2	-175.7	-44.1	116.7	0	0	0	114	L53 R56 E61 Y62 P78 W79	L53-W59 HydrophobicContact CD2-CZ2 3.66Å; R56-W59 PolarHBondContact O-N 2.96Å; W59-E61 PolarHBondContact O-N 3.37Å; W59-E61 VanDerWaalsContact O-N 3.14Å; W59-Y62 WeakPolarHBondContact O-CB 3.2Å; W59-Y62 PolarHBondContact O-N 3.1Å; W59-P78 HydrophobicContact CE3-CB 4.33Å; W59-P78 HydrophobicContact CE3-CG 3.96Å; W59-P78 HydrophobicContact CH2-CB 4.2Å; W59-P78 WeakPolarHBondContact CH2-O 3.46Å; W59-P78 HydrophobicContact CZ3-CB 3.43Å; W59-P78 VanDerWaalsContact CZ3-CB 3.43Å; W59-P78 HydrophobicContact CZ3-CG 3.55Å; W59-W79 HydrophobicContact CB-CE3 4.23Å; W59-W79 HydrophobicContact CB-CZ3 4.49Å; W59-W79 HydrophobicContact CD2-CB 3.81Å; W59-W79 AromaticContact CD2-CE3 4Å; W59-W79 HydrophobicContact CD2-CE3 4Å; W59-W79 HydrophobicContact CE3-CB 3.76Å; W59-W79 HydrophobicContact CE3-CD2 4.31Å; W59-W79 AromaticContact CE3-CE3 3.52Å; W59-W79 HydrophobicContact CE3-CE3 3.52Å; W59-W79 HydrophobicContact CE3-CG 4.45Å; W59-W79 HydrophobicContact CE3-CZ3 4.45Å; W59-W79 HydrophobicContact CG-CE3 4.34Å; W59-W79 HydrophobicContact CH2-CB 3.67Å; W59-W79 HydrophobicContact CZ2-CB 3.74Å; W59-W79 VanDerWaalsContact CZ3-CA 3.42Å; W59-W79 HydrophobicContact CZ3-CB 3.7Å; W59-W79 HydrophobicContact CZ3-CE3 4.24Å
60	D	59.3	Low	63.8	Low	118 Å²	118	96.6 Å²	96.6	63%	0.631	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.9	179.2	-78.4	-29	0	0	0	112.1	R56	R56-D60 PolarHBondContact O-N 3.43Å
61	E	64.4	Low	65.4	Low	149 Å²	149	97.9 Å²	97.9	70%	0.696	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	1.6	177.2	-60.8	-170.3	173.1	0	0	114.3	W59 K63	W59-E61 PolarHBondContact O-N 3.37Å; W59-E61 VanDerWaalsContact O-N 3.14Å; E61-K63 WeakPolarHBondContact O-CG 3.42Å; E61-K63 PolarHBondContact O-N 3.27Å
62	Y	74.9	Confident	67.4	Low	52 Å²	52	98.9 Å²	98.9	20%	0.204	51%	0.509	C	S	.	.			trans	-68.6	100.8	-179.6	-176.6	-100.1	0	0	0	111.5	W59 G64 L66 R75 P77 P78 W79	W59-Y62 WeakPolarHBondContact O-CB 3.2Å; W59-Y62 PolarHBondContact O-N 3.1Å; Y62-G64 VanDerWaalsContact C-N 3.26Å; Y62-G64 WeakPolarHBondContact CE1-O 3.47Å; Y62-G64 PolarHBondContact O-N 2.93Å; Y62-L66 HydrophobicContact CD1-CD2 3.8Å; Y62-L66 HydrophobicContact CE1-CD2 3.6Å; Y62-R75 PolarHBondContact OH-O 3.26Å; Y62-P77 HydrophobicContact CE1-CB 4.4Å; Y62-P77 HydrophobicContact CE2-CB 4.48Å; Y62-P78 HydrophobicContact CD2-CG 4.15Å; Y62-W79 HydrophobicContact CD1-CH2 4.14Å; Y62-W79 HydrophobicContact CD1-CZ3 4.14Å; Y62-W79 HydrophobicContact CG-CZ3 4.07Å
63	K	74.9	Confident	69.1	Low	204 Å²	204	99.6 Å²	99.6	89%	0.887	50%	0.502	S	S	*	.			trans	-81.8	7.6	179.1	-60.5	-176.8	-176.9	177.7	0	114.8	E61	E61-K63 WeakPolarHBondContact O-CG 3.42Å; E61-K63 PolarHBondContact O-N 3.27Å
64	G	77.6	Confident	71.2	Confident	28 Å²	28	98.6 Å²	98.6	29%	0.289	50%	0.497	S	S	.	.	S	Bend	trans	-79.6	153.3	-178.9	0	0	0	0	0	112.5	Y62 L66	Y62-G64 VanDerWaalsContact C-N 3.26Å; Y62-G64 WeakPolarHBondContact CE1-O 3.47Å; Y62-G64 PolarHBondContact O-N 2.93Å; G64-L66 PolarHBondContact O-N 3.49Å
65	N	84	Confident	73.4	Confident	88 Å²	88	103.5 Å²	103.5	47%	0.471	50%	0.496	S	S	.	.			trans	-63.9	126.1	173.5	-69.7	-23.5	0	0	0	110	L74	N65-L74 HydrophobicContact CB-CD2 4.27Å; N65-L74 WeakPolarHBondContact O-CD2 3.43Å
66	L	90.1	Very high	75.3	Confident	47 Å²	47	102.3 Å²	102.3	25%	0.246	49%	0.489	C	S	.	.			trans	-91	-28.6	175	-61.2	179.7	0	0	0	112.7	Y62 G64 L74 P77 W79 E321 Y322 T324	Y62-L66 HydrophobicContact CD1-CD2 3.8Å; Y62-L66 HydrophobicContact CE1-CD2 3.6Å; G64-L66 PolarHBondContact O-N 3.49Å; L66-L74 WeakPolarHBondContact O-CD1 3.45Å; L66-P77 HydrophobicContact CD2-CG 4.41Å; L66-W79 HydrophobicContact CD2-CH2 3.58Å; L66-W79 HydrophobicContact CD2-CZ2 3.94Å; L66-E321 CarbonylContact O-C 3.53Å; L66-E321 VanDerWaalsContact O-CA 3.24Å; L66-E321 WeakPolarHBondContact O-CA 3.33Å; L66-Y322 PolarHBondContact O-N 3.25Å; L66-T324 HydrophobicContact CD1-CG2 3.69Å
67	K	90.9	Very high	77.3	Confident	133 Å²	133	93.3 Å²	93.3	58%	0.578	46%	0.455	S	S	*	.	B	Isolated β-bridge	trans	-102	133.9	177.9	-71.7	-176	174.4	-176.5	0	111.1	Q69 E320 E321	K67-Q69 PolarHBondContact O-N 3.03Å; K67-E320 WeakPolarHBondContact CA-O 3.36Å; K67-E321 WeakPolarHBondContact CE-OE1 3.33Å; K67-E321 WeakPolarHBondContact CE-OE2 3.45Å; K67-E321 HydrophobicContact CG-CB 4.26Å; K67-E321 HydrophobicContact CG-CG 3.8Å; K67-E321 IonicContact NZ-OE1 3.86Å; K67-E321 IonicContact NZ-OE2 3.83Å
68	R	91.1	Very high	79.1	Confident	59 Å²	59	92.3 Å²	92.3	22%	0.223	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-74.2	124.5	-175.8	-167.8	-173.9	73.6	-127.9	3.5	110.7	L74 K318 V319 E320	R68-L74 HydrophobicContact CB-CD1 3.82Å; R68-L74 HydrophobicContact CB-CD2 4.27Å; R68-L74 HydrophobicContact CB-CG 3.84Å; R68-L74 HydrophobicContact CG-CG 4.15Å; R68-K318 PolarHBondContact NH1-O 3.14Å; R68-V319 WeakPolarHBondContact CD-O 3.41Å; R68-V319 PolarHBondContact NH1-O 2.89Å; R68-E320 WeakPolarHBondContact CB-O 3.34Å; R68-E320 IonicContact CZ-OE1 3.21Å; R68-E320 IonicContact CZ-OE2 2.96Å; R68-E320 PolarHBondContact N-O 3.18Å; R68-E320 IonicContact NE-OE2 3.78Å; R68-E320 IonicContact NH1-OE1 2.9Å; R68-E320 PolarHBondContact NH1-OE1 3.43Å; R68-E320 IonicContact NH1-OE2 3.04Å; R68-E320 PolarHBondContact NH1-OE2 2.77Å; R68-E320 IonicContact NH2-OE1 3.69Å; R68-E320 PolarHBondContact NH2-OE1 3.16Å; R68-E320 IonicContact NH2-OE2 2.77Å; R68-E320 PolarHBondContact NH2-OE2 3.11Å
69	Q	87.4	Confident	80.8	Confident	110 Å²	110	89.7 Å²	89.7	51%	0.514	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-86.1	151	166.3	-57.9	-170.4	13.6	0	0	111.3	K67 G71 E72	K67-Q69 PolarHBondContact O-N 3.03Å; Q69-G71 PolarHBondContact O-N 3.03Å; Q69-E72 HydrophobicContact CB-CG 4.32Å; Q69-E72 PolarHBondContact O-N 3.24Å; Q69-E72 VanDerWaalsContact O-N 3.08Å
70	K	80.1	Confident	82	Confident	214 Å²	214	88 Å²	88	93%	0.93	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	120.2	-177.4	-172.2	-179.9	179.9	-177.5	0	110
71	G	76.6	Confident	83.1	Confident	72 Å²	72	88.3 Å²	88.3	74%	0.742	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.2	-14.8	-178.9	0	0	0	0	0	114.1	Q69	Q69-G71 PolarHBondContact O-N 3.03Å
72	E	81.8	Confident	83.7	Confident	88 Å²	88	84.1 Å²	84.1	41%	0.411	40%	0.404	S	S	.	.			trans	-98	158.5	-177.6	-61.6	-169.6	164.6	0	0	113.2	Q69	Q69-E72 HydrophobicContact CB-CG 4.32Å; Q69-E72 PolarHBondContact O-N 3.24Å; Q69-E72 VanDerWaalsContact O-N 3.08Å
73	R	78.8	Confident	83.6	Confident	153 Å²	153	89.6 Å²	89.6	58%	0.577	43%	0.432	S	S	*	.			trans	-106.3	129.3	167.3	-85.4	-172.6	160.6	142.1	8.6	109.3	R314	R73-R314 VanDerWaalsContact NH1-CZ 3.34Å; R73-R314 VanDerWaalsContact NH2-CG 3.27Å
74	L	86.1	Confident	83.4	Confident	26 Å²	26	86.7 Å²	86.7	14%	0.136	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-69.8	135.3	170.3	-64.6	179.8	0	0	0	110.1	N65 L66 R68 V319 Y322	N65-L74 HydrophobicContact CB-CD2 4.27Å; N65-L74 WeakPolarHBondContact O-CD2 3.43Å; L66-L74 WeakPolarHBondContact O-CD1 3.45Å; R68-L74 HydrophobicContact CB-CD1 3.82Å; R68-L74 HydrophobicContact CB-CD2 4.27Å; R68-L74 HydrophobicContact CB-CG 3.84Å; R68-L74 HydrophobicContact CG-CG 4.15Å; L74-V319 HydrophobicContact CD1-CG1 4.36Å; L74-Y322 HydrophobicContact CB-CD2 3.92Å; L74-Y322 HydrophobicContact CB-CE2 3.42Å; L74-Y322 VanDerWaalsContact CB-CE2 3.42Å; L74-Y322 HydrophobicContact CD1-CD2 3.95Å; L74-Y322 HydrophobicContact CD1-CE2 4.11Å; L74-Y322 HydrophobicContact CG-CE2 4.41Å
75	R	86.3	Confident	82.8	Confident	192 Å²	192	87.4 Å²	87.4	73%	0.725	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-79.8	137.5	171.6	-175.2	178.3	-177.5	-172.9	1.3	108.3	Y62 P77 Y322	Y62-R75 PolarHBondContact OH-O 3.26Å; R75-P77 VanDerWaalsContact O-CD 3.3Å; R75-P77 WeakPolarHBondContact O-CD 3.39Å; R75-Y322 WeakPolarHBondContact O-CE2 3.1Å
76	L	87.5	Confident	81.8	Confident	61 Å²	61	91.4 Å²	91.4	32%	0.319	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-60.4	120.3	177.6	-167.2	67.6	0	0	0	110	L80 K81 M310 Y322	L76-L80 HydrophobicContact CD1-CB 3.69Å; L76-L80 HydrophobicContact CD1-CD1 4.16Å; L76-L80 HydrophobicContact CG-CB 4.04Å; L76-K81 HydrophobicContact CD2-CG 4.22Å; L76-M310 HydrophobicContact CD1-CE 3.62Å; L76-M310 HydrophobicContact CD1-SD 4.29Å; L76-M310 HydrophobicContact CD2-CE 4.46Å; L76-Y322 HydrophobicContact CD1-CE1 3.9Å
77	P	88.7	Confident	80.7	Confident	0 Å²	0	91 Å²	91	0%	0	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-64.4	153.1	174.4	-13.7	25.2	0	0	0	110.1	Y62 L66 R75 W79 L80 Y322	Y62-P77 HydrophobicContact CE1-CB 4.4Å; Y62-P77 HydrophobicContact CE2-CB 4.48Å; L66-P77 HydrophobicContact CD2-CG 4.41Å; R75-P77 VanDerWaalsContact O-CD 3.3Å; R75-P77 WeakPolarHBondContact O-CD 3.39Å; P77-W79 HydrophobicContact CB-CD2 3.62Å; P77-W79 HydrophobicContact CB-CE3 3.62Å; P77-W79 HydrophobicContact CB-CG 4.46Å; P77-W79 HydrophobicContact CB-CH2 3.55Å; P77-W79 HydrophobicContact CB-CZ2 3.5Å; P77-W79 VanDerWaalsContact CB-CZ2 3.5Å; P77-W79 HydrophobicContact CB-CZ3 3.6Å; P77-W79 HydrophobicContact CG-CH2 4.05Å; P77-W79 HydrophobicContact CG-CZ2 3.69Å; P77-W79 PolarHBondContact O-N 3.45Å; P77-L80 HydrophobicContact CG-CD1 4.15Å; P77-L80 PolarHBondContact O-N 2.85Å; P77-Y322 HydrophobicContact CG-CD1 4.16Å; P77-Y322 HydrophobicContact CG-CD2 3.57Å; P77-Y322 HydrophobicContact CG-CE2 4.23Å; P77-Y322 HydrophobicContact CG-CG 3.52Å
78	P	87.6	Confident	79.7	Confident	40 Å²	40	93.8 Å²	93.8	26%	0.26	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-70.6	-19.2	-171.6	20.3	-16.8	0	0	0	113	W59 Y62 L80 K81	W59-P78 HydrophobicContact CE3-CB 4.33Å; W59-P78 HydrophobicContact CE3-CG 3.96Å; W59-P78 HydrophobicContact CH2-CB 4.2Å; W59-P78 WeakPolarHBondContact CH2-O 3.46Å; W59-P78 HydrophobicContact CZ3-CB 3.43Å; W59-P78 VanDerWaalsContact CZ3-CB 3.43Å; W59-P78 HydrophobicContact CZ3-CG 3.55Å; Y62-P78 HydrophobicContact CD2-CG 4.15Å; P78-L80 PolarHBondContact O-N 3.45Å; P78-K81 HydrophobicContact CB-CD 4.11Å; P78-K81 WeakPolarHBondContact O-CB 3.25Å; P78-K81 PolarHBondContact O-N 3.06Å; P78-K81 VanDerWaalsContact O-N 3.14Å
79	W	87.3	Confident	78.5	Confident	12 Å²	12	95.1 Å²	95.1	5%	0.045	47%	0.472	C	S	.	.	G	3₁₀ helix	trans	-76.1	-6.9	177.5	62.6	87.4	0	0	0	113.9	L53 W59 Y62 L66 P77 I323 T324 P325	L53-W79 HydrophobicContact CD2-CB 3.95Å; W59-W79 HydrophobicContact CB-CE3 4.23Å; W59-W79 HydrophobicContact CB-CZ3 4.49Å; W59-W79 HydrophobicContact CD2-CB 3.81Å; W59-W79 AromaticContact CD2-CE3 4Å; W59-W79 HydrophobicContact CD2-CE3 4Å; W59-W79 HydrophobicContact CE3-CB 3.76Å; W59-W79 HydrophobicContact CE3-CD2 4.31Å; W59-W79 AromaticContact CE3-CE3 3.52Å; W59-W79 HydrophobicContact CE3-CE3 3.52Å; W59-W79 HydrophobicContact CE3-CG 4.45Å; W59-W79 HydrophobicContact CE3-CZ3 4.45Å; W59-W79 HydrophobicContact CG-CE3 4.34Å; W59-W79 HydrophobicContact CH2-CB 3.67Å; W59-W79 HydrophobicContact CZ2-CB 3.74Å; W59-W79 VanDerWaalsContact CZ3-CA 3.42Å; W59-W79 HydrophobicContact CZ3-CB 3.7Å; W59-W79 HydrophobicContact CZ3-CE3 4.24Å; Y62-W79 HydrophobicContact CD1-CH2 4.14Å; Y62-W79 HydrophobicContact CD1-CZ3 4.14Å; Y62-W79 HydrophobicContact CG-CZ3 4.07Å; L66-W79 HydrophobicContact CD2-CH2 3.58Å; L66-W79 HydrophobicContact CD2-CZ2 3.94Å; P77-W79 HydrophobicContact CB-CD2 3.62Å; P77-W79 HydrophobicContact CB-CE3 3.62Å; P77-W79 HydrophobicContact CB-CG 4.46Å; P77-W79 HydrophobicContact CB-CH2 3.55Å; P77-W79 HydrophobicContact CB-CZ2 3.5Å; P77-W79 VanDerWaalsContact CB-CZ2 3.5Å; P77-W79 HydrophobicContact CB-CZ3 3.6Å; P77-W79 HydrophobicContact CG-CH2 4.05Å; P77-W79 HydrophobicContact CG-CZ2 3.69Å; P77-W79 PolarHBondContact O-N 3.45Å; W79-I323 PolarHBondContact NE1-O 3.49Å; W79-T324 HydrophobicContact CZ2-CG2 4.46Å; W79-P325 HydrophobicContact CB-CG 4.29Å; W79-P325 HydrophobicContact CD2-CG 4.4Å; W79-P325 HydrophobicContact CG-CG 4.04Å
80	L	85.5	Confident	77.8	Confident	2 Å²	2	91.4 Å²	91.4	1%	0.01	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-106.1	1.3	174.3	-73.1	166.4	0	0	0	112.1	L76 P77 P78 Q308 M310 Y322 P347 L348	L76-L80 HydrophobicContact CD1-CB 3.69Å; L76-L80 HydrophobicContact CD1-CD1 4.16Å; L76-L80 HydrophobicContact CG-CB 4.04Å; P77-L80 HydrophobicContact CG-CD1 4.15Å; P77-L80 PolarHBondContact O-N 2.85Å; P78-L80 PolarHBondContact O-N 3.45Å; L80-Q308 HydrophobicContact CD1-CG 3.84Å; L80-Q308 HydrophobicContact CD2-CB 3.88Å; L80-Q308 HydrophobicContact CD2-CG 3.89Å; L80-M310 HydrophobicContact CB-CE 4.29Å; L80-M310 HydrophobicContact CD1-SD 4.21Å; L80-M310 HydrophobicContact CD2-SD 3.99Å; L80-M310 HydrophobicContact CG-SD 4.48Å; L80-Y322 HydrophobicContact CD1-CD1 3.33Å; L80-Y322 HydrophobicContact CD1-CE1 3.74Å; L80-Y322 HydrophobicContact CD1-CG 4.15Å; L80-P347 HydrophobicContact CD2-CB 3.5Å; L80-P347 VanDerWaalsContact CD2-CB 3.5Å; L80-P347 HydrophobicContact CG-CB 4.27Å; L80-L348 HydrophobicContact CD2-CD2 4.14Å
81	K	84	Confident	77.6	Confident	124 Å²	124	85.1 Å²	85.1	54%	0.539	43%	0.43	S	S	.	.			trans	-78.8	133.7	173.3	-66.1	176.3	-175.8	174.7	0	108.5	L76 P78	L76-K81 HydrophobicContact CD2-CG 4.22Å; P78-K81 HydrophobicContact CB-CD 4.11Å; P78-K81 WeakPolarHBondContact O-CB 3.25Å; P78-K81 PolarHBondContact O-N 3.06Å; P78-K81 VanDerWaalsContact O-N 3.14Å
82	T	76.3	Confident	77.5	Confident	61 Å²	61	88.9 Å²	88.9	37%	0.374	43%	0.426	S	S	.	.			trans	-118.5	154.2	173.8	59.2	0	0	0	0	109.4	P112 L348	T82-P112 HydrophobicContact CG2-CB 3.9Å; T82-L348 HydrophobicContact CG2-CD1 3.66Å; T82-L348 HydrophobicContact CG2-CD2 3.9Å; T82-L348 HydrophobicContact CG2-CG 4.46Å
83	E	73.3	Confident	77.1	Confident	168 Å²	168	86.2 Å²	86.2	79%	0.785	41%	0.414	S	S	*	.			trans	-67.6	155.9	171.8	-60.6	-164.3	147.1	0	0	111.4
84	I	70.9	Confident	77.1	Confident	142 Å²	142	81.1 Å²	81.1	73%	0.728	40%	0.396	S	S	*	.			trans	-76.3	126.6	175.9	-61.6	175.9	0	0	0	107.8	M86	I84-M86 PolarHBondContact O-N 3.12Å; I84-M86 VanDerWaalsContact O-N 3.09Å
85	P	65.1	Low	76.8	Confident	43 Å²	43	84 Å²	84	28%	0.279	41%	0.412	S	S	.	.			trans	-62.5	115.2	-178	25	-34.8	0	0	0	111	Y90 I114	P85-Y90 HydrophobicContact CB-CE2 4.43Å; P85-I114 HydrophobicContact CB-CG2 4.16Å; P85-I114 HydrophobicContact CG-CG2 3.87Å
86	M	62.3	Low	76.3	Confident	173 Å²	173	76.8 Å²	76.8	85%	0.852	39%	0.39	S	S	*	.			trans	-132	136.6	174.4	-61.8	-167	-57.6	0	0	109.7	I84	I84-M86 PolarHBondContact O-N 3.12Å; I84-M86 VanDerWaalsContact O-N 3.09Å
87	G	67.7	Low	76	Confident	37 Å²	37	73.9 Å²	73.9	38%	0.381	37%	0.374	S	S	.	.	S	Bend	trans	155.9	159.4	174.2	0	0	0	0	0	115.7	N91	G87-N91 PolarHBondContact O-N 2.65Å; G87-N91 PolarHBondContact O-ND2 2.8Å
88	K	68.7	Low	75.6	Confident	192 Å²	192	81.4 Å²	81.4	84%	0.835	40%	0.403	S	S	*	.	H	α-helix	trans	-65.4	-40.8	179.8	-69.6	-177.9	179.4	177	0	112.6	N91 K92	K88-N91 PolarHBondContact O-N 3.45Å; K88-K92 WeakPolarHBondContact O-CB 3.44Å; K88-K92 PolarHBondContact O-N 2.91Å
89	N	67.4	Low	75.2	Confident	87 Å²	87	86.2 Å²	86.2	47%	0.465	43%	0.426	S	S	.	.	H	α-helix	trans	-65	-46.2	179.6	-75.4	-10.3	0	0	0	112.4	N91 K92 L93 G119 G120	N89-N91 PolarHBondContact O-N 3.01Å; N89-K92 PolarHBondContact O-N 3.46Å; N89-L93 PolarHBondContact O-N 3.32Å; N89-G119 WeakPolarHBondContact CB-O 3.16Å; N89-G119 PolarHBondContact ND2-O 3.44Å; N89-G120 PolarHBondContact ND2-O 3.34Å
90	Y	72.3	Confident	74.6	Confident	32 Å²	32	89.2 Å²	89.2	13%	0.125	44%	0.443	C	S	.	.	H	α-helix	trans	-55.5	-48.6	174	171.3	-103.6	0	0	0	111.8	P85 K92 L93 K94 I114 W118	P85-Y90 HydrophobicContact CB-CE2 4.43Å; Y90-K92 PolarHBondContact O-N 2.67Å; Y90-L93 PolarHBondContact O-N 2.73Å; Y90-K94 HydrophobicContact CE1-CD 4.26Å; Y90-K94 VanDerWaalsContact O-CB 3.25Å; Y90-K94 WeakPolarHBondContact O-CB 3.33Å; Y90-K94 PolarHBondContact O-N 2.96Å; Y90-I114 HydrophobicContact CD2-CG1 4.46Å; Y90-I114 HydrophobicContact CE2-CD1 3.83Å; Y90-I114 HydrophobicContact CE2-CG1 3.88Å; Y90-I114 HydrophobicContact CE2-CG2 4.39Å; Y90-W118 HydrophobicContact CD2-CB 4.17Å; Y90-W118 HydrophobicContact CD2-CD2 4.2Å; Y90-W118 AromaticContact CD2-CE3 3.54Å; Y90-W118 HydrophobicContact CD2-CE3 3.54Å; Y90-W118 HydrophobicContact CD2-CG 4.5Å; Y90-W118 HydrophobicContact CD2-CZ3 4.29Å; Y90-W118 HydrophobicContact CE2-CD2 4.42Å; Y90-W118 AromaticContact CE2-CE3 3.69Å; Y90-W118 HydrophobicContact CE2-CE3 3.69Å; Y90-W118 HydrophobicContact CE2-CZ3 4.04Å
91	N	76.3	Confident	74.4	Confident	82 Å²	82	94.9 Å²	94.9	44%	0.439	47%	0.473	S	S	.	.	H	α-helix	trans	-64.6	-38.3	178.6	-74.2	-33.2	0	0	0	112.8	G87 K88 N89 N95	G87-N91 PolarHBondContact O-N 2.65Å; G87-N91 PolarHBondContact O-ND2 2.8Å; K88-N91 PolarHBondContact O-N 3.45Å; N89-N91 PolarHBondContact O-N 3.01Å; N91-N95 WeakPolarHBondContact O-CB 3.21Å; N91-N95 PolarHBondContact O-N 3.29Å; N91-N95 PolarHBondContact O-ND2 2.83Å
92	K	74.2	Confident	74.3	Confident	151 Å²	151	89.6 Å²	89.6	66%	0.657	45%	0.451	S	S	*	.	H	α-helix	trans	-60.8	-53	175.4	-177.4	-176.7	176.6	-173.9	0	110.7	K88 N89 Y90 K94 N95 T96	K88-K92 WeakPolarHBondContact O-CB 3.44Å; K88-K92 PolarHBondContact O-N 2.91Å; N89-K92 PolarHBondContact O-N 3.46Å; Y90-K92 PolarHBondContact O-N 2.67Å; K92-K94 VanDerWaalsContact C-N 3.32Å; K92-K94 PolarHBondContact O-N 3.05Å; K92-N95 PolarHBondContact O-N 3.02Å; K92-T96 PolarHBondContact O-N 3.02Å; K92-T96 PolarHBondContact O-OG1 3.11Å; K92-T96 VanDerWaalsContact O-OG1 3.08Å
93	L	73.8	Confident	74.7	Confident	32 Å²	32	88.6 Å²	88.6	17%	0.168	44%	0.441	C	S	.	.	H	α-helix	trans	-63.2	-41.3	-178.3	-169.7	59.7	0	0	0	111.3	N89 Y90 N95 T96 L97 W118	N89-L93 PolarHBondContact O-N 3.32Å; Y90-L93 PolarHBondContact O-N 2.73Å; L93-N95 PolarHBondContact O-N 3.47Å; L93-T96 PolarHBondContact O-N 2.86Å; L93-L97 HydrophobicContact CG-CD1 4.1Å; L93-L97 VanDerWaalsContact O-CG 3.28Å; L93-L97 WeakPolarHBondContact O-CG 3.36Å; L93-L97 PolarHBondContact O-N 3.26Å; L93-W118 HydrophobicContact CB-CE3 4.06Å; L93-W118 HydrophobicContact CD2-CB 3.91Å; L93-W118 HydrophobicContact CD2-CD2 3.63Å; L93-W118 HydrophobicContact CD2-CE3 3.98Å; L93-W118 HydrophobicContact CD2-CG 3.59Å; L93-W118 HydrophobicContact CG-CD2 4.24Å; L93-W118 HydrophobicContact CG-CE3 4.11Å
94	K	77.6	Confident	75.2	Confident	46 Å²	46	80.6 Å²	80.6	20%	0.2	40%	0.404	C	S	.	.	H	α-helix	trans	-57	-45.9	173.9	-172.8	171.2	-173.2	169	0	113.1	Y90 K92 R98 W118	Y90-K94 HydrophobicContact CE1-CD 4.26Å; Y90-K94 VanDerWaalsContact O-CB 3.25Å; Y90-K94 WeakPolarHBondContact O-CB 3.33Å; Y90-K94 PolarHBondContact O-N 2.96Å; K92-K94 VanDerWaalsContact C-N 3.32Å; K92-K94 PolarHBondContact O-N 3.05Å; K94-R98 WeakPolarHBondContact O-CG 3.46Å; K94-R98 PolarHBondContact O-N 3.29Å; K94-R98 VanDerWaalsContact O-N 3.14Å; K94-W118 HydrophobicContact CB-CZ3 3.94Å
95	N	80.3	Confident	75.8	Confident	86 Å²	86	75.6 Å²	75.6	46%	0.46	38%	0.38	S	S	.	.	H	α-helix	trans	-68	-40.2	178.9	-71.6	-19.4	0	0	0	111.6	N91 K92 L93 R98 N99	N91-N95 WeakPolarHBondContact O-CB 3.21Å; N91-N95 PolarHBondContact O-N 3.29Å; N91-N95 PolarHBondContact O-ND2 2.83Å; K92-N95 PolarHBondContact O-N 3.02Å; L93-N95 PolarHBondContact O-N 3.47Å; N95-R98 PolarHBondContact O-N 3.37Å; N95-N99 WeakPolarHBondContact O-CB 3.43Å; N95-N99 PolarHBondContact O-N 3.09Å; N95-N99 PolarHBondContact O-ND2 3.39Å; N95-N99 PolarHBondContact O-OD1 2.86Å
96	T	76.6	Confident	76.4	Confident	42 Å²	42	73.9 Å²	73.9	26%	0.258	37%	0.369	S	S	.	.	H	α-helix	trans	-60.3	-47.6	175.7	-60	0	0	0	0	111.7	K92 L93 R98 N99 L100 W170	K92-T96 PolarHBondContact O-N 3.02Å; K92-T96 PolarHBondContact O-OG1 3.11Å; K92-T96 VanDerWaalsContact O-OG1 3.08Å; L93-T96 PolarHBondContact O-N 2.86Å; T96-R98 VanDerWaalsContact C-N 3.34Å; T96-R98 PolarHBondContact O-N 3Å; T96-N99 PolarHBondContact O-N 3.33Å; T96-L100 HydrophobicContact CG2-CD1 3.77Å; T96-L100 WeakPolarHBondContact O-CG 2.89Å; T96-L100 PolarHBondContact O-N 2.77Å; T96-L100 VanDerWaalsContact O-N 3.12Å; T96-W170 HydrophobicContact CG2-CZ2 4.13Å
97	L	79.5	Confident	77.2	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-59.6	-44	178.3	-71.8	164	0	0	0	111.9	L93 L100 N101 L102 T104 W118 I130 W170	L93-L97 HydrophobicContact CG-CD1 4.1Å; L93-L97 VanDerWaalsContact O-CG 3.28Å; L93-L97 WeakPolarHBondContact O-CG 3.36Å; L93-L97 PolarHBondContact O-N 3.26Å; L97-L100 PolarHBondContact O-N 3.16Å; L97-N101 PolarHBondContact O-N 2.82Å; L97-N101 VanDerWaalsContact O-N 3.17Å; L97-L102 HydrophobicContact CD2-CB 3.94Å; L97-L102 HydrophobicContact CD2-CD1 4.37Å; L97-L102 PolarHBondContact O-N 2.95Å; L97-T104 HydrophobicContact CD1-CG2 3.47Å; L97-T104 VanDerWaalsContact CD1-CG2 3.47Å; L97-T104 HydrophobicContact CD2-CG2 3.68Å; L97-T104 HydrophobicContact CG-CG2 4.17Å; L97-W118 HydrophobicContact CD1-CH2 3.17Å; L97-W118 HydrophobicContact CD1-CZ2 3.58Å; L97-W118 HydrophobicContact CD1-CZ3 3.77Å; L97-I130 HydrophobicContact CD2-CD1 3.79Å; L97-W170 HydrophobicContact CD2-CH2 3.53Å; L97-W170 HydrophobicContact CD2-CZ2 3.99Å
98	R	80.3	Confident	77.9	Confident	158 Å²	158	68.5 Å²	68.5	60%	0.596	33%	0.332	S	S	*	.	H	α-helix	trans	-63	-44.3	176.2	-74.9	176.3	174.4	-165.6	-7.9	113.1	K94 N95 T96 L100 N101	K94-R98 WeakPolarHBondContact O-CG 3.46Å; K94-R98 PolarHBondContact O-N 3.29Å; K94-R98 VanDerWaalsContact O-N 3.14Å; N95-R98 PolarHBondContact O-N 3.37Å; T96-R98 VanDerWaalsContact C-N 3.34Å; T96-R98 PolarHBondContact O-N 3Å; R98-L100 PolarHBondContact O-N 2.84Å; R98-N101 PolarHBondContact O-N 3.06Å; R98-N101 VanDerWaalsContact O-N 3.11Å
99	N	79.4	Confident	78.2	Confident	141 Å²	141	61 Å²	61	75%	0.754	31%	0.306	S	S	*	.	H	α-helix	trans	-64.3	-28.9	-179.7	-71.1	-12.8	0	0	0	112.4	N95 T96	N95-N99 WeakPolarHBondContact O-CB 3.43Å; N95-N99 PolarHBondContact O-N 3.09Å; N95-N99 PolarHBondContact O-ND2 3.39Å; N95-N99 PolarHBondContact O-OD1 2.86Å; T96-N99 PolarHBondContact O-N 3.33Å
100	L	76.1	Confident	78.5	Confident	74 Å²	74	64.8 Å²	64.8	39%	0.387	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	2.3	178.7	-64.3	168.3	0	0	0	113.1	T96 L97 R98 L102 A166 W170	T96-L100 HydrophobicContact CG2-CD1 3.77Å; T96-L100 WeakPolarHBondContact O-CG 2.89Å; T96-L100 PolarHBondContact O-N 2.77Å; T96-L100 VanDerWaalsContact O-N 3.12Å; L97-L100 PolarHBondContact O-N 3.16Å; R98-L100 PolarHBondContact O-N 2.84Å; L100-L102 HydrophobicContact CB-CD1 3.92Å; L100-L102 HydrophobicContact CB-CG 3.78Å; L100-L102 HydrophobicContact CD1-CD1 4.06Å; L100-L102 PolarHBondContact O-N 3.16Å; L100-A166 HydrophobicContact CD1-CB 3.44Å; L100-A166 VanDerWaalsContact CD1-CB 3.44Å; L100-W170 HydrophobicContact CD1-CZ2 4.1Å
101	N	79.8	Confident	78.9	Confident	122 Å²	122	64.4 Å²	64.4	65%	0.652	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	36.8	-174.3	-161	45.5	0	0	0	112.9	L97 R98	L97-N101 PolarHBondContact O-N 2.82Å; L97-N101 VanDerWaalsContact O-N 3.17Å; R98-N101 PolarHBondContact O-N 3.06Å; R98-N101 VanDerWaalsContact O-N 3.11Å
102	L	83.1	Confident	78.9	Confident	13 Å²	13	62.1 Å²	62.1	7%	0.068	31%	0.305	C	S	.	.			trans	-95.4	136.4	178.6	-64.9	178.3	0	0	0	110.4	L97 L100 T163 A166 W170	L97-L102 HydrophobicContact CD2-CB 3.94Å; L97-L102 HydrophobicContact CD2-CD1 4.37Å; L97-L102 PolarHBondContact O-N 2.95Å; L100-L102 HydrophobicContact CB-CD1 3.92Å; L100-L102 HydrophobicContact CB-CG 3.78Å; L100-L102 HydrophobicContact CD1-CD1 4.06Å; L100-L102 PolarHBondContact O-N 3.16Å; L102-T163 HydrophobicContact CD2-CG2 4.23Å; L102-T163 WeakPolarHBondContact CD2-OG1 3.34Å; L102-A166 HydrophobicContact CD1-CB 4Å; L102-W170 HydrophobicContact CD1-CH2 3.98Å; L102-W170 HydrophobicContact CD1-CZ2 4.13Å
103	H	84.7	Confident	79	Confident	39 Å²	39	55.1 Å²	55.1	18%	0.181	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	150.5	174.1	-62.6	-83.5	0	0	0	110.8	E108 M131	H103-E108 IonicContact ND1-OE1 3.52Å; H103-M131 HydrophobicContact CB-CB 4.34Å; H103-M131 HydrophobicContact CB-CE 3.95Å; H103-M131 PolarHBondContact O-N 3.18Å
104	T	83.4	Confident	79.1	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	141	173	67.7	0	0	0	0	110.3	L97 C106 E107 E108 W118 T129 I130	L97-T104 HydrophobicContact CD1-CG2 3.47Å; L97-T104 VanDerWaalsContact CD1-CG2 3.47Å; L97-T104 HydrophobicContact CD2-CG2 3.68Å; L97-T104 HydrophobicContact CG-CG2 4.17Å; T104-C106 PolarHBondContact O-N 2.84Å; T104-E107 PolarHBondContact O-N 2.95Å; T104-E107 PolarHBondContact OG1-N 3.35Å; T104-E107 PolarHBondContact OG1-OE2 3.15Å; T104-E108 WeakPolarHBondContact O-CG 3.33Å; T104-E108 PolarHBondContact O-N 3.05Å; T104-W118 HydrophobicContact CG2-CH2 4.37Å; T104-W118 HydrophobicContact CG2-CZ2 3.92Å; T104-W118 WeakPolarHBondContact OG1-CZ2 3.44Å; T104-T129 WeakPolarHBondContact CA-O 3.44Å; T104-T129 WeakPolarHBondContact CB-O 3.34Å; T104-I130 HydrophobicContact CG2-CD1 3.89Å
105	V	82.4	Confident	78.8	Confident	36 Å²	36	53.1 Å²	53.1	22%	0.218	27%	0.272	C	S	.	.	H	α-helix	trans	-62.3	-26.9	172.3	74.1	0	0	0	0	110.7	E107 A109 T129 T178	V105-E107 VanDerWaalsContact C-N 3.31Å; V105-E107 PolarHBondContact O-N 3.38Å; V105-A109 HydrophobicContact CG2-CB 3.72Å; V105-A109 WeakPolarHBondContact O-CA 3.4Å; V105-A109 WeakPolarHBondContact O-CB 3.38Å; V105-A109 PolarHBondContact O-N 2.95Å; V105-T129 HydrophobicContact CB-CG2 4.35Å; V105-T129 HydrophobicContact CG1-CG2 3.3Å; V105-T178 HydrophobicContact CB-CG2 4.05Å; V105-T178 HydrophobicContact CG1-CG2 4.39Å
106	C	78.3	Confident	78.4	Confident	7 Å²	7	52.7 Å²	52.7	5%	0.047	27%	0.267	C	S	.	.	H	α-helix	trans	-58.2	-44	177.7	-55.4	0	0	0	0	111.6	T104 C111 I114 W118	T104-C106 PolarHBondContact O-N 2.84Å; C106-C111 HydrophobicContact CB-CB 4.41Å; C106-C111 WeakPolarHBondContact O-CB 3.44Å; C106-C111 PolarHBondContact O-N 3.37Å; C106-I114 HydrophobicContact CB-CB 4.38Å; C106-I114 HydrophobicContact CB-CD1 3.76Å; C106-I114 HydrophobicContact CB-CG1 3.83Å; C106-W118 HydrophobicContact CB-CZ2 3.91Å
107	E	80.5	Confident	78.2	Confident	50 Å²	50	51.3 Å²	51.3	23%	0.234	26%	0.259	C	S	.	.	H	α-helix	trans	-79.5	-49.7	176.8	-69.6	-178.4	120.3	0	0	111.8	T104 V105 A109 R110 I114 W118	T104-E107 PolarHBondContact O-N 2.95Å; T104-E107 PolarHBondContact OG1-N 3.35Å; T104-E107 PolarHBondContact OG1-OE2 3.15Å; V105-E107 VanDerWaalsContact C-N 3.31Å; V105-E107 PolarHBondContact O-N 3.38Å; E107-A109 PolarHBondContact O-N 3.46Å; E107-R110 PolarHBondContact O-N 3.2Å; E107-R110 VanDerWaalsContact O-N 3.16Å; E107-I114 HydrophobicContact CG-CD1 3.8Å; E107-W118 HydrophobicContact CG-CH2 3.79Å; E107-W118 HydrophobicContact CG-CZ2 4.35Å
108	E	82.4	Confident	77.8	Confident	47 Å²	47	51.6 Å²	51.6	22%	0.22	26%	0.26	C	S	.	.	H	α-helix	trans	-71.7	-31.4	-171.7	-60.1	-59.7	160.7	0	0	113	H103 T104 M131 D135 S145 V146	H103-E108 IonicContact ND1-OE1 3.52Å; T104-E108 WeakPolarHBondContact O-CG 3.33Å; T104-E108 PolarHBondContact O-N 3.05Å; E108-M131 HydrophobicContact CB-CE 3.74Å; E108-M131 HydrophobicContact CG-CE 3.46Å; E108-M131 VanDerWaalsContact CG-CE 3.46Å; E108-D135 HydrophobicContact CG-CB 4.29Å; E108-S145 PolarHBondContact O-OG 3.01Å; E108-V146 HydrophobicContact CB-CG2 4.48Å
109	A	73.1	Confident	76.8	Confident	36 Å²	36	45.5 Å²	45.5	30%	0.298	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	2.9	174.7	0	0	0	0	0	113.8	V105 E107 C111 S145	V105-A109 HydrophobicContact CG2-CB 3.72Å; V105-A109 WeakPolarHBondContact O-CA 3.4Å; V105-A109 WeakPolarHBondContact O-CB 3.38Å; V105-A109 PolarHBondContact O-N 2.95Å; E107-A109 PolarHBondContact O-N 3.46Å; A109-C111 PolarHBondContact O-N 2.83Å; A109-S145 WeakPolarHBondContact CA-OG 3.33Å
110	R	75.2	Confident	75.5	Confident	166 Å²	166	39.5 Å²	39.5	63%	0.626	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	50.6	-179.2	-54.5	178.2	177.7	-150.4	-7.2	112.5	E107	E107-R110 PolarHBondContact O-N 3.2Å; E107-R110 VanDerWaalsContact O-N 3.16Å
111	C	80.1	Confident	74.3	Confident	24 Å²	24	38.6 Å²	38.6	16%	0.162	23%	0.226	C	C	.	.			trans	-63.4	127.1	-174.4	-175.5	0	0	0	0	111.1	C106 A109 N113 I114	C106-C111 HydrophobicContact CB-CB 4.41Å; C106-C111 WeakPolarHBondContact O-CB 3.44Å; C106-C111 PolarHBondContact O-N 3.37Å; A109-C111 PolarHBondContact O-N 2.83Å; C111-N113 PolarHBondContact O-N 3.41Å; C111-N113 PolarHBondContact SG-N 3.3Å; C111-N113 VanDerWaalsContact SG-N 3.43Å; C111-I114 PolarHBondContact O-N 3.19Å
112	P	76.4	Confident	72.4	Confident	34 Å²	34	41.6 Å²	41.6	22%	0.221	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-20.6	177	27.4	-33.4	0	0	0	112.6	T82 L348	T82-P112 HydrophobicContact CG2-CB 3.9Å; P112-L348 HydrophobicContact CG-CD2 4.45Å
113	N	76.4	Confident	70.5	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.016	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	7.2	-175.9	-49.2	-10.5	0	0	0	112.9	C111 G115 E116 C117 L348 Y353	C111-N113 PolarHBondContact O-N 3.41Å; C111-N113 PolarHBondContact SG-N 3.3Å; C111-N113 VanDerWaalsContact SG-N 3.43Å; N113-G115 VanDerWaalsContact C-N 3.28Å; N113-G115 PolarHBondContact O-N 3.04Å; N113-E116 PolarHBondContact O-N 3.46Å; N113-C117 WeakPolarHBondContact O-CB 3.4Å; N113-C117 PolarHBondContact O-N 3.39Å; N113-C117 PolarHBondContact O-SG 2.94Å; N113-L348 PolarHBondContact ND2-O 3.46Å; N113-Y353 HydrophobicContact CB-CD2 4.3Å; N113-Y353 HydrophobicContact CB-CE2 4.26Å; N113-Y353 VanDerWaalsContact ND2-CD2 3.3Å; N113-Y353 WeakPolarHBondContact ND2-CD2 3.44Å
114	I	75.1	Confident	68.8	Low	14 Å²	14	51.2 Å²	51.2	7%	0.072	28%	0.28	C	S	.	.	H	α-helix	trans	-59.5	-38	-172.9	-168.5	171.5	0	0	0	112.6	P85 Y90 C106 E107 C111 C117 W118	P85-I114 HydrophobicContact CB-CG2 4.16Å; P85-I114 HydrophobicContact CG-CG2 3.87Å; Y90-I114 HydrophobicContact CD2-CG1 4.46Å; Y90-I114 HydrophobicContact CE2-CD1 3.83Å; Y90-I114 HydrophobicContact CE2-CG1 3.88Å; Y90-I114 HydrophobicContact CE2-CG2 4.39Å; C106-I114 HydrophobicContact CB-CB 4.38Å; C106-I114 HydrophobicContact CB-CD1 3.76Å; C106-I114 HydrophobicContact CB-CG1 3.83Å; E107-I114 HydrophobicContact CG-CD1 3.8Å; C111-I114 PolarHBondContact O-N 3.19Å; I114-C117 PolarHBondContact O-N 3.39Å; I114-W118 HydrophobicContact CD1-CD2 4.26Å; I114-W118 HydrophobicContact CD1-CE3 4.36Å; I114-W118 HydrophobicContact CD1-CH2 4.04Å; I114-W118 HydrophobicContact CD1-CZ2 3.95Å; I114-W118 HydrophobicContact CD1-CZ3 4.25Å; I114-W118 HydrophobicContact CG1-CD2 3.82Å; I114-W118 HydrophobicContact CG1-CE3 4.28Å; I114-W118 HydrophobicContact CG1-CG 4.11Å; I114-W118 HydrophobicContact CG1-CZ2 4.22Å; I114-W118 VanDerWaalsContact O-CB 3.3Å; I114-W118 WeakPolarHBondContact O-CB 3.26Å; I114-W118 PolarHBondContact O-N 2.9Å
115	G	71.8	Confident	67.4	Low	22 Å²	22	53.1 Å²	53.1	23%	0.227	29%	0.291	C	S	.	.	H	α-helix	trans	-64.9	-46.3	178.1	0	0	0	0	0	112.5	N113 G119	N113-G115 VanDerWaalsContact C-N 3.28Å; N113-G115 PolarHBondContact O-N 3.04Å; G115-G119 WeakPolarHBondContact O-CA 3.09Å; G115-G119 PolarHBondContact O-N 3.31Å
116	E	71.9	Confident	66.4	Low	78 Å²	78	53.3 Å²	53.3	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-65.2	-44.5	176.7	-171.6	-161.5	146.8	0	0	111.2	N113 Y353 K354	N113-E116 PolarHBondContact O-N 3.46Å; E116-Y353 WeakPolarHBondContact OE1-CE2 3.44Å; E116-Y353 PolarHBondContact OE1-OH 2.83Å; E116-Y353 PolarHBondContact OE2-OH 2.98Å; E116-K354 PolarHBondContact O-NZ 3.49Å
117	C	72.3	Confident	65.9	Low	12 Å²	12	53.3 Å²	53.3	8%	0.081	30%	0.296	C	S	.	.	H	α-helix	trans	-64.9	-47.4	-177.2	-67	0	0	0	0	111.9	N113 I114 K354	N113-C117 WeakPolarHBondContact O-CB 3.4Å; N113-C117 PolarHBondContact O-N 3.39Å; N113-C117 PolarHBondContact O-SG 2.94Å; I114-C117 PolarHBondContact O-N 3.39Å; C117-K354 PolarHBondContact O-NZ 3.37Å
118	W	71.2	Confident	65.7	Low	7 Å²	7	51 Å²	51	3%	0.027	29%	0.286	C	S	.	.	H	α-helix	trans	-88.5	-17.3	-175.6	-65.3	13.5	0	0	0	113.4	Y90 L93 K94 L97 T104 C106 E107 I114	Y90-W118 HydrophobicContact CD2-CB 4.17Å; Y90-W118 HydrophobicContact CD2-CD2 4.2Å; Y90-W118 AromaticContact CD2-CE3 3.54Å; Y90-W118 HydrophobicContact CD2-CE3 3.54Å; Y90-W118 HydrophobicContact CD2-CG 4.5Å; Y90-W118 HydrophobicContact CD2-CZ3 4.29Å; Y90-W118 HydrophobicContact CE2-CD2 4.42Å; Y90-W118 AromaticContact CE2-CE3 3.69Å; Y90-W118 HydrophobicContact CE2-CE3 3.69Å; Y90-W118 HydrophobicContact CE2-CZ3 4.04Å; L93-W118 HydrophobicContact CB-CE3 4.06Å; L93-W118 HydrophobicContact CD2-CB 3.91Å; L93-W118 HydrophobicContact CD2-CD2 3.63Å; L93-W118 HydrophobicContact CD2-CE3 3.98Å; L93-W118 HydrophobicContact CD2-CG 3.59Å; L93-W118 HydrophobicContact CG-CD2 4.24Å; L93-W118 HydrophobicContact CG-CE3 4.11Å; K94-W118 HydrophobicContact CB-CZ3 3.94Å; L97-W118 HydrophobicContact CD1-CH2 3.17Å; L97-W118 HydrophobicContact CD1-CZ2 3.58Å; L97-W118 HydrophobicContact CD1-CZ3 3.77Å; T104-W118 HydrophobicContact CG2-CH2 4.37Å; T104-W118 HydrophobicContact CG2-CZ2 3.92Å; T104-W118 WeakPolarHBondContact OG1-CZ2 3.44Å; C106-W118 HydrophobicContact CB-CZ2 3.91Å; E107-W118 HydrophobicContact CG-CH2 3.79Å; E107-W118 HydrophobicContact CG-CZ2 4.35Å; I114-W118 HydrophobicContact CD1-CD2 4.26Å; I114-W118 HydrophobicContact CD1-CE3 4.36Å; I114-W118 HydrophobicContact CD1-CH2 4.04Å; I114-W118 HydrophobicContact CD1-CZ2 3.95Å; I114-W118 HydrophobicContact CD1-CZ3 4.25Å; I114-W118 HydrophobicContact CG1-CD2 3.82Å; I114-W118 HydrophobicContact CG1-CE3 4.28Å; I114-W118 HydrophobicContact CG1-CG 4.11Å; I114-W118 HydrophobicContact CG1-CZ2 4.22Å; I114-W118 VanDerWaalsContact O-CB 3.3Å; I114-W118 WeakPolarHBondContact O-CB 3.26Å; I114-W118 PolarHBondContact O-N 2.9Å
119	G	58.5	Low	65.9	Low	29 Å²	29	49 Å²	49	30%	0.299	28%	0.277	S	S	.	.	H	α-helix	trans	-67.8	-35	-175.1	0	0	0	0	0	113.5	N89 G115	N89-G119 WeakPolarHBondContact CB-O 3.16Å; N89-G119 PolarHBondContact ND2-O 3.44Å; G115-G119 WeakPolarHBondContact O-CA 3.09Å; G115-G119 PolarHBondContact O-N 3.31Å
120	G	53.8	Low	66.7	Low	16 Å²	16	47.3 Å²	47.3	17%	0.165	26%	0.263	C	S	.	.			trans	40.1	92.9	175.5	0	0	0	0	0	113.8	N89	N89-G120 PolarHBondContact ND2-O 3.34Å
121	G	49.6	Very low	67.6	Low	54 Å²	54	39.7 Å²	39.7	56%	0.557	24%	0.235	S	C	*	.			trans	-62.7	170.9	170.6	0	0	0	0	0	112.5	Y123 A124	G121-Y123 PolarHBondContact O-N 2.99Å; G121-A124 PolarHBondContact O-N 2.9Å
122	E	40.5	Very low	68.3	Low	185 Å²	185	38.6 Å²	38.6	86%	0.864	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-18.3	179.2	-91.1	177.9	160.4	0	0	114.7
123	Y	42.4	Very low	69.2	Low	216 Å²	216	37.2 Å²	37.2	85%	0.847	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.6	4.3	-178.6	-55.8	-79.6	0	0	0	114.2	G121	G121-Y123 PolarHBondContact O-N 2.99Å
124	A	49.6	Very low	70	Confident	39 Å²	39	38.1 Å²	38.1	32%	0.322	23%	0.227	S	C	.	.	S	Bend	trans	-105.3	123.5	-174.3	0	0	0	0	0	111.5	G121 A126	G121-A124 PolarHBondContact O-N 2.9Å; A124-A126 PolarHBondContact O-N 3.49Å; A124-A126 VanDerWaalsContact O-N 3.17Å
125	T	54.8	Low	70.8	Confident	40 Å²	40	38.8 Å²	38.8	25%	0.245	23%	0.231	C	C	.	.			trans	-56.8	119.3	170.1	-40.2	0	0	0	0	108.7	D173	T125-D173 HydrophobicContact CG2-CB 3.84Å
126	A	61.1	Low	71.9	Confident	40 Å²	40	38.7 Å²	38.7	33%	0.331	23%	0.226	S	C	.	.			trans	-71.9	131.2	174.3	0	0	0	0	0	108.6	A124 L172	A124-A126 PolarHBondContact O-N 3.49Å; A124-A126 VanDerWaalsContact O-N 3.17Å; A126-L172 HydrophobicContact CB-CD2 4.05Å; A126-L172 WeakPolarHBondContact O-CD2 3.38Å
127	T	67.7	Low	73.1	Confident	7 Å²	7	35.5 Å²	35.5	4%	0.043	21%	0.212	C	C	.	.			trans	-119.3	127.2	177.4	-40.1	0	0	0	0	109	Y174 E357	T127-Y174 HydrophobicContact CG2-CD1 4.31Å; T127-E357 WeakPolarHBondContact CB-OE1 3.42Å; T127-E357 WeakPolarHBondContact CG2-OE1 3.45Å; T127-E357 PolarHBondContact OG1-OE1 2.79Å; T127-E357 PolarHBondContact OG1-OE2 2.89Å
128	A	74.8	Confident	74.4	Confident	3 Å²	3	35.5 Å²	35.5	3%	0.025	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.3	169.6	0	0	0	0	0	109.6	I130 W170 L172 V175 V176	A128-I130 HydrophobicContact CB-CD1 3.93Å; A128-I130 HydrophobicContact CB-CG1 4.4Å; A128-W170 HydrophobicContact CB-CE3 4.46Å; A128-W170 HydrophobicContact CB-CZ3 4.03Å; A128-L172 HydrophobicContact CB-CD1 3.95Å; A128-V175 WeakPolarHBondContact O-CG2 3.48Å; A128-V176 PolarHBondContact O-N 3.48Å
129	T	86.8	Confident	75.6	Confident	5 Å²	5	35.5 Å²	35.5	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	104.1	165.1	-51.7	0	0	0	0	109	T104 V105 V176 T178 S352	T104-T129 WeakPolarHBondContact CA-O 3.44Å; T104-T129 WeakPolarHBondContact CB-O 3.34Å; V105-T129 HydrophobicContact CB-CG2 4.35Å; V105-T129 HydrophobicContact CG1-CG2 3.3Å; T129-V176 CarbonylContact C-O 3.49Å; T129-V176 VanDerWaalsContact CA-O 3.27Å; T129-V176 WeakPolarHBondContact CA-O 3.4Å; T129-V176 HydrophobicContact CG2-CB 3.82Å; T129-V176 HydrophobicContact CG2-CG1 3.72Å; T129-T178 HydrophobicContact CG2-CG2 3.99Å; T129-S352 WeakPolarHBondContact OG1-CB 3.5Å; T129-S352 PolarHBondContact OG1-OG 3.28Å
130	I	90.3	Very high	77.4	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	131.4	-178	-54.5	-52	0	0	0	109.1	L97 T104 A128 L132 T163 I167 W170 V175 V176 L177 T178	L97-I130 HydrophobicContact CD2-CD1 3.79Å; T104-I130 HydrophobicContact CG2-CD1 3.89Å; A128-I130 HydrophobicContact CB-CD1 3.93Å; A128-I130 HydrophobicContact CB-CG1 4.4Å; I130-L132 HydrophobicContact CG2-CD2 4.32Å; I130-T163 HydrophobicContact CG2-CG2 3.89Å; I130-I167 HydrophobicContact CG1-CD1 4.09Å; I130-I167 HydrophobicContact CG1-CG1 4.32Å; I130-W170 HydrophobicContact CD1-CH2 3.74Å; I130-W170 HydrophobicContact CD1-CZ3 3.71Å; I130-W170 HydrophobicContact CG1-CH2 4.41Å; I130-W170 HydrophobicContact CG1-CZ3 4.12Å; I130-V175 HydrophobicContact CG1-CG2 4.36Å; I130-V176 PolarHBondContact N-O 3.27Å; I130-L177 HydrophobicContact CB-CD2 4.03Å; I130-T178 PolarHBondContact O-N 3.22Å
131	M	93.8	Very high	79.5	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.03	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	111.3	176.8	-172.6	169.3	67.1	0	0	108.7	H103 E108 G134 D135 V146 T178 V180	H103-M131 HydrophobicContact CB-CB 4.34Å; H103-M131 HydrophobicContact CB-CE 3.95Å; H103-M131 PolarHBondContact O-N 3.18Å; E108-M131 HydrophobicContact CB-CE 3.74Å; E108-M131 HydrophobicContact CG-CE 3.46Å; E108-M131 VanDerWaalsContact CG-CE 3.46Å; M131-G134 WeakPolarHBondContact CE-O 3.42Å; M131-D135 HydrophobicContact CE-CB 4.31Å; M131-V146 HydrophobicContact SD-CG2 4.31Å; M131-T178 WeakPolarHBondContact CA-O 3.48Å; M131-T178 HydrophobicContact CB-CG2 3.97Å; M131-T178 HydrophobicContact CG-CG2 4.09Å; M131-V180 HydrophobicContact CE-CG1 4.43Å; M131-V180 HydrophobicContact CG-CG1 4.44Å; M131-V180 HydrophobicContact SD-CG1 3.93Å
132	L	96	Very high	81.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	162.7	176.3	-54.4	176.5	0	0	0	110.6	I130 G134 E159 T163 L177 T178 S179 I193 T196	I130-L132 HydrophobicContact CG2-CD2 4.32Å; L132-G134 VanDerWaalsContact C-N 3.28Å; L132-G134 PolarHBondContact O-N 3.17Å; L132-E159 WeakPolarHBondContact CA-OE1 3.24Å; L132-T163 HydrophobicContact CD2-CG2 3.87Å; L132-L177 HydrophobicContact CD1-CB 4.41Å; L132-T178 PolarHBondContact N-O 3.31Å; L132-S179 WeakPolarHBondContact O-CA 3.43Å; L132-I193 HydrophobicContact CD1-CG1 4.2Å; L132-T196 HydrophobicContact CD1-CG2 4.2Å; L132-T196 HydrophobicContact CD2-CG2 4.07Å
133	M	95.6	Very high	84.4	Confident	6 Å²	6	32.5 Å²	32.5	3%	0.03	18%	0.178	C	C	.	.	S	Bend	trans	70.2	24.8	171.9	-53.6	-164.5	-85.2	0	0	113.8	L155 E159 S179 V180 R182 G189 H192 I193	M133-L155 HydrophobicContact CB-CD2 3.48Å; M133-L155 VanDerWaalsContact CB-CD2 3.48Å; M133-L155 HydrophobicContact CG-CD2 3.46Å; M133-L155 VanDerWaalsContact CG-CD2 3.46Å; M133-L155 HydrophobicContact SD-CD1 4.16Å; M133-L155 HydrophobicContact SD-CD2 3.95Å; M133-E159 WeakPolarHBondContact CA-OE2 3.49Å; M133-E159 VanDerWaalsContact N-CD 3.32Å; M133-E159 PolarHBondContact N-OE1 3.29Å; M133-E159 PolarHBondContact N-OE2 2.87Å; M133-S179 VanDerWaalsContact CE-OG 3.25Å; M133-S179 WeakPolarHBondContact CE-OG 3.45Å; M133-V180 HydrophobicContact CB-CG2 4.03Å; M133-V180 WeakPolarHBondContact O-CG2 3.4Å; M133-R182 HydrophobicContact CB-CG 4.03Å; M133-R182 HydrophobicContact CE-CG 4.23Å; M133-R182 HydrophobicContact CG-CG 4.48Å; M133-R182 HydrophobicContact SD-CB 4.38Å; M133-R182 HydrophobicContact SD-CG 3.69Å; M133-G189 VanDerWaalsContact SD-CA 3.58Å; M133-H192 HydrophobicContact SD-CB 4.12Å; M133-I193 HydrophobicContact CE-CD1 4.12Å; M133-I193 HydrophobicContact CE-CG1 4.17Å
134	G	92	Very high	86.9	Confident	21 Å²	21	24.2 Å²	24.2	22%	0.216	15%	0.151	C	C	.	.			trans	81.6	-163.6	177.2	0	0	0	0	0	114.6	M131 L132	M131-G134 WeakPolarHBondContact CE-O 3.42Å; L132-G134 VanDerWaalsContact C-N 3.28Å; L132-G134 PolarHBondContact O-N 3.17Å
135	D	92.5	Very high	89	Confident	28 Å²	28	23.6 Å²	23.6	15%	0.15	14%	0.144	C	C	.	.	S	Bend	trans	-108.8	6.3	-173.6	69.8	-3.8	0	0	0	114.5	E108 M131 V146 K147	E108-D135 HydrophobicContact CG-CB 4.29Å; M131-D135 HydrophobicContact CE-CB 4.31Å; D135-V146 VanDerWaalsContact O-CG1 3.24Å; D135-V146 WeakPolarHBondContact O-CG1 3.37Å; D135-K147 WeakPolarHBondContact O-CB 3.46Å; D135-K147 PolarHBondContact O-N 3.42Å; D135-K147 IonicContact OD2-NZ 3.27Å; D135-K147 PolarHBondContact OD2-NZ 2.99Å
136	T	95.3	Very high	90.9	Very high	20 Å²	20	22.5 Å²	22.5	12%	0.123	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	113.5	-169.8	-60.5	0	0	0	0	110.9	K147 A149 P152	T136-K147 CarbonylContact C-O 3.54Å; T136-K147 WeakPolarHBondContact CA-O 3.31Å; T136-K147 HydrophobicContact CG2-CB 4.39Å; T136-A149 HydrophobicContact CG2-CB 3.44Å; T136-A149 VanDerWaalsContact CG2-CB 3.44Å; T136-P152 HydrophobicContact CG2-CB 4.1Å
137	C	97.3	Very high	92.4	Very high	11 Å²	11	26 Å²	26	7%	0.074	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	145.9	-174.9	-169.6	0	0	0	0	112.7	R139 V146 K147 T148 A149 V180 D181	C137-R139 PolarHBondContact O-N 3.03Å; C137-R139 PolarHBondContact SG-N 3.4Å; C137-V146 HydrophobicContact CB-CG1 3.99Å; C137-K147 PolarHBondContact N-O 2.72Å; C137-T148 VanDerWaalsContact O-CA 3.23Å; C137-T148 WeakPolarHBondContact O-CA 3.34Å; C137-A149 PolarHBondContact O-N 3.4Å; C137-V180 HydrophobicContact CB-CB 3.88Å; C137-V180 HydrophobicContact CB-CG1 4.2Å; C137-D181 VanDerWaalsContact SG-CB 3.58Å; C137-D181 PolarHBondContact SG-N 2.95Å
138	T	98	Very high	93.8	Very high	12 Å²	12	30.1 Å²	30.1	7%	0.074	17%	0.17	C	C	.	.	S	Bend	trans	-78.4	-5.4	171.3	58.1	0	0	0	0	113.5	A149 P152 D181 D183 D184 R252	T138-A149 WeakPolarHBondContact CA-O 3.5Å; T138-P152 HydrophobicContact CG2-CG 3.88Å; T138-D181 WeakPolarHBondContact CB-O 3.32Å; T138-D181 PolarHBondContact N-O 2.77Å; T138-D181 VanDerWaalsContact OG1-C 3.25Å; T138-D181 PolarHBondContact OG1-O 3.18Å; T138-D183 WeakPolarHBondContact OG1-CB 3.49Å; T138-D183 PolarHBondContact OG1-N 2.87Å; T138-D184 HydrophobicContact CG2-CB 4.38Å; T138-D184 WeakPolarHBondContact CG2-OD1 3.29Å; T138-R252 PolarHBondContact O-NH1 2.85Å; T138-R252 PolarHBondContact O-NH2 3.23Å
139	R	97.7	Very high	94.8	Very high	8 Å²	8	31.7 Å²	31.7	3%	0.03	18%	0.183	C	C	.	.			trans	-118.2	147.9	-178.3	-63.7	-162.4	-172.6	173.4	10.8	113.2	C137 T148 D181 D183 D215 R217 D250	C137-R139 PolarHBondContact O-N 3.03Å; C137-R139 PolarHBondContact SG-N 3.4Å; R139-T148 WeakPolarHBondContact O-CG2 3.4Å; R139-D181 HydrophobicContact CB-CB 4.13Å; R139-D181 VanDerWaalsContact CD-CG 3.44Å; R139-D181 WeakPolarHBondContact CD-OD2 3.06Å; R139-D181 HydrophobicContact CG-CB 3.64Å; R139-D181 IonicContact CZ-OD1 3.6Å; R139-D181 IonicContact NE-OD1 2.75Å; R139-D181 IonicContact NH1-OD1 2.67Å; R139-D183 WeakPolarHBondContact CG-OD2 3.35Å; R139-D183 IonicContact CZ-OD1 3.84Å; R139-D183 IonicContact CZ-OD2 2.77Å; R139-D183 IonicContact NE-OD1 2.99Å; R139-D183 PolarHBondContact NE-OD1 2.93Å; R139-D183 IonicContact NE-OD2 2.81Å; R139-D183 PolarHBondContact NE-OD2 3.4Å; R139-D183 IonicContact NH2-OD1 3.22Å; R139-D183 PolarHBondContact NH2-OD1 2.96Å; R139-D183 IonicContact NH2-OD2 2.87Å; R139-D215 IonicContact CZ-OD1 3.24Å; R139-D215 VanDerWaalsContact CZ-OD1 3.27Å; R139-D215 IonicContact CZ-OD2 3.78Å; R139-D215 IonicContact NH1-OD1 2.96Å; R139-D215 PolarHBondContact NH1-OD1 3.45Å; R139-D215 IonicContact NH1-OD2 2.64Å; R139-D215 PolarHBondContact NH1-OD2 2.78Å; R139-D215 IonicContact NH2-OD1 2.74Å; R139-D215 PolarHBondContact NH2-OD1 2.95Å; R139-D215 IonicContact NH2-OD2 3.95Å; R139-R217 VanDerWaalsContact NH2-CG 3.26Å; R139-D250 WeakPolarHBondContact CA-OD2 3.31Å; R139-D250 HydrophobicContact CB-CB 3.86Å; R139-D250 HydrophobicContact CG-CB 4.32Å
140	G	96.3	Very high	95	Very high	38 Å²	38	42 Å²	42	39%	0.392	22%	0.222	S	C	.	.			trans	-114.3	59.4	-174.8	0	0	0	0	0	113.8	R142 D250	G140-R142 PolarHBondContact O-N 3.39Å; G140-D250 PolarHBondContact N-OD2 2.98Å
141	C	97.8	Very high	95.1	Very high	23 Å²	23	48.3 Å²	48.3	16%	0.155	26%	0.256	C	S	.	.			trans	-60.2	128.9	173.5	-69	0	0	0	0	110.8	F143 C144 D250	C141-F143 HydrophobicContact CB-CD1 3.85Å; C141-F143 HydrophobicContact CB-CE1 3.59Å; C141-F143 HydrophobicContact CB-CZ 4.25Å; C141-F143 PolarHBondContact O-N 3.25Å; C141-C144 HydrophobicContact CB-CB 3.92Å; C141-C144 PolarHBondContact O-N 2.9Å; C141-C144 VanDerWaalsContact O-N 3.13Å; C141-D250 PolarHBondContact SG-N 3.41Å; C141-D250 VanDerWaalsContact SG-N 3.37Å
142	R	97.2	Very high	95.2	Very high	129 Å²	129	48.7 Å²	48.7	49%	0.487	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-8.5	-169.2	-62.2	176.7	58.6	-162.1	14.2	114.1	G140 K247 V248 H316 L317	G140-R142 PolarHBondContact O-N 3.39Å; R142-K247 VanDerWaalsContact CD-O 3.24Å; R142-K247 WeakPolarHBondContact CD-O 3.33Å; R142-K247 PolarHBondContact NH1-O 3.48Å; R142-V248 PolarHBondContact N-O 3.4Å; R142-H316 WeakPolarHBondContact O-CB 3.08Å; R142-L317 HydrophobicContact CB-CD1 3.87Å; R142-L317 HydrophobicContact CB-CD2 4.2Å; R142-L317 HydrophobicContact CB-CG 3.7Å; R142-L317 PolarHBondContact O-N 3.48Å; R142-L317 VanDerWaalsContact O-N 3.07Å
143	F	96.1	Very high	95.1	Very high	31 Å²	31	53 Å²	53	14%	0.136	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-19	172.7	74.3	-93.5	0	0	0	113.2	C141 E239 V248 R249 M279 Y309 P312	C141-F143 HydrophobicContact CB-CD1 3.85Å; C141-F143 HydrophobicContact CB-CE1 3.59Å; C141-F143 HydrophobicContact CB-CZ 4.25Å; C141-F143 PolarHBondContact O-N 3.25Å; F143-E239 HydrophobicContact CE1-CB 4.39Å; F143-E239 HydrophobicContact CE1-CG 4.08Å; F143-E239 HydrophobicContact CZ-CB 4.48Å; F143-E239 HydrophobicContact CZ-CG 3.85Å; F143-V248 HydrophobicContact CB-CG1 4.4Å; F143-V248 HydrophobicContact CD1-CG1 3.63Å; F143-V248 HydrophobicContact CE1-CG1 4.33Å; F143-V248 HydrophobicContact CG-CG1 4.36Å; F143-R249 HydrophobicContact CE1-CG 4.21Å; F143-M279 HydrophobicContact CB-CE 4.23Å; F143-M279 HydrophobicContact CD1-CE 3.92Å; F143-M279 HydrophobicContact CD2-CE 3.39Å; F143-M279 HydrophobicContact CD2-SD 3.86Å; F143-M279 HydrophobicContact CE1-CE 4.05Å; F143-M279 HydrophobicContact CE2-CE 3.54Å; F143-M279 HydrophobicContact CE2-SD 4.23Å; F143-M279 HydrophobicContact CG-CE 3.58Å; F143-M279 HydrophobicContact CG-SD 4.4Å; F143-M279 HydrophobicContact CZ-CE 3.87Å; F143-Y309 HydrophobicContact CB-CD2 4.21Å; F143-Y309 HydrophobicContact CB-CE2 3.63Å; F143-P312 VanDerWaalsContact O-CG 3.29Å; F143-P312 WeakPolarHBondContact O-CG 3.34Å
144	C	95.1	Very high	94.9	Very high	42 Å²	42	58.5 Å²	58.5	28%	0.284	32%	0.323	S	S	.	.			trans	-97.1	136.2	-166.8	-174.3	0	0	0	0	111.5	C141 V146 H316	C141-C144 HydrophobicContact CB-CB 3.92Å; C141-C144 PolarHBondContact O-N 2.9Å; C141-C144 VanDerWaalsContact O-N 3.13Å; C144-V146 VanDerWaalsContact SG-CG2 3.56Å; C144-H316 PolarHBondContact O-CD2 3.44Å; C144-H316 VanDerWaalsContact O-CD2 3.32Å; C144-H316 PolarHBondContact O-NE2 3.39Å
145	S	93.3	Very high	95	Very high	25 Å²	25	59.3 Å²	59.3	18%	0.175	32%	0.322	C	S	.	.			trans	-94.7	-1.1	-180	60.9	0	0	0	0	115.6	E108 A109	E108-S145 PolarHBondContact O-OG 3.01Å; A109-S145 WeakPolarHBondContact CA-OG 3.33Å
146	V	93.4	Very high	95	Very high	18 Å²	18	61.9 Å²	61.9	11%	0.109	34%	0.336	C	S	.	.	S	Bend	trans	-58.1	142.8	174.6	175.2	0	0	0	0	109.2	E108 M131 D135 C137 C144 V180	E108-V146 HydrophobicContact CB-CG2 4.48Å; M131-V146 HydrophobicContact SD-CG2 4.31Å; D135-V146 VanDerWaalsContact O-CG1 3.24Å; D135-V146 WeakPolarHBondContact O-CG1 3.37Å; C137-V146 HydrophobicContact CB-CG1 3.99Å; C144-V146 VanDerWaalsContact SG-CG2 3.56Å; V146-V180 HydrophobicContact CG1-CG1 3.7Å
147	K	94.1	Very high	95	Very high	114 Å²	114	65.5 Å²	65.5	50%	0.496	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	154.6	-178.7	-61.7	170.8	-170.6	161.4	0	109.6	D135 T136 C137	D135-K147 WeakPolarHBondContact O-CB 3.46Å; D135-K147 PolarHBondContact O-N 3.42Å; D135-K147 IonicContact OD2-NZ 3.27Å; D135-K147 PolarHBondContact OD2-NZ 2.99Å; T136-K147 CarbonylContact C-O 3.54Å; T136-K147 WeakPolarHBondContact CA-O 3.31Å; T136-K147 HydrophobicContact CG2-CB 4.39Å; C137-K147 PolarHBondContact N-O 2.72Å
148	T	95.9	Very high	94.9	Very high	92 Å²	92	67.7 Å²	67.7	56%	0.564	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.9	179.6	60	0	0	0	0	111.2	C137 R139	C137-T148 VanDerWaalsContact O-CA 3.23Å; C137-T148 WeakPolarHBondContact O-CA 3.34Å; R139-T148 WeakPolarHBondContact O-CG2 3.4Å
149	A	96	Very high	94.8	Very high	36 Å²	36	68 Å²	68	30%	0.298	38%	0.384	S	S	.	.			trans	-149.1	141.3	172.2	0	0	0	0	0	109.3	T136 C137 T138 N151	T136-A149 HydrophobicContact CG2-CB 3.44Å; T136-A149 VanDerWaalsContact CG2-CB 3.44Å; C137-A149 PolarHBondContact O-N 3.4Å; T138-A149 WeakPolarHBondContact CA-O 3.5Å; A149-N151 VanDerWaalsContact C-N 3.26Å; A149-N151 PolarHBondContact O-N 2.96Å
150	R	92.1	Very high	94.7	Very high	221 Å²	221	67.8 Å²	67.8	83%	0.834	38%	0.383	S	S	*	.	S	Bend	trans	-62.9	-38.4	175	-175.1	175.8	180	172	0.5	111.7
151	N	92.7	Very high	94.7	Very high	134 Å²	134	71.6 Å²	71.6	72%	0.717	39%	0.387	S	S	*	.	S	Bend	trans	-123.8	85.8	179.2	-57.7	-31	0	0	0	107.8	A149	A149-N151 VanDerWaalsContact C-N 3.26Å; A149-N151 PolarHBondContact O-N 2.96Å
152	P	95	Very high	94.5	Very high	14 Å²	14	72.9 Å²	72.9	9%	0.091	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-66.7	167.6	173.8	30.4	-35.5	0	0	0	110.8	T136 T138	T136-P152 HydrophobicContact CG2-CB 4.1Å; T138-P152 HydrophobicContact CG2-CG 3.88Å
153	P	93.2	Very high	94.3	Very high	89 Å²	89	66.8 Å²	66.8	58%	0.578	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-54.6	152.3	172.6	-25.5	35.3	0	0	0	112.8	R182	P153-R182 PolarHBondContact O-NH1 3.19Å; P153-R182 PolarHBondContact O-NH2 2.98Å
154	P	93	Very high	94.2	Very high	123 Å²	123	65.3 Å²	65.3	80%	0.799	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-53.8	145.6	173	-24.6	34.3	0	0	0	111.7	D156	P154-D156 PolarHBondContact O-N 2.72Å
155	L	92.8	Very high	94	Very high	38 Å²	38	68 Å²	68	20%	0.199	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-62.4	135.6	172.5	-77.6	174.1	0	0	0	110.7	M133 A157 R182 M185	M133-L155 HydrophobicContact CB-CD2 3.48Å; M133-L155 VanDerWaalsContact CB-CD2 3.48Å; M133-L155 HydrophobicContact CG-CD2 3.46Å; M133-L155 VanDerWaalsContact CG-CD2 3.46Å; M133-L155 HydrophobicContact SD-CD1 4.16Å; M133-L155 HydrophobicContact SD-CD2 3.95Å; L155-A157 PolarHBondContact O-N 2.75Å; L155-R182 VanDerWaalsContact CG-NH1 3.32Å; L155-M185 HydrophobicContact CD1-CE 3.86Å; L155-M185 HydrophobicContact CD1-CG 3.95Å; L155-M185 HydrophobicContact CD1-SD 3.99Å
156	D	93.5	Very high	93.8	Very high	82 Å²	82	66.9 Å²	66.9	44%	0.439	37%	0.366	S	S	.	.			trans	-73.6	112.7	167.9	177	2.7	0	0	0	109.1	P154 S158 E159 H192	P154-D156 PolarHBondContact O-N 2.72Å; D156-S158 VanDerWaalsContact CG-OG 3.28Å; D156-S158 PolarHBondContact O-N 2.94Å; D156-S158 VanDerWaalsContact O-N 3.17Å; D156-S158 WeakPolarHBondContact OD1-CA 3.45Å; D156-S158 WeakPolarHBondContact OD1-CB 3.38Å; D156-S158 PolarHBondContact OD1-N 2.99Å; D156-S158 PolarHBondContact OD1-OG 2.67Å; D156-S158 PolarHBondContact OD2-OG 2.68Å; D156-S158 VanDerWaalsContact OD2-OG 3.09Å; D156-E159 HydrophobicContact CB-CB 4.09Å; D156-E159 WeakPolarHBondContact O-CB 3.39Å; D156-E159 PolarHBondContact O-N 2.95Å; D156-E159 VanDerWaalsContact O-N 3.16Å; D156-H192 PolarHBondContact O-CE1 2.85Å; D156-H192 VanDerWaalsContact O-CE1 3.32Å
157	A	94.4	Very high	93.5	Very high	96 Å²	96	66 Å²	66	79%	0.793	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.2	179.6	0	0	0	0	0	113.5	L155	L155-A157 PolarHBondContact O-N 2.75Å
158	S	94.9	Very high	93.1	Very high	57 Å²	57	62 Å²	62	40%	0.399	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-15.2	178.4	78.8	0	0	0	0	113.8	D156 P160 Y161 S162	D156-S158 VanDerWaalsContact CG-OG 3.28Å; D156-S158 PolarHBondContact O-N 2.94Å; D156-S158 VanDerWaalsContact O-N 3.17Å; D156-S158 WeakPolarHBondContact OD1-CA 3.45Å; D156-S158 WeakPolarHBondContact OD1-CB 3.38Å; D156-S158 PolarHBondContact OD1-N 2.99Å; D156-S158 PolarHBondContact OD1-OG 2.67Å; D156-S158 PolarHBondContact OD2-OG 2.68Å; D156-S158 VanDerWaalsContact OD2-OG 3.09Å; S158-P160 VanDerWaalsContact C-CD 3.43Å; S158-P160 VanDerWaalsContact C-N 3.34Å; S158-Y161 PolarHBondContact O-N 3.08Å; S158-Y161 VanDerWaalsContact O-N 3.11Å; S158-S162 PolarHBondContact O-N 3.26Å; S158-S162 PolarHBondContact O-OG 3.24Å
159	E	95.8	Very high	92.5	Very high	18 Å²	18	63.9 Å²	63.9	8%	0.084	35%	0.351	C	S	.	.	H	α-helix	trans	-51	-43.7	-178.1	175.2	-179.9	-144.9	0	0	112.8	L132 M133 D156 Y161 S162 T163 H192	L132-E159 WeakPolarHBondContact CA-OE1 3.24Å; M133-E159 WeakPolarHBondContact CA-OE2 3.49Å; M133-E159 VanDerWaalsContact N-CD 3.32Å; M133-E159 PolarHBondContact N-OE1 3.29Å; M133-E159 PolarHBondContact N-OE2 2.87Å; D156-E159 HydrophobicContact CB-CB 4.09Å; D156-E159 WeakPolarHBondContact O-CB 3.39Å; D156-E159 PolarHBondContact O-N 2.95Å; D156-E159 VanDerWaalsContact O-N 3.16Å; E159-Y161 PolarHBondContact O-N 3.23Å; E159-S162 PolarHBondContact O-N 2.74Å; E159-T163 WeakPolarHBondContact O-CB 3.28Å; E159-T163 PolarHBondContact O-N 3.06Å; E159-T163 PolarHBondContact O-OG1 2.75Å; E159-H192 IonicContact OE2-CD2 3.63Å; E159-H192 IonicContact OE2-CE1 3.38Å; E159-H192 PolarHBondContact OE2-CE1 3.18Å; E159-H192 IonicContact OE2-NE2 2.76Å; E159-H192 PolarHBondContact OE2-NE2 3.48Å
160	P	96.8	Very high	91.7	Very high	4 Å²	4	64.8 Å²	64.8	3%	0.026	35%	0.347	C	S	.	.	H	α-helix	trans	-60.2	-44.3	179.8	-25.3	35.5	0	0	0	113.2	S158 A164 H192 K195 T196 Y199	S158-P160 VanDerWaalsContact C-CD 3.43Å; S158-P160 VanDerWaalsContact C-N 3.34Å; P160-A164 VanDerWaalsContact O-CB 3.23Å; P160-A164 WeakPolarHBondContact O-CB 3.29Å; P160-A164 PolarHBondContact O-N 3.27Å; P160-A164 VanDerWaalsContact O-N 3.07Å; P160-H192 VanDerWaalsContact CD-CE1 3.46Å; P160-H192 WeakPolarHBondContact CD-CE1 3.46Å; P160-H192 WeakPolarHBondContact CD-NE2 3.28Å; P160-H192 WeakPolarHBondContact CG-NE2 3.38Å; P160-K195 HydrophobicContact CB-CB 3.88Å; P160-K195 HydrophobicContact CG-CB 4.27Å; P160-T196 VanDerWaalsContact CA-OG1 3.28Å; P160-T196 WeakPolarHBondContact CA-OG1 3.5Å; P160-T196 WeakPolarHBondContact CB-OG1 3.31Å; P160-Y199 HydrophobicContact CB-CD2 3.96Å; P160-Y199 HydrophobicContact CB-CE2 4.07Å
161	Y	95.8	Very high	90.8	Very high	118 Å²	118	57.1 Å²	57.1	46%	0.463	34%	0.336	S	S	.	.	H	α-helix	trans	-70.1	-48.5	-178.6	177.3	-84.2	0	0	0	110.9	S158 E159 T163 A164 K165 R203	S158-Y161 PolarHBondContact O-N 3.08Å; S158-Y161 VanDerWaalsContact O-N 3.11Å; E159-Y161 PolarHBondContact O-N 3.23Å; Y161-T163 PolarHBondContact O-N 3.27Å; Y161-A164 PolarHBondContact O-N 3.43Å; Y161-K165 HydrophobicContact CE1-CD 4.41Å; Y161-K165 WeakPolarHBondContact O-CB 3.05Å; Y161-K165 PolarHBondContact O-N 2.79Å; Y161-R203 VanDerWaalsContact CD2-NH2 3.29Å; Y161-R203 VanDerWaalsContact CZ-NH2 3.33Å
162	S	93.1	Very high	90	Very high	50 Å²	50	51.6 Å²	51.6	35%	0.35	31%	0.307	S	S	.	.	H	α-helix	trans	-63.4	-42.4	-178.4	-63.1	0	0	0	0	111.4	S158 E159 K165 A166	S158-S162 PolarHBondContact O-N 3.26Å; S158-S162 PolarHBondContact O-OG 3.24Å; E159-S162 PolarHBondContact O-N 2.74Å; S162-K165 PolarHBondContact O-N 3.03Å; S162-A166 WeakPolarHBondContact O-CB 3.36Å; S162-A166 PolarHBondContact O-N 3.41Å
163	T	93.1	Very high	89.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-48.5	176.4	-57.9	0	0	0	0	111.5	L102 I130 L132 E159 Y161 K165 A166 I167 T196	L102-T163 HydrophobicContact CD2-CG2 4.23Å; L102-T163 WeakPolarHBondContact CD2-OG1 3.34Å; I130-T163 HydrophobicContact CG2-CG2 3.89Å; L132-T163 HydrophobicContact CD2-CG2 3.87Å; E159-T163 WeakPolarHBondContact O-CB 3.28Å; E159-T163 PolarHBondContact O-N 3.06Å; E159-T163 PolarHBondContact O-OG1 2.75Å; Y161-T163 PolarHBondContact O-N 3.27Å; T163-K165 VanDerWaalsContact C-N 3.32Å; T163-K165 PolarHBondContact O-N 3Å; T163-A166 PolarHBondContact O-N 3.2Å; T163-I167 HydrophobicContact CG2-CD1 3.58Å; T163-I167 HydrophobicContact CG2-CG1 4.34Å; T163-I167 WeakPolarHBondContact O-CG1 3.3Å; T163-I167 PolarHBondContact O-N 2.99Å; T163-T196 HydrophobicContact CG2-CG2 4.01Å
164	A	94	Very high	88.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-40.8	178.1	0	0	0	0	0	112.5	P160 Y161 A168 L200	P160-A164 VanDerWaalsContact O-CB 3.23Å; P160-A164 WeakPolarHBondContact O-CB 3.29Å; P160-A164 PolarHBondContact O-N 3.27Å; P160-A164 VanDerWaalsContact O-N 3.07Å; Y161-A164 PolarHBondContact O-N 3.43Å; A164-A168 WeakPolarHBondContact O-CB 3.35Å; A164-A168 PolarHBondContact O-N 2.96Å; A164-A168 VanDerWaalsContact O-N 3.1Å; A164-L200 HydrophobicContact CB-CB 4Å
165	K	91.4	Very high	88.5	Confident	99 Å²	99	44.8 Å²	44.8	43%	0.43	26%	0.258	S	S	.	.	H	α-helix	trans	-60.4	-50	174.6	-177.3	-175.9	173.8	-172.2	0	111.1	Y161 S162 T163 A168 E169	Y161-K165 HydrophobicContact CE1-CD 4.41Å; Y161-K165 WeakPolarHBondContact O-CB 3.05Å; Y161-K165 PolarHBondContact O-N 2.79Å; S162-K165 PolarHBondContact O-N 3.03Å; T163-K165 VanDerWaalsContact C-N 3.32Å; T163-K165 PolarHBondContact O-N 3Å; K165-A168 PolarHBondContact O-N 3.25Å; K165-E169 WeakPolarHBondContact CE-OE1 3.42Å; K165-E169 WeakPolarHBondContact O-CG 3.33Å; K165-E169 PolarHBondContact O-N 3.32Å
166	A	88.5	Confident	88.4	Confident	2 Å²	2	43 Å²	43	2%	0.017	25%	0.249	C	C	.	.	H	α-helix	trans	-60.1	-48.1	-179.8	0	0	0	0	0	112.9	L100 L102 S162 T163 A168 E169 W170	L100-A166 HydrophobicContact CD1-CB 3.44Å; L100-A166 VanDerWaalsContact CD1-CB 3.44Å; L102-A166 HydrophobicContact CD1-CB 4Å; S162-A166 WeakPolarHBondContact O-CB 3.36Å; S162-A166 PolarHBondContact O-N 3.41Å; T163-A166 PolarHBondContact O-N 3.2Å; A166-A168 VanDerWaalsContact C-N 3.31Å; A166-A168 PolarHBondContact O-N 3.17Å; A166-E169 PolarHBondContact O-N 2.98Å; A166-W170 HydrophobicContact CB-CZ2 4.19Å; A166-W170 PolarHBondContact O-N 2.76Å; A166-W170 PolarHBondContact O-NE1 2.8Å
167	I	87.1	Confident	88.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.5	-40.5	-179.7	-66.4	163.6	0	0	0	110.9	I130 T163 E169 W170 V175 L177 L200 I207	I130-I167 HydrophobicContact CG1-CD1 4.09Å; I130-I167 HydrophobicContact CG1-CG1 4.32Å; T163-I167 HydrophobicContact CG2-CD1 3.58Å; T163-I167 HydrophobicContact CG2-CG1 4.34Å; T163-I167 WeakPolarHBondContact O-CG1 3.3Å; T163-I167 PolarHBondContact O-N 2.99Å; I167-E169 VanDerWaalsContact C-N 3.29Å; I167-E169 PolarHBondContact O-N 2.91Å; I167-W170 HydrophobicContact CB-CE3 4.43Å; I167-W170 HydrophobicContact CG1-CE3 4.13Å; I167-W170 HydrophobicContact CG1-CH2 4.38Å; I167-W170 HydrophobicContact CG1-CZ3 3.8Å; I167-W170 PolarHBondContact O-N 3.42Å; I167-V175 HydrophobicContact CD1-CG2 4.04Å; I167-V175 HydrophobicContact CG1-CG2 4.44Å; I167-V175 HydrophobicContact CG2-CB 4.16Å; I167-V175 HydrophobicContact CG2-CG1 4.18Å; I167-V175 HydrophobicContact CG2-CG2 4.1Å; I167-L177 HydrophobicContact CD1-CD2 3.8Å; I167-L200 HydrophobicContact CB-CD1 3.99Å; I167-L200 HydrophobicContact CD1-CD2 4.45Å; I167-L200 HydrophobicContact CG2-CD1 3.74Å; I167-L200 HydrophobicContact CG2-CD2 4.02Å; I167-I207 HydrophobicContact CG2-CD1 3.68Å
168	A	86.9	Confident	88.6	Confident	29 Å²	29	35.4 Å²	35.4	24%	0.24	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-36	177.8	0	0	0	0	0	112.4	A164 K165 A166 W170 L200 R203	A164-A168 WeakPolarHBondContact O-CB 3.35Å; A164-A168 PolarHBondContact O-N 2.96Å; A164-A168 VanDerWaalsContact O-N 3.1Å; K165-A168 PolarHBondContact O-N 3.25Å; A166-A168 VanDerWaalsContact C-N 3.31Å; A166-A168 PolarHBondContact O-N 3.17Å; A168-W170 VanDerWaalsContact C-N 3.29Å; A168-W170 PolarHBondContact O-N 2.69Å; A168-L200 HydrophobicContact CB-CD1 4.38Å; A168-R203 HydrophobicContact CB-CB 3.83Å
169	E	83.6	Confident	88.7	Confident	132 Å²	132	33.3 Å²	33.3	62%	0.617	18%	0.18	S	C	*	.	H	α-helix	trans	-72	-20.4	177.5	-71	172.3	-175.5	0	0	113.2	K165 A166 I167 G171	K165-E169 WeakPolarHBondContact CE-OE1 3.42Å; K165-E169 WeakPolarHBondContact O-CG 3.33Å; K165-E169 PolarHBondContact O-N 3.32Å; A166-E169 PolarHBondContact O-N 2.98Å; I167-E169 VanDerWaalsContact C-N 3.29Å; I167-E169 PolarHBondContact O-N 2.91Å; E169-G171 VanDerWaalsContact C-N 3.29Å; E169-G171 PolarHBondContact O-N 3.08Å
170	W	78	Confident	88.8	Confident	54 Å²	54	32.8 Å²	32.8	21%	0.205	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-13	179.1	-62.9	-13.1	0	0	0	114	T96 L97 L100 L102 A128 I130 A166 I167 A168 L172	T96-W170 HydrophobicContact CG2-CZ2 4.13Å; L97-W170 HydrophobicContact CD2-CH2 3.53Å; L97-W170 HydrophobicContact CD2-CZ2 3.99Å; L100-W170 HydrophobicContact CD1-CZ2 4.1Å; L102-W170 HydrophobicContact CD1-CH2 3.98Å; L102-W170 HydrophobicContact CD1-CZ2 4.13Å; A128-W170 HydrophobicContact CB-CE3 4.46Å; A128-W170 HydrophobicContact CB-CZ3 4.03Å; I130-W170 HydrophobicContact CD1-CH2 3.74Å; I130-W170 HydrophobicContact CD1-CZ3 3.71Å; I130-W170 HydrophobicContact CG1-CH2 4.41Å; I130-W170 HydrophobicContact CG1-CZ3 4.12Å; A166-W170 HydrophobicContact CB-CZ2 4.19Å; A166-W170 PolarHBondContact O-N 2.76Å; A166-W170 PolarHBondContact O-NE1 2.8Å; I167-W170 HydrophobicContact CB-CE3 4.43Å; I167-W170 HydrophobicContact CG1-CE3 4.13Å; I167-W170 HydrophobicContact CG1-CH2 4.38Å; I167-W170 HydrophobicContact CG1-CZ3 3.8Å; I167-W170 PolarHBondContact O-N 3.42Å; A168-W170 VanDerWaalsContact C-N 3.29Å; A168-W170 PolarHBondContact O-N 2.69Å; W170-L172 VanDerWaalsContact C-N 3.29Å; W170-L172 HydrophobicContact CB-CD2 4.1Å; W170-L172 HydrophobicContact CB-CG 3.87Å; W170-L172 HydrophobicContact CE3-CD1 3.85Å; W170-L172 HydrophobicContact CE3-CG 4.43Å; W170-L172 PolarHBondContact O-N 2.67Å
171	G	73.3	Confident	88.8	Confident	60 Å²	60	33.8 Å²	33.8	62%	0.619	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	30.7	179.6	0	0	0	0	0	113.6	E169	E169-G171 VanDerWaalsContact C-N 3.29Å; E169-G171 PolarHBondContact O-N 3.08Å
172	L	75.8	Confident	88.9	Confident	18 Å²	18	28.5 Å²	28.5	9%	0.094	16%	0.163	C	C	.	.			trans	-75.6	142.5	177.7	-52.5	-172.6	0	0	0	110.9	A126 A128 W170 I207	A126-L172 HydrophobicContact CB-CD2 4.05Å; A126-L172 WeakPolarHBondContact O-CD2 3.38Å; A128-L172 HydrophobicContact CB-CD1 3.95Å; W170-L172 VanDerWaalsContact C-N 3.29Å; W170-L172 HydrophobicContact CB-CD2 4.1Å; W170-L172 HydrophobicContact CB-CG 3.87Å; W170-L172 HydrophobicContact CE3-CD1 3.85Å; W170-L172 HydrophobicContact CE3-CG 4.43Å; W170-L172 PolarHBondContact O-N 2.67Å; L172-I207 HydrophobicContact CB-CD1 4.3Å; L172-I207 WeakPolarHBondContact O-CD1 3.28Å; L172-I207 WeakPolarHBondContact O-CG1 3.25Å
173	D	77.6	Confident	89.1	Confident	78 Å²	78	27.1 Å²	27.1	42%	0.417	15%	0.152	S	C	.	.	S	Bend	trans	-81.7	-26.7	170.4	-83.5	-10.8	0	0	0	112.3	T125 L208 K361	T125-D173 HydrophobicContact CG2-CB 3.84Å; D173-L208 PolarHBondContact O-N 3.46Å; D173-K361 IonicContact OD2-NZ 3.78Å; D173-K361 PolarHBondContact OD2-NZ 3.42Å
174	Y	83.4	Confident	89.2	Confident	6 Å²	6	30.4 Å²	30.4	2%	0.024	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	134.8	-173.1	-161.8	-81.2	0	0	0	110.3	T127 V176 L208 E210 E357 L360	T127-Y174 HydrophobicContact CG2-CD1 4.31Å; Y174-V176 HydrophobicContact CD1-CG2 4.33Å; Y174-V176 HydrophobicContact CE1-CG2 3.82Å; Y174-L208 WeakPolarHBondContact CA-O 3.38Å; Y174-L208 HydrophobicContact CD2-CB 3.39Å; Y174-L208 HydrophobicContact CD2-CD1 3.84Å; Y174-L208 HydrophobicContact CD2-CG 4.26Å; Y174-L208 HydrophobicContact CE2-CB 3.79Å; Y174-L208 HydrophobicContact CE2-CD1 4.2Å; Y174-L208 HydrophobicContact CG-CB 4.19Å; Y174-E210 HydrophobicContact CE1-CB 3.93Å; Y174-E210 WeakPolarHBondContact OH-CB 3.26Å; Y174-E210 PolarHBondContact OH-OE2 3.15Å; Y174-E357 HydrophobicContact CD1-CG 3.84Å; Y174-E357 HydrophobicContact CD2-CG 4.35Å; Y174-E357 HydrophobicContact CE1-CG 4.05Å; Y174-E357 HydrophobicContact CG-CB 4.5Å; Y174-E357 HydrophobicContact CG-CG 4Å; Y174-L360 HydrophobicContact CE2-CB 4.37Å; Y174-L360 WeakPolarHBondContact OH-CD1 3.46Å
175	V	88.3	Confident	89.3	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	140.9	174.1	69.5	0	0	0	0	110.9	A128 I130 I167 L177 L200 I207 L208 V209 E210	A128-V175 WeakPolarHBondContact O-CG2 3.48Å; I130-V175 HydrophobicContact CG1-CG2 4.36Å; I167-V175 HydrophobicContact CD1-CG2 4.04Å; I167-V175 HydrophobicContact CG1-CG2 4.44Å; I167-V175 HydrophobicContact CG2-CB 4.16Å; I167-V175 HydrophobicContact CG2-CG1 4.18Å; I167-V175 HydrophobicContact CG2-CG2 4.1Å; V175-L177 HydrophobicContact CG2-CD2 4.23Å; V175-L200 HydrophobicContact CG1-CD2 3.63Å; V175-I207 HydrophobicContact CB-CD1 4.23Å; V175-I207 HydrophobicContact CG1-CD1 3.93Å; V175-I207 HydrophobicContact CG1-CG1 4.41Å; V175-L208 PolarHBondContact N-O 3.26Å; V175-V209 HydrophobicContact CG1-CG1 4.3Å; V175-V209 HydrophobicContact CG1-CG2 4.16Å; V175-E210 PolarHBondContact O-N 2.9Å
176	V	92.4	Very high	89.5	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	121.8	169.7	-175.3	0	0	0	0	108.1	A128 T129 I130 Y174 E210 L212	A128-V176 PolarHBondContact O-N 3.48Å; T129-V176 CarbonylContact C-O 3.49Å; T129-V176 VanDerWaalsContact CA-O 3.27Å; T129-V176 WeakPolarHBondContact CA-O 3.4Å; T129-V176 HydrophobicContact CG2-CB 3.82Å; T129-V176 HydrophobicContact CG2-CG1 3.72Å; I130-V176 PolarHBondContact N-O 3.27Å; Y174-V176 HydrophobicContact CD1-CG2 4.33Å; Y174-V176 HydrophobicContact CE1-CG2 3.82Å; V176-E210 CarbonylContact C-O 3.38Å; V176-E210 WeakPolarHBondContact CA-O 3.35Å; V176-E210 HydrophobicContact CG1-CB 4.45Å; V176-E210 HydrophobicContact CG1-CG 4.27Å; V176-E210 HydrophobicContact CG2-CB 4.18Å; V176-E210 HydrophobicContact CG2-CG 4.49Å; V176-L212 HydrophobicContact CG1-CB 4.48Å
177	L	95.5	Very high	89.9	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126	169.1	-58.5	-179.5	0	0	0	108.2	I130 L132 I167 V175 T196 V197 V209 E210 C211 L212	I130-L177 HydrophobicContact CB-CD2 4.03Å; L132-L177 HydrophobicContact CD1-CB 4.41Å; I167-L177 HydrophobicContact CD1-CD2 3.8Å; V175-L177 HydrophobicContact CG2-CD2 4.23Å; L177-T196 HydrophobicContact CD1-CG2 3.84Å; L177-V197 HydrophobicContact CD1-CG2 3.91Å; L177-V209 HydrophobicContact CD1-CG1 3.91Å; L177-V209 HydrophobicContact CG-CG1 4.25Å; L177-E210 PolarHBondContact N-O 3.02Å; L177-C211 CarbonylContact O-C 3.55Å; L177-C211 VanDerWaalsContact O-CA 3.28Å; L177-C211 WeakPolarHBondContact O-CA 3.37Å; L177-L212 PolarHBondContact O-N 2.86Å
178	T	96.1	Very high	90.3	Very high	15 Å²	15	35.4 Å²	35.4	9%	0.092	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	176.9	169.9	-169.7	0	0	0	0	109.1	V105 T129 I130 M131 L132 L212	V105-T178 HydrophobicContact CB-CG2 4.05Å; V105-T178 HydrophobicContact CG1-CG2 4.39Å; T129-T178 HydrophobicContact CG2-CG2 3.99Å; I130-T178 PolarHBondContact O-N 3.22Å; M131-T178 WeakPolarHBondContact CA-O 3.48Å; M131-T178 HydrophobicContact CB-CG2 3.97Å; M131-T178 HydrophobicContact CG-CG2 4.09Å; L132-T178 PolarHBondContact N-O 3.31Å; T178-L212 WeakPolarHBondContact CA-O 3.44Å; T178-L212 PolarHBondContact OG1-O 3.38Å
179	S	97	Very high	90.9	Very high	14 Å²	14	34 Å²	34	10%	0.098	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	160.5	176.4	63.6	0	0	0	0	111.9	L132 M133 P214	L132-S179 WeakPolarHBondContact O-CA 3.43Å; M133-S179 VanDerWaalsContact CE-OG 3.25Å; M133-S179 WeakPolarHBondContact CE-OG 3.45Å; S179-P214 VanDerWaalsContact OG-CD 3.31Å; S179-P214 WeakPolarHBondContact OG-CD 3.24Å; S179-P214 WeakPolarHBondContact OG-CG 3.46Å
180	V	96.8	Very high	91.6	Very high	6 Å²	6	27.8 Å²	27.8	4%	0.036	17%	0.165	C	C	.	.			trans	-72.1	157.4	165.2	-59.2	0	0	0	0	111.4	M131 M133 C137 V146 R182	M131-V180 HydrophobicContact CE-CG1 4.43Å; M131-V180 HydrophobicContact CG-CG1 4.44Å; M131-V180 HydrophobicContact SD-CG1 3.93Å; M133-V180 HydrophobicContact CB-CG2 4.03Å; M133-V180 WeakPolarHBondContact O-CG2 3.4Å; C137-V180 HydrophobicContact CB-CB 3.88Å; C137-V180 HydrophobicContact CB-CG1 4.2Å; V146-V180 HydrophobicContact CG1-CG1 3.7Å; V180-R182 HydrophobicContact CG2-CG 4.27Å; V180-R182 PolarHBondContact O-N 2.98Å
181	D	98	Very high	92.5	Very high	26 Å²	26	28.5 Å²	28.5	14%	0.139	17%	0.171	C	C	.	.			trans	-69.9	128.4	170.2	-63.5	-83.9	0	0	0	110.4	C137 T138 R139 P214	C137-D181 VanDerWaalsContact SG-CB 3.58Å; C137-D181 PolarHBondContact SG-N 2.95Å; T138-D181 WeakPolarHBondContact CB-O 3.32Å; T138-D181 PolarHBondContact N-O 2.77Å; T138-D181 VanDerWaalsContact OG1-C 3.25Å; T138-D181 PolarHBondContact OG1-O 3.18Å; R139-D181 HydrophobicContact CB-CB 4.13Å; R139-D181 VanDerWaalsContact CD-CG 3.44Å; R139-D181 WeakPolarHBondContact CD-OD2 3.06Å; R139-D181 HydrophobicContact CG-CB 3.64Å; R139-D181 IonicContact CZ-OD1 3.6Å; R139-D181 IonicContact NE-OD1 2.75Å; R139-D181 IonicContact NH1-OD1 2.67Å; D181-P214 WeakPolarHBondContact OD1-CB 3.47Å
182	R	97.4	Very high	93.7	Very high	6 Å²	6	26.4 Å²	26.4	2%	0.023	15%	0.145	C	C	.	.			trans	-115.4	62.1	177.1	-68.5	-60.2	-59.6	-105.7	0.1	111.8	M133 P153 L155 V180 D184 M185 G188	M133-R182 HydrophobicContact CB-CG 4.03Å; M133-R182 HydrophobicContact CE-CG 4.23Å; M133-R182 HydrophobicContact CG-CG 4.48Å; M133-R182 HydrophobicContact SD-CB 4.38Å; M133-R182 HydrophobicContact SD-CG 3.69Å; P153-R182 PolarHBondContact O-NH1 3.19Å; P153-R182 PolarHBondContact O-NH2 2.98Å; L155-R182 VanDerWaalsContact CG-NH1 3.32Å; V180-R182 HydrophobicContact CG2-CG 4.27Å; V180-R182 PolarHBondContact O-N 2.98Å; R182-D184 VanDerWaalsContact C-OD1 3.28Å; R182-D184 VanDerWaalsContact CA-OD1 3.29Å; R182-D184 WeakPolarHBondContact CA-OD1 3.35Å; R182-D184 IonicContact CZ-OD1 3.75Å; R182-D184 IonicContact CZ-OD2 2.79Å; R182-D184 IonicContact NE-OD1 2.91Å; R182-D184 PolarHBondContact NE-OD1 2.99Å; R182-D184 IonicContact NE-OD2 3.43Å; R182-D184 PolarHBondContact NE-OD2 3.46Å; R182-D184 IonicContact NH2-OD1 3.21Å; R182-D184 IonicContact NH2-OD2 3.9Å; R182-D184 PolarHBondContact NH2-OD2 2.67Å; R182-D184 PolarHBondContact O-N 2.78Å; R182-D184 VanDerWaalsContact O-N 3.08Å; R182-M185 HydrophobicContact CB-CB 4.29Å; R182-M185 HydrophobicContact CB-CG 3.94Å; R182-M185 WeakPolarHBondContact O-CB 3.49Å; R182-M185 PolarHBondContact O-N 3.17Å; R182-G188 WeakPolarHBondContact O-CA 3.35Å
183	D	96.6	Very high	94.8	Very high	22 Å²	22	25.8 Å²	25.8	12%	0.118	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.5	178.6	-69.6	-29.1	0	0	0	113	T138 R139 M185 R217 R252	T138-D183 WeakPolarHBondContact OG1-CB 3.49Å; T138-D183 PolarHBondContact OG1-N 2.87Å; R139-D183 WeakPolarHBondContact CG-OD2 3.35Å; R139-D183 IonicContact CZ-OD1 3.84Å; R139-D183 IonicContact CZ-OD2 2.77Å; R139-D183 IonicContact NE-OD1 2.99Å; R139-D183 PolarHBondContact NE-OD1 2.93Å; R139-D183 IonicContact NE-OD2 2.81Å; R139-D183 PolarHBondContact NE-OD2 3.4Å; R139-D183 IonicContact NH2-OD1 3.22Å; R139-D183 PolarHBondContact NH2-OD1 2.96Å; R139-D183 IonicContact NH2-OD2 2.87Å; D183-M185 VanDerWaalsContact C-N 3.28Å; D183-R217 PolarHBondContact O-NH1 3.15Å; D183-R217 WeakPolarHBondContact OD1-CD 3.26Å; D183-R217 WeakPolarHBondContact OD1-CG 3.29Å; D183-R252 IonicContact OD2-CZ 3.01Å; D183-R252 IonicContact OD2-NE 3.95Å; D183-R252 IonicContact OD2-NH1 2.67Å; D183-R252 PolarHBondContact OD2-NH1 2.98Å
184	D	95.7	Very high	95.8	Very high	68 Å²	68	22.5 Å²	22.5	36%	0.364	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-18.6	171	64.1	-60.2	0	0	0	113.4	T138 R182	T138-D184 HydrophobicContact CG2-CB 4.38Å; T138-D184 WeakPolarHBondContact CG2-OD1 3.29Å; R182-D184 VanDerWaalsContact C-OD1 3.28Å; R182-D184 VanDerWaalsContact CA-OD1 3.29Å; R182-D184 WeakPolarHBondContact CA-OD1 3.35Å; R182-D184 IonicContact CZ-OD1 3.75Å; R182-D184 IonicContact CZ-OD2 2.79Å; R182-D184 IonicContact NE-OD1 2.91Å; R182-D184 PolarHBondContact NE-OD1 2.99Å; R182-D184 IonicContact NE-OD2 3.43Å; R182-D184 PolarHBondContact NE-OD2 3.46Å; R182-D184 IonicContact NH2-OD1 3.21Å; R182-D184 IonicContact NH2-OD2 3.9Å; R182-D184 PolarHBondContact NH2-OD2 2.67Å; R182-D184 PolarHBondContact O-N 2.78Å; R182-D184 VanDerWaalsContact O-N 3.08Å
185	M	95.4	Very high	96.5	Very high	59 Å²	59	26.4 Å²	26.4	29%	0.291	14%	0.143	S	C	.	.	S	Bend	trans	-92.5	145.7	176.4	-62.9	-64.6	-62.8	0	0	111.2	L155 R182 D183 D187 G188 R217	L155-M185 HydrophobicContact CD1-CE 3.86Å; L155-M185 HydrophobicContact CD1-CG 3.95Å; L155-M185 HydrophobicContact CD1-SD 3.99Å; R182-M185 HydrophobicContact CB-CB 4.29Å; R182-M185 HydrophobicContact CB-CG 3.94Å; R182-M185 WeakPolarHBondContact O-CB 3.49Å; R182-M185 PolarHBondContact O-N 3.17Å; D183-M185 VanDerWaalsContact C-N 3.28Å; M185-D187 PolarHBondContact O-N 2.82Å; M185-G188 PolarHBondContact O-N 2.81Å; M185-R217 PolarHBondContact O-NH2 3.12Å
186	P	95.7	Very high	97	Very high	113 Å²	113	26.4 Å²	26.4	73%	0.734	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-43.6	178.8	-27	35.5	0	0	0	113.7	R217	P186-R217 PolarHBondContact O-NH2 3.16Å
187	D	96.9	Very high	97.3	Very high	31 Å²	31	26.3 Å²	26.3	17%	0.166	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	12.3	-178	73.8	-18.9	0	0	0	113.4	M185 G189 A190 E191 K225	M185-D187 PolarHBondContact O-N 2.82Å; D187-G189 PolarHBondContact O-N 2.91Å; D187-G189 VanDerWaalsContact O-N 3.09Å; D187-G189 PolarHBondContact OD1-N 3.21Å; D187-A190 HydrophobicContact CB-CB 4.47Å; D187-A190 WeakPolarHBondContact O-CB 3.48Å; D187-A190 PolarHBondContact O-N 3.32Å; D187-A190 VanDerWaalsContact O-N 3.16Å; D187-E191 WeakPolarHBondContact OD2-CB 3.46Å; D187-E191 PolarHBondContact OD2-N 3.12Å; D187-K225 IonicContact OD2-NZ 3.68Å
188	G	96.9	Very high	97.4	Very high	3 Å²	3	28.6 Å²	28.6	3%	0.031	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	13	-177.8	0	0	0	0	0	114.8	R182 M185	R182-G188 WeakPolarHBondContact O-CA 3.35Å; M185-G188 PolarHBondContact O-N 2.81Å
189	G	97.7	Very high	97.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.01	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	91	8.4	-176.4	0	0	0	0	0	115.2	M133 D187 E191 H192 I193	M133-G189 VanDerWaalsContact SD-CA 3.58Å; D187-G189 PolarHBondContact O-N 2.91Å; D187-G189 VanDerWaalsContact O-N 3.09Å; D187-G189 PolarHBondContact OD1-N 3.21Å; G189-E191 PolarHBondContact O-N 3.38Å; G189-H192 VanDerWaalsContact O-CB 3.26Å; G189-H192 WeakPolarHBondContact O-CB 3.49Å; G189-H192 PolarHBondContact O-N 3Å; G189-I193 PolarHBondContact O-N 3.13Å; G189-I193 VanDerWaalsContact O-N 3.15Å
190	A	98.5	Very high	97.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.1	-41.7	-179.9	0	0	0	0	0	113.7	D187 H192 I193 A194 F216 A222 K225 V226	D187-A190 HydrophobicContact CB-CB 4.47Å; D187-A190 WeakPolarHBondContact O-CB 3.48Å; D187-A190 PolarHBondContact O-N 3.32Å; D187-A190 VanDerWaalsContact O-N 3.16Å; A190-H192 PolarHBondContact O-N 3.49Å; A190-I193 PolarHBondContact O-N 3.37Å; A190-A194 WeakPolarHBondContact O-CB 3.31Å; A190-A194 PolarHBondContact O-N 3.11Å; A190-F216 HydrophobicContact CB-CD1 4.16Å; A190-F216 HydrophobicContact CB-CE1 3.88Å; A190-F216 HydrophobicContact CB-CZ 4.24Å; A190-A222 HydrophobicContact CB-CB 3.66Å; A190-A222 WeakPolarHBondContact CB-O 3.36Å; A190-K225 HydrophobicContact CB-CD 4.44Å; A190-V226 HydrophobicContact CB-CG2 3.86Å
191	E	98.4	Very high	97.3	Very high	70 Å²	70	31.9 Å²	31.9	33%	0.327	17%	0.168	S	C	.	.	H	α-helix	trans	-57.6	-39.6	173.9	-178.8	70.5	-164	0	0	112	D187 G189 A194 K195 K225	D187-E191 WeakPolarHBondContact OD2-CB 3.46Å; D187-E191 PolarHBondContact OD2-N 3.12Å; G189-E191 PolarHBondContact O-N 3.38Å; E191-A194 PolarHBondContact O-N 3.28Å; E191-K195 HydrophobicContact CG-CD 4.21Å; E191-K195 WeakPolarHBondContact O-CB 3.25Å; E191-K195 WeakPolarHBondContact O-CG 3.39Å; E191-K195 PolarHBondContact O-N 2.87Å; E191-K195 WeakPolarHBondContact OE1-CE 3.4Å; E191-K195 IonicContact OE1-NZ 3.66Å; E191-K195 PolarHBondContact OE1-NZ 2.83Å; E191-K225 HydrophobicContact CB-CD 4.15Å; E191-K225 VanDerWaalsContact OE2-CD 3.28Å; E191-K225 WeakPolarHBondContact OE2-CD 3.17Å; E191-K225 WeakPolarHBondContact OE2-CE 3.21Å; E191-K225 IonicContact OE2-NZ 2.7Å; E191-K225 PolarHBondContact OE2-NZ 3.43Å
192	H	98.4	Very high	97.3	Very high	16 Å²	16	36.5 Å²	36.5	7%	0.074	19%	0.189	C	C	.	.	H	α-helix	trans	-65.8	-47.9	-178	-161.9	109.1	0	0	0	110.6	M133 D156 E159 P160 G189 A190 K195 T196	M133-H192 HydrophobicContact SD-CB 4.12Å; D156-H192 PolarHBondContact O-CE1 2.85Å; D156-H192 VanDerWaalsContact O-CE1 3.32Å; E159-H192 IonicContact OE2-CD2 3.63Å; E159-H192 IonicContact OE2-CE1 3.38Å; E159-H192 PolarHBondContact OE2-CE1 3.18Å; E159-H192 IonicContact OE2-NE2 2.76Å; E159-H192 PolarHBondContact OE2-NE2 3.48Å; P160-H192 VanDerWaalsContact CD-CE1 3.46Å; P160-H192 WeakPolarHBondContact CD-CE1 3.46Å; P160-H192 WeakPolarHBondContact CD-NE2 3.28Å; P160-H192 WeakPolarHBondContact CG-NE2 3.38Å; G189-H192 VanDerWaalsContact O-CB 3.26Å; G189-H192 WeakPolarHBondContact O-CB 3.49Å; G189-H192 PolarHBondContact O-N 3Å; A190-H192 PolarHBondContact O-N 3.49Å; H192-K195 PolarHBondContact O-N 3.14Å; H192-T196 PolarHBondContact O-N 2.86Å; H192-T196 VanDerWaalsContact O-N 3.13Å; H192-T196 PolarHBondContact O-OG1 2.73Å
193	I	98.6	Very high	97.1	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-59.8	-49.7	175.3	-61.9	168.9	0	0	0	110.2	L132 M133 G189 A190 K195 T196 V197 C211 F216 V226	L132-I193 HydrophobicContact CD1-CG1 4.2Å; M133-I193 HydrophobicContact CE-CD1 4.12Å; M133-I193 HydrophobicContact CE-CG1 4.17Å; G189-I193 PolarHBondContact O-N 3.13Å; G189-I193 VanDerWaalsContact O-N 3.15Å; A190-I193 PolarHBondContact O-N 3.37Å; I193-K195 VanDerWaalsContact C-N 3.35Å; I193-K195 PolarHBondContact O-N 2.84Å; I193-T196 PolarHBondContact O-N 3.17Å; I193-T196 VanDerWaalsContact O-N 3.17Å; I193-V197 WeakPolarHBondContact O-CG2 3.37Å; I193-V197 PolarHBondContact O-N 3.07Å; I193-C211 HydrophobicContact CG2-CB 4.42Å; I193-F216 HydrophobicContact CD1-CE1 4.11Å; I193-F216 HydrophobicContact CD1-CZ 3.92Å; I193-V226 HydrophobicContact CB-CG2 4.21Å; I193-V226 HydrophobicContact CG2-CG1 3.84Å; I193-V226 HydrophobicContact CG2-CG2 4.24Å
194	A	98.6	Very high	96.9	Very high	10 Å²	10	41 Å²	41	8%	0.083	21%	0.207	C	C	.	.	H	α-helix	trans	-61	-41.6	-176.9	0	0	0	0	0	112.5	A190 E191 V197 S198 K225	A190-A194 WeakPolarHBondContact O-CB 3.31Å; A190-A194 PolarHBondContact O-N 3.11Å; E191-A194 PolarHBondContact O-N 3.28Å; A194-V197 PolarHBondContact O-N 2.86Å; A194-S198 PolarHBondContact O-N 3.05Å; A194-K225 HydrophobicContact CB-CD 4.41Å; A194-K225 HydrophobicContact CB-CG 3.99Å
195	K	98.4	Very high	96.7	Very high	87 Å²	87	42.5 Å²	42.5	38%	0.378	22%	0.22	S	C	.	.	H	α-helix	trans	-62.6	-42.7	174.6	-81.6	178.3	168.1	154.8	0	112.5	P160 E191 H192 I193 V197 S198 Y199	P160-K195 HydrophobicContact CB-CB 3.88Å; P160-K195 HydrophobicContact CG-CB 4.27Å; E191-K195 HydrophobicContact CG-CD 4.21Å; E191-K195 WeakPolarHBondContact O-CB 3.25Å; E191-K195 WeakPolarHBondContact O-CG 3.39Å; E191-K195 PolarHBondContact O-N 2.87Å; E191-K195 WeakPolarHBondContact OE1-CE 3.4Å; E191-K195 IonicContact OE1-NZ 3.66Å; E191-K195 PolarHBondContact OE1-NZ 2.83Å; H192-K195 PolarHBondContact O-N 3.14Å; I193-K195 VanDerWaalsContact C-N 3.35Å; I193-K195 PolarHBondContact O-N 2.84Å; K195-V197 VanDerWaalsContact C-N 3.31Å; K195-V197 PolarHBondContact O-N 3.4Å; K195-S198 PolarHBondContact O-N 3.24Å; K195-Y199 HydrophobicContact CB-CE2 4.24Å; K195-Y199 WeakPolarHBondContact O-CB 3.16Å; K195-Y199 WeakPolarHBondContact O-CD2 3.38Å; K195-Y199 VanDerWaalsContact O-CG 3.32Å; K195-Y199 PolarHBondContact O-N 3.07Å
196	T	98.3	Very high	96.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-44.7	177.7	-54.4	0	0	0	0	110.8	L132 P160 T163 L177 H192 I193 L200	L132-T196 HydrophobicContact CD1-CG2 4.2Å; L132-T196 HydrophobicContact CD2-CG2 4.07Å; P160-T196 VanDerWaalsContact CA-OG1 3.28Å; P160-T196 WeakPolarHBondContact CA-OG1 3.5Å; P160-T196 WeakPolarHBondContact CB-OG1 3.31Å; T163-T196 HydrophobicContact CG2-CG2 4.01Å; L177-T196 HydrophobicContact CD1-CG2 3.84Å; H192-T196 PolarHBondContact O-N 2.86Å; H192-T196 VanDerWaalsContact O-N 3.13Å; H192-T196 PolarHBondContact O-OG1 2.73Å; I193-T196 PolarHBondContact O-N 3.17Å; I193-T196 VanDerWaalsContact O-N 3.17Å; T196-L200 VanDerWaalsContact O-CB 3.26Å; T196-L200 WeakPolarHBondContact O-CB 3.49Å; T196-L200 PolarHBondContact O-N 2.8Å
197	V	98.2	Very high	95.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.7	-48.9	176.8	-179.6	0	0	0	0	110.9	L177 I193 A194 K195 Y199 L200 K201 V209 C211 S229 L231	L177-V197 HydrophobicContact CD1-CG2 3.91Å; I193-V197 WeakPolarHBondContact O-CG2 3.37Å; I193-V197 PolarHBondContact O-N 3.07Å; A194-V197 PolarHBondContact O-N 2.86Å; K195-V197 VanDerWaalsContact C-N 3.31Å; K195-V197 PolarHBondContact O-N 3.4Å; V197-Y199 PolarHBondContact O-N 2.79Å; V197-L200 WeakPolarHBondContact O-CB 3.42Å; V197-L200 PolarHBondContact O-N 2.7Å; V197-K201 HydrophobicContact CG1-CG 4.23Å; V197-K201 WeakPolarHBondContact O-CG 3.23Å; V197-K201 PolarHBondContact O-N 3.19Å; V197-V209 HydrophobicContact CG1-CG1 4.18Å; V197-V209 HydrophobicContact CG2-CG1 4.02Å; V197-C211 WeakPolarHBondContact CG2-SG 3.25Å; V197-S229 WeakPolarHBondContact CB-OG 2.9Å; V197-S229 VanDerWaalsContact CG1-O 3.31Å; V197-S229 WeakPolarHBondContact CG1-O 3.42Å; V197-S229 WeakPolarHBondContact CG1-OG 3.26Å; V197-L231 HydrophobicContact CG1-CB 4.08Å
198	S	98	Very high	95.5	Very high	49 Å²	49	42.6 Å²	42.6	34%	0.343	21%	0.207	S	C	.	.	H	α-helix	trans	-59.6	-49.4	-178.8	-171.3	0	0	0	0	111.6	A194 K195 L200 K201 E202	A194-S198 PolarHBondContact O-N 3.05Å; K195-S198 PolarHBondContact O-N 3.24Å; S198-L200 PolarHBondContact O-N 2.67Å; S198-K201 PolarHBondContact O-N 2.94Å; S198-E202 WeakPolarHBondContact O-CG 3.3Å; S198-E202 PolarHBondContact O-N 2.82Å
199	Y	97.8	Very high	95.4	Very high	73 Å²	73	42.5 Å²	42.5	29%	0.286	21%	0.205	S	C	.	.	H	α-helix	trans	-61.8	-33.9	177.7	-70	-28.5	0	0	0	112.7	P160 K195 V197 R203	P160-Y199 HydrophobicContact CB-CD2 3.96Å; P160-Y199 HydrophobicContact CB-CE2 4.07Å; K195-Y199 HydrophobicContact CB-CE2 4.24Å; K195-Y199 WeakPolarHBondContact O-CB 3.16Å; K195-Y199 WeakPolarHBondContact O-CD2 3.38Å; K195-Y199 VanDerWaalsContact O-CG 3.32Å; K195-Y199 PolarHBondContact O-N 3.07Å; V197-Y199 PolarHBondContact O-N 2.79Å; Y199-R203 WeakPolarHBondContact O-CD 3.47Å; Y199-R203 WeakPolarHBondContact O-CG 3.3Å; Y199-R203 PolarHBondContact O-N 3.17Å; Y199-R203 PolarHBondContact O-NH1 2.93Å
200	L	95.4	Very high	95.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-70.3	-44.2	176.3	178.4	58.7	0	0	0	111.2	A164 I167 A168 V175 T196 V197 S198 E202 R203 N204 I207 V209	A164-L200 HydrophobicContact CB-CB 4Å; I167-L200 HydrophobicContact CB-CD1 3.99Å; I167-L200 HydrophobicContact CD1-CD2 4.45Å; I167-L200 HydrophobicContact CG2-CD1 3.74Å; I167-L200 HydrophobicContact CG2-CD2 4.02Å; A168-L200 HydrophobicContact CB-CD1 4.38Å; V175-L200 HydrophobicContact CG1-CD2 3.63Å; T196-L200 VanDerWaalsContact O-CB 3.26Å; T196-L200 WeakPolarHBondContact O-CB 3.49Å; T196-L200 PolarHBondContact O-N 2.8Å; V197-L200 WeakPolarHBondContact O-CB 3.42Å; V197-L200 PolarHBondContact O-N 2.7Å; S198-L200 PolarHBondContact O-N 2.67Å; L200-E202 VanDerWaalsContact C-N 3.35Å; L200-E202 PolarHBondContact O-N 3.37Å; L200-R203 PolarHBondContact O-N 3.45Å; L200-N204 PolarHBondContact O-N 2.88Å; L200-I207 HydrophobicContact CD1-CD1 4.25Å; L200-I207 HydrophobicContact CD1-CG2 4.17Å; L200-I207 HydrophobicContact CD2-CD1 4.26Å; L200-I207 HydrophobicContact CD2-CG2 4.15Å; L200-I207 HydrophobicContact CG-CG2 3.83Å; L200-V209 HydrophobicContact CD2-CG2 3.7Å; L200-V209 HydrophobicContact CG-CG2 4.38Å
201	K	95.2	Very high	95.2	Very high	32 Å²	32	42.5 Å²	42.5	14%	0.139	21%	0.205	C	C	.	.	H	α-helix	trans	-65.7	-34.7	177.5	-71.5	-61	-165.5	172.9	0	113.1	V197 S198 R203 N204 P205 I207 V209 G230 D232	V197-K201 HydrophobicContact CG1-CG 4.23Å; V197-K201 WeakPolarHBondContact O-CG 3.23Å; V197-K201 PolarHBondContact O-N 3.19Å; S198-K201 PolarHBondContact O-N 2.94Å; K201-R203 VanDerWaalsContact C-N 3.29Å; K201-R203 PolarHBondContact O-N 2.9Å; K201-N204 CarbonylContact O-C 3.48Å; K201-P205 WeakPolarHBondContact O-CA 3.43Å; K201-P205 WeakPolarHBondContact O-CD 3.48Å; K201-P205 WeakPolarHBondContact O-CG 3.47Å; K201-P205 VanDerWaalsContact O-N 3.14Å; K201-I207 PolarHBondContact NZ-O 2.77Å; K201-V209 HydrophobicContact CD-CG2 4.3Å; K201-G230 WeakPolarHBondContact CE-O 3.38Å; K201-D232 IonicContact NZ-OD1 3.55Å; K201-D232 IonicContact NZ-OD2 3.65Å; K201-D232 PolarHBondContact NZ-OD2 3.02Å
202	E	96.1	Very high	95.2	Very high	123 Å²	123	40.3 Å²	40.3	58%	0.575	20%	0.195	S	C	*	.	H	α-helix	trans	-60.6	-38.7	171.9	-75.4	167.2	-164.1	0	0	112.1	S198 L200	S198-E202 WeakPolarHBondContact O-CG 3.3Å; S198-E202 PolarHBondContact O-N 2.82Å; L200-E202 VanDerWaalsContact C-N 3.35Å; L200-E202 PolarHBondContact O-N 3.37Å
203	R	94.9	Very high	95.1	Very high	85 Å²	85	39.9 Å²	39.9	32%	0.321	19%	0.194	S	C	.	.	H	α-helix	trans	-81.9	-39	-178.3	-72.4	163.9	177.2	62.6	8.6	112.8	Y161 A168 Y199 L200 K201	Y161-R203 VanDerWaalsContact CD2-NH2 3.29Å; Y161-R203 VanDerWaalsContact CZ-NH2 3.33Å; A168-R203 HydrophobicContact CB-CB 3.83Å; Y199-R203 WeakPolarHBondContact O-CD 3.47Å; Y199-R203 WeakPolarHBondContact O-CG 3.3Å; Y199-R203 PolarHBondContact O-N 3.17Å; Y199-R203 PolarHBondContact O-NH1 2.93Å; L200-R203 PolarHBondContact O-N 3.45Å; K201-R203 VanDerWaalsContact C-N 3.29Å; K201-R203 PolarHBondContact O-N 2.9Å
204	N	91.2	Very high	95.1	Very high	37 Å²	37	40.2 Å²	40.2	20%	0.198	20%	0.197	C	C	.	.			trans	-139.9	90.3	180	-174.1	-9.4	0	0	0	109.6	L200 K201 K206 I207	L200-N204 PolarHBondContact O-N 2.88Å; K201-N204 CarbonylContact O-C 3.48Å; N204-K206 PolarHBondContact O-N 3.41Å; N204-K206 VanDerWaalsContact O-N 3.14Å; N204-K206 PolarHBondContact OD1-N 3.21Å; N204-K206 VanDerWaalsContact OD1-N 3.12Å; N204-I207 HydrophobicContact CB-CB 4.28Å; N204-I207 HydrophobicContact CB-CG2 4.1Å; N204-I207 WeakPolarHBondContact O-CG2 3.42Å; N204-I207 PolarHBondContact O-N 3.38Å; N204-I207 PolarHBondContact OD1-N 2.92Å; N204-I207 VanDerWaalsContact OD1-N 3.15Å
205	P	91.4	Very high	95.1	Very high	100 Å²	100	39.9 Å²	39.9	65%	0.649	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.1	179	-23.8	33.2	0	0	0	114	K201	K201-P205 WeakPolarHBondContact O-CA 3.43Å; K201-P205 WeakPolarHBondContact O-CD 3.48Å; K201-P205 WeakPolarHBondContact O-CG 3.47Å; K201-P205 VanDerWaalsContact O-N 3.14Å
206	K	88.1	Confident	95.1	Very high	191 Å²	191	36 Å²	36	83%	0.83	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-23.3	-175.8	-63.8	-177.2	-178.7	178.7	0	113.4	N204 L208	N204-K206 PolarHBondContact O-N 3.41Å; N204-K206 VanDerWaalsContact O-N 3.14Å; N204-K206 PolarHBondContact OD1-N 3.21Å; N204-K206 VanDerWaalsContact OD1-N 3.12Å; K206-L208 PolarHBondContact O-N 3.49Å
207	I	86.3	Confident	95	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	20%	0.197	C	C	.	.	S	Bend	trans	-61.2	137.1	178.9	-165.8	168.5	0	0	0	109.9	I167 L172 V175 L200 K201 N204 V209	I167-I207 HydrophobicContact CG2-CD1 3.68Å; L172-I207 HydrophobicContact CB-CD1 4.3Å; L172-I207 WeakPolarHBondContact O-CD1 3.28Å; L172-I207 WeakPolarHBondContact O-CG1 3.25Å; V175-I207 HydrophobicContact CB-CD1 4.23Å; V175-I207 HydrophobicContact CG1-CD1 3.93Å; V175-I207 HydrophobicContact CG1-CG1 4.41Å; L200-I207 HydrophobicContact CD1-CD1 4.25Å; L200-I207 HydrophobicContact CD1-CG2 4.17Å; L200-I207 HydrophobicContact CD2-CD1 4.26Å; L200-I207 HydrophobicContact CD2-CG2 4.15Å; L200-I207 HydrophobicContact CG-CG2 3.83Å; K201-I207 PolarHBondContact NZ-O 2.77Å; N204-I207 HydrophobicContact CB-CB 4.28Å; N204-I207 HydrophobicContact CB-CG2 4.1Å; N204-I207 WeakPolarHBondContact O-CG2 3.42Å; N204-I207 PolarHBondContact O-N 3.38Å; N204-I207 PolarHBondContact OD1-N 2.92Å; N204-I207 VanDerWaalsContact OD1-N 3.15Å; I207-V209 HydrophobicContact CG2-CG2 3.97Å
208	L	89.6	Confident	94.9	Very high	13 Å²	13	42.6 Å²	42.6	7%	0.068	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	133	171.7	-65.6	178.3	0	0	0	110	D173 Y174 V175 K206 D232 K361 V364	D173-L208 PolarHBondContact O-N 3.46Å; Y174-L208 WeakPolarHBondContact CA-O 3.38Å; Y174-L208 HydrophobicContact CD2-CB 3.39Å; Y174-L208 HydrophobicContact CD2-CD1 3.84Å; Y174-L208 HydrophobicContact CD2-CG 4.26Å; Y174-L208 HydrophobicContact CE2-CB 3.79Å; Y174-L208 HydrophobicContact CE2-CD1 4.2Å; Y174-L208 HydrophobicContact CG-CB 4.19Å; V175-L208 PolarHBondContact N-O 3.26Å; K206-L208 PolarHBondContact O-N 3.49Å; L208-D232 VanDerWaalsContact CA-OD2 3.32Å; L208-D232 WeakPolarHBondContact CA-OD2 3.41Å; L208-D232 HydrophobicContact CD2-CB 4.1Å; L208-K361 HydrophobicContact CD1-CB 3.67Å; L208-K361 HydrophobicContact CD1-CD 4.42Å; L208-K361 HydrophobicContact CD1-CG 3.74Å; L208-V364 HydrophobicContact CD2-CB 4.29Å; L208-V364 HydrophobicContact CD2-CG1 3.78Å; L208-V364 HydrophobicContact CD2-CG2 4.44Å
209	V	93.7	Very high	94.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	115.2	-176.3	-172.6	0	0	0	0	109.8	V175 L177 V197 L200 K201 I207 D232 V233	V175-V209 HydrophobicContact CG1-CG1 4.3Å; V175-V209 HydrophobicContact CG1-CG2 4.16Å; L177-V209 HydrophobicContact CD1-CG1 3.91Å; L177-V209 HydrophobicContact CG-CG1 4.25Å; V197-V209 HydrophobicContact CG1-CG1 4.18Å; V197-V209 HydrophobicContact CG2-CG1 4.02Å; L200-V209 HydrophobicContact CD2-CG2 3.7Å; L200-V209 HydrophobicContact CG-CG2 4.38Å; K201-V209 HydrophobicContact CD-CG2 4.3Å; I207-V209 HydrophobicContact CG2-CG2 3.97Å; V209-D232 PolarHBondContact N-OD2 3.28Å; V209-D232 PolarHBondContact O-N 3.43Å; V209-V233 PolarHBondContact O-N 2.96Å; V209-V233 VanDerWaalsContact O-N 3.15Å
210	E	95.6	Very high	94.9	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.4	166.9	177.2	170.9	131.7	0	0	109.5	Y174 V175 V176 L177 V233 A235 K275	Y174-E210 HydrophobicContact CE1-CB 3.93Å; Y174-E210 WeakPolarHBondContact OH-CB 3.26Å; Y174-E210 PolarHBondContact OH-OE2 3.15Å; V175-E210 PolarHBondContact O-N 2.9Å; V176-E210 CarbonylContact C-O 3.38Å; V176-E210 WeakPolarHBondContact CA-O 3.35Å; V176-E210 HydrophobicContact CG1-CB 4.45Å; V176-E210 HydrophobicContact CG1-CG 4.27Å; V176-E210 HydrophobicContact CG2-CB 4.18Å; V176-E210 HydrophobicContact CG2-CG 4.49Å; L177-E210 PolarHBondContact N-O 3.02Å; E210-V233 CarbonylContact C-O 3.5Å; E210-V233 VanDerWaalsContact CA-O 3.31Å; E210-V233 WeakPolarHBondContact CA-O 3.41Å; E210-V233 HydrophobicContact CB-CB 3.87Å; E210-V233 HydrophobicContact CB-CG1 4.44Å; E210-V233 HydrophobicContact CG-CB 3.85Å; E210-V233 HydrophobicContact CG-CG1 3.88Å; E210-A235 HydrophobicContact CG-CB 4.13Å; E210-K275 VanDerWaalsContact CD-NZ 3.25Å; E210-K275 IonicContact OE1-NZ 2.8Å; E210-K275 PolarHBondContact OE1-NZ 3.41Å; E210-K275 WeakPolarHBondContact OE2-CD 3.35Å; E210-K275 IonicContact OE2-NZ 3.7Å; E210-K275 PolarHBondContact OE2-NZ 2.86Å
211	C	97.4	Very high	95.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	111.4	170.9	-63.6	0	0	0	0	110.1	L177 I193 V197 T213 V226 L231 V233 A235	L177-C211 CarbonylContact O-C 3.55Å; L177-C211 VanDerWaalsContact O-CA 3.28Å; L177-C211 WeakPolarHBondContact O-CA 3.37Å; I193-C211 HydrophobicContact CG2-CB 4.42Å; V197-C211 WeakPolarHBondContact CG2-SG 3.25Å; C211-T213 HydrophobicContact CB-CG2 3.96Å; C211-T213 PolarHBondContact O-N 3.14Å; C211-V226 HydrophobicContact CB-CG1 4.36Å; C211-L231 HydrophobicContact CB-CD2 3.94Å; C211-V233 PolarHBondContact N-O 2.94Å; C211-A235 WeakPolarHBondContact O-CA 3.36Å; C211-A235 PolarHBondContact O-N 3.04Å; C211-A235 VanDerWaalsContact O-O 3.09Å
212	L	97.4	Very high	95.2	Very high	24 Å²	24	50 Å²	50	13%	0.126	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	99.9	166.4	176.1	57.6	0	0	0	109	V176 L177 T178 A235	V176-L212 HydrophobicContact CG1-CB 4.48Å; L177-L212 PolarHBondContact O-N 2.86Å; T178-L212 WeakPolarHBondContact CA-O 3.44Å; T178-L212 PolarHBondContact OG1-O 3.38Å; L212-A235 WeakPolarHBondContact CA-O 3.48Å; L212-A235 HydrophobicContact CB-CB 4.23Å; L212-A235 HydrophobicContact CD1-CB 4.02Å
213	T	97.8	Very high	95.4	Very high	7 Å²	7	44.2 Å²	44.2	4%	0.043	22%	0.216	C	C	.	.			trans	-95.8	149.5	-168.2	59.5	0	0	0	0	113	C211 F216 V226 Y234 A235 H236	C211-T213 HydrophobicContact CB-CG2 3.96Å; C211-T213 PolarHBondContact O-N 3.14Å; T213-F216 HydrophobicContact CG2-CE2 4.31Å; T213-F216 HydrophobicContact CG2-CZ 4.28Å; T213-V226 HydrophobicContact CG2-CG1 3.77Å; T213-Y234 HydrophobicContact CG2-CE1 4.18Å; T213-Y234 HydrophobicContact CG2-CE2 4.27Å; T213-Y234 WeakPolarHBondContact OG1-CE1 3.3Å; T213-Y234 PolarHBondContact OG1-OH 2.75Å; T213-A235 PolarHBondContact N-O 2.84Å; T213-A235 PolarHBondContact OG1-O 2.92Å; T213-A235 VanDerWaalsContact OG1-O 3.05Å; T213-H236 PolarHBondContact O-ND1 3.3Å
214	P	98	Very high	95.5	Very high	12 Å²	12	44.2 Å²	44.2	8%	0.078	22%	0.219	C	C	.	.			trans	-55.6	171.8	157.4	-26	37.3	0	0	0	112.5	S179 D181 F216 H236	S179-P214 VanDerWaalsContact OG-CD 3.31Å; S179-P214 WeakPolarHBondContact OG-CD 3.24Å; S179-P214 WeakPolarHBondContact OG-CG 3.46Å; D181-P214 WeakPolarHBondContact OD1-CB 3.47Å; P214-F216 VanDerWaalsContact C-N 3.29Å; P214-F216 HydrophobicContact CB-CD1 4.32Å; P214-F216 HydrophobicContact CB-CE1 4.23Å; P214-F216 HydrophobicContact CG-CE1 4.27Å; P214-H236 PolarHBondContact O-ND1 2.9Å
215	D	98.2	Very high	95.9	Very high	3 Å²	3	46 Å²	46	2%	0.016	23%	0.226	C	C	.	.			trans	-83.2	-5.7	172.8	63.5	23.3	0	0	0	113.9	R139 R217 G218 Q257 V261	R139-D215 IonicContact CZ-OD1 3.24Å; R139-D215 VanDerWaalsContact CZ-OD1 3.27Å; R139-D215 IonicContact CZ-OD2 3.78Å; R139-D215 IonicContact NH1-OD1 2.96Å; R139-D215 PolarHBondContact NH1-OD1 3.45Å; R139-D215 IonicContact NH1-OD2 2.64Å; R139-D215 PolarHBondContact NH1-OD2 2.78Å; R139-D215 IonicContact NH2-OD1 2.74Å; R139-D215 PolarHBondContact NH2-OD1 2.95Å; R139-D215 IonicContact NH2-OD2 3.95Å; D215-R217 PolarHBondContact O-N 2.86Å; D215-R217 PolarHBondContact OD1-N 3.48Å; D215-G218 PolarHBondContact O-N 3.37Å; D215-Q257 HydrophobicContact CB-CG 4.22Å; D215-Q257 PolarHBondContact OD2-NE2 2.89Å; D215-V261 HydrophobicContact CB-CG2 4.05Å
216	F	98.3	Very high	96.2	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.018	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	50.2	28.9	-175.3	-51.3	-69.2	0	0	0	114.1	A190 I193 T213 P214 G218 D219 A222 I223 V226	A190-F216 HydrophobicContact CB-CD1 4.16Å; A190-F216 HydrophobicContact CB-CE1 3.88Å; A190-F216 HydrophobicContact CB-CZ 4.24Å; I193-F216 HydrophobicContact CD1-CE1 4.11Å; I193-F216 HydrophobicContact CD1-CZ 3.92Å; T213-F216 HydrophobicContact CG2-CE2 4.31Å; T213-F216 HydrophobicContact CG2-CZ 4.28Å; P214-F216 VanDerWaalsContact C-N 3.29Å; P214-F216 HydrophobicContact CB-CD1 4.32Å; P214-F216 HydrophobicContact CB-CE1 4.23Å; P214-F216 HydrophobicContact CG-CE1 4.27Å; F216-G218 PolarHBondContact O-N 2.92Å; F216-G218 VanDerWaalsContact O-N 3.16Å; F216-D219 HydrophobicContact CB-CB 4.41Å; F216-D219 WeakPolarHBondContact O-CB 3.37Å; F216-D219 PolarHBondContact O-N 3.29Å; F216-A222 HydrophobicContact CB-CB 3.68Å; F216-A222 HydrophobicContact CD1-CB 4.18Å; F216-A222 HydrophobicContact CD2-CB 4.24Å; F216-A222 HydrophobicContact CG-CB 3.77Å; F216-I223 HydrophobicContact CD2-CG1 3.82Å; F216-V226 HydrophobicContact CE2-CG2 4.28Å; F216-V226 HydrophobicContact CZ-CG2 3.91Å
217	R	96.6	Very high	96.7	Very high	116 Å²	116	32.3 Å²	32.3	44%	0.438	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	55.6	26.2	-172.1	-55.1	176.7	-66.6	-152.9	-8.3	113.2	R139 D183 M185 P186 D215 D219	R139-R217 VanDerWaalsContact NH2-CG 3.26Å; D183-R217 PolarHBondContact O-NH1 3.15Å; D183-R217 WeakPolarHBondContact OD1-CD 3.26Å; D183-R217 WeakPolarHBondContact OD1-CG 3.29Å; M185-R217 PolarHBondContact O-NH2 3.12Å; P186-R217 PolarHBondContact O-NH2 3.16Å; D215-R217 PolarHBondContact O-N 2.86Å; D215-R217 PolarHBondContact OD1-N 3.48Å; R217-D219 VanDerWaalsContact C-N 3.34Å
218	G	96.1	Very high	97.3	Very high	24 Å²	24	36.6 Å²	36.6	25%	0.247	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	75.8	14.9	-175.9	0	0	0	0	0	114.9	D215 F216 L220	D215-G218 PolarHBondContact O-N 3.37Å; F216-G218 PolarHBondContact O-N 2.92Å; F216-G218 VanDerWaalsContact O-N 3.16Å; G218-L220 PolarHBondContact O-N 3.46Å; G218-L220 VanDerWaalsContact O-N 3.11Å
219	D	98.2	Very high	97.6	Very high	65 Å²	65	36.7 Å²	36.7	35%	0.348	18%	0.181	S	C	.	.			trans	-67.4	107.4	173.9	-175.4	-10.5	0	0	0	110.7	F216 R217 K221 A222 I223	F216-D219 HydrophobicContact CB-CB 4.41Å; F216-D219 WeakPolarHBondContact O-CB 3.37Å; F216-D219 PolarHBondContact O-N 3.29Å; R217-D219 VanDerWaalsContact C-N 3.34Å; D219-K221 VanDerWaalsContact C-N 3.29Å; D219-K221 PolarHBondContact O-N 3.26Å; D219-K221 WeakPolarHBondContact OD1-CB 3.32Å; D219-K221 PolarHBondContact OD1-N 2.99Å; D219-A222 HydrophobicContact CB-CB 3.87Å; D219-A222 WeakPolarHBondContact O-CB 3.31Å; D219-A222 PolarHBondContact O-N 3.38Å; D219-A222 PolarHBondContact OD1-N 2.81Å; D219-I223 WeakPolarHBondContact O-CD1 3.35Å; D219-I223 WeakPolarHBondContact O-CG1 3.31Å; D219-I223 PolarHBondContact O-N 2.92Å; D219-I223 VanDerWaalsContact O-N 3.09Å
220	L	98.2	Very high	97.7	Very high	82 Å²	82	38.8 Å²	38.8	43%	0.429	20%	0.202	S	C	.	.	H	α-helix	trans	-62.4	-33.7	-179.3	-60.3	-172.5	0	0	0	112.7	G218 I223 E224 H264	G218-L220 PolarHBondContact O-N 3.46Å; G218-L220 VanDerWaalsContact O-N 3.11Å; L220-I223 HydrophobicContact CD2-CD1 4.04Å; L220-I223 PolarHBondContact O-N 3.4Å; L220-E224 VanDerWaalsContact O-CB 3.3Å; L220-E224 WeakPolarHBondContact O-CB 3.33Å; L220-E224 PolarHBondContact O-N 2.96Å; L220-H264 HydrophobicContact CD2-CB 4.09Å; L220-H264 PolarHBondContact O-CD2 3.44Å; L220-H264 PolarHBondContact O-NE2 3.2Å
221	K	98.5	Very high	97.8	Very high	161 Å²	161	39.4 Å²	39.4	70%	0.7	21%	0.205	S	C	*	.	H	α-helix	trans	-70.3	-36.2	178.5	-67	-176	177.6	-178.6	0	111.5	D219 K225	D219-K221 VanDerWaalsContact C-N 3.29Å; D219-K221 PolarHBondContact O-N 3.26Å; D219-K221 WeakPolarHBondContact OD1-CB 3.32Å; D219-K221 PolarHBondContact OD1-N 2.99Å; K221-K225 VanDerWaalsContact O-CB 3.32Å; K221-K225 WeakPolarHBondContact O-CB 3.14Å; K221-K225 PolarHBondContact O-N 3.15Å
222	A	98.6	Very high	97.7	Very high	1 Å²	1	40 Å²	40	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-64.6	-44.8	174.3	0	0	0	0	0	110.9	A190 F216 D219 K225 V226	A190-A222 HydrophobicContact CB-CB 3.66Å; A190-A222 WeakPolarHBondContact CB-O 3.36Å; F216-A222 HydrophobicContact CB-CB 3.68Å; F216-A222 HydrophobicContact CD1-CB 4.18Å; F216-A222 HydrophobicContact CD2-CB 4.24Å; F216-A222 HydrophobicContact CG-CB 3.77Å; D219-A222 HydrophobicContact CB-CB 3.87Å; D219-A222 WeakPolarHBondContact O-CB 3.31Å; D219-A222 PolarHBondContact O-N 3.38Å; D219-A222 PolarHBondContact OD1-N 2.81Å; A222-K225 PolarHBondContact O-N 3.17Å; A222-V226 PolarHBondContact O-N 3.26Å
223	I	98.6	Very high	97.6	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-49.1	175.4	-63	156.8	0	0	0	110.9	F216 D219 L220 K225 V226 A227 Y234 V261 H264 A265	F216-I223 HydrophobicContact CD2-CG1 3.82Å; D219-I223 WeakPolarHBondContact O-CD1 3.35Å; D219-I223 WeakPolarHBondContact O-CG1 3.31Å; D219-I223 PolarHBondContact O-N 2.92Å; D219-I223 VanDerWaalsContact O-N 3.09Å; L220-I223 HydrophobicContact CD2-CD1 4.04Å; L220-I223 PolarHBondContact O-N 3.4Å; I223-K225 VanDerWaalsContact C-N 3.33Å; I223-K225 PolarHBondContact O-N 3.07Å; I223-V226 PolarHBondContact O-N 2.8Å; I223-A227 WeakPolarHBondContact O-CB 3.36Å; I223-A227 PolarHBondContact O-N 3.13Å; I223-Y234 HydrophobicContact CG2-CE2 4.44Å; I223-V261 HydrophobicContact CD1-CB 4.26Å; I223-V261 HydrophobicContact CD1-CG1 4.44Å; I223-V261 HydrophobicContact CD1-CG2 3.82Å; I223-V261 HydrophobicContact CG1-CG1 4.31Å; I223-V261 HydrophobicContact CG1-CG2 4.36Å; I223-H264 HydrophobicContact CG2-CB 4.22Å; I223-A265 HydrophobicContact CG2-CB 4.19Å
224	E	98.6	Very high	97.6	Very high	85 Å²	85	38.5 Å²	38.5	40%	0.397	20%	0.2	S	C	.	.	H	α-helix	trans	-56.2	-46.9	177.9	171.4	171.9	-173.3	0	0	111.5	L220 V226 A227 L228 V268	L220-E224 VanDerWaalsContact O-CB 3.3Å; L220-E224 WeakPolarHBondContact O-CB 3.33Å; L220-E224 PolarHBondContact O-N 2.96Å; E224-V226 VanDerWaalsContact C-N 3.32Å; E224-V226 PolarHBondContact O-N 2.83Å; E224-A227 PolarHBondContact O-N 3.24Å; E224-L228 HydrophobicContact CG-CD1 3.75Å; E224-L228 HydrophobicContact CG-CG 4.43Å; E224-L228 WeakPolarHBondContact O-CB 3.48Å; E224-L228 WeakPolarHBondContact O-CG 3.08Å; E224-L228 PolarHBondContact O-N 3.43Å; E224-V268 HydrophobicContact CB-CG1 4.32Å; E224-V268 HydrophobicContact CB-CG2 4.09Å; E224-V268 HydrophobicContact CG-CG1 3.82Å; E224-V268 HydrophobicContact CG-CG2 4.14Å
225	K	98.6	Very high	97.5	Very high	76 Å²	76	38 Å²	38	33%	0.33	20%	0.197	S	C	.	.	H	α-helix	trans	-56.8	-45.2	179.6	-175	-176.9	-63.7	-169.4	0	112.4	D187 A190 E191 A194 K221 A222 I223 S229	D187-K225 IonicContact OD2-NZ 3.68Å; A190-K225 HydrophobicContact CB-CD 4.44Å; E191-K225 HydrophobicContact CB-CD 4.15Å; E191-K225 VanDerWaalsContact OE2-CD 3.28Å; E191-K225 WeakPolarHBondContact OE2-CD 3.17Å; E191-K225 WeakPolarHBondContact OE2-CE 3.21Å; E191-K225 IonicContact OE2-NZ 2.7Å; E191-K225 PolarHBondContact OE2-NZ 3.43Å; A194-K225 HydrophobicContact CB-CD 4.41Å; A194-K225 HydrophobicContact CB-CG 3.99Å; K221-K225 VanDerWaalsContact O-CB 3.32Å; K221-K225 WeakPolarHBondContact O-CB 3.14Å; K221-K225 PolarHBondContact O-N 3.15Å; A222-K225 PolarHBondContact O-N 3.17Å; I223-K225 VanDerWaalsContact C-N 3.33Å; I223-K225 PolarHBondContact O-N 3.07Å; K225-S229 PolarHBondContact O-N 2.79Å
226	V	98.6	Very high	97.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-71	-43.8	178	-179.7	0	0	0	0	110.5	A190 I193 C211 T213 F216 A222 I223 E224 L228 S229 L231 Y234	A190-V226 HydrophobicContact CB-CG2 3.86Å; I193-V226 HydrophobicContact CB-CG2 4.21Å; I193-V226 HydrophobicContact CG2-CG1 3.84Å; I193-V226 HydrophobicContact CG2-CG2 4.24Å; C211-V226 HydrophobicContact CB-CG1 4.36Å; T213-V226 HydrophobicContact CG2-CG1 3.77Å; F216-V226 HydrophobicContact CE2-CG2 4.28Å; F216-V226 HydrophobicContact CZ-CG2 3.91Å; A222-V226 PolarHBondContact O-N 3.26Å; I223-V226 PolarHBondContact O-N 2.8Å; E224-V226 VanDerWaalsContact C-N 3.32Å; E224-V226 PolarHBondContact O-N 2.83Å; V226-L228 PolarHBondContact O-N 3.5Å; V226-L228 VanDerWaalsContact O-N 3.16Å; V226-S229 WeakPolarHBondContact O-CB 3.49Å; V226-S229 PolarHBondContact O-N 2.87Å; V226-S229 PolarHBondContact O-OG 3.31Å; V226-L231 HydrophobicContact CG1-CD2 3.66Å; V226-L231 WeakPolarHBondContact O-CD2 3.28Å; V226-Y234 HydrophobicContact CB-CE2 4.09Å; V226-Y234 HydrophobicContact CG1-CE2 3.98Å
227	A	98.1	Very high	97.6	Very high	2 Å²	2	38.4 Å²	38.4	2%	0.017	20%	0.199	C	C	.	.	H	α-helix	trans	-58.8	-30.2	178.9	0	0	0	0	0	113.5	I223 E224 Y234 A265 V268	I223-A227 WeakPolarHBondContact O-CB 3.36Å; I223-A227 PolarHBondContact O-N 3.13Å; E224-A227 PolarHBondContact O-N 3.24Å; A227-Y234 HydrophobicContact CB-CD2 3.97Å; A227-Y234 HydrophobicContact CB-CE2 4.02Å; A227-A265 HydrophobicContact CB-CB 4.29Å; A227-V268 HydrophobicContact CB-CG1 4.3Å
228	L	98	Very high	97.7	Very high	91 Å²	91	32.9 Å²	32.9	48%	0.476	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	2.4	178.6	-64	176.7	0	0	0	114.3	E224 V226 G230 V268	E224-L228 HydrophobicContact CG-CD1 3.75Å; E224-L228 HydrophobicContact CG-CG 4.43Å; E224-L228 WeakPolarHBondContact O-CB 3.48Å; E224-L228 WeakPolarHBondContact O-CG 3.08Å; E224-L228 PolarHBondContact O-N 3.43Å; V226-L228 PolarHBondContact O-N 3.5Å; V226-L228 VanDerWaalsContact O-N 3.16Å; L228-G230 PolarHBondContact O-N 3.32Å; L228-G230 VanDerWaalsContact O-N 3.11Å; L228-V268 HydrophobicContact CD1-CG1 3.94Å; L228-V268 HydrophobicContact CD2-CG1 3.68Å; L228-V268 HydrophobicContact CG-CG1 3.62Å
229	S	97.8	Very high	97.8	Very high	16 Å²	16	33.1 Å²	33.1	11%	0.112	17%	0.173	C	C	.	.	S	Bend	trans	-73.8	-1.5	-175.4	78.6	0	0	0	0	114.6	V197 K225 V226	V197-S229 WeakPolarHBondContact CB-OG 2.9Å; V197-S229 VanDerWaalsContact CG1-O 3.31Å; V197-S229 WeakPolarHBondContact CG1-O 3.42Å; V197-S229 WeakPolarHBondContact CG1-OG 3.26Å; K225-S229 PolarHBondContact O-N 2.79Å; V226-S229 WeakPolarHBondContact O-CB 3.49Å; V226-S229 PolarHBondContact O-N 2.87Å; V226-S229 PolarHBondContact O-OG 3.31Å
230	G	95.6	Very high	97.8	Very high	43 Å²	43	30 Å²	30	44%	0.443	16%	0.156	S	C	.	.	S	Bend	trans	88.8	11.5	-175.4	0	0	0	0	0	114.7	K201 L228	K201-G230 WeakPolarHBondContact CE-O 3.38Å; L228-G230 PolarHBondContact O-N 3.32Å; L228-G230 VanDerWaalsContact O-N 3.11Å
231	L	96.3	Very high	97.8	Very high	14 Å²	14	26.1 Å²	26.1	7%	0.073	14%	0.136	C	C	.	.			trans	-62.7	158.1	172.7	64.8	88.3	0	0	0	111.9	V197 C211 V226 Y234 V272	V197-L231 HydrophobicContact CG1-CB 4.08Å; C211-L231 HydrophobicContact CB-CD2 3.94Å; V226-L231 HydrophobicContact CG1-CD2 3.66Å; V226-L231 WeakPolarHBondContact O-CD2 3.28Å; L231-Y234 HydrophobicContact CD1-CD2 4.44Å; L231-Y234 HydrophobicContact CD2-CD2 4.09Å; L231-V272 HydrophobicContact CD1-CG2 3.51Å
232	D	94.8	Very high	97.8	Very high	13 Å²	13	21.1 Å²	21.1	7%	0.07	12%	0.12	C	C	.	.	S	Bend	trans	-99.5	-30.7	179.1	-54	-90.9	0	0	0	112.5	K201 L208 V209 V364 K368	K201-D232 IonicContact NZ-OD1 3.55Å; K201-D232 IonicContact NZ-OD2 3.65Å; K201-D232 PolarHBondContact NZ-OD2 3.02Å; L208-D232 VanDerWaalsContact CA-OD2 3.32Å; L208-D232 WeakPolarHBondContact CA-OD2 3.41Å; L208-D232 HydrophobicContact CD2-CB 4.1Å; V209-D232 PolarHBondContact N-OD2 3.28Å; V209-D232 PolarHBondContact O-N 3.43Å; D232-V364 HydrophobicContact CB-CG1 4.26Å; D232-V364 HydrophobicContact CB-CG2 4Å; D232-K368 IonicContact OD1-NZ 2.73Å; D232-K368 PolarHBondContact OD1-NZ 3.24Å
233	V	95.6	Very high	97.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	118	179.6	-174.5	0	0	0	0	110.8	V209 E210 C211 I273 K275 L360	V209-V233 PolarHBondContact O-N 2.96Å; V209-V233 VanDerWaalsContact O-N 3.15Å; E210-V233 CarbonylContact C-O 3.5Å; E210-V233 VanDerWaalsContact CA-O 3.31Å; E210-V233 WeakPolarHBondContact CA-O 3.41Å; E210-V233 HydrophobicContact CB-CB 3.87Å; E210-V233 HydrophobicContact CB-CG1 4.44Å; E210-V233 HydrophobicContact CG-CB 3.85Å; E210-V233 HydrophobicContact CG-CG1 3.88Å; C211-V233 PolarHBondContact N-O 2.94Å; V233-I273 CarbonylContact C-O 3.59Å; V233-I273 WeakPolarHBondContact CA-O 3.24Å; V233-I273 HydrophobicContact CG1-CB 4.39Å; V233-I273 HydrophobicContact CG1-CG2 4.24Å; V233-I273 HydrophobicContact CG2-CB 4.23Å; V233-I273 HydrophobicContact CG2-CD1 4.49Å; V233-K275 HydrophobicContact CG1-CB 3.93Å; V233-K275 HydrophobicContact CG1-CD 4.23Å; V233-L360 HydrophobicContact CG2-CD1 4.41Å; V233-L360 HydrophobicContact CG2-CD2 4.18Å
234	Y	97.8	Very high	97.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	107.6	173.1	-163.3	-68.9	0	0	0	109.2	T213 I223 V226 A227 L231 H236 V261 A265 I273 S274 K275	T213-Y234 HydrophobicContact CG2-CE1 4.18Å; T213-Y234 HydrophobicContact CG2-CE2 4.27Å; T213-Y234 WeakPolarHBondContact OG1-CE1 3.3Å; T213-Y234 PolarHBondContact OG1-OH 2.75Å; I223-Y234 HydrophobicContact CG2-CE2 4.44Å; V226-Y234 HydrophobicContact CB-CE2 4.09Å; V226-Y234 HydrophobicContact CG1-CE2 3.98Å; A227-Y234 HydrophobicContact CB-CD2 3.97Å; A227-Y234 HydrophobicContact CB-CE2 4.02Å; L231-Y234 HydrophobicContact CD1-CD2 4.44Å; L231-Y234 HydrophobicContact CD2-CD2 4.09Å; Y234-H236 HydrophobicContact CE1-CB 4.47Å; Y234-V261 HydrophobicContact CE1-CG1 3.79Å; Y234-A265 HydrophobicContact CD1-CB 3.78Å; Y234-A265 HydrophobicContact CD2-CB 3.73Å; Y234-A265 HydrophobicContact CE1-CB 4Å; Y234-A265 HydrophobicContact CE2-CB 3.91Å; Y234-A265 HydrophobicContact CG-CB 3.67Å; Y234-I273 PolarHBondContact N-O 3.16Å; Y234-S274 CarbonylContact O-C 3.56Å; Y234-S274 VanDerWaalsContact O-CA 3.29Å; Y234-S274 WeakPolarHBondContact O-CA 3.44Å; Y234-K275 PolarHBondContact O-N 3.09Å
235	A	97.6	Very high	97.8	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.008	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	138.3	177.8	0	0	0	0	0	111.6	E210 C211 L212 T213 K275	E210-A235 HydrophobicContact CG-CB 4.13Å; C211-A235 WeakPolarHBondContact O-CA 3.36Å; C211-A235 PolarHBondContact O-N 3.04Å; C211-A235 VanDerWaalsContact O-O 3.09Å; L212-A235 WeakPolarHBondContact CA-O 3.48Å; L212-A235 HydrophobicContact CB-CB 4.23Å; L212-A235 HydrophobicContact CD1-CB 4.02Å; T213-A235 PolarHBondContact N-O 2.84Å; T213-A235 PolarHBondContact OG1-O 2.92Å; T213-A235 VanDerWaalsContact OG1-O 3.05Å; A235-K275 CarbonylContact C-O 3.6Å; A235-K275 VanDerWaalsContact CA-O 3.25Å; A235-K275 WeakPolarHBondContact CA-O 3.49Å; A235-K275 HydrophobicContact CB-CB 4.05Å
236	H	98.4	Very high	97.7	Very high	5 Å²	5	24.7 Å²	24.7	2%	0.023	15%	0.149	C	C	.	.			trans	-149.7	119.9	167.2	-179	73.1	0	0	0	109.1	T213 P214 Y234 S258 V261 L262 K275 T276	T213-H236 PolarHBondContact O-ND1 3.3Å; P214-H236 PolarHBondContact O-ND1 2.9Å; Y234-H236 HydrophobicContact CE1-CB 4.47Å; H236-S258 VanDerWaalsContact CD2-CB 3.49Å; H236-S258 WeakPolarHBondContact CD2-CB 3.44Å; H236-S258 WeakPolarHBondContact NE2-CA 3.12Å; H236-S258 WeakPolarHBondContact NE2-CB 3.19Å; H236-S258 PolarHBondContact NE2-OG 3.06Å; H236-V261 HydrophobicContact CB-CG1 3.88Å; H236-L262 HydrophobicContact CB-CD2 3.81Å; H236-L262 HydrophobicContact CB-CG 4.16Å; H236-K275 PolarHBondContact N-O 3.36Å; H236-T276 VanDerWaalsContact O-CB 3.3Å; H236-T276 WeakPolarHBondContact O-CB 3.45Å; H236-T276 PolarHBondContact O-OG1 3.19Å
237	N	98.4	Very high	97.6	Very high	10 Å²	10	27.9 Å²	27.9	5%	0.053	16%	0.163	C	C	.	.			trans	-84.7	131.1	-175.3	-66.4	-15.1	0	0	0	111.6	E239 R249 T276 S277	N237-E239 VanDerWaalsContact C-N 3.28Å; N237-E239 HydrophobicContact CB-CG 3.97Å; N237-E239 WeakPolarHBondContact CB-OE1 3.38Å; N237-E239 PolarHBondContact ND2-OE1 3.37Å; N237-R249 PolarHBondContact O-NH2 3.26Å; N237-T276 WeakPolarHBondContact CA-OG1 3.4Å; N237-S277 VanDerWaalsContact CG-CB 3.46Å; N237-S277 VanDerWaalsContact OD1-CB 3.23Å; N237-S277 WeakPolarHBondContact OD1-CB 3.33Å; N237-S277 PolarHBondContact OD1-N 2.95Å
238	V	98.5	Very high	97.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.162	C	C	.	.			trans	-77.5	-19.8	166.7	-64.9	0	0	0	0	112.2	T240 Q245 F255 T276 I278 L296	V238-T240 PolarHBondContact O-N 2.83Å; V238-Q245 PolarHBondContact O-NE2 2.97Å; V238-F255 HydrophobicContact CB-CD2 4Å; V238-F255 HydrophobicContact CB-CE2 3.97Å; V238-F255 HydrophobicContact CG1-CD2 4.03Å; V238-F255 HydrophobicContact CG1-CE2 3.84Å; V238-F255 HydrophobicContact CG2-CE2 4.25Å; V238-T276 PolarHBondContact N-OG1 3.22Å; V238-I278 HydrophobicContact CG2-CG1 3.9Å; V238-L296 HydrophobicContact CG1-CD2 3.85Å; V238-L296 HydrophobicContact CG2-CD1 4.19Å; V238-L296 HydrophobicContact CG2-CD2 4.31Å
239	E	98.4	Very high	97.7	Very high	29 Å²	29	24.2 Å²	24.2	14%	0.136	14%	0.142	C	C	.	.	B	Isolated β-bridge	trans	66.5	-40.8	175.7	-51.6	-63.3	-173.4	0	0	115.9	F143 N237 R249 S277 M279	F143-E239 HydrophobicContact CE1-CB 4.39Å; F143-E239 HydrophobicContact CE1-CG 4.08Å; F143-E239 HydrophobicContact CZ-CB 4.48Å; F143-E239 HydrophobicContact CZ-CG 3.85Å; N237-E239 VanDerWaalsContact C-N 3.28Å; N237-E239 HydrophobicContact CB-CG 3.97Å; N237-E239 WeakPolarHBondContact CB-OE1 3.38Å; N237-E239 PolarHBondContact ND2-OE1 3.37Å; E239-R249 HydrophobicContact CB-CG 4.32Å; E239-R249 HydrophobicContact CG-CG 4.47Å; E239-S277 WeakPolarHBondContact CA-O 3.47Å; E239-S277 PolarHBondContact N-O 2.85Å; E239-M279 HydrophobicContact CB-CE 3.8Å; E239-M279 HydrophobicContact CG-CE 4.36Å; E239-M279 PolarHBondContact O-N 3.21Å
240	T	98.6	Very high	97.7	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-156	176	-178.2	-166.1	0	0	0	0	111	V238 L244 Q245 V248	V238-T240 PolarHBondContact O-N 2.83Å; T240-L244 HydrophobicContact CG2-CB 3.8Å; T240-Q245 PolarHBondContact O-NE2 3.24Å; T240-V248 HydrophobicContact CG2-CB 3.82Å; T240-V248 HydrophobicContact CG2-CG1 4.04Å; T240-V248 HydrophobicContact CG2-CG2 3.95Å
241	V	98.8	Very high	97.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.154	C	C	.	.			trans	-66.7	154.8	178.3	-54.9	0	0	0	0	111.6	E243 L244 Q245 E284 Q288 V289 T292	V241-E243 HydrophobicContact CG2-CB 4.42Å; V241-E243 WeakPolarHBondContact CG2-OE2 3.39Å; V241-E243 PolarHBondContact O-N 2.93Å; V241-E243 VanDerWaalsContact O-N 3.12Å; V241-L244 HydrophobicContact CG2-CB 4.12Å; V241-L244 HydrophobicContact CG2-CD1 4.05Å; V241-L244 HydrophobicContact CG2-CG 3.79Å; V241-L244 PolarHBondContact O-N 2.72Å; V241-Q245 PolarHBondContact O-N 3.45Å; V241-E284 HydrophobicContact CB-CB 4.44Å; V241-E284 HydrophobicContact CG1-CB 3.76Å; V241-E284 HydrophobicContact CG1-CG 4.28Å; V241-E284 HydrophobicContact CG2-CB 3.75Å; V241-Q288 HydrophobicContact CB-CB 4.05Å; V241-Q288 HydrophobicContact CG1-CB 3.88Å; V241-Q288 HydrophobicContact CG2-CB 4.15Å; V241-V289 HydrophobicContact CG1-CG2 4.16Å; V241-T292 WeakPolarHBondContact CG1-OG1 3.33Å
242	P	98.6	Very high	97.8	Very high	57 Å²	57	31.9 Å²	31.9	37%	0.37	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-49.1	-39.7	-177.9	-29.7	35.2	0	0	0	114.6	L244 Q245 F255 T292	P242-L244 PolarHBondContact O-N 3.47Å; P242-Q245 WeakPolarHBondContact O-CG 3.12Å; P242-Q245 PolarHBondContact O-N 3Å; P242-F255 HydrophobicContact CB-CB 4.31Å; P242-F255 HydrophobicContact CB-CG 4.37Å; P242-F255 HydrophobicContact CG-CB 4.29Å; P242-F255 HydrophobicContact CG-CD1 3.84Å; P242-F255 HydrophobicContact CG-CD2 4.14Å; P242-F255 HydrophobicContact CG-CE1 4.16Å; P242-F255 HydrophobicContact CG-CE2 4.47Å; P242-F255 HydrophobicContact CG-CG 3.82Å; P242-F255 HydrophobicContact CG-CZ 4.47Å; P242-T292 VanDerWaalsContact CD-OG1 3.3Å; P242-T292 WeakPolarHBondContact CD-OG1 3.17Å
243	E	98.4	Very high	97.9	Very high	109 Å²	109	31.6 Å²	31.6	51%	0.509	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-67.3	-23.8	-176.3	-62.1	85	169.1	0	0	113.2	V241	V241-E243 HydrophobicContact CG2-CB 4.42Å; V241-E243 WeakPolarHBondContact CG2-OE2 3.39Å; V241-E243 PolarHBondContact O-N 2.93Å; V241-E243 VanDerWaalsContact O-N 3.12Å
244	L	98.4	Very high	98	Very high	22 Å²	22	34.2 Å²	34.2	12%	0.115	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-103.1	-3.8	-177.1	-63.3	-173.5	0	0	0	113.6	T240 V241 P242 S246 K247 V248 L282 E284	T240-L244 HydrophobicContact CG2-CB 3.8Å; V241-L244 HydrophobicContact CG2-CB 4.12Å; V241-L244 HydrophobicContact CG2-CD1 4.05Å; V241-L244 HydrophobicContact CG2-CG 3.79Å; V241-L244 PolarHBondContact O-N 2.72Å; P242-L244 PolarHBondContact O-N 3.47Å; L244-S246 PolarHBondContact O-N 3.45Å; L244-K247 HydrophobicContact CD2-CD 4.24Å; L244-K247 PolarHBondContact O-N 3.04Å; L244-V248 HydrophobicContact CB-CG2 4.02Å; L244-V248 WeakPolarHBondContact O-CB 3.49Å; L244-V248 VanDerWaalsContact O-CG2 3.31Å; L244-V248 WeakPolarHBondContact O-CG2 3.38Å; L244-V248 PolarHBondContact O-N 2.86Å; L244-L282 HydrophobicContact CD1-CB 4.14Å; L244-E284 HydrophobicContact CD1-CB 4.01Å
245	Q	98.2	Very high	98	Very high	9 Å²	9	35 Å²	35	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-51.6	-52.6	-175.5	-69.9	-74.4	-46.9	0	0	112.5	V238 T240 V241 P242 K247 V248 R249 F255	V238-Q245 PolarHBondContact O-NE2 2.97Å; T240-Q245 PolarHBondContact O-NE2 3.24Å; V241-Q245 PolarHBondContact O-N 3.45Å; P242-Q245 WeakPolarHBondContact O-CG 3.12Å; P242-Q245 PolarHBondContact O-N 3Å; Q245-K247 VanDerWaalsContact C-N 3.29Å; Q245-K247 PolarHBondContact O-N 2.84Å; Q245-V248 PolarHBondContact O-N 2.82Å; Q245-R249 PolarHBondContact O-N 2.95Å; Q245-F255 HydrophobicContact CG-CB 3.93Å
246	S	96.7	Very high	98	Very high	97 Å²	97	39.7 Å²	39.7	68%	0.678	21%	0.212	S	C	*	.	H	α-helix	trans	-69.2	-24.9	-179	62.4	0	0	0	0	113.8	L244	L244-S246 PolarHBondContact O-N 3.45Å
247	K	97.4	Very high	98	Very high	68 Å²	68	40.4 Å²	40.4	30%	0.296	22%	0.215	S	C	.	.	H	α-helix	trans	-77.8	-33.7	174.7	-175.8	-172.1	174	-164.6	0	111	R142 L244 Q245 L282 E320	R142-K247 VanDerWaalsContact CD-O 3.24Å; R142-K247 WeakPolarHBondContact CD-O 3.33Å; R142-K247 PolarHBondContact NH1-O 3.48Å; L244-K247 HydrophobicContact CD2-CD 4.24Å; L244-K247 PolarHBondContact O-N 3.04Å; Q245-K247 VanDerWaalsContact C-N 3.29Å; Q245-K247 PolarHBondContact O-N 2.84Å; K247-L282 PolarHBondContact NZ-O 3.32Å; K247-E320 IonicContact NZ-OE1 2.67Å; K247-E320 PolarHBondContact NZ-OE1 2.8Å
248	V	98.1	Very high	98.1	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-99.7	-48.6	-167.4	174.3	0	0	0	0	112.8	R142 F143 T240 L244 Q245 L282 L317	R142-V248 PolarHBondContact N-O 3.4Å; F143-V248 HydrophobicContact CB-CG1 4.4Å; F143-V248 HydrophobicContact CD1-CG1 3.63Å; F143-V248 HydrophobicContact CE1-CG1 4.33Å; F143-V248 HydrophobicContact CG-CG1 4.36Å; T240-V248 HydrophobicContact CG2-CB 3.82Å; T240-V248 HydrophobicContact CG2-CG1 4.04Å; T240-V248 HydrophobicContact CG2-CG2 3.95Å; L244-V248 HydrophobicContact CB-CG2 4.02Å; L244-V248 WeakPolarHBondContact O-CB 3.49Å; L244-V248 VanDerWaalsContact O-CG2 3.31Å; L244-V248 WeakPolarHBondContact O-CG2 3.38Å; L244-V248 PolarHBondContact O-N 2.86Å; Q245-V248 PolarHBondContact O-N 2.82Å; V248-L282 HydrophobicContact CG1-CD1 3.89Å; V248-L282 HydrophobicContact CG2-CB 4.35Å; V248-L282 HydrophobicContact CG2-CD1 3.98Å; V248-L282 HydrophobicContact CG2-CD2 4.3Å; V248-L282 HydrophobicContact CG2-CG 4.46Å; V248-L317 HydrophobicContact CB-CD1 4.26Å; V248-L317 HydrophobicContact CG1-CD1 4.46Å; V248-L317 HydrophobicContact CG2-CD1 3.91Å
249	R	98.4	Very high	98	Very high	16 Å²	16	40.8 Å²	40.8	6%	0.06	22%	0.217	C	C	.	.	S	Bend	trans	-100.5	167.1	-173.2	-56.6	174.2	80.4	-166	5.4	110.5	F143 N237 E239 Q245 A253 S258	F143-R249 HydrophobicContact CE1-CG 4.21Å; N237-R249 PolarHBondContact O-NH2 3.26Å; E239-R249 HydrophobicContact CB-CG 4.32Å; E239-R249 HydrophobicContact CG-CG 4.47Å; Q245-R249 PolarHBondContact O-N 2.95Å; R249-A253 HydrophobicContact CB-CB 4.16Å; R249-S258 PolarHBondContact NH1-OG 2.88Å; R249-S258 PolarHBondContact NH2-OG 2.95Å; R249-S258 VanDerWaalsContact NH2-OG 3.14Å
250	D	98.1	Very high	98	Very high	11 Å²	11	45.6 Å²	45.6	6%	0.059	23%	0.234	C	C	.	.			trans	-56.9	140.8	170.4	-173.7	-75.5	0	0	0	110	R139 G140 C141 R252 A253	R139-D250 WeakPolarHBondContact CA-OD2 3.31Å; R139-D250 HydrophobicContact CB-CB 3.86Å; R139-D250 HydrophobicContact CG-CB 4.32Å; G140-D250 PolarHBondContact N-OD2 2.98Å; C141-D250 PolarHBondContact SG-N 3.41Å; C141-D250 VanDerWaalsContact SG-N 3.37Å; D250-R252 PolarHBondContact O-N 3.47Å; D250-R252 WeakPolarHBondContact OD1-CB 3.37Å; D250-R252 IonicContact OD1-CZ 2.95Å; D250-R252 PolarHBondContact OD1-N 2.92Å; D250-R252 IonicContact OD1-NE 3.59Å; D250-R252 PolarHBondContact OD1-NE 3.3Å; D250-R252 IonicContact OD1-NH2 2.69Å; D250-R252 PolarHBondContact OD1-NH2 2.86Å; D250-R252 IonicContact OD2-CZ 2.8Å; D250-R252 IonicContact OD2-NE 3.94Å; D250-R252 IonicContact OD2-NH2 3.51Å; D250-R252 PolarHBondContact OD2-NH2 3.1Å; D250-A253 PolarHBondContact O-N 3.5Å
251	P	96.9	Very high	98	Very high	115 Å²	115	45.7 Å²	45.7	75%	0.747	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.4	-178.1	-27.3	35.4	0	0	0	115.4	A253	P251-A253 VanDerWaalsContact C-N 3.29Å
252	R	97	Very high	98	Very high	108 Å²	108	45.7 Å²	45.7	41%	0.408	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-15.3	175	-69.1	166.2	-78.6	-174.8	-11	113.5	T138 D183 D250 Q257	T138-R252 PolarHBondContact O-NH1 2.85Å; T138-R252 PolarHBondContact O-NH2 3.23Å; D183-R252 IonicContact OD2-CZ 3.01Å; D183-R252 IonicContact OD2-NE 3.95Å; D183-R252 IonicContact OD2-NH1 2.67Å; D183-R252 PolarHBondContact OD2-NH1 2.98Å; D250-R252 PolarHBondContact O-N 3.47Å; D250-R252 WeakPolarHBondContact OD1-CB 3.37Å; D250-R252 IonicContact OD1-CZ 2.95Å; D250-R252 PolarHBondContact OD1-N 2.92Å; D250-R252 IonicContact OD1-NE 3.59Å; D250-R252 PolarHBondContact OD1-NE 3.3Å; D250-R252 IonicContact OD1-NH2 2.69Å; D250-R252 PolarHBondContact OD1-NH2 2.86Å; D250-R252 IonicContact OD2-CZ 2.8Å; D250-R252 IonicContact OD2-NE 3.94Å; D250-R252 IonicContact OD2-NH2 3.51Å; D250-R252 PolarHBondContact OD2-NH2 3.1Å; R252-Q257 PolarHBondContact O-NE2 2.8Å; R252-Q257 VanDerWaalsContact O-NE2 3.11Å
253	A	97.5	Very high	98	Very high	6 Å²	6	47.8 Å²	47.8	5%	0.05	24%	0.238	C	C	.	.			trans	-100.9	142.7	176.7	0	0	0	0	0	111.2	R249 D250 P251	R249-A253 HydrophobicContact CB-CB 4.16Å; D250-A253 PolarHBondContact O-N 3.5Å; P251-A253 VanDerWaalsContact C-N 3.29Å
254	N	97.6	Very high	98	Very high	56 Å²	56	44 Å²	44	30%	0.299	22%	0.22	S	C	.	.			trans	-152.3	164.7	175.7	63.6	81.5	0	0	0	111.3	D256 Q257 S258	N254-D256 PolarHBondContact OD1-N 3.28Å; N254-Q257 PolarHBondContact O-N 3.41Å; N254-Q257 WeakPolarHBondContact OD1-CB 3.41Å; N254-Q257 PolarHBondContact OD1-N 3.4Å; N254-S258 PolarHBondContact O-N 3.35Å; N254-S258 PolarHBondContact O-OG 3.17Å
255	F	98.4	Very high	98	Very high	16 Å²	16	43 Å²	43	7%	0.07	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-47.1	-174.9	-174.1	-101.3	0	0	0	112.7	V238 P242 Q245 Q257 S258 L259 T292 A295	V238-F255 HydrophobicContact CB-CD2 4Å; V238-F255 HydrophobicContact CB-CE2 3.97Å; V238-F255 HydrophobicContact CG1-CD2 4.03Å; V238-F255 HydrophobicContact CG1-CE2 3.84Å; V238-F255 HydrophobicContact CG2-CE2 4.25Å; P242-F255 HydrophobicContact CB-CB 4.31Å; P242-F255 HydrophobicContact CB-CG 4.37Å; P242-F255 HydrophobicContact CG-CB 4.29Å; P242-F255 HydrophobicContact CG-CD1 3.84Å; P242-F255 HydrophobicContact CG-CD2 4.14Å; P242-F255 HydrophobicContact CG-CE1 4.16Å; P242-F255 HydrophobicContact CG-CE2 4.47Å; P242-F255 HydrophobicContact CG-CG 3.82Å; P242-F255 HydrophobicContact CG-CZ 4.47Å; Q245-F255 HydrophobicContact CG-CB 3.93Å; F255-Q257 VanDerWaalsContact C-N 3.34Å; F255-Q257 PolarHBondContact O-N 2.82Å; F255-S258 WeakPolarHBondContact O-CB 3.38Å; F255-S258 PolarHBondContact O-N 3.32Å; F255-L259 HydrophobicContact CE1-CD2 4.28Å; F255-L259 WeakPolarHBondContact O-CB 3.47Å; F255-L259 PolarHBondContact O-N 3.21Å; F255-T292 HydrophobicContact CE2-CG2 3.66Å; F255-T292 HydrophobicContact CZ-CG2 4.03Å; F255-A295 HydrophobicContact CE1-CB 4.21Å; F255-A295 HydrophobicContact CZ-CB 4.16Å
256	D	98.1	Very high	97.8	Very high	100 Å²	100	43.3 Å²	43.3	54%	0.535	22%	0.216	S	C	.	.	H	α-helix	trans	-64.6	-39.5	-177.6	-68.4	-25	0	0	0	112.2	N254 L259 R260	N254-D256 PolarHBondContact OD1-N 3.28Å; D256-L259 PolarHBondContact O-N 3.44Å; D256-R260 WeakPolarHBondContact O-CB 3.33Å; D256-R260 WeakPolarHBondContact O-CG 3.36Å; D256-R260 PolarHBondContact O-N 2.87Å
257	Q	98.3	Very high	97.9	Very high	20 Å²	20	46.8 Å²	46.8	9%	0.093	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-48	173.4	179.5	164.9	-69.5	0	0	111.1	D215 R252 N254 F255 L259 R260 V261	D215-Q257 HydrophobicContact CB-CG 4.22Å; D215-Q257 PolarHBondContact OD2-NE2 2.89Å; R252-Q257 PolarHBondContact O-NE2 2.8Å; R252-Q257 VanDerWaalsContact O-NE2 3.11Å; N254-Q257 PolarHBondContact O-N 3.41Å; N254-Q257 WeakPolarHBondContact OD1-CB 3.41Å; N254-Q257 PolarHBondContact OD1-N 3.4Å; F255-Q257 VanDerWaalsContact C-N 3.34Å; F255-Q257 PolarHBondContact O-N 2.82Å; Q257-L259 VanDerWaalsContact C-N 3.29Å; Q257-L259 PolarHBondContact O-N 3.39Å; Q257-R260 WeakPolarHBondContact O-CB 3.41Å; Q257-R260 PolarHBondContact O-N 2.84Å; Q257-R260 VanDerWaalsContact O-N 3.15Å; Q257-V261 WeakPolarHBondContact O-CG2 3.13Å; Q257-V261 PolarHBondContact O-N 2.91Å
258	S	98.6	Very high	97.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-38.5	176.1	-72	0	0	0	0	112.6	H236 R249 N254 F255 V261 L262	H236-S258 VanDerWaalsContact CD2-CB 3.49Å; H236-S258 WeakPolarHBondContact CD2-CB 3.44Å; H236-S258 WeakPolarHBondContact NE2-CA 3.12Å; H236-S258 WeakPolarHBondContact NE2-CB 3.19Å; H236-S258 PolarHBondContact NE2-OG 3.06Å; R249-S258 PolarHBondContact NH1-OG 2.88Å; R249-S258 PolarHBondContact NH2-OG 2.95Å; R249-S258 VanDerWaalsContact NH2-OG 3.14Å; N254-S258 PolarHBondContact O-N 3.35Å; N254-S258 PolarHBondContact O-OG 3.17Å; F255-S258 WeakPolarHBondContact O-CB 3.38Å; F255-S258 PolarHBondContact O-N 3.32Å; S258-V261 WeakPolarHBondContact O-CB 3.06Å; S258-V261 PolarHBondContact O-N 3.42Å; S258-L262 PolarHBondContact O-N 3.29Å
259	L	98.3	Very high	97.8	Very high	18 Å²	18	48.7 Å²	48.7	9%	0.094	23%	0.231	C	C	.	.	H	α-helix	trans	-67.5	-38.8	175.6	-159.1	67.2	0	0	0	111.6	F255 D256 Q257 V261 L262 K263 L296 A299	F255-L259 HydrophobicContact CE1-CD2 4.28Å; F255-L259 WeakPolarHBondContact O-CB 3.47Å; F255-L259 PolarHBondContact O-N 3.21Å; D256-L259 PolarHBondContact O-N 3.44Å; Q257-L259 VanDerWaalsContact C-N 3.29Å; Q257-L259 PolarHBondContact O-N 3.39Å; L259-V261 VanDerWaalsContact C-N 3.34Å; L259-L262 PolarHBondContact O-N 2.7Å; L259-K263 WeakPolarHBondContact O-CB 3.14Å; L259-K263 WeakPolarHBondContact O-CG 3.32Å; L259-K263 PolarHBondContact O-N 2.77Å; L259-L296 HydrophobicContact CD1-CD2 3.89Å; L259-A299 HydrophobicContact CD1-CB 3.3Å; L259-A299 HydrophobicContact CD2-CB 4.12Å; L259-A299 HydrophobicContact CG-CB 3.68Å
260	R	98.4	Very high	97.6	Very high	130 Å²	130	52.1 Å²	52.1	49%	0.491	26%	0.256	S	S	.	.	H	α-helix	trans	-63.1	-37.7	174.3	-77.3	-169	-59	-95.3	3.8	112.2	D256 Q257 K263 H264	D256-R260 WeakPolarHBondContact O-CB 3.33Å; D256-R260 WeakPolarHBondContact O-CG 3.36Å; D256-R260 PolarHBondContact O-N 2.87Å; Q257-R260 WeakPolarHBondContact O-CB 3.41Å; Q257-R260 PolarHBondContact O-N 2.84Å; Q257-R260 VanDerWaalsContact O-N 3.15Å; R260-K263 PolarHBondContact O-N 2.92Å; R260-H264 WeakPolarHBondContact O-CB 3.5Å; R260-H264 PolarHBondContact O-N 3.45Å
261	V	98.6	Very high	97.2	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-56.7	-54.4	175.2	170.8	0	0	0	0	110.3	D215 I223 Y234 H236 Q257 S258 L259 K263 H264 A265	D215-V261 HydrophobicContact CB-CG2 4.05Å; I223-V261 HydrophobicContact CD1-CB 4.26Å; I223-V261 HydrophobicContact CD1-CG1 4.44Å; I223-V261 HydrophobicContact CD1-CG2 3.82Å; I223-V261 HydrophobicContact CG1-CG1 4.31Å; I223-V261 HydrophobicContact CG1-CG2 4.36Å; Y234-V261 HydrophobicContact CE1-CG1 3.79Å; H236-V261 HydrophobicContact CB-CG1 3.88Å; Q257-V261 WeakPolarHBondContact O-CG2 3.13Å; Q257-V261 PolarHBondContact O-N 2.91Å; S258-V261 WeakPolarHBondContact O-CB 3.06Å; S258-V261 PolarHBondContact O-N 3.42Å; L259-V261 VanDerWaalsContact C-N 3.34Å; V261-K263 PolarHBondContact O-N 3.02Å; V261-H264 PolarHBondContact O-N 3.4Å; V261-A265 PolarHBondContact O-N 3.43Å
262	L	98.4	Very high	97.1	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-63	-44.9	-178.8	-66.2	167.8	0	0	0	112	H236 S258 L259 H264 A265 K266 L296 V301	H236-L262 HydrophobicContact CB-CD2 3.81Å; H236-L262 HydrophobicContact CB-CG 4.16Å; S258-L262 PolarHBondContact O-N 3.29Å; L259-L262 PolarHBondContact O-N 2.7Å; L262-H264 VanDerWaalsContact C-N 3.33Å; L262-H264 PolarHBondContact O-N 3.41Å; L262-A265 PolarHBondContact O-N 3.15Å; L262-K266 PolarHBondContact O-N 2.89Å; L262-L296 HydrophobicContact CD1-CD2 4.49Å; L262-V301 HydrophobicContact CB-CG2 4.19Å; L262-V301 HydrophobicContact CD1-CG2 3.71Å; L262-V301 HydrophobicContact CG-CG2 4.47Å
263	K	98.1	Very high	97	Very high	101 Å²	101	46.1 Å²	46.1	44%	0.439	23%	0.225	S	C	.	.	H	α-helix	trans	-60.1	-42.5	175.9	-76.1	179.4	174.6	-179.3	0	112.1	L259 R260 V261 K267 A299	L259-K263 WeakPolarHBondContact O-CB 3.14Å; L259-K263 WeakPolarHBondContact O-CG 3.32Å; L259-K263 PolarHBondContact O-N 2.77Å; R260-K263 PolarHBondContact O-N 2.92Å; V261-K263 PolarHBondContact O-N 3.02Å; K263-K267 WeakPolarHBondContact O-CB 3.5Å; K263-K267 PolarHBondContact O-N 2.78Å; K263-A299 HydrophobicContact CD-CB 4.21Å; K263-A299 VanDerWaalsContact CE-CA 3.45Å; K263-A299 HydrophobicContact CG-CB 3.91Å
264	H	98.4	Very high	96.9	Very high	29 Å²	29	45.9 Å²	45.9	13%	0.134	22%	0.223	C	C	.	.	H	α-helix	trans	-71.2	-41.7	-177.4	-169.2	72.4	0	0	0	111.7	L220 I223 R260 V261 L262 K266 K267 V268	L220-H264 HydrophobicContact CD2-CB 4.09Å; L220-H264 PolarHBondContact O-CD2 3.44Å; L220-H264 PolarHBondContact O-NE2 3.2Å; I223-H264 HydrophobicContact CG2-CB 4.22Å; R260-H264 WeakPolarHBondContact O-CB 3.5Å; R260-H264 PolarHBondContact O-N 3.45Å; V261-H264 PolarHBondContact O-N 3.4Å; L262-H264 VanDerWaalsContact C-N 3.33Å; L262-H264 PolarHBondContact O-N 3.41Å; H264-K266 VanDerWaalsContact C-N 3.3Å; H264-K266 PolarHBondContact O-N 2.99Å; H264-K267 WeakPolarHBondContact O-CB 3.37Å; H264-K267 PolarHBondContact O-N 3.22Å; H264-K267 VanDerWaalsContact O-N 3.1Å; H264-V268 WeakPolarHBondContact O-CG2 3.42Å; H264-V268 PolarHBondContact O-N 3.47Å
265	A	97.9	Very high	96.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-55.3	-46	174	0	0	0	0	0	111.5	I223 A227 Y234 V261 L262 V268 Q269	I223-A265 HydrophobicContact CG2-CB 4.19Å; A227-A265 HydrophobicContact CB-CB 4.29Å; Y234-A265 HydrophobicContact CD1-CB 3.78Å; Y234-A265 HydrophobicContact CD2-CB 3.73Å; Y234-A265 HydrophobicContact CE1-CB 4Å; Y234-A265 HydrophobicContact CE2-CB 3.91Å; Y234-A265 HydrophobicContact CG-CB 3.67Å; V261-A265 PolarHBondContact O-N 3.43Å; L262-A265 PolarHBondContact O-N 3.15Å; A265-V268 PolarHBondContact O-N 3.28Å; A265-Q269 PolarHBondContact O-N 3.37Å
266	K	95.3	Very high	96.9	Very high	17 Å²	17	42.7 Å²	42.7	7%	0.074	21%	0.207	C	C	.	.	H	α-helix	trans	-66.2	-38.1	173.9	-85.6	-160.9	150.3	-171.5	0	114.2	L262 H264 V268 Q269 P270 V272 S274 D300 D302	L262-K266 PolarHBondContact O-N 2.89Å; H264-K266 VanDerWaalsContact C-N 3.3Å; H264-K266 PolarHBondContact O-N 2.99Å; K266-V268 VanDerWaalsContact C-N 3.27Å; K266-V268 PolarHBondContact O-N 2.81Å; K266-Q269 CarbonylContact O-C 3.24Å; K266-Q269 VanDerWaalsContact O-C 3.24Å; K266-P270 WeakPolarHBondContact O-CA 3.31Å; K266-P270 VanDerWaalsContact O-N 3.12Å; K266-V272 HydrophobicContact CG-CG1 4.33Å; K266-S274 VanDerWaalsContact CE-OG 3.3Å; K266-S274 WeakPolarHBondContact CE-OG 3.12Å; K266-D300 HydrophobicContact CD-CB 4.17Å; K266-D300 VanDerWaalsContact CD-O 3.25Å; K266-D300 WeakPolarHBondContact CD-O 3.07Å; K266-D300 WeakPolarHBondContact CD-OD2 3.23Å; K266-D300 WeakPolarHBondContact CE-O 3.41Å; K266-D300 PolarHBondContact NZ-O 3.23Å; K266-D300 IonicContact NZ-OD1 2.93Å; K266-D300 IonicContact NZ-OD2 3.62Å; K266-D300 PolarHBondContact NZ-OD2 3.47Å; K266-D302 WeakPolarHBondContact CE-OD2 3.27Å; K266-D302 IonicContact NZ-OD1 2.67Å; K266-D302 PolarHBondContact NZ-OD1 3.16Å; K266-D302 IonicContact NZ-OD2 3.05Å; K266-D302 PolarHBondContact NZ-OD2 3.45Å
267	K	97.3	Very high	96.8	Very high	169 Å²	169	38.2 Å²	38.2	74%	0.735	18%	0.184	S	C	*	.	H	α-helix	trans	-61.1	-40.8	176.8	-178.9	-176.7	174.3	-174.9	0	111.3	K263 H264	K263-K267 WeakPolarHBondContact O-CB 3.5Å; K263-K267 PolarHBondContact O-N 2.78Å; H264-K267 WeakPolarHBondContact O-CB 3.37Å; H264-K267 PolarHBondContact O-N 3.22Å; H264-K267 VanDerWaalsContact O-N 3.1Å
268	V	97.2	Very high	96.8	Very high	37 Å²	37	37.3 Å²	37.3	22%	0.224	18%	0.179	C	C	.	.	H	α-helix	trans	-75.9	-43.4	-179.1	168	0	0	0	0	111.4	E224 A227 L228 H264 A265 K266	E224-V268 HydrophobicContact CB-CG1 4.32Å; E224-V268 HydrophobicContact CB-CG2 4.09Å; E224-V268 HydrophobicContact CG-CG1 3.82Å; E224-V268 HydrophobicContact CG-CG2 4.14Å; A227-V268 HydrophobicContact CB-CG1 4.3Å; L228-V268 HydrophobicContact CD1-CG1 3.94Å; L228-V268 HydrophobicContact CD2-CG1 3.68Å; L228-V268 HydrophobicContact CG-CG1 3.62Å; H264-V268 WeakPolarHBondContact O-CG2 3.42Å; H264-V268 PolarHBondContact O-N 3.47Å; A265-V268 PolarHBondContact O-N 3.28Å; K266-V268 VanDerWaalsContact C-N 3.27Å; K266-V268 PolarHBondContact O-N 2.81Å
269	Q	96.4	Very high	96.8	Very high	71 Å²	71	38.6 Å²	38.6	33%	0.332	19%	0.186	S	C	.	.			trans	-127.1	87	178.8	-178.4	57.9	-80.8	0	0	109.7	A265 K266 D271 V272	A265-Q269 PolarHBondContact O-N 3.37Å; K266-Q269 CarbonylContact O-C 3.24Å; K266-Q269 VanDerWaalsContact O-C 3.24Å; Q269-D271 PolarHBondContact O-N 3.03Å; Q269-D271 VanDerWaalsContact O-N 3.12Å; Q269-V272 HydrophobicContact CB-CB 4.11Å; Q269-V272 HydrophobicContact CB-CG1 4.31Å; Q269-V272 HydrophobicContact CG-CB 3.72Å; Q269-V272 HydrophobicContact CG-CG1 4.45Å; Q269-V272 WeakPolarHBondContact O-CB 3.39Å; Q269-V272 WeakPolarHBondContact O-CG1 3.25Å; Q269-V272 PolarHBondContact O-N 3.2Å
270	P	94.6	Very high	96.8	Very high	88 Å²	88	37.8 Å²	37.8	57%	0.571	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-29.8	-174.2	-28.9	37	0	0	0	115.1	K266	K266-P270 WeakPolarHBondContact O-CA 3.31Å; K266-P270 VanDerWaalsContact O-N 3.12Å
271	D	90.6	Very high	96.8	Very high	100 Å²	100	31.6 Å²	31.6	54%	0.535	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-11.5	-177.9	-67.8	-42.8	0	0	0	113.6	Q269 I273 R367	Q269-D271 PolarHBondContact O-N 3.03Å; Q269-D271 VanDerWaalsContact O-N 3.12Å; D271-I273 PolarHBondContact O-N 3.14Å; D271-R367 WeakPolarHBondContact O-CD 3.39Å; D271-R367 PolarHBondContact O-NH1 3.35Å
272	V	93.8	Very high	96.7	Very high	6 Å²	6	31.7 Å²	31.7	4%	0.036	16%	0.159	C	C	.	.	S	Bend	trans	-62.1	137.6	179.7	81.2	0	0	0	0	110.1	L231 K266 Q269 R367	L231-V272 HydrophobicContact CD1-CG2 3.51Å; K266-V272 HydrophobicContact CG-CG1 4.33Å; Q269-V272 HydrophobicContact CB-CB 4.11Å; Q269-V272 HydrophobicContact CB-CG1 4.31Å; Q269-V272 HydrophobicContact CG-CB 3.72Å; Q269-V272 HydrophobicContact CG-CG1 4.45Å; Q269-V272 WeakPolarHBondContact O-CB 3.39Å; Q269-V272 WeakPolarHBondContact O-CG1 3.25Å; Q269-V272 PolarHBondContact O-N 3.2Å; V272-R367 PolarHBondContact O-NH1 2.99Å
273	I	95.3	Very high	96.7	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	124.9	171.4	-61.7	167.6	0	0	0	107.5	V233 Y234 D271 D302 L360 L363 V364	V233-I273 CarbonylContact C-O 3.59Å; V233-I273 WeakPolarHBondContact CA-O 3.24Å; V233-I273 HydrophobicContact CG1-CB 4.39Å; V233-I273 HydrophobicContact CG1-CG2 4.24Å; V233-I273 HydrophobicContact CG2-CB 4.23Å; V233-I273 HydrophobicContact CG2-CD1 4.49Å; Y234-I273 PolarHBondContact N-O 3.16Å; D271-I273 PolarHBondContact O-N 3.14Å; I273-D302 WeakPolarHBondContact CA-OD2 3.45Å; I273-D302 HydrophobicContact CG2-CB 3.95Å; I273-L360 HydrophobicContact CD1-CD2 4.24Å; I273-L360 HydrophobicContact CG2-CD2 3.76Å; I273-L363 HydrophobicContact CD1-CB 4.05Å; I273-L363 HydrophobicContact CD1-CD2 3.75Å; I273-L363 HydrophobicContact CD1-CG 3.8Å; I273-L363 HydrophobicContact CG1-CD2 4.07Å; I273-L363 HydrophobicContact CG1-CG 4.37Å; I273-L363 HydrophobicContact CG2-CD2 4.3Å; I273-V364 HydrophobicContact CD1-CB 4.34Å; I273-V364 HydrophobicContact CD1-CG2 3.35Å
274	S	96.4	Very high	96.7	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.007	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	134.2	176.3	59.5	0	0	0	0	110.7	Y234 K266 D300 V301 D302 C303	Y234-S274 CarbonylContact O-C 3.56Å; Y234-S274 VanDerWaalsContact O-CA 3.29Å; Y234-S274 WeakPolarHBondContact O-CA 3.44Å; K266-S274 VanDerWaalsContact CE-OG 3.3Å; K266-S274 WeakPolarHBondContact CE-OG 3.12Å; S274-D300 PolarHBondContact OG-O 2.76Å; S274-V301 WeakPolarHBondContact OG-CA 3.37Å; S274-D302 PolarHBondContact N-OD2 2.98Å; S274-D302 WeakPolarHBondContact O-CB 3.47Å; S274-D302 PolarHBondContact O-N 2.89Å; S274-D302 PolarHBondContact OG-N 3.27Å; S274-D302 PolarHBondContact OG-OD2 3.22Å; S274-C303 PolarHBondContact O-N 3.38Å
275	K	96.6	Very high	96.7	Very high	6 Å²	6	31.6 Å²	31.6	3%	0.026	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145	-177.1	-175.9	178.7	172.8	-164.5	0	111.5	E210 V233 Y234 A235 H236 C303 S351 L360	E210-K275 VanDerWaalsContact CD-NZ 3.25Å; E210-K275 IonicContact OE1-NZ 2.8Å; E210-K275 PolarHBondContact OE1-NZ 3.41Å; E210-K275 WeakPolarHBondContact OE2-CD 3.35Å; E210-K275 IonicContact OE2-NZ 3.7Å; E210-K275 PolarHBondContact OE2-NZ 2.86Å; V233-K275 HydrophobicContact CG1-CB 3.93Å; V233-K275 HydrophobicContact CG1-CD 4.23Å; Y234-K275 PolarHBondContact O-N 3.09Å; A235-K275 CarbonylContact C-O 3.6Å; A235-K275 VanDerWaalsContact CA-O 3.25Å; A235-K275 WeakPolarHBondContact CA-O 3.49Å; A235-K275 HydrophobicContact CB-CB 4.05Å; H236-K275 PolarHBondContact N-O 3.36Å; K275-C303 WeakPolarHBondContact CA-O 3.45Å; K275-C303 HydrophobicContact CB-CB 4.05Å; K275-C303 HydrophobicContact CD-CB 4.47Å; K275-C303 HydrophobicContact CG-CB 3.88Å; K275-S351 WeakPolarHBondContact CE-O 3.42Å; K275-S351 PolarHBondContact NZ-O 3.26Å; K275-L360 HydrophobicContact CD-CD1 4.36Å
276	T	97.9	Very high	96.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	168.7	176.7	-159	0	0	0	0	111.5	H236 N237 V238 L296 V301 C303 L304 T305	H236-T276 VanDerWaalsContact O-CB 3.3Å; H236-T276 WeakPolarHBondContact O-CB 3.45Å; H236-T276 PolarHBondContact O-OG1 3.19Å; N237-T276 WeakPolarHBondContact CA-OG1 3.4Å; V238-T276 PolarHBondContact N-OG1 3.22Å; T276-L296 HydrophobicContact CG2-CD1 3.73Å; T276-L296 HydrophobicContact CG2-CD2 3.91Å; T276-L296 HydrophobicContact CG2-CG 4.36Å; T276-V301 HydrophobicContact CG2-CG1 3.89Å; T276-C303 PolarHBondContact N-O 2.92Å; T276-L304 HydrophobicContact CG2-CD1 3.7Å; T276-L304 WeakPolarHBondContact O-CA 3.42Å; T276-T305 PolarHBondContact O-N 3.17Å; T276-T305 PolarHBondContact O-OG1 3.13Å
277	S	97.1	Very high	96.8	Very high	6 Å²	6	40.8 Å²	40.8	4%	0.042	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	148.1	179.5	-167	0	0	0	0	112	N237 E239 T305	N237-S277 VanDerWaalsContact CG-CB 3.46Å; N237-S277 VanDerWaalsContact OD1-CB 3.23Å; N237-S277 WeakPolarHBondContact OD1-CB 3.33Å; N237-S277 PolarHBondContact OD1-N 2.95Å; E239-S277 WeakPolarHBondContact CA-O 3.47Å; E239-S277 PolarHBondContact N-O 2.85Å; S277-T305 CarbonylContact C-O 3.45Å; S277-T305 VanDerWaalsContact CA-O 3.25Å; S277-T305 WeakPolarHBondContact CA-O 3.26Å; S277-T305 WeakPolarHBondContact CA-OG1 3.42Å; S277-T305 WeakPolarHBondContact CB-OG1 3.41Å; S277-T305 PolarHBondContact OG-O 2.87Å; S277-T305 PolarHBondContact OG-OG1 2.7Å
278	I	98.3	Very high	96.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.5	169	-58	173.1	0	0	0	108.2	V238 L280 T292 M293 L296 L304 T305 L306 G307	V238-I278 HydrophobicContact CG2-CG1 3.9Å; I278-L280 HydrophobicContact CG2-CD2 3.85Å; I278-T292 HydrophobicContact CD1-CG2 3.73Å; I278-M293 HydrophobicContact CD1-CG 4.36Å; I278-L296 HydrophobicContact CD1-CD1 3.98Å; I278-L296 HydrophobicContact CG1-CD1 4.48Å; I278-L304 HydrophobicContact CD1-CD1 4.12Å; I278-L304 HydrophobicContact CG1-CD1 4.1Å; I278-T305 PolarHBondContact N-O 3.31Å; I278-L306 WeakPolarHBondContact O-CA 3.19Å; I278-G307 PolarHBondContact O-N 2.95Å; I278-G307 VanDerWaalsContact O-N 3.12Å
279	M	98.1	Very high	97	Very high	28 Å²	28	32.9 Å²	32.9	14%	0.138	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	130.1	167.3	-63.6	178.5	-78.2	0	0	109.5	F143 E239 L282 G307 Y309	F143-M279 HydrophobicContact CB-CE 4.23Å; F143-M279 HydrophobicContact CD1-CE 3.92Å; F143-M279 HydrophobicContact CD2-CE 3.39Å; F143-M279 HydrophobicContact CD2-SD 3.86Å; F143-M279 HydrophobicContact CE1-CE 4.05Å; F143-M279 HydrophobicContact CE2-CE 3.54Å; F143-M279 HydrophobicContact CE2-SD 4.23Å; F143-M279 HydrophobicContact CG-CE 3.58Å; F143-M279 HydrophobicContact CG-SD 4.4Å; F143-M279 HydrophobicContact CZ-CE 3.87Å; E239-M279 HydrophobicContact CB-CE 3.8Å; E239-M279 HydrophobicContact CG-CE 4.36Å; E239-M279 PolarHBondContact O-N 3.21Å; M279-L282 HydrophobicContact CB-CD1 4.08Å; M279-L282 HydrophobicContact CE-CD1 4.41Å; M279-G307 CarbonylContact C-O 3.54Å; M279-G307 WeakPolarHBondContact CA-O 3.39Å; M279-Y309 HydrophobicContact SD-CD2 4.05Å
280	L	98.5	Very high	97.1	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	156.6	177.1	-55	-178.6	0	0	0	111.7	I278 E284 V289 L306 G307 Q308 Y309 I323 F328	I278-L280 HydrophobicContact CG2-CD2 3.85Å; L280-E284 WeakPolarHBondContact CA-OE1 3.47Å; L280-E284 WeakPolarHBondContact CB-OE1 3.15Å; L280-E284 HydrophobicContact CD2-CG 4.2Å; L280-V289 HydrophobicContact CD2-CG1 4.26Å; L280-V289 HydrophobicContact CD2-CG2 3.77Å; L280-L306 HydrophobicContact CD1-CB 4.44Å; L280-L306 HydrophobicContact CD1-CD2 4.21Å; L280-L306 HydrophobicContact CD2-CD2 4.45Å; L280-G307 PolarHBondContact N-O 2.81Å; L280-Q308 PolarHBondContact O-NE2 3.04Å; L280-Y309 VanDerWaalsContact O-CB 3.29Å; L280-Y309 WeakPolarHBondContact O-CB 3.33Å; L280-Y309 PolarHBondContact O-N 2.9Å; L280-I323 HydrophobicContact CB-CD1 4.49Å; L280-I323 HydrophobicContact CB-CG1 3.73Å; L280-I323 HydrophobicContact CD1-CG2 4.43Å; L280-F328 HydrophobicContact CD1-CD1 4.22Å; L280-F328 HydrophobicContact CD1-CE1 3.74Å; L280-F328 HydrophobicContact CD1-CZ 4.33Å; L280-F328 HydrophobicContact CG-CE1 4.36Å
281	G	97.6	Very high	97.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.18	C	C	.	.	S	Bend	trans	92.7	18.7	-176.8	0	0	0	0	0	114.6	E284 E320 E321	G281-E284 PolarHBondContact N-OE1 3.14Å; G281-E320 PolarHBondContact O-N 2.93Å; G281-E321 WeakPolarHBondContact CA-O 3.45Å; G281-E321 PolarHBondContact O-N 3.47Å
282	L	97.6	Very high	97.7	Very high	3 Å²	3	28 Å²	28	2%	0.016	16%	0.155	C	C	.	.	S	Bend	trans	-98.6	-5.3	178.8	-74.1	166.6	0	0	0	113.4	L244 K247 V248 M279 E284 Y309 L317 E320	L244-L282 HydrophobicContact CD1-CB 4.14Å; K247-L282 PolarHBondContact NZ-O 3.32Å; V248-L282 HydrophobicContact CG1-CD1 3.89Å; V248-L282 HydrophobicContact CG2-CB 4.35Å; V248-L282 HydrophobicContact CG2-CD1 3.98Å; V248-L282 HydrophobicContact CG2-CD2 4.3Å; V248-L282 HydrophobicContact CG2-CG 4.46Å; M279-L282 HydrophobicContact CB-CD1 4.08Å; M279-L282 HydrophobicContact CE-CD1 4.41Å; L282-E284 WeakPolarHBondContact CA-OE2 3.46Å; L282-E284 PolarHBondContact N-OE2 3.17Å; L282-Y309 HydrophobicContact CD1-CG 4.41Å; L282-Y309 HydrophobicContact CD2-CD1 3.32Å; L282-Y309 HydrophobicContact CD2-CD2 4.1Å; L282-Y309 HydrophobicContact CD2-CE1 3.64Å; L282-Y309 HydrophobicContact CD2-CE2 4.4Å; L282-Y309 HydrophobicContact CD2-CG 3.57Å; L282-Y309 HydrophobicContact CG-CD1 3.96Å; L282-Y309 HydrophobicContact CG-CG 3.87Å; L282-L317 HydrophobicContact CD2-CB 4.38Å; L282-L317 HydrophobicContact CD2-CD1 4.03Å; L282-E320 WeakPolarHBondContact O-CG 3.36Å
283	G	96.9	Very high	97.9	Very high	43 Å²	43	27.8 Å²	27.8	44%	0.443	15%	0.153	S	C	.	.	S	Bend	trans	116.3	9	175.4	0	0	0	0	0	114
284	E	98.3	Very high	98.1	Very high	15 Å²	15	32.1 Å²	32.1	7%	0.07	17%	0.172	C	C	.	.			trans	-67.7	151.1	172.7	70.8	-64	158.4	0	0	111.2	V241 L244 L280 G281 L282 V289	V241-E284 HydrophobicContact CB-CB 4.44Å; V241-E284 HydrophobicContact CG1-CB 3.76Å; V241-E284 HydrophobicContact CG1-CG 4.28Å; V241-E284 HydrophobicContact CG2-CB 3.75Å; L244-E284 HydrophobicContact CD1-CB 4.01Å; L280-E284 WeakPolarHBondContact CA-OE1 3.47Å; L280-E284 WeakPolarHBondContact CB-OE1 3.15Å; L280-E284 HydrophobicContact CD2-CG 4.2Å; G281-E284 PolarHBondContact N-OE1 3.14Å; L282-E284 WeakPolarHBondContact CA-OE2 3.46Å; L282-E284 PolarHBondContact N-OE2 3.17Å; E284-V289 HydrophobicContact CB-CG2 4.2Å; E284-V289 HydrophobicContact CG-CG2 3.44Å; E284-V289 VanDerWaalsContact CG-CG2 3.44Å
285	N	98.2	Very high	98.2	Very high	70 Å²	70	33.3 Å²	33.3	37%	0.374	18%	0.182	S	C	.	.			trans	-103	172.3	169.9	67.3	36.2	0	0	0	111.6	E287 Q288 V289	N285-E287 PolarHBondContact O-N 2.99Å; N285-E287 PolarHBondContact OD1-N 3.12Å; N285-E287 PolarHBondContact OD1-OE2 2.77Å; N285-Q288 PolarHBondContact O-N 2.94Å; N285-Q288 WeakPolarHBondContact OD1-CB 3.45Å; N285-Q288 WeakPolarHBondContact OD1-CG 3.45Å; N285-Q288 PolarHBondContact OD1-N 3.19Å; N285-V289 WeakPolarHBondContact O-CG2 3.47Å; N285-V289 PolarHBondContact O-N 3.35Å
286	D	98.4	Very high	98.3	Very high	74 Å²	74	33 Å²	33	40%	0.396	18%	0.18	S	C	.	.	H	α-helix	trans	-62.7	-41.3	-176.8	-71.6	-16.3	0	0	0	112.5	Q288 V289 Y290 K327 W331	D286-Q288 VanDerWaalsContact C-N 3.3Å; D286-Q288 PolarHBondContact O-N 3.45Å; D286-V289 PolarHBondContact O-N 3.27Å; D286-Y290 WeakPolarHBondContact O-CB 2.9Å; D286-Y290 PolarHBondContact O-N 3.19Å; D286-K327 WeakPolarHBondContact OD1-CE 3.23Å; D286-K327 IonicContact OD1-NZ 2.73Å; D286-K327 PolarHBondContact OD1-NZ 3.4Å; D286-K327 IonicContact OD2-NZ 3.36Å; D286-K327 PolarHBondContact OD2-NZ 3.19Å; D286-W331 HydrophobicContact CB-CH2 4.12Å; D286-W331 HydrophobicContact CB-CZ2 4.09Å; D286-W331 VanDerWaalsContact O-CH2 3.31Å; D286-W331 WeakPolarHBondContact O-CH2 3.38Å; D286-W331 WeakPolarHBondContact OD1-CZ2 3.24Å
287	E	98.6	Very high	98.3	Very high	136 Å²	136	35.4 Å²	35.4	64%	0.636	19%	0.19	S	C	*	.	H	α-helix	trans	-62.4	-40.1	179.9	-63.6	77.3	-167.9	0	0	111.5	N285 A291	N285-E287 PolarHBondContact O-N 2.99Å; N285-E287 PolarHBondContact OD1-N 3.12Å; N285-E287 PolarHBondContact OD1-OE2 2.77Å; E287-A291 VanDerWaalsContact O-CB 3.25Å; E287-A291 WeakPolarHBondContact O-CB 3.21Å; E287-A291 PolarHBondContact O-N 3.03Å
288	Q	98.8	Very high	98.3	Very high	38 Å²	38	41.4 Å²	41.4	18%	0.178	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-43.2	176.9	-72.4	169.8	-25.2	0	0	111.7	V241 N285 D286 A291 T292	V241-Q288 HydrophobicContact CB-CB 4.05Å; V241-Q288 HydrophobicContact CG1-CB 3.88Å; V241-Q288 HydrophobicContact CG2-CB 4.15Å; N285-Q288 PolarHBondContact O-N 2.94Å; N285-Q288 WeakPolarHBondContact OD1-CB 3.45Å; N285-Q288 WeakPolarHBondContact OD1-CG 3.45Å; N285-Q288 PolarHBondContact OD1-N 3.19Å; D286-Q288 VanDerWaalsContact C-N 3.3Å; D286-Q288 PolarHBondContact O-N 3.45Å; Q288-A291 PolarHBondContact O-N 3.19Å; Q288-T292 VanDerWaalsContact O-CB 3.3Å; Q288-T292 WeakPolarHBondContact O-CB 3.44Å; Q288-T292 PolarHBondContact O-N 2.67Å; Q288-T292 PolarHBondContact O-OG1 3.37Å
289	V	98.8	Very high	98.2	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-63	-48.2	176.4	175.7	0	0	0	0	110	V241 L280 E284 N285 D286 A291 T292 M293 L306 W331	V241-V289 HydrophobicContact CG1-CG2 4.16Å; L280-V289 HydrophobicContact CD2-CG1 4.26Å; L280-V289 HydrophobicContact CD2-CG2 3.77Å; E284-V289 HydrophobicContact CB-CG2 4.2Å; E284-V289 HydrophobicContact CG-CG2 3.44Å; E284-V289 VanDerWaalsContact CG-CG2 3.44Å; N285-V289 WeakPolarHBondContact O-CG2 3.47Å; N285-V289 PolarHBondContact O-N 3.35Å; D286-V289 PolarHBondContact O-N 3.27Å; V289-A291 PolarHBondContact O-N 2.64Å; V289-T292 WeakPolarHBondContact O-CB 3.15Å; V289-T292 PolarHBondContact O-N 2.92Å; V289-M293 HydrophobicContact CG1-CG 4.41Å; V289-M293 HydrophobicContact CG1-SD 3.93Å; V289-M293 VanDerWaalsContact O-CG 3.29Å; V289-M293 WeakPolarHBondContact O-CG 3.24Å; V289-M293 PolarHBondContact O-N 3.41Å; V289-L306 HydrophobicContact CG1-CD2 4.25Å; V289-W331 HydrophobicContact CB-CH2 3.7Å; V289-W331 HydrophobicContact CB-CZ2 3.7Å; V289-W331 HydrophobicContact CB-CZ3 4.23Å; V289-W331 HydrophobicContact CG1-CD2 3.85Å; V289-W331 HydrophobicContact CG1-CE3 3.85Å; V289-W331 HydrophobicContact CG1-CH2 3.7Å; V289-W331 HydrophobicContact CG1-CZ2 3.65Å; V289-W331 HydrophobicContact CG1-CZ3 3.79Å; V289-W331 HydrophobicContact CG2-CZ2 4.34Å
290	Y	98.8	Very high	98.1	Very high	102 Å²	102	44.2 Å²	44.2	40%	0.4	23%	0.233	S	C	.	.	H	α-helix	trans	-59	-47.9	177.3	-179	-90.2	0	0	0	112.1	D286 T292 M293 K294 V334 L338	D286-Y290 WeakPolarHBondContact O-CB 2.9Å; D286-Y290 PolarHBondContact O-N 3.19Å; Y290-T292 VanDerWaalsContact C-N 3.29Å; Y290-T292 PolarHBondContact O-N 3.06Å; Y290-M293 PolarHBondContact O-N 3.46Å; Y290-K294 HydrophobicContact CE1-CD 4.3Å; Y290-K294 WeakPolarHBondContact O-CB 3.4Å; Y290-K294 PolarHBondContact O-N 2.86Å; Y290-V334 HydrophobicContact CD2-CG1 3.75Å; Y290-V334 HydrophobicContact CE2-CG1 3.96Å; Y290-L338 HydrophobicContact CE2-CD2 4.41Å
291	A	98.8	Very high	98.1	Very high	54 Å²	54	44.1 Å²	44.1	45%	0.446	23%	0.233	S	C	.	.	H	α-helix	trans	-60.6	-39.3	177.6	0	0	0	0	0	111.9	E287 Q288 V289 K294 A295	E287-A291 VanDerWaalsContact O-CB 3.25Å; E287-A291 WeakPolarHBondContact O-CB 3.21Å; E287-A291 PolarHBondContact O-N 3.03Å; Q288-A291 PolarHBondContact O-N 3.19Å; V289-A291 PolarHBondContact O-N 2.64Å; A291-K294 PolarHBondContact O-N 3.07Å; A291-A295 WeakPolarHBondContact O-CB 3.42Å; A291-A295 PolarHBondContact O-N 3.35Å
292	T	98.8	Very high	98	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-64	-47.6	175.9	-58.9	0	0	0	0	111.1	V241 P242 F255 I278 Q288 V289 Y290 K294 A295 L296	V241-T292 WeakPolarHBondContact CG1-OG1 3.33Å; P242-T292 VanDerWaalsContact CD-OG1 3.3Å; P242-T292 WeakPolarHBondContact CD-OG1 3.17Å; F255-T292 HydrophobicContact CE2-CG2 3.66Å; F255-T292 HydrophobicContact CZ-CG2 4.03Å; I278-T292 HydrophobicContact CD1-CG2 3.73Å; Q288-T292 VanDerWaalsContact O-CB 3.3Å; Q288-T292 WeakPolarHBondContact O-CB 3.44Å; Q288-T292 PolarHBondContact O-N 2.67Å; Q288-T292 PolarHBondContact O-OG1 3.37Å; V289-T292 WeakPolarHBondContact O-CB 3.15Å; V289-T292 PolarHBondContact O-N 2.92Å; Y290-T292 VanDerWaalsContact C-N 3.29Å; Y290-T292 PolarHBondContact O-N 3.06Å; T292-K294 VanDerWaalsContact C-N 3.31Å; T292-K294 PolarHBondContact O-N 3.22Å; T292-A295 PolarHBondContact O-N 3.38Å; T292-L296 HydrophobicContact CG2-CD1 4.18Å; T292-L296 VanDerWaalsContact O-CG 3.26Å; T292-L296 WeakPolarHBondContact O-CG 3.44Å; T292-L296 PolarHBondContact O-N 2.76Å
293	M	98.8	Very high	97.9	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.6	-42.1	176.8	-68.4	172.3	71.6	0	0	111.9	I278 V289 Y290 L296 R297 L304 L306 W331 V334 G335 L338 F340	I278-M293 HydrophobicContact CD1-CG 4.36Å; V289-M293 HydrophobicContact CG1-CG 4.41Å; V289-M293 HydrophobicContact CG1-SD 3.93Å; V289-M293 VanDerWaalsContact O-CG 3.29Å; V289-M293 WeakPolarHBondContact O-CG 3.24Å; V289-M293 PolarHBondContact O-N 3.41Å; Y290-M293 PolarHBondContact O-N 3.46Å; M293-L296 PolarHBondContact O-N 2.65Å; M293-R297 PolarHBondContact O-N 2.89Å; M293-L304 HydrophobicContact CE-CD2 3.85Å; M293-L304 HydrophobicContact CG-CD2 3.8Å; M293-L304 HydrophobicContact SD-CD2 4.42Å; M293-L306 HydrophobicContact SD-CD2 4.31Å; M293-W331 HydrophobicContact CE-CE3 4.38Å; M293-W331 HydrophobicContact SD-CD2 4.38Å; M293-W331 HydrophobicContact SD-CE3 3.52Å; M293-W331 VanDerWaalsContact SD-CE3 3.52Å; M293-W331 HydrophobicContact SD-CZ3 3.95Å; M293-V334 HydrophobicContact CE-CB 4.17Å; M293-V334 HydrophobicContact CE-CG1 3.81Å; M293-V334 HydrophobicContact SD-CG1 4.19Å; M293-G335 VanDerWaalsContact CE-CA 3.44Å; M293-L338 HydrophobicContact CB-CD1 3.66Å; M293-L338 HydrophobicContact CE-CD1 4.37Å; M293-F340 HydrophobicContact CB-CE2 4.34Å
294	K	98.8	Very high	97.8	Very high	93 Å²	93	42 Å²	42	40%	0.404	21%	0.211	S	C	.	.	H	α-helix	trans	-62.1	-47.1	175.6	-176.4	171.6	-177.5	-75	0	111.7	Y290 A291 T292 L296 R297 E298	Y290-K294 HydrophobicContact CE1-CD 4.3Å; Y290-K294 WeakPolarHBondContact O-CB 3.4Å; Y290-K294 PolarHBondContact O-N 2.86Å; A291-K294 PolarHBondContact O-N 3.07Å; T292-K294 VanDerWaalsContact C-N 3.31Å; T292-K294 PolarHBondContact O-N 3.22Å; K294-L296 VanDerWaalsContact C-N 3.31Å; K294-L296 PolarHBondContact O-N 3.44Å; K294-R297 PolarHBondContact O-N 2.93Å; K294-E298 IonicContact NZ-OE1 3.77Å; K294-E298 PolarHBondContact NZ-OE1 3.23Å; K294-E298 WeakPolarHBondContact O-CG 2.98Å; K294-E298 PolarHBondContact O-N 3Å
295	A	98.7	Very high	97.7	Very high	26 Å²	26	41.4 Å²	41.4	22%	0.215	21%	0.209	C	C	.	.	H	α-helix	trans	-62.4	-37.5	177.8	0	0	0	0	0	112.7	F255 A291 T292 E298 A299	F255-A295 HydrophobicContact CE1-CB 4.21Å; F255-A295 HydrophobicContact CZ-CB 4.16Å; A291-A295 WeakPolarHBondContact O-CB 3.42Å; A291-A295 PolarHBondContact O-N 3.35Å; T292-A295 PolarHBondContact O-N 3.38Å; A295-E298 PolarHBondContact O-N 2.92Å; A295-A299 WeakPolarHBondContact O-CB 3.45Å; A295-A299 PolarHBondContact O-N 3.18Å
296	L	98.6	Very high	97.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64	-41.8	174.1	-71.7	169.9	0	0	0	111.7	V238 L259 L262 T276 I278 T292 M293 K294 A299 V301 L304 F340	V238-L296 HydrophobicContact CG1-CD2 3.85Å; V238-L296 HydrophobicContact CG2-CD1 4.19Å; V238-L296 HydrophobicContact CG2-CD2 4.31Å; L259-L296 HydrophobicContact CD1-CD2 3.89Å; L262-L296 HydrophobicContact CD1-CD2 4.49Å; T276-L296 HydrophobicContact CG2-CD1 3.73Å; T276-L296 HydrophobicContact CG2-CD2 3.91Å; T276-L296 HydrophobicContact CG2-CG 4.36Å; I278-L296 HydrophobicContact CD1-CD1 3.98Å; I278-L296 HydrophobicContact CG1-CD1 4.48Å; T292-L296 HydrophobicContact CG2-CD1 4.18Å; T292-L296 VanDerWaalsContact O-CG 3.26Å; T292-L296 WeakPolarHBondContact O-CG 3.44Å; T292-L296 PolarHBondContact O-N 2.76Å; M293-L296 PolarHBondContact O-N 2.65Å; K294-L296 VanDerWaalsContact C-N 3.31Å; K294-L296 PolarHBondContact O-N 3.44Å; L296-A299 WeakPolarHBondContact O-CB 3.47Å; L296-A299 PolarHBondContact O-N 2.67Å; L296-V301 HydrophobicContact CB-CB 4.43Å; L296-V301 HydrophobicContact CB-CG2 4.4Å; L296-V301 HydrophobicContact CD2-CG2 4.23Å; L296-V301 VanDerWaalsContact O-CB 3.31Å; L296-V301 WeakPolarHBondContact O-CB 3.26Å; L296-V301 VanDerWaalsContact O-CG2 3.28Å; L296-V301 WeakPolarHBondContact O-CG2 3.45Å; L296-V301 PolarHBondContact O-N 3.07Å; L296-L304 HydrophobicContact CD1-CD1 4.1Å; L296-F340 HydrophobicContact CB-CE1 4.31Å; L296-F340 HydrophobicContact CB-CZ 3.87Å
297	R	97.8	Very high	97.6	Very high	51 Å²	51	34.8 Å²	34.8	19%	0.192	17%	0.174	C	C	.	.	H	α-helix	trans	-67.8	-41	174.4	-77.9	-57.6	-59.5	118	-3.1	113.7	M293 K294 A299 D300 V301 L338 G339 F340	M293-R297 PolarHBondContact O-N 2.89Å; K294-R297 PolarHBondContact O-N 2.93Å; R297-A299 PolarHBondContact O-N 2.79Å; R297-D300 IonicContact NH1-OD1 3.76Å; R297-D300 WeakPolarHBondContact O-CA 3.43Å; R297-D300 PolarHBondContact O-N 3.38Å; R297-V301 PolarHBondContact NH1-O 3Å; R297-L338 HydrophobicContact CG-CB 4.01Å; R297-L338 PolarHBondContact NE-O 3.3Å; R297-G339 VanDerWaalsContact CZ-O 3.27Å; R297-G339 PolarHBondContact NE-O 3.01Å; R297-G339 PolarHBondContact NH2-O 3.41Å; R297-F340 HydrophobicContact CG-CD1 4.13Å; R297-F340 HydrophobicContact CG-CD2 3.68Å; R297-F340 HydrophobicContact CG-CE1 3.83Å; R297-F340 HydrophobicContact CG-CE2 3.36Å; R297-F340 HydrophobicContact CG-CG 4.06Å; R297-F340 HydrophobicContact CG-CZ 3.44Å; R297-F340 VanDerWaalsContact CG-CZ 3.44Å
298	E	97.7	Very high	97.5	Very high	131 Å²	131	28.4 Å²	28.4	61%	0.612	14%	0.144	S	C	*	.	H	α-helix	trans	-62.8	-23.9	173.9	-72.4	172.6	-179.8	0	0	112.2	K294 A295 D300	K294-E298 IonicContact NZ-OE1 3.77Å; K294-E298 PolarHBondContact NZ-OE1 3.23Å; K294-E298 WeakPolarHBondContact O-CG 2.98Å; K294-E298 PolarHBondContact O-N 3Å; A295-E298 PolarHBondContact O-N 2.92Å; E298-D300 PolarHBondContact O-N 2.82Å
299	A	96.7	Very high	97.4	Very high	6 Å²	6	26.7 Å²	26.7	5%	0.05	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	7.5	170.4	0	0	0	0	0	114.4	L259 K263 A295 L296 R297 V301	L259-A299 HydrophobicContact CD1-CB 3.3Å; L259-A299 HydrophobicContact CD2-CB 4.12Å; L259-A299 HydrophobicContact CG-CB 3.68Å; K263-A299 HydrophobicContact CD-CB 4.21Å; K263-A299 VanDerWaalsContact CE-CA 3.45Å; K263-A299 HydrophobicContact CG-CB 3.91Å; A295-A299 WeakPolarHBondContact O-CB 3.45Å; A295-A299 PolarHBondContact O-N 3.18Å; L296-A299 WeakPolarHBondContact O-CB 3.47Å; L296-A299 PolarHBondContact O-N 2.67Å; R297-A299 PolarHBondContact O-N 2.79Å; A299-V301 VanDerWaalsContact C-N 3.3Å; A299-V301 HydrophobicContact CB-CG2 4.4Å; A299-V301 PolarHBondContact O-N 2.73Å
300	D	96.2	Very high	97	Very high	81 Å²	81	28.8 Å²	28.8	43%	0.433	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	34	-176.1	-161.9	35.8	0	0	0	113.7	K266 S274 R297 E298 D302	K266-D300 HydrophobicContact CD-CB 4.17Å; K266-D300 VanDerWaalsContact CD-O 3.25Å; K266-D300 WeakPolarHBondContact CD-O 3.07Å; K266-D300 WeakPolarHBondContact CD-OD2 3.23Å; K266-D300 WeakPolarHBondContact CE-O 3.41Å; K266-D300 PolarHBondContact NZ-O 3.23Å; K266-D300 IonicContact NZ-OD1 2.93Å; K266-D300 IonicContact NZ-OD2 3.62Å; K266-D300 PolarHBondContact NZ-OD2 3.47Å; S274-D300 PolarHBondContact OG-O 2.76Å; R297-D300 IonicContact NH1-OD1 3.76Å; R297-D300 WeakPolarHBondContact O-CA 3.43Å; R297-D300 PolarHBondContact O-N 3.38Å; E298-D300 PolarHBondContact O-N 2.82Å; D300-D302 PolarHBondContact O-N 2.65Å
301	V	97.4	Very high	96.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.			trans	-69.9	131.8	172.7	179.9	0	0	0	0	110	L262 S274 T276 L296 R297 A299 C303 F340	L262-V301 HydrophobicContact CB-CG2 4.19Å; L262-V301 HydrophobicContact CD1-CG2 3.71Å; L262-V301 HydrophobicContact CG-CG2 4.47Å; S274-V301 WeakPolarHBondContact OG-CA 3.37Å; T276-V301 HydrophobicContact CG2-CG1 3.89Å; L296-V301 HydrophobicContact CB-CB 4.43Å; L296-V301 HydrophobicContact CB-CG2 4.4Å; L296-V301 HydrophobicContact CD2-CG2 4.23Å; L296-V301 VanDerWaalsContact O-CB 3.31Å; L296-V301 WeakPolarHBondContact O-CB 3.26Å; L296-V301 VanDerWaalsContact O-CG2 3.28Å; L296-V301 WeakPolarHBondContact O-CG2 3.45Å; L296-V301 PolarHBondContact O-N 3.07Å; R297-V301 PolarHBondContact NH1-O 3Å; A299-V301 VanDerWaalsContact C-N 3.3Å; A299-V301 HydrophobicContact CB-CG2 4.4Å; A299-V301 PolarHBondContact O-N 2.73Å; V301-C303 WeakPolarHBondContact CG1-O 3.16Å; V301-F340 HydrophobicContact CB-CE1 4.14Å; V301-F340 HydrophobicContact CG1-CE1 4.15Å; V301-F340 WeakPolarHBondContact O-CD1 2.9Å
302	D	95.6	Very high	96.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.13	C	C	.	.			trans	-82.5	-44.4	-174.3	-58.5	-73.4	0	0	0	112.3	K266 I273 S274 D300 F340 H341 Y342 R367	K266-D302 WeakPolarHBondContact CE-OD2 3.27Å; K266-D302 IonicContact NZ-OD1 2.67Å; K266-D302 PolarHBondContact NZ-OD1 3.16Å; K266-D302 IonicContact NZ-OD2 3.05Å; K266-D302 PolarHBondContact NZ-OD2 3.45Å; I273-D302 WeakPolarHBondContact CA-OD2 3.45Å; I273-D302 HydrophobicContact CG2-CB 3.95Å; S274-D302 PolarHBondContact N-OD2 2.98Å; S274-D302 WeakPolarHBondContact O-CB 3.47Å; S274-D302 PolarHBondContact O-N 2.89Å; S274-D302 PolarHBondContact OG-N 3.27Å; S274-D302 PolarHBondContact OG-OD2 3.22Å; D300-D302 PolarHBondContact O-N 2.65Å; D302-F340 CarbonylContact O-C 3.59Å; D302-H341 WeakPolarHBondContact O-CB 3.4Å; D302-H341 PolarHBondContact O-N 3.25Å; D302-H341 IonicContact OD1-CD2 3.84Å; D302-H341 PolarHBondContact OD1-CD2 3.31Å; D302-H341 VanDerWaalsContact OD1-CD2 3.24Å; D302-H341 IonicContact OD1-NE2 3.27Å; D302-Y342 PolarHBondContact O-N 2.85Å; D302-R367 IonicContact OD1-CZ 2.78Å; D302-R367 IonicContact OD1-NH1 3.58Å; D302-R367 IonicContact OD1-NH2 3.97Å; D302-R367 PolarHBondContact OD1-NH2 3.32Å; D302-R367 IonicContact OD2-NH1 3.56Å; D302-R367 IonicContact OD2-NH2 3.4Å
303	C	95.2	Very high	95.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.1	-170.4	-58.9	0	0	0	0	111.7	S274 K275 T276 V301 Y342	S274-C303 PolarHBondContact O-N 3.38Å; K275-C303 WeakPolarHBondContact CA-O 3.45Å; K275-C303 HydrophobicContact CB-CB 4.05Å; K275-C303 HydrophobicContact CD-CB 4.47Å; K275-C303 HydrophobicContact CG-CB 3.88Å; T276-C303 PolarHBondContact N-O 2.92Å; V301-C303 WeakPolarHBondContact CG1-O 3.16Å; C303-Y342 WeakPolarHBondContact CA-O 2.86Å; C303-Y342 HydrophobicContact CB-CD1 4.33Å
304	L	95.8	Very high	95.4	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	136	179.4	176	63.2	0	0	0	110.8	T276 I278 M293 L296 L306 F340 Y342 T343 A344	T276-L304 HydrophobicContact CG2-CD1 3.7Å; T276-L304 WeakPolarHBondContact O-CA 3.42Å; I278-L304 HydrophobicContact CD1-CD1 4.12Å; I278-L304 HydrophobicContact CG1-CD1 4.1Å; M293-L304 HydrophobicContact CE-CD2 3.85Å; M293-L304 HydrophobicContact CG-CD2 3.8Å; M293-L304 HydrophobicContact SD-CD2 4.42Å; L296-L304 HydrophobicContact CD1-CD1 4.1Å; L304-L306 HydrophobicContact CD2-CD1 3.75Å; L304-L306 HydrophobicContact CD2-CG 4.31Å; L304-L306 HydrophobicContact CG-CD1 3.85Å; L304-L306 HydrophobicContact CG-CG 4.3Å; L304-F340 HydrophobicContact CB-CD1 3.82Å; L304-F340 HydrophobicContact CB-CD2 4.25Å; L304-F340 HydrophobicContact CB-CE1 3.76Å; L304-F340 HydrophobicContact CB-CE2 4.19Å; L304-F340 HydrophobicContact CB-CG 4.08Å; L304-F340 HydrophobicContact CB-CZ 3.94Å; L304-F340 HydrophobicContact CD2-CD2 4.18Å; L304-F340 HydrophobicContact CD2-CE1 4.45Å; L304-F340 HydrophobicContact CD2-CE2 3.61Å; L304-F340 HydrophobicContact CD2-CZ 3.77Å; L304-F340 HydrophobicContact CG-CZ 4.38Å; L304-Y342 PolarHBondContact N-O 3.11Å; L304-T343 CarbonylContact O-C 3.57Å; L304-T343 WeakPolarHBondContact O-CA 3.39Å; L304-A344 PolarHBondContact O-N 2.9Å
305	T	95.7	Very high	95	Very high	4 Å²	4	44.2 Å²	44.2	3%	0.025	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	134.6	167	58.9	0	0	0	0	111.2	T276 S277 I278 A344 V349	T276-T305 PolarHBondContact O-N 3.17Å; T276-T305 PolarHBondContact O-OG1 3.13Å; S277-T305 CarbonylContact C-O 3.45Å; S277-T305 VanDerWaalsContact CA-O 3.25Å; S277-T305 WeakPolarHBondContact CA-O 3.26Å; S277-T305 WeakPolarHBondContact CA-OG1 3.42Å; S277-T305 WeakPolarHBondContact CB-OG1 3.41Å; S277-T305 PolarHBondContact OG-O 2.87Å; S277-T305 PolarHBondContact OG-OG1 2.7Å; I278-T305 PolarHBondContact N-O 3.31Å; T305-A344 CarbonylContact C-O 3.57Å; T305-A344 VanDerWaalsContact CA-O 3.24Å; T305-A344 WeakPolarHBondContact CA-O 3.26Å; T305-A344 HydrophobicContact CG2-CB 3.99Å; T305-V349 HydrophobicContact CG2-CG1 4.31Å
306	L	97.3	Very high	94.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	122.6	171.7	-57.6	103.1	0	0	0	109.5	I278 L280 V289 M293 L304 F328 W331 T343 A344 S345 G346 V349	I278-L306 WeakPolarHBondContact O-CA 3.19Å; L280-L306 HydrophobicContact CD1-CB 4.44Å; L280-L306 HydrophobicContact CD1-CD2 4.21Å; L280-L306 HydrophobicContact CD2-CD2 4.45Å; V289-L306 HydrophobicContact CG1-CD2 4.25Å; M293-L306 HydrophobicContact SD-CD2 4.31Å; L304-L306 HydrophobicContact CD2-CD1 3.75Å; L304-L306 HydrophobicContact CD2-CG 4.31Å; L304-L306 HydrophobicContact CG-CD1 3.85Å; L304-L306 HydrophobicContact CG-CG 4.3Å; L306-F328 HydrophobicContact CB-CD1 4.47Å; L306-W331 HydrophobicContact CD1-CB 4.34Å; L306-W331 HydrophobicContact CD2-CB 4.03Å; L306-W331 HydrophobicContact CD2-CG 4.19Å; L306-T343 HydrophobicContact CD1-CG2 3.7Å; L306-A344 PolarHBondContact N-O 3.33Å; L306-S345 WeakPolarHBondContact O-CA 3.43Å; L306-G346 PolarHBondContact O-N 3.12Å; L306-V349 WeakPolarHBondContact O-CB 3.32Å
307	G	95.9	Very high	94.6	Very high	4 Å²	4	45.6 Å²	45.6	4%	0.041	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	157.9	-177.6	0	0	0	0	0	112.8	I278 M279 L280 Y309 G346 V349	I278-G307 PolarHBondContact O-N 2.95Å; I278-G307 VanDerWaalsContact O-N 3.12Å; M279-G307 CarbonylContact C-O 3.54Å; M279-G307 WeakPolarHBondContact CA-O 3.39Å; L280-G307 PolarHBondContact N-O 2.81Å; G307-Y309 PolarHBondContact O-N 3.37Å; G307-G346 WeakPolarHBondContact CA-O 3.27Å; G307-V349 WeakPolarHBondContact CA-O 3.45Å
308	Q	96.9	Very high	94.5	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.009	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	129.9	173.3	176	66.1	55.6	0	0	110.2	L80 L280 M310 E321 Y322 F328 P347 R350	L80-Q308 HydrophobicContact CD1-CG 3.84Å; L80-Q308 HydrophobicContact CD2-CB 3.88Å; L80-Q308 HydrophobicContact CD2-CG 3.89Å; L280-Q308 PolarHBondContact O-NE2 3.04Å; Q308-M310 HydrophobicContact CG-CG 4.43Å; Q308-M310 HydrophobicContact CG-SD 3.88Å; Q308-M310 PolarHBondContact O-N 2.82Å; Q308-E321 PolarHBondContact NE2-O 3.28Å; Q308-Y322 HydrophobicContact CG-CD1 4.31Å; Q308-F328 HydrophobicContact CB-CE2 4.42Å; Q308-F328 HydrophobicContact CB-CZ 4Å; Q308-P347 WeakPolarHBondContact CB-O 3.29Å; Q308-P347 PolarHBondContact N-O 2.95Å; Q308-R350 PolarHBondContact O-NH1 3.29Å
309	Y	96.3	Very high	94.4	Very high	3 Å²	3	42.3 Å²	42.3	1%	0.012	19%	0.189	C	C	.	.			trans	-63.3	120.2	164.2	171.4	-118.9	0	0	0	109.8	F143 M279 L280 L282 G307 Q311 L317 V319	F143-Y309 HydrophobicContact CB-CD2 4.21Å; F143-Y309 HydrophobicContact CB-CE2 3.63Å; M279-Y309 HydrophobicContact SD-CD2 4.05Å; L280-Y309 VanDerWaalsContact O-CB 3.29Å; L280-Y309 WeakPolarHBondContact O-CB 3.33Å; L280-Y309 PolarHBondContact O-N 2.9Å; L282-Y309 HydrophobicContact CD1-CG 4.41Å; L282-Y309 HydrophobicContact CD2-CD1 3.32Å; L282-Y309 HydrophobicContact CD2-CD2 4.1Å; L282-Y309 HydrophobicContact CD2-CE1 3.64Å; L282-Y309 HydrophobicContact CD2-CE2 4.4Å; L282-Y309 HydrophobicContact CD2-CG 3.57Å; L282-Y309 HydrophobicContact CG-CD1 3.96Å; L282-Y309 HydrophobicContact CG-CG 3.87Å; G307-Y309 PolarHBondContact O-N 3.37Å; Y309-Q311 HydrophobicContact CE1-CB 4.38Å; Y309-L317 HydrophobicContact CE1-CB 4.09Å; Y309-L317 VanDerWaalsContact CE1-O 3.27Å; Y309-L317 WeakPolarHBondContact CE1-O 3.39Å; Y309-L317 PolarHBondContact OH-N 3.27Å; Y309-L317 PolarHBondContact OH-O 3.23Å; Y309-V319 HydrophobicContact CD1-CG2 4.01Å; Y309-V319 HydrophobicContact CE1-CG2 4.15Å
310	M	91.7	Very high	94.3	Very high	46 Å²	46	44.1 Å²	44.1	23%	0.227	20%	0.196	C	C	.	.			trans	-110.6	117	176.9	-66.5	-63.1	-79.4	0	0	109.1	L76 L80 Q308 P312 R350	L76-M310 HydrophobicContact CD1-CE 3.62Å; L76-M310 HydrophobicContact CD1-SD 4.29Å; L76-M310 HydrophobicContact CD2-CE 4.46Å; L80-M310 HydrophobicContact CB-CE 4.29Å; L80-M310 HydrophobicContact CD1-SD 4.21Å; L80-M310 HydrophobicContact CD2-SD 3.99Å; L80-M310 HydrophobicContact CG-SD 4.48Å; Q308-M310 HydrophobicContact CG-CG 4.43Å; Q308-M310 HydrophobicContact CG-SD 3.88Å; Q308-M310 PolarHBondContact O-N 2.82Å; M310-P312 WeakPolarHBondContact O-CD 3.14Å; M310-R350 VanDerWaalsContact CG-NH2 3.29Å
311	Q	92.3	Very high	94.3	Very high	64 Å²	64	42.6 Å²	42.6	30%	0.299	19%	0.187	S	C	.	.			trans	-63.5	115.6	-179.6	179.9	177.8	41.3	0	0	110.6	Y309 T313 H316 L317 V319	Y309-Q311 HydrophobicContact CE1-CB 4.38Å; Q311-T313 WeakPolarHBondContact CG-O 3.42Å; Q311-T313 PolarHBondContact NE2-O 3.26Å; Q311-H316 HydrophobicContact CG-CB 4.33Å; Q311-H316 PolarHBondContact NE2-O 2.84Å; Q311-L317 VanDerWaalsContact CG-O 3.32Å; Q311-L317 WeakPolarHBondContact CG-O 3.44Å; Q311-L317 PolarHBondContact NE2-O 3.42Å; Q311-V319 HydrophobicContact CB-CG2 4.09Å
312	P	89.7	Confident	94.2	Very high	31 Å²	31	43.6 Å²	43.6	20%	0.201	19%	0.191	C	C	.	.			trans	-70.6	-40.1	-175	-21.1	32.7	0	0	0	113.4	F143 M310	F143-P312 VanDerWaalsContact O-CG 3.29Å; F143-P312 WeakPolarHBondContact O-CG 3.34Å; M310-P312 WeakPolarHBondContact O-CD 3.14Å
313	T	89.4	Confident	94.2	Very high	41 Å²	41	44.2 Å²	44.2	25%	0.252	19%	0.194	S	C	.	.	S	Bend	trans	-147.3	165.9	176.4	84.1	0	0	0	0	110.5	Q311 R315 H316	Q311-T313 WeakPolarHBondContact CG-O 3.42Å; Q311-T313 PolarHBondContact NE2-O 3.26Å; T313-R315 PolarHBondContact O-N 2.92Å; T313-R315 PolarHBondContact OG1-N 3.45Å; T313-H316 PolarHBondContact N-ND1 3.03Å; T313-H316 PolarHBondContact O-N 3.16Å; T313-H316 PolarHBondContact OG1-CE1 3.22Å; T313-H316 VanDerWaalsContact OG1-CE1 3.25Å; T313-H316 PolarHBondContact OG1-ND1 2.94Å
314	R	89.4	Confident	94.1	Very high	194 Å²	194	46 Å²	46	73%	0.732	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-16	179	-62	-178.3	169.3	-171.5	3	114.9	R73	R73-R314 VanDerWaalsContact NH1-CZ 3.34Å; R73-R314 VanDerWaalsContact NH2-CG 3.27Å
315	R	90.2	Very high	93.9	Very high	244 Å²	244	47.2 Å²	47.2	92%	0.921	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-19.5	179.6	-62.5	-177.6	-178.7	177.5	-0.2	113.3	T313	T313-R315 PolarHBondContact O-N 2.92Å; T313-R315 PolarHBondContact OG1-N 3.45Å
316	H	94.8	Very high	93.8	Very high	41 Å²	41	51 Å²	51	19%	0.19	23%	0.23	C	C	.	.	S	Bend	trans	-82.1	173.3	-179.9	-62.1	90.9	0	0	0	111.3	R142 C144 Q311 T313 K318	R142-H316 WeakPolarHBondContact O-CB 3.08Å; C144-H316 PolarHBondContact O-CD2 3.44Å; C144-H316 VanDerWaalsContact O-CD2 3.32Å; C144-H316 PolarHBondContact O-NE2 3.39Å; Q311-H316 HydrophobicContact CG-CB 4.33Å; Q311-H316 PolarHBondContact NE2-O 2.84Å; T313-H316 PolarHBondContact N-ND1 3.03Å; T313-H316 PolarHBondContact O-N 3.16Å; T313-H316 PolarHBondContact OG1-CE1 3.22Å; T313-H316 VanDerWaalsContact OG1-CE1 3.25Å; T313-H316 PolarHBondContact OG1-ND1 2.94Å; H316-K318 PolarHBondContact O-N 3.38Å
317	L	95.1	Very high	93.7	Very high	14 Å²	14	53.2 Å²	53.2	7%	0.073	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-49.4	137.4	175.4	-70.4	175.8	0	0	0	111.4	R142 V248 L282 Y309 Q311	R142-L317 HydrophobicContact CB-CD1 3.87Å; R142-L317 HydrophobicContact CB-CD2 4.2Å; R142-L317 HydrophobicContact CB-CG 3.7Å; R142-L317 PolarHBondContact O-N 3.48Å; R142-L317 VanDerWaalsContact O-N 3.07Å; V248-L317 HydrophobicContact CB-CD1 4.26Å; V248-L317 HydrophobicContact CG1-CD1 4.46Å; V248-L317 HydrophobicContact CG2-CD1 3.91Å; L282-L317 HydrophobicContact CD2-CB 4.38Å; L282-L317 HydrophobicContact CD2-CD1 4.03Å; Y309-L317 HydrophobicContact CE1-CB 4.09Å; Y309-L317 VanDerWaalsContact CE1-O 3.27Å; Y309-L317 WeakPolarHBondContact CE1-O 3.39Å; Y309-L317 PolarHBondContact OH-N 3.27Å; Y309-L317 PolarHBondContact OH-O 3.23Å; Q311-L317 VanDerWaalsContact CG-O 3.32Å; Q311-L317 WeakPolarHBondContact CG-O 3.44Å; Q311-L317 PolarHBondContact NE2-O 3.42Å
318	K	94.8	Very high	93.7	Very high	106 Å²	106	53 Å²	53	46%	0.461	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-74.7	142.1	173.1	-67.6	-180	-177.6	-176.6	0	108.3	R68 H316 E320	R68-K318 PolarHBondContact NH1-O 3.14Å; H316-K318 PolarHBondContact O-N 3.38Å; K318-E320 PolarHBondContact O-N 3.03Å
319	V	95.2	Very high	93.6	Very high	8 Å²	8	58.7 Å²	58.7	5%	0.048	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-61.2	127.3	167.6	-175.7	0	0	0	0	108	R68 L74 Y309 Q311 E321 Y322	R68-V319 WeakPolarHBondContact CD-O 3.41Å; R68-V319 PolarHBondContact NH1-O 2.89Å; L74-V319 HydrophobicContact CD1-CG1 4.36Å; Y309-V319 HydrophobicContact CD1-CG2 4.01Å; Y309-V319 HydrophobicContact CE1-CG2 4.15Å; Q311-V319 HydrophobicContact CB-CG2 4.09Å; V319-E321 WeakPolarHBondContact CG1-O 3.28Å; V319-Y322 HydrophobicContact CB-CE1 4.41Å; V319-Y322 HydrophobicContact CG1-CD1 3.95Å; V319-Y322 HydrophobicContact CG1-CE1 3.83Å; V319-Y322 HydrophobicContact CG1-CG 4.4Å; V319-Y322 HydrophobicContact CG2-CE1 4.22Å
320	E	96	Very high	93.7	Very high	43 Å²	43	63.7 Å²	63.7	20%	0.201	28%	0.282	C	S	.	.	S	Bend	trans	-85.2	-37.9	173.4	-61.8	-63.8	158.2	0	0	110.5	K67 R68 K247 G281 L282 K318	K67-E320 WeakPolarHBondContact CA-O 3.36Å; R68-E320 WeakPolarHBondContact CB-O 3.34Å; R68-E320 IonicContact CZ-OE1 3.21Å; R68-E320 IonicContact CZ-OE2 2.96Å; R68-E320 PolarHBondContact N-O 3.18Å; R68-E320 IonicContact NE-OE2 3.78Å; R68-E320 IonicContact NH1-OE1 2.9Å; R68-E320 PolarHBondContact NH1-OE1 3.43Å; R68-E320 IonicContact NH1-OE2 3.04Å; R68-E320 PolarHBondContact NH1-OE2 2.77Å; R68-E320 IonicContact NH2-OE1 3.69Å; R68-E320 PolarHBondContact NH2-OE1 3.16Å; R68-E320 IonicContact NH2-OE2 2.77Å; R68-E320 PolarHBondContact NH2-OE2 3.11Å; K247-E320 IonicContact NZ-OE1 2.67Å; K247-E320 PolarHBondContact NZ-OE1 2.8Å; G281-E320 PolarHBondContact O-N 2.93Å; L282-E320 WeakPolarHBondContact O-CG 3.36Å; K318-E320 PolarHBondContact O-N 3.03Å
321	E	95.4	Very high	94	Very high	50 Å²	50	61.7 Å²	61.7	23%	0.234	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-147.4	140.4	-178.6	-173.4	169.8	-170.5	0	0	111.9	L66 K67 G281 Q308 V319 I323	L66-E321 CarbonylContact O-C 3.53Å; L66-E321 VanDerWaalsContact O-CA 3.24Å; L66-E321 WeakPolarHBondContact O-CA 3.33Å; K67-E321 WeakPolarHBondContact CE-OE1 3.33Å; K67-E321 WeakPolarHBondContact CE-OE2 3.45Å; K67-E321 HydrophobicContact CG-CB 4.26Å; K67-E321 HydrophobicContact CG-CG 3.8Å; K67-E321 IonicContact NZ-OE1 3.86Å; K67-E321 IonicContact NZ-OE2 3.83Å; G281-E321 WeakPolarHBondContact CA-O 3.45Å; G281-E321 PolarHBondContact O-N 3.47Å; Q308-E321 PolarHBondContact NE2-O 3.28Å; V319-E321 WeakPolarHBondContact CG1-O 3.28Å; E321-I323 HydrophobicContact CB-CD1 4.27Å; E321-I323 HydrophobicContact CG-CD1 3.85Å
322	Y	95.8	Very high	94.1	Very high	21 Å²	21	60.8 Å²	60.8	8%	0.082	27%	0.268	C	S	.	.			trans	-93.3	110.5	164	-72.5	-57.7	0	0	0	109.8	L66 L74 R75 L76 P77 L80 Q308 V319	L66-Y322 PolarHBondContact O-N 3.25Å; L74-Y322 HydrophobicContact CB-CD2 3.92Å; L74-Y322 HydrophobicContact CB-CE2 3.42Å; L74-Y322 VanDerWaalsContact CB-CE2 3.42Å; L74-Y322 HydrophobicContact CD1-CD2 3.95Å; L74-Y322 HydrophobicContact CD1-CE2 4.11Å; L74-Y322 HydrophobicContact CG-CE2 4.41Å; R75-Y322 WeakPolarHBondContact O-CE2 3.1Å; L76-Y322 HydrophobicContact CD1-CE1 3.9Å; P77-Y322 HydrophobicContact CG-CD1 4.16Å; P77-Y322 HydrophobicContact CG-CD2 3.57Å; P77-Y322 HydrophobicContact CG-CE2 4.23Å; P77-Y322 HydrophobicContact CG-CG 3.52Å; L80-Y322 HydrophobicContact CD1-CD1 3.33Å; L80-Y322 HydrophobicContact CD1-CE1 3.74Å; L80-Y322 HydrophobicContact CD1-CG 4.15Å; Q308-Y322 HydrophobicContact CG-CD1 4.31Å; V319-Y322 HydrophobicContact CB-CE1 4.41Å; V319-Y322 HydrophobicContact CG1-CD1 3.95Å; V319-Y322 HydrophobicContact CG1-CE1 3.83Å; V319-Y322 HydrophobicContact CG1-CG 4.4Å; V319-Y322 HydrophobicContact CG2-CE1 4.22Å
323	I	95.3	Very high	94.5	Very high	12 Å²	12	65.2 Å²	65.2	6%	0.062	28%	0.284	C	S	.	.			trans	-75.8	134.8	-178	-53.3	-60.1	0	0	0	109.2	W79 L280 E321 K327 F328	W79-I323 PolarHBondContact NE1-O 3.49Å; L280-I323 HydrophobicContact CB-CD1 4.49Å; L280-I323 HydrophobicContact CB-CG1 3.73Å; L280-I323 HydrophobicContact CD1-CG2 4.43Å; E321-I323 HydrophobicContact CB-CD1 4.27Å; E321-I323 HydrophobicContact CG-CD1 3.85Å; I323-K327 HydrophobicContact CG2-CB 3.66Å; I323-K327 HydrophobicContact CG2-CG 3.66Å; I323-F328 HydrophobicContact CB-CD2 4.21Å; I323-F328 HydrophobicContact CB-CE2 3.52Å; I323-F328 HydrophobicContact CB-CZ 3.83Å; I323-F328 HydrophobicContact CG1-CZ 4.48Å; I323-F328 HydrophobicContact CG2-CD2 3.78Å; I323-F328 HydrophobicContact CG2-CE2 3.58Å; I323-F328 HydrophobicContact CG2-CG 4.33Å; I323-F328 HydrophobicContact CG2-CZ 3.97Å
324	T	93.4	Very high	94.9	Very high	39 Å²	39	63.6 Å²	63.6	24%	0.239	27%	0.274	C	S	.	.			trans	-77.7	154.1	-178.5	78.4	0	0	0	0	111.4	L66 W79 E326 K327 F328	L66-T324 HydrophobicContact CD1-CG2 3.69Å; W79-T324 HydrophobicContact CZ2-CG2 4.46Å; T324-E326 WeakPolarHBondContact CB-OE2 3.2Å; T324-E326 PolarHBondContact O-N 3.43Å; T324-E326 PolarHBondContact OG1-OE2 3.08Å; T324-K327 WeakPolarHBondContact O-CB 3.24Å; T324-K327 PolarHBondContact O-N 3.5Å; T324-K327 PolarHBondContact OG1-N 3.22Å; T324-F328 WeakPolarHBondContact O-CD2 2.94Å; T324-F328 PolarHBondContact O-N 3.41Å; T324-F328 VanDerWaalsContact O-N 3.11Å
325	P	92.3	Very high	95.3	Very high	25 Å²	25	54.3 Å²	54.3	16%	0.162	24%	0.239	C	C	.	.	H	α-helix	trans	-53.5	-37.9	174.7	-26.9	36.3	0	0	0	113.6	W79 K327 F328 K329 P347	W79-P325 HydrophobicContact CB-CG 4.29Å; W79-P325 HydrophobicContact CD2-CG 4.4Å; W79-P325 HydrophobicContact CG-CG 4.04Å; P325-K327 VanDerWaalsContact C-N 3.3Å; P325-K327 PolarHBondContact O-N 3.17Å; P325-F328 PolarHBondContact O-N 3.35Å; P325-K329 PolarHBondContact O-N 3.11Å; P325-P347 HydrophobicContact CG-CG 4.24Å
326	E	92	Very high	95.5	Very high	83 Å²	83	46.7 Å²	46.7	39%	0.388	22%	0.216	S	C	.	.	H	α-helix	trans	-63.2	-39.3	178.3	-57.3	66.2	-136.1	0	0	110.9	T324 K329 Y330	T324-E326 WeakPolarHBondContact CB-OE2 3.2Å; T324-E326 PolarHBondContact O-N 3.43Å; T324-E326 PolarHBondContact OG1-OE2 3.08Å; E326-K329 PolarHBondContact O-N 3.21Å; E326-Y330 PolarHBondContact O-N 3.26Å
327	K	95.6	Very high	95.6	Very high	46 Å²	46	51 Å²	51	20%	0.2	24%	0.236	C	C	.	.	H	α-helix	trans	-69.3	-36.5	177.7	-172.7	61.5	173.7	-176.3	0	111.7	D286 I323 T324 P325 Y330 W331	D286-K327 WeakPolarHBondContact OD1-CE 3.23Å; D286-K327 IonicContact OD1-NZ 2.73Å; D286-K327 PolarHBondContact OD1-NZ 3.4Å; D286-K327 IonicContact OD2-NZ 3.36Å; D286-K327 PolarHBondContact OD2-NZ 3.19Å; I323-K327 HydrophobicContact CG2-CB 3.66Å; I323-K327 HydrophobicContact CG2-CG 3.66Å; T324-K327 WeakPolarHBondContact O-CB 3.24Å; T324-K327 PolarHBondContact O-N 3.5Å; T324-K327 PolarHBondContact OG1-N 3.22Å; P325-K327 VanDerWaalsContact C-N 3.3Å; P325-K327 PolarHBondContact O-N 3.17Å; K327-Y330 HydrophobicContact CD-CD1 4.06Å; K327-Y330 WeakPolarHBondContact O-CB 3.29Å; K327-Y330 PolarHBondContact O-N 3.09Å; K327-W331 PolarHBondContact O-N 2.75Å
328	F	96.7	Very high	95.8	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-63	-43.7	170.1	-78.7	-73.4	0	0	0	112	L280 L306 Q308 I323 T324 P325 Y330 W331 E332 S345 P347	L280-F328 HydrophobicContact CD1-CD1 4.22Å; L280-F328 HydrophobicContact CD1-CE1 3.74Å; L280-F328 HydrophobicContact CD1-CZ 4.33Å; L280-F328 HydrophobicContact CG-CE1 4.36Å; L306-F328 HydrophobicContact CB-CD1 4.47Å; Q308-F328 HydrophobicContact CB-CE2 4.42Å; Q308-F328 HydrophobicContact CB-CZ 4Å; I323-F328 HydrophobicContact CB-CD2 4.21Å; I323-F328 HydrophobicContact CB-CE2 3.52Å; I323-F328 HydrophobicContact CB-CZ 3.83Å; I323-F328 HydrophobicContact CG1-CZ 4.48Å; I323-F328 HydrophobicContact CG2-CD2 3.78Å; I323-F328 HydrophobicContact CG2-CE2 3.58Å; I323-F328 HydrophobicContact CG2-CG 4.33Å; I323-F328 HydrophobicContact CG2-CZ 3.97Å; T324-F328 WeakPolarHBondContact O-CD2 2.94Å; T324-F328 PolarHBondContact O-N 3.41Å; T324-F328 VanDerWaalsContact O-N 3.11Å; P325-F328 PolarHBondContact O-N 3.35Å; F328-Y330 VanDerWaalsContact C-N 3.27Å; F328-Y330 PolarHBondContact O-N 3.41Å; F328-W331 PolarHBondContact O-N 3.06Å; F328-E332 PolarHBondContact O-N 2.8Å; F328-S345 WeakPolarHBondContact CA-OG 3.37Å; F328-S345 WeakPolarHBondContact CD1-OG 3.46Å; F328-S345 VanDerWaalsContact O-CB 3.26Å; F328-S345 WeakPolarHBondContact O-CB 3.08Å; F328-S345 PolarHBondContact O-OG 3.4Å; F328-P347 HydrophobicContact CD2-CB 4.4Å; F328-P347 HydrophobicContact CD2-CG 3.77Å; F328-P347 HydrophobicContact CE2-CB 4.09Å; F328-P347 HydrophobicContact CE2-CG 3.94Å
329	K	94.9	Very high	95.8	Very high	121 Å²	121	48.7 Å²	48.7	53%	0.526	24%	0.237	S	C	.	.	H	α-helix	trans	-61.3	-36.1	175.3	-172	168.7	-173.3	163.2	0	112.4	P325 E326 E332 K333	P325-K329 PolarHBondContact O-N 3.11Å; E326-K329 PolarHBondContact O-N 3.21Å; K329-E332 WeakPolarHBondContact O-CB 3.42Å; K329-E332 PolarHBondContact O-N 3.39Å; K329-K333 PolarHBondContact O-N 3.17Å; K329-K333 VanDerWaalsContact O-N 3.15Å
330	Y	97.3	Very high	95.8	Very high	108 Å²	108	48.8 Å²	48.8	42%	0.424	24%	0.236	S	C	.	.	H	α-helix	trans	-59.9	-48.2	170.5	167.4	-97.8	0	0	0	111.6	E326 K327 F328 E332 K333 V334	E326-Y330 PolarHBondContact O-N 3.26Å; K327-Y330 HydrophobicContact CD-CD1 4.06Å; K327-Y330 WeakPolarHBondContact O-CB 3.29Å; K327-Y330 PolarHBondContact O-N 3.09Å; F328-Y330 VanDerWaalsContact C-N 3.27Å; F328-Y330 PolarHBondContact O-N 3.41Å; Y330-E332 VanDerWaalsContact C-N 3.31Å; Y330-E332 PolarHBondContact O-N 2.74Å; Y330-K333 WeakPolarHBondContact O-CB 3.22Å; Y330-K333 PolarHBondContact O-N 3.24Å; Y330-V334 HydrophobicContact CD1-CG2 4.34Å; Y330-V334 HydrophobicContact CD2-CG2 4.34Å; Y330-V334 HydrophobicContact CE1-CG2 3.86Å; Y330-V334 HydrophobicContact CE2-CG2 3.85Å; Y330-V334 WeakPolarHBondContact O-CG2 3.4Å; Y330-V334 PolarHBondContact O-N 2.7Å
331	W	98.1	Very high	95.6	Very high	3 Å²	3	50.8 Å²	50.8	1%	0.011	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-33	178.3	-70.6	126.6	0	0	0	113.8	D286 V289 M293 L306 K327 F328 V334 G335	D286-W331 HydrophobicContact CB-CH2 4.12Å; D286-W331 HydrophobicContact CB-CZ2 4.09Å; D286-W331 VanDerWaalsContact O-CH2 3.31Å; D286-W331 WeakPolarHBondContact O-CH2 3.38Å; D286-W331 WeakPolarHBondContact OD1-CZ2 3.24Å; V289-W331 HydrophobicContact CB-CH2 3.7Å; V289-W331 HydrophobicContact CB-CZ2 3.7Å; V289-W331 HydrophobicContact CB-CZ3 4.23Å; V289-W331 HydrophobicContact CG1-CD2 3.85Å; V289-W331 HydrophobicContact CG1-CE3 3.85Å; V289-W331 HydrophobicContact CG1-CH2 3.7Å; V289-W331 HydrophobicContact CG1-CZ2 3.65Å; V289-W331 HydrophobicContact CG1-CZ3 3.79Å; V289-W331 HydrophobicContact CG2-CZ2 4.34Å; M293-W331 HydrophobicContact CE-CE3 4.38Å; M293-W331 HydrophobicContact SD-CD2 4.38Å; M293-W331 HydrophobicContact SD-CE3 3.52Å; M293-W331 VanDerWaalsContact SD-CE3 3.52Å; M293-W331 HydrophobicContact SD-CZ3 3.95Å; L306-W331 HydrophobicContact CD1-CB 4.34Å; L306-W331 HydrophobicContact CD2-CB 4.03Å; L306-W331 HydrophobicContact CD2-CG 4.19Å; K327-W331 PolarHBondContact O-N 2.75Å; F328-W331 PolarHBondContact O-N 3.06Å; W331-V334 HydrophobicContact CE3-CB 4.18Å; W331-V334 HydrophobicContact CE3-CG1 4.23Å; W331-V334 HydrophobicContact CE3-CG2 4.3Å; W331-V334 HydrophobicContact CZ3-CG1 4.29Å; W331-V334 PolarHBondContact O-N 3.17Å; W331-G335 PolarHBondContact O-N 2.85Å
332	E	95.9	Very high	95.1	Very high	45 Å²	45	49.5 Å²	49.5	21%	0.21	24%	0.239	C	C	.	.	H	α-helix	trans	-58.1	-51.4	171.6	-165.2	177.9	-169.1	0	0	111.1	F328 K329 Y330 V334 G335 N336	F328-E332 PolarHBondContact O-N 2.8Å; K329-E332 WeakPolarHBondContact O-CB 3.42Å; K329-E332 PolarHBondContact O-N 3.39Å; Y330-E332 VanDerWaalsContact C-N 3.31Å; Y330-E332 PolarHBondContact O-N 2.74Å; E332-V334 VanDerWaalsContact C-N 3.34Å; E332-V334 PolarHBondContact O-N 3.22Å; E332-G335 PolarHBondContact O-N 3Å; E332-N336 VanDerWaalsContact O-CG 3.26Å; E332-N336 PolarHBondContact O-N 3.13Å; E332-N336 PolarHBondContact O-ND2 3.4Å
333	K	97.3	Very high	95	Very high	125 Å²	125	48.6 Å²	48.6	54%	0.543	24%	0.235	S	C	.	.	H	α-helix	trans	-57.9	-47.3	177.7	-177.6	-177.8	170.8	-176	0	111.2	K329 Y330 G335 N336 E337	K329-K333 PolarHBondContact O-N 3.17Å; K329-K333 VanDerWaalsContact O-N 3.15Å; Y330-K333 WeakPolarHBondContact O-CB 3.22Å; Y330-K333 PolarHBondContact O-N 3.24Å; K333-G335 VanDerWaalsContact C-N 3.34Å; K333-G335 PolarHBondContact O-N 2.85Å; K333-N336 PolarHBondContact O-N 3.31Å; K333-E337 WeakPolarHBondContact CE-OE1 3.35Å; K333-E337 IonicContact NZ-OE1 2.79Å; K333-E337 WeakPolarHBondContact O-CG 3.3Å; K333-E337 PolarHBondContact O-N 2.89Å
334	V	98.3	Very high	94.8	Very high	6 Å²	6	48 Å²	48	4%	0.036	23%	0.233	C	C	.	.	H	α-helix	trans	-59.5	-44.2	177.5	171.3	0	0	0	0	111.3	Y290 M293 Y330 W331 E332 N336 E337 L338	Y290-V334 HydrophobicContact CD2-CG1 3.75Å; Y290-V334 HydrophobicContact CE2-CG1 3.96Å; M293-V334 HydrophobicContact CE-CB 4.17Å; M293-V334 HydrophobicContact CE-CG1 3.81Å; M293-V334 HydrophobicContact SD-CG1 4.19Å; Y330-V334 HydrophobicContact CD1-CG2 4.34Å; Y330-V334 HydrophobicContact CD2-CG2 4.34Å; Y330-V334 HydrophobicContact CE1-CG2 3.86Å; Y330-V334 HydrophobicContact CE2-CG2 3.85Å; Y330-V334 WeakPolarHBondContact O-CG2 3.4Å; Y330-V334 PolarHBondContact O-N 2.7Å; W331-V334 HydrophobicContact CE3-CB 4.18Å; W331-V334 HydrophobicContact CE3-CG1 4.23Å; W331-V334 HydrophobicContact CE3-CG2 4.3Å; W331-V334 HydrophobicContact CZ3-CG1 4.29Å; W331-V334 PolarHBondContact O-N 3.17Å; E332-V334 VanDerWaalsContact C-N 3.34Å; E332-V334 PolarHBondContact O-N 3.22Å; V334-N336 VanDerWaalsContact C-N 3.33Å; V334-N336 PolarHBondContact O-N 2.97Å; V334-E337 PolarHBondContact O-N 3.32Å; V334-L338 HydrophobicContact CG1-CD1 3.93Å; V334-L338 HydrophobicContact CG1-CG 4.36Å; V334-L338 WeakPolarHBondContact O-CB 3.41Å; V334-L338 VanDerWaalsContact O-CG 3.31Å; V334-L338 WeakPolarHBondContact O-CG 3.3Å; V334-L338 PolarHBondContact O-N 3.04Å
335	G	97.4	Very high	94.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-41.8	178.3	0	0	0	0	0	112.3	M293 W331 E332 K333 L338 G339 F340 T343	M293-G335 VanDerWaalsContact CE-CA 3.44Å; W331-G335 PolarHBondContact O-N 2.85Å; E332-G335 PolarHBondContact O-N 3Å; K333-G335 VanDerWaalsContact C-N 3.34Å; K333-G335 PolarHBondContact O-N 2.85Å; G335-L338 PolarHBondContact O-N 3.47Å; G335-G339 PolarHBondContact O-N 3.45Å; G335-F340 WeakPolarHBondContact O-CD2 3.46Å; G335-F340 PolarHBondContact O-N 2.59Å; G335-F340 VanDerWaalsContact O-N 3.15Å; G335-T343 VanDerWaalsContact C-OG1 3.29Å; G335-T343 WeakPolarHBondContact CA-OG1 3.49Å
336	N	94.1	Very high	94.9	Very high	83 Å²	83	45.7 Å²	45.7	44%	0.444	22%	0.219	S	C	.	.	H	α-helix	trans	-65.7	-39.6	176.3	-64.5	-19	0	0	0	111.8	E332 K333 V334 G339 T343	E332-N336 VanDerWaalsContact O-CG 3.26Å; E332-N336 PolarHBondContact O-N 3.13Å; E332-N336 PolarHBondContact O-ND2 3.4Å; K333-N336 PolarHBondContact O-N 3.31Å; V334-N336 VanDerWaalsContact C-N 3.33Å; V334-N336 PolarHBondContact O-N 2.97Å; N336-G339 WeakPolarHBondContact O-CA 3.31Å; N336-G339 PolarHBondContact O-N 3.27Å; N336-G339 VanDerWaalsContact O-N 3.08Å; N336-T343 WeakPolarHBondContact OD1-CB 3.32Å; N336-T343 PolarHBondContact OD1-OG1 2.79Å
337	E	97.6	Very high	94.8	Very high	131 Å²	131	42.1 Å²	42.1	61%	0.612	20%	0.203	S	C	*	.	H	α-helix	trans	-66.9	-36	175.5	-73.8	174.4	172.4	0	0	113	K333 V334 G339	K333-E337 WeakPolarHBondContact CE-OE1 3.35Å; K333-E337 IonicContact NZ-OE1 2.79Å; K333-E337 WeakPolarHBondContact O-CG 3.3Å; K333-E337 PolarHBondContact O-N 2.89Å; V334-E337 PolarHBondContact O-N 3.32Å; E337-G339 PolarHBondContact O-N 2.97Å
338	L	97.9	Very high	94.5	Very high	40 Å²	40	41.8 Å²	41.8	21%	0.209	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-6.1	172.1	-68	173.1	0	0	0	112.7	Y290 M293 R297 V334 G335	Y290-L338 HydrophobicContact CE2-CD2 4.41Å; M293-L338 HydrophobicContact CB-CD1 3.66Å; M293-L338 HydrophobicContact CE-CD1 4.37Å; R297-L338 HydrophobicContact CG-CB 4.01Å; R297-L338 PolarHBondContact NE-O 3.3Å; V334-L338 HydrophobicContact CG1-CD1 3.93Å; V334-L338 HydrophobicContact CG1-CG 4.36Å; V334-L338 WeakPolarHBondContact O-CB 3.41Å; V334-L338 VanDerWaalsContact O-CG 3.31Å; V334-L338 WeakPolarHBondContact O-CG 3.3Å; V334-L338 PolarHBondContact O-N 3.04Å; G335-L338 PolarHBondContact O-N 3.47Å
339	G	96.1	Very high	94.2	Very high	32 Å²	32	42 Å²	42	33%	0.33	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	30.2	173	0	0	0	0	0	114.2	R297 G335 N336 E337	R297-G339 VanDerWaalsContact CZ-O 3.27Å; R297-G339 PolarHBondContact NE-O 3.01Å; R297-G339 PolarHBondContact NH2-O 3.41Å; G335-G339 PolarHBondContact O-N 3.45Å; N336-G339 WeakPolarHBondContact O-CA 3.31Å; N336-G339 PolarHBondContact O-N 3.27Å; N336-G339 VanDerWaalsContact O-N 3.08Å; E337-G339 PolarHBondContact O-N 2.97Å
340	F	95.6	Very high	93.8	Very high	10 Å²	10	38.5 Å²	38.5	4%	0.044	19%	0.188	C	C	.	.			trans	-59	141.4	159.4	-75.4	-77.8	0	0	0	108.1	M293 L296 R297 V301 D302 L304 G335 Y342	M293-F340 HydrophobicContact CB-CE2 4.34Å; L296-F340 HydrophobicContact CB-CE1 4.31Å; L296-F340 HydrophobicContact CB-CZ 3.87Å; R297-F340 HydrophobicContact CG-CD1 4.13Å; R297-F340 HydrophobicContact CG-CD2 3.68Å; R297-F340 HydrophobicContact CG-CE1 3.83Å; R297-F340 HydrophobicContact CG-CE2 3.36Å; R297-F340 HydrophobicContact CG-CG 4.06Å; R297-F340 HydrophobicContact CG-CZ 3.44Å; R297-F340 VanDerWaalsContact CG-CZ 3.44Å; V301-F340 HydrophobicContact CB-CE1 4.14Å; V301-F340 HydrophobicContact CG1-CE1 4.15Å; V301-F340 WeakPolarHBondContact O-CD1 2.9Å; D302-F340 CarbonylContact O-C 3.59Å; L304-F340 HydrophobicContact CB-CD1 3.82Å; L304-F340 HydrophobicContact CB-CD2 4.25Å; L304-F340 HydrophobicContact CB-CE1 3.76Å; L304-F340 HydrophobicContact CB-CE2 4.19Å; L304-F340 HydrophobicContact CB-CG 4.08Å; L304-F340 HydrophobicContact CB-CZ 3.94Å; L304-F340 HydrophobicContact CD2-CD2 4.18Å; L304-F340 HydrophobicContact CD2-CE1 4.45Å; L304-F340 HydrophobicContact CD2-CE2 3.61Å; L304-F340 HydrophobicContact CD2-CZ 3.77Å; L304-F340 HydrophobicContact CG-CZ 4.38Å; G335-F340 WeakPolarHBondContact O-CD2 3.46Å; G335-F340 PolarHBondContact O-N 2.59Å; G335-F340 VanDerWaalsContact O-N 3.15Å; F340-Y342 PolarHBondContact O-N 3Å
341	H	90.3	Very high	93.1	Very high	86 Å²	86	34.2 Å²	34.2	40%	0.398	17%	0.174	S	C	.	.	S	Bend	trans	-64.2	-31.7	172.3	-69.9	-59.6	0	0	0	111	D302 F359 L363	D302-H341 WeakPolarHBondContact O-CB 3.4Å; D302-H341 PolarHBondContact O-N 3.25Å; D302-H341 IonicContact OD1-CD2 3.84Å; D302-H341 PolarHBondContact OD1-CD2 3.31Å; D302-H341 VanDerWaalsContact OD1-CD2 3.24Å; D302-H341 IonicContact OD1-NE2 3.27Å; H341-F359 HydrophobicContact CB-CE1 4.35Å; H341-F359 VanDerWaalsContact O-CE1 3.26Å; H341-F359 WeakPolarHBondContact O-CE1 3.47Å; H341-F359 WeakPolarHBondContact O-CZ 3.2Å; H341-L363 HydrophobicContact CB-CD2 4.03Å
342	Y	85.9	Confident	92.1	Very high	22 Å²	22	35 Å²	35	9%	0.086	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	129.2	179.2	178	-110.5	0	0	0	110.8	D302 C303 L304 F340 A344 A355 G356 F359	D302-Y342 PolarHBondContact O-N 2.85Å; C303-Y342 WeakPolarHBondContact CA-O 2.86Å; C303-Y342 HydrophobicContact CB-CD1 4.33Å; L304-Y342 PolarHBondContact N-O 3.11Å; F340-Y342 PolarHBondContact O-N 3Å; Y342-A344 HydrophobicContact CE1-CB 3.65Å; Y342-A344 WeakPolarHBondContact OH-CB 3.19Å; Y342-A355 VanDerWaalsContact OH-CB 3.26Å; Y342-A355 WeakPolarHBondContact OH-CB 3.5Å; Y342-A355 PolarHBondContact OH-O 3.43Å; Y342-G356 WeakPolarHBondContact OH-CA 3.36Å; Y342-G356 PolarHBondContact OH-N 3.22Å; Y342-F359 HydrophobicContact CD2-CB 3.96Å; Y342-F359 AromaticContact CD2-CD1 3.79Å; Y342-F359 HydrophobicContact CD2-CD1 3.79Å; Y342-F359 HydrophobicContact CD2-CD2 4.21Å; Y342-F359 HydrophobicContact CD2-CE1 4.4Å; Y342-F359 AromaticContact CD2-CG 3.69Å; Y342-F359 HydrophobicContact CD2-CG 3.69Å; Y342-F359 HydrophobicContact CE2-CB 4.18Å; Y342-F359 HydrophobicContact CE2-CG 4.38Å; Y342-F359 AromaticContact CG-CD1 3.81Å; Y342-F359 HydrophobicContact CG-CD1 3.81Å; Y342-F359 HydrophobicContact CG-CE1 4.3Å; Y342-F359 HydrophobicContact CG-CG 4.19Å
343	T	92.8	Very high	90.7	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.012	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	113.3	171.1	-47.7	0	0	0	0	108.7	L304 L306 G335 N336	L304-T343 CarbonylContact O-C 3.57Å; L304-T343 WeakPolarHBondContact O-CA 3.39Å; L306-T343 HydrophobicContact CD1-CG2 3.7Å; G335-T343 VanDerWaalsContact C-OG1 3.29Å; G335-T343 WeakPolarHBondContact CA-OG1 3.49Å; N336-T343 WeakPolarHBondContact OD1-CB 3.32Å; N336-T343 PolarHBondContact OD1-OG1 2.79Å
344	A	91.4	Very high	89	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.008	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	123	167.4	0	0	0	0	0	108.5	L304 T305 L306 Y342 V349 A355	L304-A344 PolarHBondContact O-N 2.9Å; T305-A344 CarbonylContact C-O 3.57Å; T305-A344 VanDerWaalsContact CA-O 3.24Å; T305-A344 WeakPolarHBondContact CA-O 3.26Å; T305-A344 HydrophobicContact CG2-CB 3.99Å; L306-A344 PolarHBondContact N-O 3.33Å; Y342-A344 HydrophobicContact CE1-CB 3.65Å; Y342-A344 WeakPolarHBondContact OH-CB 3.19Å; A344-V349 HydrophobicContact CB-CG1 3.91Å; A344-V349 HydrophobicContact CB-CG2 4.5Å; A344-A355 HydrophobicContact CB-CB 4.46Å
345	S	93.9	Very high	86.7	Confident	10 Å²	10	29.9 Å²	29.9	7%	0.07	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	117.3	-178.6	-173.4	0	0	0	0	110	L306 F328	L306-S345 WeakPolarHBondContact O-CA 3.43Å; F328-S345 WeakPolarHBondContact CA-OG 3.37Å; F328-S345 WeakPolarHBondContact CD1-OG 3.46Å; F328-S345 VanDerWaalsContact O-CB 3.26Å; F328-S345 WeakPolarHBondContact O-CB 3.08Å; F328-S345 PolarHBondContact O-OG 3.4Å
346	G	92.9	Very high	84.7	Confident	5 Å²	5	30 Å²	30	5%	0.052	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.3	160	-178.5	0	0	0	0	0	113.3	L306 G307 L348 V349	L306-G346 PolarHBondContact O-N 3.12Å; G307-G346 WeakPolarHBondContact CA-O 3.27Å; G346-L348 VanDerWaalsContact C-N 3.3Å; G346-L348 PolarHBondContact O-N 3.43Å; G346-V349 WeakPolarHBondContact O-CB 3.39Å; G346-V349 PolarHBondContact O-N 3.26Å; G346-V349 VanDerWaalsContact O-N 3.09Å
347	P	91.6	Very high	83.3	Confident	7 Å²	7	26.7 Å²	26.7	5%	0.045	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-42.7	-174.6	-23.4	31.9	0	0	0	113.3	L80 Q308 P325 F328 R350	L80-P347 HydrophobicContact CD2-CB 3.5Å; L80-P347 VanDerWaalsContact CD2-CB 3.5Å; L80-P347 HydrophobicContact CG-CB 4.27Å; Q308-P347 WeakPolarHBondContact CB-O 3.29Å; Q308-P347 PolarHBondContact N-O 2.95Å; P325-P347 HydrophobicContact CG-CG 4.24Å; F328-P347 HydrophobicContact CD2-CB 4.4Å; F328-P347 HydrophobicContact CD2-CG 3.77Å; F328-P347 HydrophobicContact CE2-CB 4.09Å; F328-P347 HydrophobicContact CE2-CG 3.94Å; P347-R350 PolarHBondContact O-NH1 2.87Å
348	L	89.3	Confident	81.4	Confident	40 Å²	40	25.4 Å²	25.4	21%	0.209	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	0.8	-178.7	-61.7	178.8	0	0	0	113.7	L80 T82 P112 N113 G346 R350	L80-L348 HydrophobicContact CD2-CD2 4.14Å; T82-L348 HydrophobicContact CG2-CD1 3.66Å; T82-L348 HydrophobicContact CG2-CD2 3.9Å; T82-L348 HydrophobicContact CG2-CG 4.46Å; P112-L348 HydrophobicContact CG-CD2 4.45Å; N113-L348 PolarHBondContact ND2-O 3.46Å; G346-L348 VanDerWaalsContact C-N 3.3Å; G346-L348 PolarHBondContact O-N 3.43Å; L348-R350 PolarHBondContact O-N 3.42Å
349	V	89.4	Confident	79.8	Confident	4 Å²	4	26.2 Å²	26.2	2%	0.024	14%	0.138	C	C	.	.			trans	-60.2	139	177.4	171.4	0	0	0	0	110.1	T305 L306 G307 A344 G346 Y353	T305-V349 HydrophobicContact CG2-CG1 4.31Å; L306-V349 WeakPolarHBondContact O-CB 3.32Å; G307-V349 WeakPolarHBondContact CA-O 3.45Å; A344-V349 HydrophobicContact CB-CG1 3.91Å; A344-V349 HydrophobicContact CB-CG2 4.5Å; G346-V349 WeakPolarHBondContact O-CB 3.39Å; G346-V349 PolarHBondContact O-N 3.26Å; G346-V349 VanDerWaalsContact O-N 3.09Å; V349-Y353 HydrophobicContact CG2-CD1 4.27Å
350	R	87.3	Confident	78.5	Confident	48 Å²	48	24.8 Å²	24.8	18%	0.181	12%	0.122	C	C	.	.			trans	-129.9	160.5	173.7	-61.1	-65.8	179.4	-96.5	2.4	108.7	Q308 M310 P347 L348 S352 Y353	Q308-R350 PolarHBondContact O-NH1 3.29Å; M310-R350 VanDerWaalsContact CG-NH2 3.29Å; P347-R350 PolarHBondContact O-NH1 2.87Å; L348-R350 PolarHBondContact O-N 3.42Å; R350-S352 PolarHBondContact O-N 2.97Å; R350-Y353 VanDerWaalsContact O-CB 3.26Å; R350-Y353 WeakPolarHBondContact O-CB 3.25Å; R350-Y353 PolarHBondContact O-N 3.23Å
351	S	82.6	Confident	77.3	Confident	19 Å²	19	28.3 Å²	28.3	13%	0.133	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-37.9	176.5	55.3	0	0	0	0	111.9	K275	K275-S351 WeakPolarHBondContact CE-O 3.42Å; K275-S351 PolarHBondContact NZ-O 3.26Å
352	S	75.8	Confident	76.3	Confident	20 Å²	20	28 Å²	28	14%	0.14	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	15.6	176.6	63.5	0	0	0	0	114.7	T129 R350	T129-S352 WeakPolarHBondContact OG1-CB 3.5Å; T129-S352 PolarHBondContact OG1-OG 3.28Å; R350-S352 PolarHBondContact O-N 2.97Å
353	Y	67.7	Low	75.7	Confident	16 Å²	16	28 Å²	28	6%	0.063	14%	0.141	C	C	.	.			trans	-74.6	138.7	-178.3	-173.2	-119.7	0	0	0	112	N113 E116 V349 R350 A355 G356	N113-Y353 HydrophobicContact CB-CD2 4.3Å; N113-Y353 HydrophobicContact CB-CE2 4.26Å; N113-Y353 VanDerWaalsContact ND2-CD2 3.3Å; N113-Y353 WeakPolarHBondContact ND2-CD2 3.44Å; E116-Y353 WeakPolarHBondContact OE1-CE2 3.44Å; E116-Y353 PolarHBondContact OE1-OH 2.83Å; E116-Y353 PolarHBondContact OE2-OH 2.98Å; V349-Y353 HydrophobicContact CG2-CD1 4.27Å; R350-Y353 VanDerWaalsContact O-CB 3.26Å; R350-Y353 WeakPolarHBondContact O-CB 3.25Å; R350-Y353 PolarHBondContact O-N 3.23Å; Y353-A355 HydrophobicContact CD1-CB 3.71Å; Y353-A355 HydrophobicContact CE1-CB 4.08Å; Y353-A355 PolarHBondContact O-N 3.36Å; Y353-G356 PolarHBondContact O-N 2.95Å
354	K	62.1	Low	74.8	Confident	30 Å²	30	28.3 Å²	28.3	13%	0.13	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-44.2	-30.1	-173.3	-72	177.8	148.4	179.6	0	116.2	E116 C117 G356 E357	E116-K354 PolarHBondContact O-NZ 3.49Å; C117-K354 PolarHBondContact O-NZ 3.37Å; K354-G356 PolarHBondContact O-N 3.32Å; K354-E357 PolarHBondContact O-N 3.43Å
355	A	49.9	Very low	73.9	Confident	21 Å²	21	30.7 Å²	30.7	17%	0.174	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-46.4	-33.6	-179.3	0	0	0	0	0	114.3	L45 Y342 A344 Y353	L45-A355 HydrophobicContact CD1-CB 3.3Å; Y342-A355 VanDerWaalsContact OH-CB 3.26Å; Y342-A355 WeakPolarHBondContact OH-CB 3.5Å; Y342-A355 PolarHBondContact OH-O 3.43Å; A344-A355 HydrophobicContact CB-CB 4.46Å; Y353-A355 HydrophobicContact CD1-CB 3.71Å; Y353-A355 HydrophobicContact CE1-CB 4.08Å; Y353-A355 PolarHBondContact O-N 3.36Å
356	G	55.1	Low	72.8	Confident	2 Å²	2	33.9 Å²	33.9	2%	0.021	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-85.7	-16.3	-177.4	0	0	0	0	0	115.3	Y342 Y353 K354 F359 L360	Y342-G356 WeakPolarHBondContact OH-CA 3.36Å; Y342-G356 PolarHBondContact OH-N 3.22Å; Y353-G356 PolarHBondContact O-N 2.95Å; K354-G356 PolarHBondContact O-N 3.32Å; G356-F359 PolarHBondContact O-N 3.27Å; G356-L360 WeakPolarHBondContact O-CB 3.3Å; G356-L360 WeakPolarHBondContact O-CD1 3.13Å; G356-L360 WeakPolarHBondContact O-CG 3.46Å; G356-L360 PolarHBondContact O-N 2.79Å
357	E	64.4	Low	71.9	Confident	15 Å²	15	36 Å²	36	7%	0.07	18%	0.181	C	C	.	.	H	α-helix	trans	-73.2	-43.6	-162.5	-70	173.8	-150	0	0	113.8	T127 Y174 K354 F359 L360 K361	T127-E357 WeakPolarHBondContact CB-OE1 3.42Å; T127-E357 WeakPolarHBondContact CG2-OE1 3.45Å; T127-E357 PolarHBondContact OG1-OE1 2.79Å; T127-E357 PolarHBondContact OG1-OE2 2.89Å; Y174-E357 HydrophobicContact CD1-CG 3.84Å; Y174-E357 HydrophobicContact CD2-CG 4.35Å; Y174-E357 HydrophobicContact CE1-CG 4.05Å; Y174-E357 HydrophobicContact CG-CB 4.5Å; Y174-E357 HydrophobicContact CG-CG 4Å; K354-E357 PolarHBondContact O-N 3.43Å; E357-F359 VanDerWaalsContact C-N 3.32Å; E357-F359 PolarHBondContact O-N 3.17Å; E357-L360 PolarHBondContact O-N 3.3Å; E357-K361 WeakPolarHBondContact O-CB 3.45Å; E357-K361 PolarHBondContact O-N 3.25Å
358	F	58.1	Low	70.8	Confident	103 Å²	103	40.7 Å²	40.7	45%	0.452	20%	0.201	S	C	.	.	H	α-helix	trans	-63.2	-41.3	175.1	-77.3	-79.8	0	0	0	111.4	F48 N362	F48-F358 HydrophobicContact CZ-CE2 4.27Å; F358-N362 WeakPolarHBondContact O-CB 3.33Å; F358-N362 VanDerWaalsContact O-CG 3.31Å; F358-N362 PolarHBondContact O-N 3.4Å; F358-N362 VanDerWaalsContact O-N 3.07Å; F358-N362 PolarHBondContact O-ND2 3.08Å
359	F	63.8	Low	69.4	Low	58 Å²	58	43.7 Å²	43.7	25%	0.254	22%	0.221	S	C	.	.	H	α-helix	trans	-67.4	-46.6	178	-172.9	-86.6	0	0	0	111.7	H341 Y342 G356 E357 N362 L363	H341-F359 HydrophobicContact CB-CE1 4.35Å; H341-F359 VanDerWaalsContact O-CE1 3.26Å; H341-F359 WeakPolarHBondContact O-CE1 3.47Å; H341-F359 WeakPolarHBondContact O-CZ 3.2Å; Y342-F359 HydrophobicContact CD2-CB 3.96Å; Y342-F359 AromaticContact CD2-CD1 3.79Å; Y342-F359 HydrophobicContact CD2-CD1 3.79Å; Y342-F359 HydrophobicContact CD2-CD2 4.21Å; Y342-F359 HydrophobicContact CD2-CE1 4.4Å; Y342-F359 AromaticContact CD2-CG 3.69Å; Y342-F359 HydrophobicContact CD2-CG 3.69Å; Y342-F359 HydrophobicContact CE2-CB 4.18Å; Y342-F359 HydrophobicContact CE2-CG 4.38Å; Y342-F359 AromaticContact CG-CD1 3.81Å; Y342-F359 HydrophobicContact CG-CD1 3.81Å; Y342-F359 HydrophobicContact CG-CE1 4.3Å; Y342-F359 HydrophobicContact CG-CG 4.19Å; G356-F359 PolarHBondContact O-N 3.27Å; E357-F359 VanDerWaalsContact C-N 3.32Å; E357-F359 PolarHBondContact O-N 3.17Å; F359-N362 PolarHBondContact O-N 3.31Å; F359-L363 HydrophobicContact CD1-CB 4.5Å; F359-L363 HydrophobicContact CE1-CB 4.24Å; F359-L363 HydrophobicContact CE1-CD2 4.04Å; F359-L363 WeakPolarHBondContact O-CB 3.5Å; F359-L363 PolarHBondContact O-N 3.22Å
360	L	69.5	Low	67.7	Low	1 Å²	1	52.1 Å²	52.1	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-64	-41.2	178	-71.6	168.2	0	0	0	110.7	Y174 V233 I273 K275 G356 E357 N362 L363 V364	Y174-L360 HydrophobicContact CE2-CB 4.37Å; Y174-L360 WeakPolarHBondContact OH-CD1 3.46Å; V233-L360 HydrophobicContact CG2-CD1 4.41Å; V233-L360 HydrophobicContact CG2-CD2 4.18Å; I273-L360 HydrophobicContact CD1-CD2 4.24Å; I273-L360 HydrophobicContact CG2-CD2 3.76Å; K275-L360 HydrophobicContact CD-CD1 4.36Å; G356-L360 WeakPolarHBondContact O-CB 3.3Å; G356-L360 WeakPolarHBondContact O-CD1 3.13Å; G356-L360 WeakPolarHBondContact O-CG 3.46Å; G356-L360 PolarHBondContact O-N 2.79Å; E357-L360 PolarHBondContact O-N 3.3Å; L360-N362 VanDerWaalsContact C-N 3.32Å; L360-N362 PolarHBondContact O-N 2.95Å; L360-L363 PolarHBondContact O-N 3.32Å; L360-V364 WeakPolarHBondContact O-CB 3.37Å; L360-V364 WeakPolarHBondContact O-CG2 3.3Å; L360-V364 PolarHBondContact O-N 3.22Å
361	K	69.6	Low	65.9	Low	85 Å²	85	53.2 Å²	53.2	37%	0.37	28%	0.277	S	S	.	.	H	α-helix	trans	-57	-46.4	173.9	-176	169.3	-174.4	178.2	0	111.2	D173 L208 E357 A365	D173-K361 IonicContact OD2-NZ 3.78Å; D173-K361 PolarHBondContact OD2-NZ 3.42Å; L208-K361 HydrophobicContact CD1-CB 3.67Å; L208-K361 HydrophobicContact CD1-CD 4.42Å; L208-K361 HydrophobicContact CD1-CG 3.74Å; E357-K361 WeakPolarHBondContact O-CB 3.45Å; E357-K361 PolarHBondContact O-N 3.25Å; K361-A365 VanDerWaalsContact O-CB 3.28Å; K361-A365 WeakPolarHBondContact O-CB 3.38Å; K361-A365 PolarHBondContact O-N 3.26Å
362	N	69.6	Low	63.7	Low	80 Å²	80	63.7 Å²	63.7	43%	0.428	32%	0.32	S	S	.	.	H	α-helix	trans	-67.2	-37.9	176.3	-73.3	-24.9	0	0	0	113	F358 F359 L360 K366	F358-N362 WeakPolarHBondContact O-CB 3.33Å; F358-N362 VanDerWaalsContact O-CG 3.31Å; F358-N362 PolarHBondContact O-N 3.4Å; F358-N362 VanDerWaalsContact O-N 3.07Å; F358-N362 PolarHBondContact O-ND2 3.08Å; F359-N362 PolarHBondContact O-N 3.31Å; L360-N362 VanDerWaalsContact C-N 3.32Å; L360-N362 PolarHBondContact O-N 2.95Å; N362-K366 WeakPolarHBondContact O-CB 3.32Å; N362-K366 VanDerWaalsContact O-CG 3.24Å; N362-K366 WeakPolarHBondContact O-CG 3.4Å; N362-K366 PolarHBondContact O-N 2.99Å
363	L	73.1	Confident	63.1	Low	21 Å²	21	65.9 Å²	65.9	11%	0.11	33%	0.329	C	S	.	.	H	α-helix	trans	-69.9	-44.8	179	-173.4	63.5	0	0	0	111.6	I273 H341 F359 L360 K366 R367	I273-L363 HydrophobicContact CD1-CB 4.05Å; I273-L363 HydrophobicContact CD1-CD2 3.75Å; I273-L363 HydrophobicContact CD1-CG 3.8Å; I273-L363 HydrophobicContact CG1-CD2 4.07Å; I273-L363 HydrophobicContact CG1-CG 4.37Å; I273-L363 HydrophobicContact CG2-CD2 4.3Å; H341-L363 HydrophobicContact CB-CD2 4.03Å; F359-L363 HydrophobicContact CD1-CB 4.5Å; F359-L363 HydrophobicContact CE1-CB 4.24Å; F359-L363 HydrophobicContact CE1-CD2 4.04Å; F359-L363 WeakPolarHBondContact O-CB 3.5Å; F359-L363 PolarHBondContact O-N 3.22Å; L360-L363 PolarHBondContact O-N 3.32Å; L363-K366 PolarHBondContact O-N 3.24Å; L363-R367 PolarHBondContact O-N 3.14Å
364	V	73.9	Confident	62.8	Low	9 Å²	9	68.5 Å²	68.5	6%	0.055	34%	0.343	C	S	.	.	H	α-helix	trans	-59.5	-48	174.2	174.2	0	0	0	0	109.8	L208 D232 I273 L360 K366 R367 K368	L208-V364 HydrophobicContact CD2-CB 4.29Å; L208-V364 HydrophobicContact CD2-CG1 3.78Å; L208-V364 HydrophobicContact CD2-CG2 4.44Å; D232-V364 HydrophobicContact CB-CG1 4.26Å; D232-V364 HydrophobicContact CB-CG2 4Å; I273-V364 HydrophobicContact CD1-CB 4.34Å; I273-V364 HydrophobicContact CD1-CG2 3.35Å; L360-V364 WeakPolarHBondContact O-CB 3.37Å; L360-V364 WeakPolarHBondContact O-CG2 3.3Å; L360-V364 PolarHBondContact O-N 3.22Å; V364-K366 PolarHBondContact O-N 3.14Å; V364-R367 PolarHBondContact O-N 3.38Å; V364-K368 HydrophobicContact CG1-CD 3.99Å; V364-K368 HydrophobicContact CG1-CG 4.41Å; V364-K368 WeakPolarHBondContact O-CG 3.38Å; V364-K368 PolarHBondContact O-N 3.01Å
365	A	73.4	Confident	62.9	Low	50 Å²	50	70.7 Å²	70.7	41%	0.413	36%	0.355	S	S	.	.	H	α-helix	trans	-58.2	-46.9	177.7	0	0	0	0	0	111.6	K361 R367 K368 T369	K361-A365 VanDerWaalsContact O-CB 3.28Å; K361-A365 WeakPolarHBondContact O-CB 3.38Å; K361-A365 PolarHBondContact O-N 3.26Å; A365-R367 PolarHBondContact O-N 3.41Å; A365-K368 PolarHBondContact O-N 3.29Å; A365-T369 WeakPolarHBondContact O-CG2 3.39Å; A365-T369 PolarHBondContact O-N 3.33Å; A365-T369 PolarHBondContact O-OG1 3.09Å
366	K	70.3	Confident	63.6	Low	77 Å²	77	73.6 Å²	73.6	34%	0.335	37%	0.366	S	S	.	.	H	α-helix	trans	-60.5	-39.7	177.6	-77.4	171.8	-177	175.2	0	113.1	N362 L363 V364 T369 K370	N362-K366 WeakPolarHBondContact O-CB 3.32Å; N362-K366 VanDerWaalsContact O-CG 3.24Å; N362-K366 WeakPolarHBondContact O-CG 3.4Å; N362-K366 PolarHBondContact O-N 2.99Å; L363-K366 PolarHBondContact O-N 3.24Å; V364-K366 PolarHBondContact O-N 3.14Å; K366-T369 WeakPolarHBondContact CA-OG1 3.48Å; K366-T369 PolarHBondContact O-OG1 2.94Å; K366-K370 PolarHBondContact O-N 2.57Å
367	R	73.3	Confident	64.2	Low	50 Å²	50	78.1 Å²	78.1	19%	0.189	39%	0.387	C	S	.	.	H	α-helix	trans	-69.3	-44.4	177.1	-74.5	-168.7	179.4	175.9	1.3	111.4	D271 V272 D302 L363 V364 A365 T369 K370 A371	D271-R367 WeakPolarHBondContact O-CD 3.39Å; D271-R367 PolarHBondContact O-NH1 3.35Å; V272-R367 PolarHBondContact O-NH1 2.99Å; D302-R367 IonicContact OD1-CZ 2.78Å; D302-R367 IonicContact OD1-NH1 3.58Å; D302-R367 IonicContact OD1-NH2 3.97Å; D302-R367 PolarHBondContact OD1-NH2 3.32Å; D302-R367 IonicContact OD2-NH1 3.56Å; D302-R367 IonicContact OD2-NH2 3.4Å; L363-R367 PolarHBondContact O-N 3.14Å; V364-R367 PolarHBondContact O-N 3.38Å; A365-R367 PolarHBondContact O-N 3.41Å; R367-T369 VanDerWaalsContact C-N 3.26Å; R367-T369 PolarHBondContact O-N 2.75Å; R367-K370 PolarHBondContact O-N 3.25Å; R367-A371 PolarHBondContact O-N 3.19Å
368	K	68.4	Low	64.2	Low	105 Å²	105	82.3 Å²	82.3	46%	0.457	41%	0.409	S	S	.	.	H	α-helix	trans	-58.9	-36.8	176	-72.6	-178.8	-178.6	172.4	0	112.4	D232 V364 A365 K370 F372	D232-K368 IonicContact OD1-NZ 2.73Å; D232-K368 PolarHBondContact OD1-NZ 3.24Å; V364-K368 HydrophobicContact CG1-CD 3.99Å; V364-K368 HydrophobicContact CG1-CG 4.41Å; V364-K368 WeakPolarHBondContact O-CG 3.38Å; V364-K368 PolarHBondContact O-N 3.01Å; A365-K368 PolarHBondContact O-N 3.29Å; K368-K370 VanDerWaalsContact C-N 3.34Å; K368-K370 PolarHBondContact O-N 3.38Å; K368-F372 WeakPolarHBondContact O-CD2 3.3Å
369	T	61.3	Low	64.6	Low	103 Å²	103	80.8 Å²	80.8	63%	0.632	41%	0.405	S	S	*	.	H	α-helix	trans	-74.7	-16.1	176.8	53.5	0	0	0	0	115.2	A365 K366 R367	A365-T369 WeakPolarHBondContact O-CG2 3.39Å; A365-T369 PolarHBondContact O-N 3.33Å; A365-T369 PolarHBondContact O-OG1 3.09Å; K366-T369 WeakPolarHBondContact CA-OG1 3.48Å; K366-T369 PolarHBondContact O-OG1 2.94Å; R367-T369 VanDerWaalsContact C-N 3.26Å; R367-T369 PolarHBondContact O-N 2.75Å
370	K	53.7	Low	64.7	Low	181 Å²	181	82.5 Å²	82.5	79%	0.787	42%	0.417	S	S	*	.	H	α-helix	trans	-90.2	-13.5	177.1	-79.4	-175	175.6	-173.4	0	113.3	K366 R367 K368	K366-K370 PolarHBondContact O-N 2.57Å; R367-K370 PolarHBondContact O-N 3.25Å; K368-K370 VanDerWaalsContact C-N 3.34Å; K368-K370 PolarHBondContact O-N 3.38Å
371	A	49.5	Very low	64.2	Low	72 Å²	72	89.3 Å²	89.3	60%	0.595	45%	0.451	S	S	*	.			trans	-87.6	-7.1	-179.6	0	0	0	0	0	113.3	R367	R367-A371 PolarHBondContact O-N 3.19Å
372	F	35.1	Very low	63.8	Low	239 Å²	239	89.7 Å²	89.7	100%	1.048	46%	0.459	S	S	*	.			trans	-108.9	0	166.8	-67.2	-83.7	0	0	0	108.5	K368	K368-F372 WeakPolarHBondContact O-CD2 3.3Å

Retrieved 372 of 372 residues in 258.6 ms (Link to these results)

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