A0A087XSS8_POEFO Loading...

RAP1 GTPase activating protein 2a

GTPase activator for the nuclear Ras-related regulatory protein RAP-1A (KREV-1), converting it to the putatively inactive GDP-bound state.

AlphaFold DB , UniProt , Accession A0A087XSS8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 613 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	33.9	Very low	27.9	Very low	246 Å²	246	182.5 Å²	182.5	100%	1.212	88%	0.876	S	S	*	*				0	149.2	0	-72.5	177.6	172.1	0	0	109.2
2	L	30.1	Very low	27.5	Very low	161 Å²	161	173.5 Å²	173.5	84%	0.843	87%	0.866	S	S	*	*			trans	-81.7	149.6	175.7	-74	73.5	0	0	0	111.3
3	R	27.9	Very low	27.8	Very low	260 Å²	260	175.2 Å²	175.2	98%	0.981	87%	0.866	S	S	*	*			trans	-147.1	111.8	134.1	-117.2	177.7	-172.3	-162.2	2.3	111.7
4	R	29	Very low	27.6	Very low	238 Å²	238	167.1 Å²	167.1	90%	0.898	85%	0.85	S	S	*	*			trans	-117.6	108.1	-178.7	-172.7	-171.7	-166	-170.4	7.3	108.9
5	R	28.4	Very low	27.7	Very low	240 Å²	240	172.3 Å²	172.3	91%	0.906	86%	0.855	S	S	*	*			trans	-159.2	146	168.4	-83.1	-166.5	179.9	-165.3	0.5	108.9
6	R	27.3	Very low	28.2	Very low	230 Å²	230	166.6 Å²	166.6	87%	0.868	83%	0.828	S	S	*	*			cis	-160.7	163.9	-32.8	-132.3	-177.6	-169.9	-173.3	2.4	106.4
7	S	26.5	Very low	29	Very low	109 Å²	109	162.5 Å²	162.5	76%	0.762	81%	0.81	S	S	*	*			trans	-62.6	148.5	178.9	45.3	0	0	0	0	113.4
8	A	24.5	Very low	29.8	Very low	106 Å²	106	162.9 Å²	162.9	88%	0.876	81%	0.806	S	S	*	*			trans	-139.2	86.4	164.3	0	0	0	0	0	109.8
9	T	27.9	Very low	30.4	Very low	128 Å²	128	157.5 Å²	157.5	79%	0.785	79%	0.786	S	S	*	*			trans	-88.7	121.6	162.3	40.1	0	0	0	0	108.9
10	F	24.1	Very low	31.2	Very low	201 Å²	201	151.7 Å²	151.7	88%	0.882	76%	0.759	S	S	*	*			trans	-153.4	159.2	150.8	-138.9	-99	0	0	0	112
11	S	27.7	Very low	32	Very low	89 Å²	89	147.5 Å²	147.5	62%	0.622	74%	0.739	S	S	*	*			trans	-73.9	134.1	-173.3	53.8	0	0	0	0	113.4
12	G	22.3	Very low	32.8	Very low	74 Å²	74	139.7 Å²	139.7	76%	0.763	71%	0.708	S	S	*	*			trans	-119	109.2	161.1	0	0	0	0	0	110.5	G14	G12-G14 PolarHBondContact O-N 2.8Å
13	F	31.4	Very low	33.9	Very low	195 Å²	195	134.6 Å²	134.6	86%	0.855	69%	0.689	S	S	*	*			trans	-74.4	79.7	166	-90.6	-89.1	0	0	0	108.9	W15	F13-W15 PolarHBondContact O-N 2.76Å; F13-W15 VanDerWaalsContact O-N 3.1Å
14	G	25	Very low	35	Very low	63 Å²	63	122.9 Å²	122.9	65%	0.649	65%	0.646	S	S	*	*			trans	-65.1	106.9	173.2	0	0	0	0	0	110.4	G12 I16	G12-G14 PolarHBondContact O-N 2.8Å; G14-I16 PolarHBondContact O-N 2.99Å
15	W	30.2	Very low	36.1	Very low	245 Å²	245	115.7 Å²	115.7	93%	0.928	62%	0.621	S	S	*	*			trans	-68.5	97.1	167.2	-81.2	50.1	0	0	0	108.3	F13	F13-W15 PolarHBondContact O-N 2.76Å; F13-W15 VanDerWaalsContact O-N 3.1Å
16	I	35.4	Very low	37.1	Very low	80 Å²	80	105.6 Å²	105.6	41%	0.41	59%	0.592	S	S	.	*			trans	-73.4	138.3	172.6	-66.4	169.7	0	0	0	108.5	G14	G14-I16 PolarHBondContact O-N 2.99Å
17	D	40.8	Very low	38.5	Very low	98 Å²	98	100 Å²	100	52%	0.524	57%	0.571	S	S	.	*			trans	-59.1	137.3	-175.6	-169.3	-2.8	0	0	0	111.9	S19	D17-S19 PolarHBondContact O-N 3.33Å; D17-S19 PolarHBondContact OD1-N 3.39Å; D17-S19 VanDerWaalsContact OD2-CB 3.31Å; D17-S19 WeakPolarHBondContact OD2-CB 3.12Å; D17-S19 PolarHBondContact OD2-OG 3.25Å
18	K	43.9	Very low	39.5	Very low	169 Å²	169	99 Å²	99	74%	0.735	55%	0.553	S	S	*	*	H	α-helix	trans	-64.8	-26.4	172.4	-67	-178.9	179.9	178	0	111.2	T20 L21 S22	K18-T20 PolarHBondContact O-N 2.95Å; K18-L21 PolarHBondContact O-N 3.06Å; K18-S22 WeakPolarHBondContact O-CB 3.01Å; K18-S22 PolarHBondContact O-N 3.14Å
19	S	40.9	Very low	40.4	Very low	61 Å²	61	100 Å²	100	43%	0.427	54%	0.539	S	S	.	.	H	α-helix	trans	-56.7	-49	178.9	74.8	0	0	0	0	112.3	D17 L21 S22 A23	D17-S19 PolarHBondContact O-N 3.33Å; D17-S19 PolarHBondContact OD1-N 3.39Å; D17-S19 VanDerWaalsContact OD2-CB 3.31Å; D17-S19 WeakPolarHBondContact OD2-CB 3.12Å; D17-S19 PolarHBondContact OD2-OG 3.25Å; S19-L21 PolarHBondContact O-N 3.25Å; S19-S22 CarbonylContact O-C 3.59Å; S19-S22 PolarHBondContact O-N 3.08Å; S19-S22 VanDerWaalsContact O-N 3.17Å; S19-A23 WeakPolarHBondContact O-CB 3.31Å; S19-A23 PolarHBondContact O-N 3.08Å
20	T	47.2	Very low	40.9	Very low	40 Å²	40	100.3 Å²	100.3	25%	0.245	53%	0.532	C	S	.	.	H	α-helix	trans	-64.2	-41.8	-177.3	-44.8	0	0	0	0	112.4	K18 A23 L24	K18-T20 PolarHBondContact O-N 2.95Å; T20-A23 PolarHBondContact O-N 2.95Å; T20-L24 WeakPolarHBondContact O-CG 3.44Å; T20-L24 PolarHBondContact O-N 3.14Å
21	L	47.5	Very low	41.5	Very low	65 Å²	65	97.9 Å²	97.9	34%	0.34	53%	0.527	S	S	.	.	H	α-helix	trans	-70.1	-35.4	174.9	-76.9	170.5	0	0	0	112	K18 S19 K25	K18-L21 PolarHBondContact O-N 3.06Å; S19-L21 PolarHBondContact O-N 3.25Å; L21-K25 PolarHBondContact O-N 3.35Å
22	S	51.5	Low	41.9	Very low	82 Å²	82	99.7 Å²	99.7	57%	0.573	53%	0.529	S	S	*	.	H	α-helix	trans	-69.2	-34.2	174.8	-164.1	0	0	0	0	112.2	K18 S19 G26	K18-S22 WeakPolarHBondContact O-CB 3.01Å; K18-S22 PolarHBondContact O-N 3.14Å; S19-S22 CarbonylContact O-C 3.59Å; S19-S22 PolarHBondContact O-N 3.08Å; S19-S22 VanDerWaalsContact O-N 3.17Å; S22-G26 WeakPolarHBondContact O-CA 3.29Å; S22-G26 PolarHBondContact O-N 3.04Å
23	A	53.3	Low	42.3	Very low	53 Å²	53	101.6 Å²	101.6	44%	0.438	52%	0.522	S	S	.	.	H	α-helix	trans	-70	-41.2	174.9	0	0	0	0	0	111.7	S19 T20 G26 R27	S19-A23 WeakPolarHBondContact O-CB 3.31Å; S19-A23 PolarHBondContact O-N 3.08Å; T20-A23 PolarHBondContact O-N 2.95Å; A23-G26 PolarHBondContact O-N 3.04Å; A23-R27 WeakPolarHBondContact O-CB 3.5Å; A23-R27 WeakPolarHBondContact O-CG 3.36Å; A23-R27 PolarHBondContact O-N 3.46Å
24	L	50.2	Low	42.4	Very low	14 Å²	14	99.9 Å²	99.9	7%	0.073	52%	0.52	C	S	.	.	H	α-helix	trans	-64.5	-42	173.6	-78.4	165.7	0	0	0	112.3	T20 K28 I197 I202 P206 L214	T20-L24 WeakPolarHBondContact O-CG 3.44Å; T20-L24 PolarHBondContact O-N 3.14Å; L24-K28 WeakPolarHBondContact O-CB 3.48Å; L24-K28 PolarHBondContact O-N 3.1Å; L24-I197 HydrophobicContact CD2-CG2 3.69Å; L24-I202 HydrophobicContact CD2-CD1 3.94Å; L24-I202 HydrophobicContact CG-CD1 4.43Å; L24-P206 HydrophobicContact CD1-CG 4.38Å; L24-L214 HydrophobicContact CB-CD1 4.33Å; L24-L214 HydrophobicContact CB-CD2 4Å; L24-L214 HydrophobicContact CD1-CD2 4.4Å; L24-L214 HydrophobicContact CD2-CD2 4.25Å; L24-L214 HydrophobicContact CG-CD2 4.46Å
25	K	52.9	Low	42.7	Very low	87 Å²	87	101.7 Å²	101.7	38%	0.378	52%	0.523	S	S	.	.	H	α-helix	trans	-69.8	-38.1	173.3	-73.2	-152.5	176.7	-154.2	0	112.9	L21 K28 Q29 L214 D217	L21-K25 PolarHBondContact O-N 3.35Å; K25-K28 WeakPolarHBondContact O-CB 3.39Å; K25-K28 PolarHBondContact O-N 3.22Å; K25-Q29 WeakPolarHBondContact O-CB 3.43Å; K25-Q29 PolarHBondContact O-N 2.79Å; K25-L214 HydrophobicContact CG-CD1 3.81Å; K25-D217 IonicContact NZ-OD1 2.66Å; K25-D217 PolarHBondContact NZ-OD1 3.35Å; K25-D217 IonicContact NZ-OD2 3.1Å; K25-D217 PolarHBondContact NZ-OD2 2.96Å
26	G	49.7	Very low	42.6	Very low	29 Å²	29	98 Å²	98	30%	0.299	52%	0.522	S	S	.	.	H	α-helix	trans	-59.2	-52.1	175.4	0	0	0	0	0	111.9	S22 A23 K28 Q29 E30	S22-G26 WeakPolarHBondContact O-CA 3.29Å; S22-G26 PolarHBondContact O-N 3.04Å; A23-G26 PolarHBondContact O-N 3.04Å; G26-K28 VanDerWaalsContact C-N 3.32Å; G26-K28 PolarHBondContact O-N 2.7Å; G26-Q29 CarbonylContact O-C 3.52Å; G26-Q29 WeakPolarHBondContact O-CA 3.33Å; G26-Q29 WeakPolarHBondContact O-CB 3.49Å; G26-Q29 PolarHBondContact O-N 2.91Å; G26-E30 PolarHBondContact O-N 2.85Å
27	R	55.7	Low	42.5	Very low	112 Å²	112	100.1 Å²	100.1	42%	0.423	54%	0.538	S	S	.	.	H	α-helix	trans	-61.3	-36.7	176.8	-72.4	176.6	175.8	178.8	-1	113.2	A23 Q29 E30 L31 A200	A23-R27 WeakPolarHBondContact O-CB 3.5Å; A23-R27 WeakPolarHBondContact O-CG 3.36Å; A23-R27 PolarHBondContact O-N 3.46Å; R27-Q29 PolarHBondContact O-N 3.25Å; R27-E30 WeakPolarHBondContact CA-OE2 3.17Å; R27-E30 PolarHBondContact O-N 3.13Å; R27-L31 WeakPolarHBondContact O-CG 3.16Å; R27-L31 PolarHBondContact O-N 3.03Å; R27-L31 VanDerWaalsContact O-N 3.1Å; R27-A200 PolarHBondContact NH1-O 2.93Å; R27-A200 PolarHBondContact NH2-O 3.05Å; R27-A200 VanDerWaalsContact NH2-O 3.13Å
28	K	46.8	Very low	42.1	Very low	89 Å²	89	100.9 Å²	100.9	39%	0.387	55%	0.548	S	S	.	.	H	α-helix	trans	-61.7	-32.4	171.4	-173.5	-179.5	-175.9	-177.1	0	112	L24 K25 G26 L32 L214	L24-K28 WeakPolarHBondContact O-CB 3.48Å; L24-K28 PolarHBondContact O-N 3.1Å; K25-K28 WeakPolarHBondContact O-CB 3.39Å; K25-K28 PolarHBondContact O-N 3.22Å; G26-K28 VanDerWaalsContact C-N 3.32Å; G26-K28 PolarHBondContact O-N 2.7Å; K28-L32 WeakPolarHBondContact O-CD1 3.45Å; K28-L32 WeakPolarHBondContact O-CG 3.44Å; K28-L214 HydrophobicContact CD-CD1 4.48Å; K28-L214 PolarHBondContact NZ-O 3.06Å
29	Q	44.8	Very low	41.7	Very low	126 Å²	126	102 Å²	102	59%	0.589	56%	0.561	S	S	*	*	H	α-helix	trans	-86.2	-29.5	-179.7	-161.6	161.3	5.2	0	0	112.9	K25 G26 R27 L32 N33	K25-Q29 WeakPolarHBondContact O-CB 3.43Å; K25-Q29 PolarHBondContact O-N 2.79Å; G26-Q29 CarbonylContact O-C 3.52Å; G26-Q29 WeakPolarHBondContact O-CA 3.33Å; G26-Q29 WeakPolarHBondContact O-CB 3.49Å; G26-Q29 PolarHBondContact O-N 2.91Å; R27-Q29 PolarHBondContact O-N 3.25Å; Q29-L32 PolarHBondContact O-N 3.03Å; Q29-N33 PolarHBondContact O-N 2.85Å
30	E	37.2	Very low	41.5	Very low	135 Å²	135	101.9 Å²	101.9	63%	0.631	57%	0.57	S	S	*	*	H	α-helix	trans	-62.9	-44.4	167.8	-70.1	174.4	129.9	0	0	111.2	G26 R27 L32 N33	G26-E30 PolarHBondContact O-N 2.85Å; R27-E30 WeakPolarHBondContact CA-OE2 3.17Å; R27-E30 PolarHBondContact O-N 3.13Å; E30-L32 PolarHBondContact O-N 2.95Å; E30-N33 PolarHBondContact O-N 3.07Å; E30-N33 VanDerWaalsContact O-N 3.13Å
31	L	38.1	Very low	41	Very low	149 Å²	149	109.5 Å²	109.5	78%	0.78	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-14.7	176.8	-74.7	168.3	0	0	0	114.7	R27	R27-L31 WeakPolarHBondContact O-CG 3.16Å; R27-L31 PolarHBondContact O-N 3.03Å; R27-L31 VanDerWaalsContact O-N 3.1Å
32	L	35	Very low	40.2	Very low	128 Å²	128	112.2 Å²	112.2	67%	0.67	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-10.1	175.9	-70.2	169.3	0	0	0	113.1	K28 Q29 E30	K28-L32 WeakPolarHBondContact O-CD1 3.45Å; K28-L32 WeakPolarHBondContact O-CG 3.44Å; Q29-L32 PolarHBondContact O-N 3.03Å; E30-L32 PolarHBondContact O-N 2.95Å
33	N	31.5	Very low	39.3	Very low	114 Å²	114	113.6 Å²	113.6	61%	0.61	63%	0.633	S	S	*	*			trans	-107.2	59.7	-171.2	-80.1	-5.1	0	0	0	112.8	Q29 E30	Q29-N33 PolarHBondContact O-N 2.85Å; E30-N33 PolarHBondContact O-N 3.07Å; E30-N33 VanDerWaalsContact O-N 3.13Å
34	I	33.7	Very low	38.3	Very low	158 Å²	158	117.4 Å²	117.4	81%	0.81	65%	0.653	S	S	*	*			trans	-123.7	61.9	168	-45.7	-175.9	0	0	0	111.3
35	S	30	Very low	37.4	Very low	102 Å²	102	121.9 Å²	121.9	71%	0.713	69%	0.686	S	S	*	*			trans	-162.4	76.2	156.2	51	0	0	0	0	111.8	V37	S35-V37 PolarHBondContact O-N 3.48Å; S35-V37 VanDerWaalsContact O-N 3.07Å
36	N	29.6	Very low	36.5	Very low	168 Å²	168	123.1 Å²	123.1	90%	0.898	70%	0.702	S	S	*	*			trans	-75.7	92.8	168	-82.3	-34	0	0	0	110.1
37	V	32.9	Very low	35.7	Very low	124 Å²	124	128.1 Å²	128.1	75%	0.752	73%	0.729	S	S	*	*			trans	-98.4	131.7	165.6	-176.6	0	0	0	0	108.4	S35	S35-V37 PolarHBondContact O-N 3.48Å; S35-V37 VanDerWaalsContact O-N 3.07Å
38	P	32	Very low	34.8	Very low	114 Å²	114	133.9 Å²	133.9	74%	0.74	75%	0.751	S	S	*	*			trans	-61.2	148.1	179.5	-24.5	35.1	0	0	0	113.5	G40	P38-G40 PolarHBondContact O-N 3.43Å
39	L	35.8	Very low	34.5	Very low	191 Å²	191	136.1 Å²	136.1	100%	1	77%	0.772	S	S	*	*	S	Bend	trans	-74.2	89.1	175.2	-81.4	163.7	0	0	0	111.4
40	G	36.5	Very low	33.9	Very low	60 Å²	60	133.5 Å²	133.5	62%	0.619	77%	0.772	S	S	*	*			trans	-164.5	141.4	169.2	0	0	0	0	0	110	P38	P38-G40 PolarHBondContact O-N 3.43Å
41	E	35.9	Very low	33.8	Very low	200 Å²	200	130.8 Å²	130.8	94%	0.935	77%	0.767	S	S	*	*			trans	62.8	75.6	175.7	-57.1	-174.7	178.9	0	0	116.3
42	C	31.5	Very low	33.9	Very low	121 Å²	121	130.5 Å²	130.5	82%	0.818	77%	0.773	S	S	*	*			trans	-108.2	140.5	149	-72.4	0	0	0	0	109.3
43	P	32.5	Very low	34.5	Very low	112 Å²	112	129.3 Å²	129.3	73%	0.727	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-66.1	156.9	169	29.4	-34.5	0	0	0	111.2	S45	P43-S45 PolarHBondContact O-N 2.88Å
44	P	33.2	Very low	35	Very low	132 Å²	132	128.1 Å²	128.1	86%	0.857	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-64.1	127.3	-177.7	26.4	-34.4	0	0	0	111.5
45	S	31.3	Very low	35.7	Very low	109 Å²	109	128 Å²	128	76%	0.762	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-72	145.5	175	-49	0	0	0	0	111.4	P43	P43-S45 PolarHBondContact O-N 2.88Å
46	P	32.8	Very low	36.5	Very low	112 Å²	112	127.7 Å²	127.7	73%	0.727	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-62.7	149.4	173	26.9	-34.4	0	0	0	111.3	R48	P46-R48 PolarHBondContact O-N 2.89Å
47	P	34	Very low	37.4	Very low	134 Å²	134	122.4 Å²	122.4	87%	0.87	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-67.1	126.8	-171.2	26.1	-34.4	0	0	0	112.3
48	R	36.6	Very low	38.1	Very low	234 Å²	234	119.9 Å²	119.9	88%	0.883	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-78.6	129.9	177.1	-77	-176.4	163.4	-150	-4.4	112.1	P46	P46-R48 PolarHBondContact O-N 2.89Å
49	T	40	Very low	38.8	Very low	135 Å²	135	119.9 Å²	119.9	83%	0.828	71%	0.71	S	S	*	*			trans	55.7	114.7	158.1	49.1	0	0	0	0	118
50	A	31.8	Very low	39.3	Very low	71 Å²	71	117 Å²	117	59%	0.587	69%	0.69	S	S	*	*			trans	-63.2	148.2	165.3	0	0	0	0	0	112.1	M54	A50-M54 HydrophobicContact CB-SD 4.39Å
51	P	35.5	Very low	40	Very low	79 Å²	79	118.2 Å²	118.2	51%	0.513	68%	0.682	S	S	.	*			trans	-72.6	149	179.9	29.8	-35	0	0	0	112.3	S53 M54	P51-S53 PolarHBondContact O-N 3.39Å; P51-M54 HydrophobicContact CG-CG 4.25Å; P51-M54 HydrophobicContact CG-SD 4.34Å
52	P	39.7	Very low	40.8	Very low	142 Å²	142	112.2 Å²	112.2	92%	0.922	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	38.7	-167.1	34.3	-39.1	0	0	0	114.7
53	S	48.4	Very low	41.7	Very low	103 Å²	103	110.1 Å²	110.1	72%	0.72	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.6	16	-177.5	71.4	0	0	0	0	116	P51	P51-S53 PolarHBondContact O-N 3.39Å
54	M	42.5	Very low	42.5	Very low	89 Å²	89	111 Å²	111	44%	0.438	63%	0.629	S	S	.	*			trans	-72.4	143.1	174.1	-64.8	-175.6	70.5	0	0	110.8	A50 P51 D58	A50-M54 HydrophobicContact CB-SD 4.39Å; P51-M54 HydrophobicContact CG-CG 4.25Å; P51-M54 HydrophobicContact CG-SD 4.34Å; M54-D58 HydrophobicContact CB-CB 4.39Å; M54-D58 HydrophobicContact CE-CB 3.65Å
55	K	48.2	Very low	43.1	Very low	157 Å²	157	111.5 Å²	111.5	68%	0.683	62%	0.618	S	S	*	*			trans	-85	161	175.9	-65.4	169.6	-177.2	167.5	0	109.4	A57 D58 F59	K55-A57 PolarHBondContact O-N 3.49Å; K55-A57 VanDerWaalsContact O-N 3.17Å; K55-D58 WeakPolarHBondContact CB-OD2 3.45Å; K55-D58 PolarHBondContact N-OD2 2.91Å; K55-D58 PolarHBondContact O-N 3.37Å; K55-F59 PolarHBondContact O-N 2.89Å
56	S	47	Very low	43.8	Very low	94 Å²	94	111.5 Å²	111.5	66%	0.657	61%	0.607	S	S	*	*	H	α-helix	trans	-57.9	-32.1	-177.3	51.4	0	0	0	0	113.9	F59 F60	S56-F59 PolarHBondContact O-N 3.11Å; S56-F60 WeakPolarHBondContact O-CD2 3.34Å; S56-F60 PolarHBondContact O-N 3.09Å
57	A	47.8	Very low	44.4	Very low	58 Å²	58	112.7 Å²	112.7	48%	0.479	60%	0.603	S	S	.	*	H	α-helix	trans	-63.4	-47.2	174.3	0	0	0	0	0	112.1	K55 F59 F60 D61	K55-A57 PolarHBondContact O-N 3.49Å; K55-A57 VanDerWaalsContact O-N 3.17Å; A57-F59 PolarHBondContact O-N 3.35Å; A57-F59 VanDerWaalsContact O-N 3.14Å; A57-F60 PolarHBondContact O-N 2.73Å; A57-D61 PolarHBondContact O-N 2.69Å
58	D	47.3	Very low	44.6	Very low	71 Å²	71	113.7 Å²	113.7	38%	0.38	60%	0.601	S	S	.	*	H	α-helix	trans	-61.5	-25.8	-178.8	-41	-41.3	0	0	0	112.3	M54 K55 M62	M54-D58 HydrophobicContact CB-CB 4.39Å; M54-D58 HydrophobicContact CE-CB 3.65Å; K55-D58 WeakPolarHBondContact CB-OD2 3.45Å; K55-D58 PolarHBondContact N-OD2 2.91Å; K55-D58 PolarHBondContact O-N 3.37Å; D58-M62 WeakPolarHBondContact O-CB 3.43Å; D58-M62 PolarHBondContact O-N 3.18Å
59	F	46	Very low	45	Very low	113 Å²	113	109.7 Å²	109.7	50%	0.496	60%	0.597	S	S	.	*	H	α-helix	trans	-75.7	-36.7	174.1	179	-101.4	0	0	0	112.8	K55 S56 A57 M62 L63	K55-F59 PolarHBondContact O-N 2.89Å; S56-F59 PolarHBondContact O-N 3.11Å; A57-F59 PolarHBondContact O-N 3.35Å; A57-F59 VanDerWaalsContact O-N 3.14Å; F59-M62 PolarHBondContact O-N 3.41Å; F59-L63 HydrophobicContact CD1-CD1 3.96Å; F59-L63 HydrophobicContact CE1-CD1 3.46Å; F59-L63 VanDerWaalsContact CE1-CD1 3.46Å; F59-L63 HydrophobicContact CZ-CD1 3.85Å; F59-L63 PolarHBondContact O-N 3.39Å
60	F	47.9	Very low	45.4	Very low	132 Å²	132	108.3 Å²	108.3	58%	0.579	58%	0.577	S	S	*	*	H	α-helix	trans	-71.7	-41.9	173.6	-74.7	-69.1	0	0	0	111.7	S56 A57 M62 L63 E64	S56-F60 WeakPolarHBondContact O-CD2 3.34Å; S56-F60 PolarHBondContact O-N 3.09Å; A57-F60 PolarHBondContact O-N 2.73Å; F60-M62 PolarHBondContact O-N 3.05Å; F60-L63 WeakPolarHBondContact O-CB 3.41Å; F60-L63 PolarHBondContact O-N 3.47Å; F60-E64 PolarHBondContact O-N 3.27Å
61	D	49.3	Very low	46.5	Very low	85 Å²	85	112.2 Å²	112.2	46%	0.455	59%	0.587	S	S	.	*	H	α-helix	trans	-56.4	-34.9	171.3	-103.5	64.5	0	0	0	112.7	A57 K65	A57-D61 PolarHBondContact O-N 2.69Å; D61-K65 WeakPolarHBondContact O-CB 3.43Å; D61-K65 WeakPolarHBondContact O-CD 3.45Å; D61-K65 WeakPolarHBondContact O-CG 3.43Å; D61-K65 PolarHBondContact O-N 2.89Å; D61-K65 IonicContact OD2-NZ 3.55Å
62	M	53.1	Low	47.9	Very low	73 Å²	73	111.8 Å²	111.8	36%	0.36	58%	0.584	S	S	.	*	H	α-helix	trans	-76.2	-35.3	175.8	-166.2	-171.7	80.9	0	0	112	D58 F59 F60 K65 M66	D58-M62 WeakPolarHBondContact O-CB 3.43Å; D58-M62 PolarHBondContact O-N 3.18Å; F59-M62 PolarHBondContact O-N 3.41Å; F60-M62 PolarHBondContact O-N 3.05Å; M62-K65 PolarHBondContact O-N 3.06Å; M62-M66 HydrophobicContact CE-CE 4.37Å; M62-M66 WeakPolarHBondContact O-CG 3.48Å; M62-M66 PolarHBondContact O-N 3.02Å
63	L	50.8	Low	49.4	Very low	77 Å²	77	109.8 Å²	109.8	40%	0.403	56%	0.559	S	S	.	*	H	α-helix	trans	-65.8	-47.4	174.5	-99.1	161.5	0	0	0	111.8	F59 F60 K65 M66 Q67	F59-L63 HydrophobicContact CD1-CD1 3.96Å; F59-L63 HydrophobicContact CE1-CD1 3.46Å; F59-L63 VanDerWaalsContact CE1-CD1 3.46Å; F59-L63 HydrophobicContact CZ-CD1 3.85Å; F59-L63 PolarHBondContact O-N 3.39Å; F60-L63 WeakPolarHBondContact O-CB 3.41Å; F60-L63 PolarHBondContact O-N 3.47Å; L63-K65 VanDerWaalsContact C-N 3.29Å; L63-K65 PolarHBondContact O-N 3.22Å; L63-M66 PolarHBondContact O-N 2.98Å; L63-Q67 PolarHBondContact O-N 3.03Å
64	E	50	Low	50.7	Low	131 Å²	131	107.5 Å²	107.5	61%	0.612	54%	0.541	S	S	*	.	H	α-helix	trans	-59	-40.8	174.2	-71.3	-173.2	159.7	0	0	111.1	F60 M66 Q67	F60-E64 PolarHBondContact O-N 3.27Å; E64-M66 VanDerWaalsContact C-N 3.34Å; E64-M66 PolarHBondContact O-N 3.17Å; E64-Q67 WeakPolarHBondContact O-CB 3.41Å; E64-Q67 PolarHBondContact O-N 3.14Å
65	K	45.2	Very low	52.6	Low	142 Å²	142	109.6 Å²	109.6	62%	0.617	55%	0.545	S	S	*	.	H	α-helix	trans	-71.5	-20.1	177.5	-76.9	170.5	-175	146.4	0	115.4	D61 M62 L63	D61-K65 WeakPolarHBondContact O-CB 3.43Å; D61-K65 WeakPolarHBondContact O-CD 3.45Å; D61-K65 WeakPolarHBondContact O-CG 3.43Å; D61-K65 PolarHBondContact O-N 2.89Å; D61-K65 IonicContact OD2-NZ 3.55Å; M62-K65 PolarHBondContact O-N 3.06Å; L63-K65 VanDerWaalsContact C-N 3.29Å; L63-K65 PolarHBondContact O-N 3.22Å
66	M	46.3	Very low	54.3	Low	110 Å²	110	102.9 Å²	102.9	54%	0.542	52%	0.516	S	S	.	.	H	α-helix	trans	-92.1	-4.3	168.3	-64.5	-159.5	-47.9	0	0	112.4	M62 L63 E64 Y70	M62-M66 HydrophobicContact CE-CE 4.37Å; M62-M66 WeakPolarHBondContact O-CG 3.48Å; M62-M66 PolarHBondContact O-N 3.02Å; L63-M66 PolarHBondContact O-N 2.98Å; E64-M66 VanDerWaalsContact C-N 3.34Å; E64-M66 PolarHBondContact O-N 3.17Å; M66-Y70 WeakPolarHBondContact O-CB 3.38Å; M66-Y70 PolarHBondContact O-N 2.67Å; M66-Y70 VanDerWaalsContact O-N 3.14Å
67	Q	44.6	Very low	56.1	Low	136 Å²	136	101.8 Å²	101.8	64%	0.636	50%	0.5	S	S	*	.	H	α-helix	trans	-77.1	-25.2	179.9	-157.2	163.6	25.3	0	0	112.5	L63 E64	L63-Q67 PolarHBondContact O-N 3.03Å; E64-Q67 WeakPolarHBondContact O-CB 3.41Å; E64-Q67 PolarHBondContact O-N 3.14Å
68	D	39.1	Very low	57.9	Low	155 Å²	155	101.8 Å²	101.8	83%	0.829	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-30.2	172.6	-77.9	-29.1	0	0	0	112.9
69	D	44.4	Very low	59.7	Low	150 Å²	150	99.1 Å²	99.1	80%	0.802	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-13.8	177.5	-78.6	-35	0	0	0	113.2	I71	D69-I71 PolarHBondContact O-N 2.71Å
70	Y	48.4	Very low	61.5	Low	106 Å²	106	95.7 Å²	95.7	42%	0.416	47%	0.465	S	S	.	.			trans	-88.1	98.5	-178.7	-169	-98.6	0	0	0	111.7	M66 P72 Q93	M66-Y70 WeakPolarHBondContact O-CB 3.38Å; M66-Y70 PolarHBondContact O-N 2.67Å; M66-Y70 VanDerWaalsContact O-N 3.14Å; Y70-P72 HydrophobicContact CD1-CB 4.38Å; Y70-P72 HydrophobicContact CE1-CB 4.07Å; Y70-P72 WeakPolarHBondContact O-CD 3.15Å; Y70-Q93 PolarHBondContact OH-O 2.97Å; Y70-Q93 VanDerWaalsContact OH-O 3.09Å
71	I	55.4	Low	63.4	Low	153 Å²	153	97.5 Å²	97.5	79%	0.785	48%	0.475	S	S	*	.			trans	-78.9	107.8	168	-56	176.1	0	0	0	108.2	D69	D69-I71 PolarHBondContact O-N 2.71Å
72	P	64.1	Low	65.1	Low	70 Å²	70	100.8 Å²	100.8	46%	0.455	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-69.2	148.3	177	30.9	-35.8	0	0	0	110.4	Y70	Y70-P72 HydrophobicContact CD1-CB 4.38Å; Y70-P72 HydrophobicContact CE1-CB 4.07Å; Y70-P72 WeakPolarHBondContact O-CD 3.15Å
73	Y	71.6	Confident	66.4	Low	101 Å²	101	99 Å²	99	40%	0.396	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-59.5	141.4	171.4	-69.5	-77.3	0	0	0	110.7	L91 P92 Q93	Y73-L91 WeakPolarHBondContact CB-O 3.31Å; Y73-L91 HydrophobicContact CD1-CB 4.05Å; Y73-L91 HydrophobicContact CD2-CB 3.77Å; Y73-L91 HydrophobicContact CE1-CB 3.99Å; Y73-L91 HydrophobicContact CE1-CD1 4.13Å; Y73-L91 HydrophobicContact CE2-CB 3.71Å; Y73-L91 HydrophobicContact CE2-CD1 4.15Å; Y73-L91 HydrophobicContact CG-CB 3.95Å; Y73-L91 WeakPolarHBondContact OH-CD1 3.48Å; Y73-P92 WeakPolarHBondContact CD2-O 3.35Å; Y73-Q93 PolarHBondContact O-NE2 3.23Å
74	P	76.3	Confident	67.9	Low	54 Å²	54	97.9 Å²	97.9	35%	0.351	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-63.5	151.5	-178.3	29.4	-36.6	0	0	0	110.4	D78 V79	P74-D78 HydrophobicContact CB-CB 4.46Å; P74-V79 HydrophobicContact CB-CG2 3.92Å; P74-V79 HydrophobicContact CG-CG2 3.68Å
75	R	81.9	Confident	69.4	Low	134 Å²	134	97.9 Å²	97.9	51%	0.506	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-67	153.6	173.4	-53.6	171	56.8	140.9	1.5	109.4	E77 D78 V79	R75-E77 IonicContact CZ-OE2 3.15Å; R75-E77 IonicContact NE-OE2 2.73Å; R75-E77 PolarHBondContact NE-OE2 3.31Å; R75-E77 IonicContact NH2-OE2 3Å; R75-E77 PolarHBondContact NH2-OE2 3.28Å; R75-E77 PolarHBondContact O-N 3.34Å; R75-D78 HydrophobicContact CB-CB 4.36Å; R75-D78 VanDerWaalsContact CB-OD2 3.31Å; R75-D78 WeakPolarHBondContact CB-OD2 3.2Å; R75-D78 WeakPolarHBondContact CG-OD2 3.46Å; R75-D78 PolarHBondContact N-OD2 2.87Å; R75-D78 WeakPolarHBondContact O-CB 3.43Å; R75-D78 PolarHBondContact O-N 3.35Å; R75-D78 VanDerWaalsContact O-N 3.11Å; R75-V79 PolarHBondContact O-N 3.1Å; R75-V79 VanDerWaalsContact O-N 3.14Å
76	I	84.8	Confident	71.5	Confident	15 Å²	15	93 Å²	93	8%	0.077	48%	0.482	C	S	.	.	H	α-helix	trans	-62.5	-34.2	176.3	-169.9	165.5	0	0	0	111.2	V79 L80 I90 T260 P358 V360	I76-V79 PolarHBondContact O-N 2.81Å; I76-L80 WeakPolarHBondContact O-CG 3.44Å; I76-L80 PolarHBondContact O-N 3.1Å; I76-L80 VanDerWaalsContact O-N 3.08Å; I76-I90 HydrophobicContact CB-CD1 4.28Å; I76-I90 HydrophobicContact CG1-CD1 4.21Å; I76-T260 HydrophobicContact CD1-CG2 3.62Å; I76-T260 HydrophobicContact CG1-CG2 3.76Å; I76-T260 HydrophobicContact CG2-CG2 4.08Å; I76-P358 HydrophobicContact CD1-CB 4.07Å; I76-P358 HydrophobicContact CD1-CG 3.94Å; I76-P358 WeakPolarHBondContact CD1-O 3.17Å; I76-P358 HydrophobicContact CG1-CB 3.99Å; I76-P358 HydrophobicContact CG1-CG 3.63Å; I76-V360 HydrophobicContact CB-CG2 4.27Å; I76-V360 HydrophobicContact CD1-CG2 4.26Å
77	E	84.3	Confident	73.5	Confident	72 Å²	72	90.6 Å²	90.6	34%	0.336	48%	0.475	S	S	.	.	H	α-helix	trans	-58.3	-53	168.2	-56.4	83.5	-125	0	0	112.1	R75 V79 L80 E81	R75-E77 IonicContact CZ-OE2 3.15Å; R75-E77 IonicContact NE-OE2 2.73Å; R75-E77 PolarHBondContact NE-OE2 3.31Å; R75-E77 IonicContact NH2-OE2 3Å; R75-E77 PolarHBondContact NH2-OE2 3.28Å; R75-E77 PolarHBondContact O-N 3.34Å; E77-V79 PolarHBondContact O-N 2.85Å; E77-L80 PolarHBondContact O-N 2.8Å; E77-L80 VanDerWaalsContact O-N 3.08Å; E77-E81 PolarHBondContact O-N 2.88Å
78	D	84.4	Confident	75.8	Confident	58 Å²	58	84.4 Å²	84.4	31%	0.31	45%	0.446	S	S	.	.	H	α-helix	trans	-60	-21.3	-179.7	-45.3	-25.3	0	0	0	113.3	P74 R75 K82	P74-D78 HydrophobicContact CB-CB 4.46Å; R75-D78 HydrophobicContact CB-CB 4.36Å; R75-D78 VanDerWaalsContact CB-OD2 3.31Å; R75-D78 WeakPolarHBondContact CB-OD2 3.2Å; R75-D78 WeakPolarHBondContact CG-OD2 3.46Å; R75-D78 PolarHBondContact N-OD2 2.87Å; R75-D78 WeakPolarHBondContact O-CB 3.43Å; R75-D78 PolarHBondContact O-N 3.35Å; R75-D78 VanDerWaalsContact O-N 3.11Å; D78-K82 WeakPolarHBondContact O-CD 3.42Å; D78-K82 WeakPolarHBondContact O-CE 3.4Å; D78-K82 VanDerWaalsContact O-CG 3.31Å; D78-K82 WeakPolarHBondContact O-CG 3.48Å; D78-K82 PolarHBondContact O-NZ 2.94Å
79	V	85.1	Confident	78.4	Confident	14 Å²	14	77.6 Å²	77.6	9%	0.085	41%	0.41	C	S	.	.	H	α-helix	trans	-86.5	-40.7	176.8	170.6	0	0	0	0	110.9	P74 R75 I76 E77 K82 Y86 P87 I90	P74-V79 HydrophobicContact CB-CG2 3.92Å; P74-V79 HydrophobicContact CG-CG2 3.68Å; R75-V79 PolarHBondContact O-N 3.1Å; R75-V79 VanDerWaalsContact O-N 3.14Å; I76-V79 PolarHBondContact O-N 2.81Å; E77-V79 PolarHBondContact O-N 2.85Å; V79-K82 PolarHBondContact O-N 2.82Å; V79-Y86 HydrophobicContact CG1-CD1 3.95Å; V79-Y86 WeakPolarHBondContact O-CE1 3.25Å; V79-P87 HydrophobicContact CG1-CG 4.1Å; V79-I90 HydrophobicContact CB-CD1 3.86Å; V79-I90 HydrophobicContact CG1-CD1 4.02Å; V79-I90 HydrophobicContact CG2-CD1 3.69Å
80	L	85.1	Confident	80.7	Confident	42 Å²	42	70.8 Å²	70.8	22%	0.22	37%	0.374	C	S	.	.	H	α-helix	trans	-64.8	-40.4	174.7	-70.3	170.7	0	0	0	111.9	I76 E77 K82 G83 Y86 T260 P358	I76-L80 WeakPolarHBondContact O-CG 3.44Å; I76-L80 PolarHBondContact O-N 3.1Å; I76-L80 VanDerWaalsContact O-N 3.08Å; E77-L80 PolarHBondContact O-N 2.8Å; E77-L80 VanDerWaalsContact O-N 3.08Å; L80-K82 PolarHBondContact O-N 3.07Å; L80-G83 PolarHBondContact O-N 3.27Å; L80-Y86 HydrophobicContact CD2-CE1 4.23Å; L80-Y86 HydrophobicContact CD2-CE2 4.42Å; L80-T260 HydrophobicContact CD1-CG2 3.65Å; L80-P358 HydrophobicContact CD2-CG 3.91Å; L80-P358 HydrophobicContact CG-CG 4.1Å
81	E	86.8	Confident	82.6	Confident	169 Å²	169	66.6 Å²	66.6	79%	0.79	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.4	178	-73.6	-170.5	175.5	0	0	114.1	E77 G83	E77-E81 PolarHBondContact O-N 2.88Å; E81-G83 VanDerWaalsContact C-N 3.33Å
82	K	85.1	Confident	84.2	Confident	154 Å²	154	59.7 Å²	59.7	67%	0.67	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-14.7	-179.4	-72.8	166.3	-165.7	143.9	0	113.6	D78 V79 L80	D78-K82 WeakPolarHBondContact O-CD 3.42Å; D78-K82 WeakPolarHBondContact O-CE 3.4Å; D78-K82 VanDerWaalsContact O-CG 3.31Å; D78-K82 WeakPolarHBondContact O-CG 3.48Å; D78-K82 PolarHBondContact O-NZ 2.94Å; V79-K82 PolarHBondContact O-N 2.82Å; L80-K82 PolarHBondContact O-N 3.07Å
83	G	80.8	Confident	84.9	Confident	36 Å²	36	59.9 Å²	59.9	37%	0.371	32%	0.318	S	S	.	.			trans	76.1	164.5	-171.6	0	0	0	0	0	113.5	L80 E81 Y86	L80-G83 PolarHBondContact O-N 3.27Å; E81-G83 VanDerWaalsContact C-N 3.33Å; G83-Y86 WeakPolarHBondContact O-CE1 3.4Å
84	G	82.3	Confident	85.3	Confident	53 Å²	53	64 Å²	64	55%	0.546	34%	0.338	S	S	.	.	S	Bend	trans	-76	169.3	-175.8	0	0	0	0	0	114.5
85	P	82.3	Confident	85.7	Confident	132 Å²	132	62.3 Å²	62.3	86%	0.857	33%	0.332	S	S	*	.	S	Bend	cis	-76.9	133.1	6.4	30.5	-35	0	0	0	112.8
86	Y	87.9	Confident	86.1	Confident	38 Å²	38	57.4 Å²	57.4	15%	0.149	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-83.7	144.6	-179.1	-52	-64.9	0	0	0	111.7	V79 L80 G83 F257 S356	V79-Y86 HydrophobicContact CG1-CD1 3.95Å; V79-Y86 WeakPolarHBondContact O-CE1 3.25Å; L80-Y86 HydrophobicContact CD2-CE1 4.23Å; L80-Y86 HydrophobicContact CD2-CE2 4.42Å; G83-Y86 WeakPolarHBondContact O-CE1 3.4Å; Y86-F257 HydrophobicContact CE2-CE2 4.09Å; Y86-F257 HydrophobicContact CE2-CZ 4.43Å; Y86-S356 VanDerWaalsContact CD2-O 3.29Å; Y86-S356 WeakPolarHBondContact CD2-O 3.48Å
87	P	89.4	Confident	86.5	Confident	61 Å²	61	57.6 Å²	57.6	40%	0.396	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-64	134.3	163.8	30	-34.6	0	0	0	109.2	V79 V89 I90 P358	V79-P87 HydrophobicContact CG1-CG 4.1Å; P87-V89 VanDerWaalsContact C-N 3.33Å; P87-V89 PolarHBondContact O-N 2.9Å; P87-I90 HydrophobicContact CG-CG1 3.92Å; P87-P358 WeakPolarHBondContact O-CA 3.49Å
88	Q	91.9	Very high	87	Confident	6 Å²	6	56.6 Å²	56.6	3%	0.028	32%	0.316	C	S	.	.	S	Bend	trans	-70.8	-32	-176.6	-162.6	-178.5	-1	0	0	111.9	Q353 F359 L374 S390	Q88-Q353 VanDerWaalsContact CG-OE1 3.23Å; Q88-F359 PolarHBondContact O-N 3.27Å; Q88-F359 VanDerWaalsContact O-N 3.07Å; Q88-L374 HydrophobicContact CG-CB 4.48Å; Q88-L374 HydrophobicContact CG-CD2 4.19Å; Q88-S390 PolarHBondContact OE1-OG 3.34Å
89	V	93.4	Very high	87.5	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.067	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-120.4	136.4	170.7	-175.9	0	0	0	0	109.2	P87 I99 F359 P361 L374 T392	P87-V89 VanDerWaalsContact C-N 3.33Å; P87-V89 PolarHBondContact O-N 2.9Å; V89-I99 HydrophobicContact CB-CD1 3.8Å; V89-I99 HydrophobicContact CB-CG1 4.1Å; V89-I99 HydrophobicContact CG1-CD1 3.77Å; V89-I99 HydrophobicContact CG1-CG1 3.82Å; V89-F359 CarbonylContact C-O 3.57Å; V89-F359 WeakPolarHBondContact CA-O 3.47Å; V89-P361 HydrophobicContact CG1-CG 4.48Å; V89-L374 HydrophobicContact CG2-CD1 3.6Å; V89-L374 HydrophobicContact CG2-CD2 3.63Å; V89-L374 HydrophobicContact CG2-CG 4.25Å; V89-T392 HydrophobicContact CG1-CG2 3.89Å; V89-T392 HydrophobicContact CG2-CG2 4.1Å
90	I	92.4	Very high	87.9	Confident	8 Å²	8	58.1 Å²	58.1	4%	0.041	32%	0.321	C	S	.	.			trans	-113.5	130.1	164.6	-58	169.3	0	0	0	106.8	I76 V79 P87 P358 F359 V360 P361	I76-I90 HydrophobicContact CB-CD1 4.28Å; I76-I90 HydrophobicContact CG1-CD1 4.21Å; V79-I90 HydrophobicContact CB-CD1 3.86Å; V79-I90 HydrophobicContact CG1-CD1 4.02Å; V79-I90 HydrophobicContact CG2-CD1 3.69Å; P87-I90 HydrophobicContact CG-CG1 3.92Å; I90-P358 HydrophobicContact CD1-CB 3.53Å; I90-P358 HydrophobicContact CD1-CG 4.36Å; I90-P358 HydrophobicContact CG1-CB 4.04Å; I90-F359 PolarHBondContact N-O 2.94Å; I90-V360 HydrophobicContact CB-CG2 3.89Å; I90-V360 HydrophobicContact CG2-CG2 4.29Å; I90-P361 WeakPolarHBondContact O-CD 3.27Å
91	L	90.1	Very high	87.9	Confident	18 Å²	18	60.8 Å²	60.8	9%	0.094	34%	0.336	C	S	.	.			trans	-73.1	146.8	175.4	-73.1	175.2	0	0	0	111	Y73 Y97 I99	Y73-L91 WeakPolarHBondContact CB-O 3.31Å; Y73-L91 HydrophobicContact CD1-CB 4.05Å; Y73-L91 HydrophobicContact CD2-CB 3.77Å; Y73-L91 HydrophobicContact CE1-CB 3.99Å; Y73-L91 HydrophobicContact CE1-CD1 4.13Å; Y73-L91 HydrophobicContact CE2-CB 3.71Å; Y73-L91 HydrophobicContact CE2-CD1 4.15Å; Y73-L91 HydrophobicContact CG-CB 3.95Å; Y73-L91 WeakPolarHBondContact OH-CD1 3.48Å; L91-Y97 VanDerWaalsContact CD2-O 3.29Å; L91-Y97 WeakPolarHBondContact CD2-O 3.31Å; L91-I99 HydrophobicContact CD1-CD1 4.3Å; L91-I99 HydrophobicContact CD1-CG1 4.35Å; L91-I99 HydrophobicContact CD2-CD1 4.28Å; L91-I99 HydrophobicContact CD2-CG1 3.89Å; L91-I99 HydrophobicContact CG-CD1 3.85Å; L91-I99 HydrophobicContact CG-CG1 3.99Å
92	P	87.9	Confident	87.3	Confident	8 Å²	8	54.1 Å²	54.1	5%	0.052	31%	0.31	C	S	.	.			trans	-60.2	150.3	179.3	-23	34.7	0	0	0	112.3	Y73 F94 G95 Y97 V360 D362	Y73-P92 WeakPolarHBondContact CD2-O 3.35Å; P92-F94 PolarHBondContact O-N 2.71Å; P92-G95 PolarHBondContact O-N 2.8Å; P92-Y97 HydrophobicContact CG-CD2 3.75Å; P92-Y97 HydrophobicContact CG-CE2 4.07Å; P92-V360 HydrophobicContact CB-CG1 4.43Å; P92-V360 HydrophobicContact CG-CG1 4.1Å; P92-D362 HydrophobicContact CB-CB 4.3Å; P92-D362 WeakPolarHBondContact CB-OD2 3.32Å; P92-D362 HydrophobicContact CG-CB 4.01Å; P92-D362 WeakPolarHBondContact CG-OD2 3.38Å
93	Q	79.4	Confident	86.5	Confident	73 Å²	73	53 Å²	53	34%	0.341	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-11.3	-175.1	-56.9	-153.7	-69	0	0	115.3	Y70 Y73	Y70-Q93 PolarHBondContact OH-O 2.97Å; Y70-Q93 VanDerWaalsContact OH-O 3.09Å; Y73-Q93 PolarHBondContact O-NE2 3.23Å
94	F	79.6	Confident	85.5	Confident	187 Å²	187	53.8 Å²	53.8	82%	0.82	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.9	11.7	179.2	-54.7	-70.9	0	0	0	113.1	P92	P92-F94 PolarHBondContact O-N 2.71Å
95	G	85	Confident	83.9	Confident	20 Å²	20	57.2 Å²	57.2	21%	0.206	32%	0.323	C	S	.	.			trans	79.2	-137	179.5	0	0	0	0	0	113.9	P92 Y97	P92-G95 PolarHBondContact O-N 2.8Å; G95-Y97 VanDerWaalsContact C-N 3.28Å; G95-Y97 PolarHBondContact O-N 2.85Å
96	G	89.2	Confident	82.1	Confident	31 Å²	31	54.6 Å²	54.6	32%	0.32	31%	0.312	S	S	.	.			trans	79	-5	177.4	0	0	0	0	0	116.4	R394 E395	G96-R394 CarbonylContact O-C 3.58Å; G96-R394 VanDerWaalsContact O-CA 3.29Å; G96-R394 WeakPolarHBondContact O-CA 3.47Å; G96-E395 PolarHBondContact O-N 3.18Å
97	Y	94	Very high	79.9	Confident	19 Å²	19	55.8 Å²	55.8	8%	0.075	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	156	175.4	-63.6	-106.2	0	0	0	111.1	L91 P92 G95 P361 D362 Y372 A393 R394	L91-Y97 VanDerWaalsContact CD2-O 3.29Å; L91-Y97 WeakPolarHBondContact CD2-O 3.31Å; P92-Y97 HydrophobicContact CG-CD2 3.75Å; P92-Y97 HydrophobicContact CG-CE2 4.07Å; G95-Y97 VanDerWaalsContact C-N 3.28Å; G95-Y97 PolarHBondContact O-N 2.85Å; Y97-P361 HydrophobicContact CD1-CB 3.49Å; Y97-P361 VanDerWaalsContact CD1-CB 3.49Å; Y97-P361 HydrophobicContact CD1-CG 3.93Å; Y97-P361 HydrophobicContact CD2-CB 4.07Å; Y97-P361 HydrophobicContact CE1-CB 3.38Å; Y97-P361 HydrophobicContact CE1-CG 4.32Å; Y97-P361 HydrophobicContact CE2-CB 3.97Å; Y97-P361 HydrophobicContact CG-CB 3.85Å; Y97-P361 HydrophobicContact CG-CG 4.07Å; Y97-D362 WeakPolarHBondContact CE2-OD1 3.49Å; Y97-D362 PolarHBondContact OH-OD1 2.92Å; Y97-Y372 HydrophobicContact CE1-CE2 4.38Å; Y97-A393 CarbonylContact C-O 3.5Å; Y97-A393 WeakPolarHBondContact CA-O 3.39Å; Y97-A393 WeakPolarHBondContact CB-O 3.44Å; Y97-R394 HydrophobicContact CD1-CB 4.42Å; Y97-R394 HydrophobicContact CD1-CG 3.69Å; Y97-R394 HydrophobicContact CE1-CB 4.46Å; Y97-R394 HydrophobicContact CE1-CG 3.31Å; Y97-R394 HydrophobicContact CE2-CG 4.23Å; Y97-R394 HydrophobicContact CG-CG 4.28Å; Y97-R394 PolarHBondContact OH-NE 3.32Å; Y97-R394 VanDerWaalsContact OH-NE 3.12Å; Y97-R394 PolarHBondContact OH-NH2 2.84Å
98	W	95	Very high	77.4	Confident	51 Å²	51	59 Å²	59	19%	0.193	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	161.9	168.2	53.3	-97.1	0	0	0	111.2	E100 V391 T392 A393 R394 V397 F400	W98-E100 HydrophobicContact CZ3-CB 4.03Å; W98-V391 HydrophobicContact CZ3-CG1 4.49Å; W98-T392 WeakPolarHBondContact O-CA 3.36Å; W98-T392 VanDerWaalsContact O-CB 3.26Å; W98-T392 WeakPolarHBondContact O-CB 3.41Å; W98-T392 PolarHBondContact O-OG1 3.21Å; W98-A393 HydrophobicContact CD2-CB 4.46Å; W98-A393 HydrophobicContact CH2-CB 4.13Å; W98-A393 HydrophobicContact CZ2-CB 3.67Å; W98-A393 PolarHBondContact N-O 3.38Å; W98-A393 PolarHBondContact O-N 2.67Å; W98-R394 VanDerWaalsContact CD1-O 3.31Å; W98-R394 PolarHBondContact NE1-O 3.39Å; W98-V397 PolarHBondContact NE1-O 2.91Å; W98-F400 HydrophobicContact CH2-CD1 4.04Å; W98-F400 AromaticContact CH2-CE1 3.55Å; W98-F400 HydrophobicContact CH2-CE1 3.55Å; W98-F400 HydrophobicContact CH2-CZ 4.07Å; W98-F400 HydrophobicContact CZ2-CD1 4.24Å; W98-F400 AromaticContact CZ2-CE1 3.83Å; W98-F400 HydrophobicContact CZ2-CE1 3.83Å
99	I	94.4	Very high	75	Confident	71 Å²	71	61.4 Å²	61.4	36%	0.364	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.9	168.6	-62.9	169.1	0	0	0	107.3	V89 L91 D101 V391	V89-I99 HydrophobicContact CB-CD1 3.8Å; V89-I99 HydrophobicContact CB-CG1 4.1Å; V89-I99 HydrophobicContact CG1-CD1 3.77Å; V89-I99 HydrophobicContact CG1-CG1 3.82Å; L91-I99 HydrophobicContact CD1-CD1 4.3Å; L91-I99 HydrophobicContact CD1-CG1 4.35Å; L91-I99 HydrophobicContact CD2-CD1 4.28Å; L91-I99 HydrophobicContact CD2-CG1 3.89Å; L91-I99 HydrophobicContact CG-CD1 3.85Å; L91-I99 HydrophobicContact CG-CG1 3.99Å; I99-D101 PolarHBondContact O-N 2.93Å; I99-V391 WeakPolarHBondContact CA-O 3.44Å
100	E	93.8	Very high	72.2	Confident	32 Å²	32	66.9 Å²	66.9	15%	0.15	41%	0.41	C	S	.	.			trans	-70.9	120.9	174.3	-167.6	169.8	159.3	0	0	110.7	W98 V391 L404 K423	W98-E100 HydrophobicContact CZ3-CB 4.03Å; E100-V391 HydrophobicContact CB-CB 3.87Å; E100-V391 HydrophobicContact CB-CG1 4.43Å; E100-V391 PolarHBondContact N-O 3.07Å; E100-V391 WeakPolarHBondContact OE2-CB 3.17Å; E100-V391 WeakPolarHBondContact OE2-CG1 3.26Å; E100-L404 HydrophobicContact CB-CD1 3.9Å; E100-L404 HydrophobicContact CG-CD1 3.91Å; E100-L404 HydrophobicContact CG-CG 4.33Å; E100-L404 PolarHBondContact OE1-N 3.02Å; E100-L404 VanDerWaalsContact OE1-N 3.1Å; E100-K423 IonicContact OE1-NZ 2.88Å; E100-K423 PolarHBondContact OE1-NZ 2.98Å; E100-K423 WeakPolarHBondContact OE2-CE 3.42Å; E100-K423 IonicContact OE2-NZ 2.69Å; E100-K423 PolarHBondContact OE2-NZ 3.43Å
101	D	84.9	Confident	69.4	Low	98 Å²	98	69.2 Å²	69.2	52%	0.524	43%	0.426	S	S	.	.			trans	-84.4	122.9	174.2	179.6	14.5	0	0	0	110.3	I99 E103 A104	I99-D101 PolarHBondContact O-N 2.93Å; D101-E103 VanDerWaalsContact C-N 3.3Å; D101-E103 WeakPolarHBondContact OD1-CB 3.4Å; D101-E103 PolarHBondContact OD1-N 2.9Å; D101-A104 HydrophobicContact CB-CB 4.03Å; D101-A104 WeakPolarHBondContact O-CB 3.46Å; D101-A104 PolarHBondContact O-N 3.36Å; D101-A104 PolarHBondContact OD2-N 3.27Å
102	A	75.1	Confident	66.7	Low	30 Å²	30	74.8 Å²	74.8	25%	0.248	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-13.6	176.9	0	0	0	0	0	113.2	L404 A408	A102-L404 HydrophobicContact CB-CB 4.19Å; A102-A408 HydrophobicContact CB-CB 4.44Å
103	E	66.8	Low	64.4	Low	131 Å²	131	80.9 Å²	80.9	61%	0.612	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-11	172.5	-57.9	-67.3	-179.1	0	0	112.4	D101 N406	D101-E103 VanDerWaalsContact C-N 3.3Å; D101-E103 WeakPolarHBondContact OD1-CB 3.4Å; D101-E103 PolarHBondContact OD1-N 2.9Å; E103-N406 PolarHBondContact OE1-ND2 3.12Å; E103-N406 PolarHBondContact OE2-ND2 3.24Å
104	A	61.2	Low	62.3	Low	52 Å²	52	78.3 Å²	78.3	43%	0.43	49%	0.485	S	S	.	.	S	Bend	trans	-63.5	122.3	178.6	0	0	0	0	0	110	D101 A106	D101-A104 HydrophobicContact CB-CB 4.03Å; D101-A104 WeakPolarHBondContact O-CB 3.46Å; D101-A104 PolarHBondContact O-N 3.36Å; D101-A104 PolarHBondContact OD2-N 3.27Å; A104-A106 PolarHBondContact O-N 2.85Å
105	P	47.8	Very low	60.8	Low	125 Å²	125	70.8 Å²	70.8	81%	0.812	46%	0.456	S	S	*	.			trans	-61.6	116.4	-174.6	24.1	-33.7	0	0	0	109.7	G107	P105-G107 WeakPolarHBondContact O-CA 3.29Å; P105-G107 PolarHBondContact O-N 3.24Å
106	A	45.2	Very low	59.1	Low	76 Å²	76	74.1 Å²	74.1	63%	0.628	47%	0.465	S	S	*	.			trans	-34.6	95.1	-164.9	0	0	0	0	0	113.4	A104 T108 P403	A104-A106 PolarHBondContact O-N 2.85Å; A106-T108 PolarHBondContact O-N 3.47Å; A106-T108 VanDerWaalsContact O-N 3.1Å; A106-P403 HydrophobicContact CB-CG 4.39Å
107	G	40.3	Very low	56.9	Low	64 Å²	64	73.2 Å²	73.2	66%	0.66	45%	0.454	S	S	*	.			trans	-64.8	113.8	-164.4	0	0	0	0	0	111.7	P105 P109	P105-G107 WeakPolarHBondContact O-CA 3.29Å; P105-G107 PolarHBondContact O-N 3.24Å; G107-P109 VanDerWaalsContact O-N 3.1Å
108	T	38.5	Very low	54.7	Low	129 Å²	129	78.1 Å²	78.1	79%	0.791	48%	0.477	S	S	*	.			trans	-50.1	119.6	166.9	-38.7	0	0	0	0	107.6	A106 S110	A106-T108 PolarHBondContact O-N 3.47Å; A106-T108 VanDerWaalsContact O-N 3.1Å; T108-S110 PolarHBondContact O-N 2.94Å
109	P	40.3	Very low	52.3	Low	55 Å²	55	80.1 Å²	80.1	36%	0.357	49%	0.489	S	S	.	.			trans	-57	113.1	-161.2	16.7	-30.7	0	0	0	111.1	G107 S111 F116	G107-P109 VanDerWaalsContact O-N 3.1Å; P109-S111 PolarHBondContact O-N 2.96Å; P109-F116 HydrophobicContact CG-CE1 4.14Å; P109-F116 HydrophobicContact CG-CZ 3.89Å
110	S	34.7	Very low	49.7	Very low	127 Å²	127	85.9 Å²	85.9	89%	0.888	51%	0.514	S	S	*	.	S	Bend	trans	-82.3	62.3	-158.7	-168.9	0	0	0	0	113	T108	T108-S110 PolarHBondContact O-N 2.94Å
111	S	34.1	Very low	47.1	Very low	56 Å²	56	92.4 Å²	92.4	39%	0.392	55%	0.55	S	S	.	*			trans	-162.6	138.7	160.3	65.2	0	0	0	0	111.2	P109 E113 S114	P109-S111 PolarHBondContact O-N 2.96Å; S111-E113 PolarHBondContact O-N 2.89Å; S111-S114 PolarHBondContact O-N 2.99Å; S111-S114 PolarHBondContact O-OG 3.38Å; S111-S114 WeakPolarHBondContact OG-CB 3.41Å; S111-S114 PolarHBondContact OG-N 3.38Å; S111-S114 PolarHBondContact OG-OG 3.14Å; S111-S114 VanDerWaalsContact OG-OG 3.05Å
112	S	34.1	Very low	44.7	Very low	136 Å²	136	91.2 Å²	91.2	95%	0.951	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	10.2	170.8	-45	0	0	0	0	113.8
113	E	38.3	Very low	42.6	Very low	135 Å²	135	96.6 Å²	96.6	63%	0.631	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	-10.6	178.2	-59.2	-168.2	146.8	0	0	112.1	S111 S115 K191	S111-E113 PolarHBondContact O-N 2.89Å; E113-S115 VanDerWaalsContact C-N 3.29Å; E113-S115 PolarHBondContact O-N 3.46Å; E113-K191 IonicContact OE1-NZ 3.78Å; E113-K191 PolarHBondContact OE1-NZ 2.98Å
114	S	36.3	Very low	41.2	Very low	19 Å²	19	100.3 Å²	100.3	13%	0.133	60%	0.602	C	S	.	*			trans	-82.1	70.5	168.9	50.7	0	0	0	0	111.7	S111	S111-S114 PolarHBondContact O-N 2.99Å; S111-S114 PolarHBondContact O-OG 3.38Å; S111-S114 WeakPolarHBondContact OG-CB 3.41Å; S111-S114 PolarHBondContact OG-N 3.38Å; S111-S114 PolarHBondContact OG-OG 3.14Å; S111-S114 VanDerWaalsContact OG-OG 3.05Å
115	S	47.9	Very low	39.6	Very low	30 Å²	30	99.6 Å²	99.6	21%	0.21	60%	0.601	C	S	.	*			trans	-61.6	156.7	168.6	59.2	0	0	0	0	112.3	E113 C138 S140	E113-S115 VanDerWaalsContact C-N 3.29Å; E113-S115 PolarHBondContact O-N 3.46Å; S115-C138 PolarHBondContact OG-O 2.81Å; S115-S140 VanDerWaalsContact CB-OG 3.29Å; S115-S140 WeakPolarHBondContact CB-OG 3.28Å; S115-S140 WeakPolarHBondContact OG-CB 3.26Å; S115-S140 PolarHBondContact OG-N 3.03Å; S115-S140 PolarHBondContact OG-OG 3.39Å
116	F	48.8	Very low	39	Very low	89 Å²	89	102.6 Å²	102.6	39%	0.39	61%	0.606	S	S	.	*	B	Isolated β-bridge	trans	-96.1	150.7	176.2	-56.8	-67.6	0	0	0	112.9	P109 E118 S140	P109-F116 HydrophobicContact CG-CE1 4.14Å; P109-F116 HydrophobicContact CG-CZ 3.89Å; F116-E118 PolarHBondContact O-N 3.06Å; F116-S140 VanDerWaalsContact O-CB 3.28Å; F116-S140 WeakPolarHBondContact O-CB 3.34Å
117	C	43.8	Very low	38.1	Very low	13 Å²	13	103.8 Å²	103.8	9%	0.088	61%	0.61	C	S	.	*			trans	-71.5	113.4	158.3	-92.3	0	0	0	0	108.5	E119 R135 C138	C117-E119 PolarHBondContact O-N 3.17Å; C117-R135 PolarHBondContact O-NE 2.92Å; C117-R135 PolarHBondContact O-NH2 3.13Å; C117-C138 WeakPolarHBondContact CA-SG 3.4Å; C117-C138 HydrophobicContact CB-CB 4.18Å; C117-C138 WeakPolarHBondContact CB-SG 3.21Å; C117-C138 PolarHBondContact N-SG 3.4Å; C117-C138 WeakPolarHBondContact SG-CB 3.42Å; C117-C138 CovalentContact SG-SG 2.05Å; C117-C138 PolarHBondContact SG-SG 3.29Å
118	E	47.6	Very low	37.9	Very low	121 Å²	121	107.3 Å²	107.3	57%	0.565	62%	0.621	S	S	*	*			trans	-74.8	101.3	151.9	-67.6	171.7	165.6	0	0	105.8	F116 K147	F116-E118 PolarHBondContact O-N 3.06Å; E118-K147 IonicContact OE2-NZ 2.69Å; E118-K147 PolarHBondContact OE2-NZ 3.06Å
119	E	43.9	Very low	37.6	Very low	94 Å²	94	104.5 Å²	104.5	44%	0.439	62%	0.617	S	S	.	*			trans	-62.7	153.2	159	-63.6	179.7	-144	0	0	107.5	C117 D121 R315	C117-E119 PolarHBondContact O-N 3.17Å; E119-D121 PolarHBondContact O-N 2.85Å; E119-D121 VanDerWaalsContact O-N 3.11Å; E119-R315 WeakPolarHBondContact OE1-CD 3.16Å; E119-R315 IonicContact OE1-CZ 2.8Å; E119-R315 IonicContact OE1-NH1 2.67Å; E119-R315 PolarHBondContact OE1-NH1 2.84Å
120	E	41.1	Very low	37.3	Very low	192 Å²	192	105.7 Å²	105.7	90%	0.897	64%	0.64	S	S	*	*			trans	-73.7	109.7	-164.4	-68.3	179	115.2	0	0	111.7	G122	E120-G122 VanDerWaalsContact C-N 3.26Å; E120-G122 PolarHBondContact O-N 3.02Å
121	D	38.8	Very low	37.6	Very low	169 Å²	169	103.1 Å²	103.1	90%	0.904	63%	0.627	S	S	*	*			trans	-57.7	90.5	163.7	-69.7	-55.5	0	0	0	108.9	E119	E119-D121 PolarHBondContact O-N 2.85Å; E119-D121 VanDerWaalsContact O-N 3.11Å
122	G	35	Very low	38.2	Very low	72 Å²	72	108.1 Å²	108.1	74%	0.742	64%	0.644	S	S	*	*			trans	-148.9	7.3	-168.4	0	0	0	0	0	114.7	E120	E120-G122 VanDerWaalsContact C-N 3.26Å; E120-G122 PolarHBondContact O-N 3.02Å
123	D	29.9	Very low	39.9	Very low	144 Å²	144	105.6 Å²	105.6	77%	0.77	63%	0.626	S	S	*	*			trans	-131.6	112.5	167.1	-173.2	38.5	0	0	0	109.4	G125	D123-G125 PolarHBondContact O-N 3.21Å
124	E	36.9	Very low	42	Very low	208 Å²	208	101.9 Å²	101.9	97%	0.972	61%	0.606	S	S	*	*			trans	-77.6	44.8	171.1	-69.6	-172	103.9	0	0	110.7	M126	E124-M126 PolarHBondContact O-N 3.42Å
125	G	29.3	Very low	44.3	Very low	38 Å²	38	107.1 Å²	107.1	39%	0.392	62%	0.623	S	S	.	*			trans	-90.8	60.5	-175.7	0	0	0	0	0	112.9	D123 S127	D123-G125 PolarHBondContact O-N 3.21Å; G125-S127 PolarHBondContact O-N 3.38Å; G125-S127 PolarHBondContact O-OG 3.12Å
126	M	33.8	Very low	46.2	Very low	187 Å²	187	105.8 Å²	105.8	92%	0.921	61%	0.614	S	S	*	*			trans	-58.6	86.4	-171.8	-163.5	73.9	161.7	0	0	113.5	E124 P128	E124-M126 PolarHBondContact O-N 3.42Å; M126-P128 VanDerWaalsContact O-CD 3.29Å; M126-P128 WeakPolarHBondContact O-CD 3.29Å
127	S	27.4	Very low	47.9	Very low	102 Å²	102	102.4 Å²	102.4	71%	0.713	60%	0.599	S	S	*	*			trans	-99.7	102.2	-178.9	-64.1	0	0	0	0	110.6	G125 G129	G125-S127 PolarHBondContact O-N 3.38Å; G125-S127 PolarHBondContact O-OG 3.12Å; S127-G129 VanDerWaalsContact C-N 3.3Å; S127-G129 PolarHBondContact O-N 2.89Å
128	P	34.5	Very low	49.3	Very low	137 Å²	137	102.9 Å²	102.9	89%	0.89	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	77.1	-175.5	32.3	-36.4	0	0	0	111.6	M126	M126-P128 VanDerWaalsContact O-CD 3.29Å; M126-P128 WeakPolarHBondContact O-CD 3.29Å
129	G	32.2	Very low	50.7	Low	70 Å²	70	100.4 Å²	100.4	72%	0.722	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-176.3	-1.6	178.9	0	0	0	0	0	117.6	S127 A131	S127-G129 VanDerWaalsContact C-N 3.3Å; S127-G129 PolarHBondContact O-N 2.89Å; G129-A131 PolarHBondContact O-N 3.47Å
130	G	34.9	Very low	52.3	Low	81 Å²	81	97.9 Å²	97.9	84%	0.835	59%	0.585	S	S	*	*			trans	-74	89.4	-178.3	0	0	0	0	0	113.7
131	A	40.6	Very low	54.4	Low	73 Å²	73	90 Å²	90	60%	0.603	55%	0.551	S	S	*	*			trans	-76.5	134.4	175.6	0	0	0	0	0	112.2	G129 S133	G129-A131 PolarHBondContact O-N 3.47Å; A131-S133 PolarHBondContact O-N 3.4Å
132	H	47.6	Very low	56.7	Low	161 Å²	161	82.2 Å²	82.2	75%	0.745	51%	0.509	S	S	*	.			trans	48.8	44.3	159.8	-55.3	-62.8	0	0	0	118.9	Y134	H132-Y134 PolarHBondContact O-N 2.87Å; H132-Y134 VanDerWaalsContact O-N 3.12Å
133	S	68.4	Low	59.3	Low	82 Å²	82	83.3 Å²	83.3	57%	0.573	49%	0.491	S	S	*	.			trans	-61.2	119	165.8	-172.5	0	0	0	0	110.8	A131 R315 E418	A131-S133 PolarHBondContact O-N 3.4Å; S133-R315 PolarHBondContact OG-NH2 3.34Å; S133-E418 WeakPolarHBondContact CA-OE1 3.35Å; S133-E418 PolarHBondContact OG-OE1 3.35Å
134	Y	83.9	Confident	62.3	Low	58 Å²	58	76.7 Å²	76.7	23%	0.227	46%	0.456	C	S	.	.			trans	-69.1	159.2	-179.8	-60.3	-70.6	0	0	0	111	H132 R315 P402 E418 F419	H132-Y134 PolarHBondContact O-N 2.87Å; H132-Y134 VanDerWaalsContact O-N 3.12Å; Y134-R315 VanDerWaalsContact O-CZ 3.3Å; Y134-R315 PolarHBondContact O-NH1 2.83Å; Y134-R315 PolarHBondContact O-NH2 3.36Å; Y134-P402 HydrophobicContact CD1-CB 3.34Å; Y134-P402 HydrophobicContact CD1-CG 3.73Å; Y134-P402 HydrophobicContact CE1-CB 3.89Å; Y134-P402 HydrophobicContact CE1-CG 4.26Å; Y134-P402 HydrophobicContact CG-CB 4.03Å; Y134-P402 HydrophobicContact CG-CG 3.96Å; Y134-E418 HydrophobicContact CD2-CB 4.09Å; Y134-E418 HydrophobicContact CD2-CG 4.02Å; Y134-E418 HydrophobicContact CE2-CB 4.47Å; Y134-E418 PolarHBondContact N-OE1 3.19Å; Y134-F419 HydrophobicContact CD2-CB 4.14Å; Y134-F419 HydrophobicContact CE1-CD2 4.13Å; Y134-F419 HydrophobicContact CE2-CB 3.56Å; Y134-F419 HydrophobicContact CE2-CD2 4.4Å; Y134-F419 AromaticContact CZ-CD2 3.97Å
135	R	85.1	Confident	65.1	Low	128 Å²	128	66.8 Å²	66.8	48%	0.483	41%	0.41	S	S	.	.			trans	-111.8	132.2	-174.9	-153.8	171.2	-166	170.3	6.8	113	C117 T422 N426	C117-R135 PolarHBondContact O-NE 2.92Å; C117-R135 PolarHBondContact O-NH2 3.13Å; R135-T422 WeakPolarHBondContact O-CG2 3.44Å; R135-N426 PolarHBondContact O-ND2 2.97Å
136	L	87.7	Confident	68.2	Low	3 Å²	3	71.2 Å²	71.2	2%	0.016	42%	0.415	C	S	.	.			trans	-78.2	120.6	171.6	-69.3	169.8	0	0	0	110.5	R315 T422 I425 N426	L136-R315 HydrophobicContact CD1-CB 4.13Å; L136-T422 HydrophobicContact CD2-CG2 3.94Å; L136-T422 HydrophobicContact CG-CG2 4.38Å; L136-I425 HydrophobicContact CD2-CB 3.91Å; L136-I425 HydrophobicContact CD2-CD1 3.93Å; L136-I425 HydrophobicContact CD2-CG2 3.68Å; L136-N426 WeakPolarHBondContact CA-OD1 3.49Å
137	E	83.8	Confident	71	Confident	18 Å²	18	67 Å²	67	8%	0.084	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-73.2	136.8	169	-67.1	-179.4	-139.2	0	0	109.4	G401 N426 N429 K433	E137-G401 PolarHBondContact OE1-N 3.26Å; E137-N426 PolarHBondContact N-OD1 3.19Å; E137-N429 PolarHBondContact O-ND2 3.37Å; E137-K433 IonicContact OE2-NZ 3.3Å; E137-K433 PolarHBondContact OE2-NZ 2.91Å
138	C	73.6	Confident	74.2	Confident	22 Å²	22	64 Å²	64	15%	0.149	37%	0.366	C	S	.	.			trans	-159.2	155.4	-179	83.2	0	0	0	0	112.4	S115 C117 S140	S115-C138 PolarHBondContact OG-O 2.81Å; C117-C138 WeakPolarHBondContact CA-SG 3.4Å; C117-C138 HydrophobicContact CB-CB 4.18Å; C117-C138 WeakPolarHBondContact CB-SG 3.21Å; C117-C138 PolarHBondContact N-SG 3.4Å; C117-C138 WeakPolarHBondContact SG-CB 3.42Å; C117-C138 CovalentContact SG-SG 2.05Å; C117-C138 PolarHBondContact SG-SG 3.29Å; C138-S140 PolarHBondContact O-N 3.26Å
139	N	76.3	Confident	77.2	Confident	69 Å²	69	57.5 Å²	57.5	37%	0.369	32%	0.324	S	S	.	.			trans	-74.1	89.5	169.9	-174.5	2.5	0	0	0	110	T141 A142 E243	N139-T141 PolarHBondContact O-N 2.84Å; N139-T141 WeakPolarHBondContact OD1-CB 3.43Å; N139-T141 PolarHBondContact OD1-N 3.39Å; N139-T141 PolarHBondContact OD1-OG1 3.35Å; N139-A142 HydrophobicContact CB-CB 4.47Å; N139-A142 VanDerWaalsContact O-CB 3.28Å; N139-A142 WeakPolarHBondContact O-CB 3.4Å; N139-A142 PolarHBondContact O-N 2.96Å; N139-A142 VanDerWaalsContact O-N 3.16Å; N139-E243 PolarHBondContact ND2-OE2 2.83Å
140	S	76.9	Confident	80.2	Confident	41 Å²	41	56.5 Å²	56.5	29%	0.287	30%	0.302	S	S	.	.	H	α-helix	trans	-67.3	-25.4	-178.3	88.8	0	0	0	0	112.1	S115 F116 C138 A142 R143 A144	S115-S140 VanDerWaalsContact CB-OG 3.29Å; S115-S140 WeakPolarHBondContact CB-OG 3.28Å; S115-S140 WeakPolarHBondContact OG-CB 3.26Å; S115-S140 PolarHBondContact OG-N 3.03Å; S115-S140 PolarHBondContact OG-OG 3.39Å; F116-S140 VanDerWaalsContact O-CB 3.28Å; F116-S140 WeakPolarHBondContact O-CB 3.34Å; C138-S140 PolarHBondContact O-N 3.26Å; S140-A142 PolarHBondContact O-N 3.37Å; S140-R143 PolarHBondContact O-N 3.29Å; S140-A144 PolarHBondContact O-N 2.9Å
141	T	85.5	Confident	83.1	Confident	28 Å²	28	56.6 Å²	56.6	17%	0.172	30%	0.303	C	S	.	.	H	α-helix	trans	-54.9	-35.9	172.3	-50.5	0	0	0	0	111.7	N139 R143 A144 M185 T192 H194	N139-T141 PolarHBondContact O-N 2.84Å; N139-T141 WeakPolarHBondContact OD1-CB 3.43Å; N139-T141 PolarHBondContact OD1-N 3.39Å; N139-T141 PolarHBondContact OD1-OG1 3.35Å; T141-R143 VanDerWaalsContact C-N 3.28Å; T141-R143 PolarHBondContact O-N 2.84Å; T141-A144 WeakPolarHBondContact O-CB 3.43Å; T141-A144 PolarHBondContact O-N 2.74Å; T141-M185 HydrophobicContact CG2-CE 4.12Å; T141-M185 WeakPolarHBondContact O-CE 3.13Å; T141-T192 HydrophobicContact CG2-CG2 3.68Å; T141-H194 HydrophobicContact CG2-CB 3.9Å
142	A	87.6	Confident	85.7	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.033	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-33.4	176.8	0	0	0	0	0	113	N139 S140 D240 E241 V244	N139-A142 HydrophobicContact CB-CB 4.47Å; N139-A142 VanDerWaalsContact O-CB 3.28Å; N139-A142 WeakPolarHBondContact O-CB 3.4Å; N139-A142 PolarHBondContact O-N 2.96Å; N139-A142 VanDerWaalsContact O-N 3.16Å; S140-A142 PolarHBondContact O-N 3.37Å; A142-D240 WeakPolarHBondContact CA-O 3.09Å; A142-D240 VanDerWaalsContact CB-O 3.27Å; A142-D240 WeakPolarHBondContact CB-O 3.48Å; A142-D240 CarbonylContact O-C 3.59Å; A142-D240 WeakPolarHBondContact O-CB 3.32Å; A142-E241 VanDerWaalsContact O-CG 3.31Å; A142-E241 WeakPolarHBondContact O-CG 3.13Å; A142-V244 HydrophobicContact CB-CG2 3.67Å
143	R	89.7	Confident	88	Confident	95 Å²	95	59.4 Å²	59.4	36%	0.358	30%	0.302	S	S	.	.	H	α-helix	trans	-94.1	-12.4	177.4	-64.3	-177.2	179.3	-173.8	-1.4	113.4	S140 T141 Y145 R146 K147 V244 N246	S140-R143 PolarHBondContact O-N 3.29Å; T141-R143 VanDerWaalsContact C-N 3.28Å; T141-R143 PolarHBondContact O-N 2.84Å; R143-Y145 VanDerWaalsContact C-N 3.27Å; R143-Y145 PolarHBondContact O-N 2.67Å; R143-R146 PolarHBondContact O-N 2.85Å; R143-R146 VanDerWaalsContact O-N 3.15Å; R143-K147 PolarHBondContact O-N 2.62Å; R143-V244 HydrophobicContact CG-CG2 3.96Å; R143-N246 PolarHBondContact NH2-OD1 2.8Å
144	A	92.5	Very high	89.3	Confident	5 Å²	5	57.3 Å²	57.3	4%	0.041	28%	0.283	C	S	.	.	H	α-helix	trans	-57.9	-36.2	-176.7	0	0	0	0	0	113.2	S140 T141 K147 H148 M185	S140-A144 PolarHBondContact O-N 2.9Å; T141-A144 WeakPolarHBondContact O-CB 3.43Å; T141-A144 PolarHBondContact O-N 2.74Å; A144-K147 PolarHBondContact O-N 2.57Å; A144-H148 WeakPolarHBondContact O-CB 3.49Å; A144-H148 PolarHBondContact O-CD2 2.92Å; A144-H148 VanDerWaalsContact O-CD2 3.27Å; A144-H148 PolarHBondContact O-N 2.96Å; A144-M185 HydrophobicContact CB-CE 4.46Å; A144-M185 HydrophobicContact CB-SD 4.31Å
145	Y	95.8	Very high	89.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.9	-41.5	178	-168.8	-104.7	0	0	0	112.6	R143 F149 L150 H154 N156 S170 M185 S233 I236 V237 D240	R143-Y145 VanDerWaalsContact C-N 3.27Å; R143-Y145 PolarHBondContact O-N 2.67Å; Y145-F149 HydrophobicContact CD2-CB 3.48Å; Y145-F149 VanDerWaalsContact CD2-CB 3.48Å; Y145-F149 HydrophobicContact CD2-CD1 4.33Å; Y145-F149 AromaticContact CD2-CD2 3.78Å; Y145-F149 HydrophobicContact CD2-CD2 3.78Å; Y145-F149 AromaticContact CD2-CG 3.63Å; Y145-F149 HydrophobicContact CD2-CG 3.63Å; Y145-F149 HydrophobicContact CE2-CB 3.45Å; Y145-F149 VanDerWaalsContact CE2-CB 3.45Å; Y145-F149 HydrophobicContact CE2-CD1 4.18Å; Y145-F149 HydrophobicContact CE2-CD2 4.41Å; Y145-F149 AromaticContact CE2-CG 3.8Å; Y145-F149 HydrophobicContact CE2-CG 3.8Å; Y145-F149 HydrophobicContact CG-CB 4.18Å; Y145-F149 WeakPolarHBondContact O-CB 3.35Å; Y145-F149 PolarHBondContact O-N 2.91Å; Y145-L150 PolarHBondContact O-N 3.04Å; Y145-H154 AromaticContact CZ-NE2 3.87Å; Y145-H154 PolarHBondContact OH-NE2 3.47Å; Y145-N156 PolarHBondContact OH-ND2 2.88Å; Y145-S170 VanDerWaalsContact CE2-OG 3.25Å; Y145-S170 WeakPolarHBondContact CE2-OG 3.41Å; Y145-M185 HydrophobicContact CD2-SD 4.2Å; Y145-M185 HydrophobicContact CG-SD 4.46Å; Y145-S233 WeakPolarHBondContact CE1-O 3.22Å; Y145-S233 WeakPolarHBondContact OH-CA 3.41Å; Y145-S233 VanDerWaalsContact OH-CB 3.31Å; Y145-S233 WeakPolarHBondContact OH-CB 3.28Å; Y145-S233 PolarHBondContact OH-OG 3.36Å; Y145-I236 HydrophobicContact CD1-CG2 3.98Å; Y145-I236 HydrophobicContact CD2-CG2 4.19Å; Y145-I236 HydrophobicContact CE1-CB 3.93Å; Y145-I236 HydrophobicContact CE1-CG2 3.63Å; Y145-I236 HydrophobicContact CE2-CG2 3.86Å; Y145-I236 HydrophobicContact CG-CG2 4.22Å; Y145-V237 HydrophobicContact CD1-CB 3.73Å; Y145-V237 HydrophobicContact CD1-CG2 4.13Å; Y145-V237 HydrophobicContact CE1-CB 4.09Å; Y145-D240 WeakPolarHBondContact CB-OD2 3.26Å
146	R	94.6	Very high	90.5	Very high	132 Å²	132	53.5 Å²	53.5	50%	0.498	28%	0.275	S	S	.	.	H	α-helix	trans	-62	-48	171.1	175.4	175	-74	138	17.6	111.3	R143 H148 V237 E241	R143-R146 PolarHBondContact O-N 2.85Å; R143-R146 VanDerWaalsContact O-N 3.15Å; R146-H148 PolarHBondContact O-N 2.81Å; R146-V237 HydrophobicContact CB-CG2 4.14Å; R146-E241 WeakPolarHBondContact CB-OE1 3.23Å; R146-E241 IonicContact CZ-OE1 2.92Å; R146-E241 IonicContact CZ-OE2 2.82Å; R146-E241 IonicContact NE-OE1 2.69Å; R146-E241 PolarHBondContact NE-OE1 2.94Å; R146-E241 IonicContact NH1-OE1 3.88Å; R146-E241 PolarHBondContact NH1-OE1 3.25Å; R146-E241 IonicContact NH1-OE2 2.69Å; R146-E241 PolarHBondContact NH1-OE2 3.2Å; R146-E241 IonicContact NH2-OE1 3.14Å; R146-E241 PolarHBondContact NH2-OE1 3.44Å; R146-E241 VanDerWaalsContact NH2-OE1 3.1Å; R146-E241 IonicContact NH2-OE2 2.69Å; R146-E241 PolarHBondContact NH2-OE2 2.77Å
147	K	93.4	Very high	91	Very high	98 Å²	98	55.6 Å²	55.6	43%	0.426	28%	0.283	S	S	.	.	H	α-helix	trans	-63.2	-43.6	-176.3	-169.1	166.6	-174.7	166.2	0	112.5	E118 R143 A144 K152	E118-K147 IonicContact OE2-NZ 2.69Å; E118-K147 PolarHBondContact OE2-NZ 3.06Å; R143-K147 PolarHBondContact O-N 2.62Å; A144-K147 PolarHBondContact O-N 2.57Å; K147-K152 PolarHBondContact O-NZ 2.83Å
148	H	94.6	Very high	91.5	Very high	39 Å²	39	54.9 Å²	54.9	18%	0.181	28%	0.279	C	S	.	.	H	α-helix	trans	-108.1	-30.6	-167.9	-57.8	-68.5	0	0	0	116	A144 R146 K152 K172 R183 H194	A144-H148 WeakPolarHBondContact O-CB 3.49Å; A144-H148 PolarHBondContact O-CD2 2.92Å; A144-H148 VanDerWaalsContact O-CD2 3.27Å; A144-H148 PolarHBondContact O-N 2.96Å; R146-H148 PolarHBondContact O-N 2.81Å; H148-K152 WeakPolarHBondContact O-CD 3.42Å; H148-K172 VanDerWaalsContact O-CD 3.25Å; H148-K172 WeakPolarHBondContact O-CD 3.3Å; H148-K172 WeakPolarHBondContact O-CE 3.29Å; H148-K172 PolarHBondContact O-NZ 2.86Å; H148-R183 VanDerWaalsContact CB-CD 3.41Å; H148-H194 AromaticContact CD2-CE1 3.89Å; H148-H194 AromaticContact CD2-NE2 3.89Å
149	F	96.5	Very high	92.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-44.8	-170.2	-63.4	-103.2	0	0	0	113.5	Y145 G151 K152 H154 K172 R183 M185	Y145-F149 HydrophobicContact CD2-CB 3.48Å; Y145-F149 VanDerWaalsContact CD2-CB 3.48Å; Y145-F149 HydrophobicContact CD2-CD1 4.33Å; Y145-F149 AromaticContact CD2-CD2 3.78Å; Y145-F149 HydrophobicContact CD2-CD2 3.78Å; Y145-F149 AromaticContact CD2-CG 3.63Å; Y145-F149 HydrophobicContact CD2-CG 3.63Å; Y145-F149 HydrophobicContact CE2-CB 3.45Å; Y145-F149 VanDerWaalsContact CE2-CB 3.45Å; Y145-F149 HydrophobicContact CE2-CD1 4.18Å; Y145-F149 HydrophobicContact CE2-CD2 4.41Å; Y145-F149 AromaticContact CE2-CG 3.8Å; Y145-F149 HydrophobicContact CE2-CG 3.8Å; Y145-F149 HydrophobicContact CG-CB 4.18Å; Y145-F149 WeakPolarHBondContact O-CB 3.35Å; Y145-F149 PolarHBondContact O-N 2.91Å; F149-G151 PolarHBondContact O-N 2.81Å; F149-K152 PolarHBondContact O-N 2.89Å; F149-K152 VanDerWaalsContact O-N 3.09Å; F149-H154 HydrophobicContact CD1-CB 3.8Å; F149-H154 PolarHBondContact O-CE1 2.82Å; F149-H154 VanDerWaalsContact O-CE1 3.28Å; F149-H154 PolarHBondContact O-ND1 2.96Å; F149-K172 HydrophobicContact CD1-CB 3.82Å; F149-K172 HydrophobicContact CE1-CB 3.64Å; F149-K172 HydrophobicContact CZ-CB 4.46Å; F149-R183 HydrophobicContact CE2-CG 3.94Å; F149-R183 HydrophobicContact CZ-CB 4.28Å; F149-R183 HydrophobicContact CZ-CG 3.76Å; F149-M185 HydrophobicContact CE2-CB 4.06Å; F149-M185 HydrophobicContact CE2-SD 4.31Å; F149-M185 HydrophobicContact CZ-CB 3.94Å
150	L	95.7	Very high	92.7	Very high	49 Å²	49	52.3 Å²	52.3	26%	0.257	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	133.3	-175.4	-169.4	68.3	0	0	0	111.4	Y145 K152 V237	Y145-L150 PolarHBondContact O-N 3.04Å; L150-K152 PolarHBondContact O-N 3.12Å; L150-V237 HydrophobicContact CD1-CG1 4.47Å; L150-V237 HydrophobicContact CD2-CB 4.46Å; L150-V237 HydrophobicContact CD2-CG1 4.24Å; L150-V237 HydrophobicContact CD2-CG2 4.27Å
151	G	94.6	Very high	92.5	Very high	84 Å²	84	53.6 Å²	53.6	87%	0.866	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	2.5	-177.7	0	0	0	0	0	115.4	F149	F149-G151 PolarHBondContact O-N 2.81Å
152	K	95.6	Very high	92.3	Very high	110 Å²	110	52.9 Å²	52.9	48%	0.478	28%	0.283	S	S	.	.	S	Bend	trans	-117.9	162.1	-179.1	-63.6	164.3	-173.2	177.2	0	109.1	K147 H148 F149 L150 H154	K147-K152 PolarHBondContact O-NZ 2.83Å; H148-K152 WeakPolarHBondContact O-CD 3.42Å; F149-K152 PolarHBondContact O-N 2.89Å; F149-K152 VanDerWaalsContact O-N 3.09Å; L150-K152 PolarHBondContact O-N 3.12Å; K152-H154 PolarHBondContact O-N 2.79Å; K152-H154 PolarHBondContact O-ND1 2.89Å
153	E	95.9	Very high	92.1	Very high	182 Å²	182	56.3 Å²	56.3	85%	0.85	31%	0.307	S	S	*	.			trans	-65	128.9	175.5	-172.6	172.1	-167.9	0	0	110.6	K172	E153-K172 WeakPolarHBondContact O-CD 3.4Å; E153-K172 WeakPolarHBondContact O-CG 3.49Å
154	H	96.8	Very high	91.8	Very high	38 Å²	38	54.2 Å²	54.2	18%	0.176	30%	0.302	C	S	.	.			trans	-164.5	160	177.6	63.1	-73.8	0	0	0	110.6	Y145 F149 K152 N156 L171 K172 S233	Y145-H154 AromaticContact CZ-NE2 3.87Å; Y145-H154 PolarHBondContact OH-NE2 3.47Å; F149-H154 HydrophobicContact CD1-CB 3.8Å; F149-H154 PolarHBondContact O-CE1 2.82Å; F149-H154 VanDerWaalsContact O-CE1 3.28Å; F149-H154 PolarHBondContact O-ND1 2.96Å; K152-H154 PolarHBondContact O-N 2.79Å; K152-H154 PolarHBondContact O-ND1 2.89Å; H154-N156 PolarHBondContact CD2-ND2 2.82Å; H154-N156 PolarHBondContact NE2-ND2 3.3Å; H154-L171 WeakPolarHBondContact CA-O 3.25Å; H154-L171 WeakPolarHBondContact CB-O 3.42Å; H154-K172 HydrophobicContact CB-CB 4.04Å; H154-K172 HydrophobicContact CB-CG 4.48Å; H154-S233 PolarHBondContact CE1-OG 3.13Å; H154-S233 PolarHBondContact NE2-OG 2.78Å
155	M	96.5	Very high	91.5	Very high	96 Å²	96	55.2 Å²	55.2	47%	0.473	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.5	173.6	-69.7	-64.3	-69.1	0	0	110.5	Y157 S170 L171	M155-Y157 HydrophobicContact CB-CE2 3.59Å; M155-S170 WeakPolarHBondContact O-CA 3.41Å; M155-L171 PolarHBondContact N-O 3.47Å; M155-L171 PolarHBondContact O-N 3.31Å
156	N	97.9	Very high	91.3	Very high	11 Å²	11	56.7 Å²	56.7	6%	0.059	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	144.3	174.1	-71.7	-53.3	0	0	0	110.4	Y145 H154 M169 S170 V227 S233 I236	Y145-N156 PolarHBondContact OH-ND2 2.88Å; H154-N156 PolarHBondContact CD2-ND2 2.82Å; H154-N156 PolarHBondContact NE2-ND2 3.3Å; N156-M169 CarbonylContact C-O 3.54Å; N156-M169 WeakPolarHBondContact CA-O 3.18Å; N156-S170 WeakPolarHBondContact OD1-CB 3.47Å; N156-S170 PolarHBondContact OD1-OG 3.07Å; N156-V227 HydrophobicContact CB-CB 3.84Å; N156-V227 HydrophobicContact CB-CG2 3.81Å; N156-V227 PolarHBondContact O-N 3.2Å; N156-S233 PolarHBondContact ND2-OG 2.73Å; N156-I236 HydrophobicContact CB-CD1 3.92Å; N156-I236 VanDerWaalsContact CG-CD1 3.49Å
157	Y	96.8	Very high	91.3	Very high	47 Å²	47	50.4 Å²	50.4	18%	0.184	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.4	-179.6	-57.3	-92.6	0	0	0	110.7	M155 I168 M169 L171 V208 S225 P226	M155-Y157 HydrophobicContact CB-CE2 3.59Å; Y157-I168 CarbonylContact O-C 3.54Å; Y157-I168 WeakPolarHBondContact O-CA 3.18Å; Y157-M169 PolarHBondContact N-O 2.79Å; Y157-M169 PolarHBondContact O-N 3.15Å; Y157-L171 HydrophobicContact CD2-CD1 4.48Å; Y157-L171 HydrophobicContact CE2-CB 4.5Å; Y157-L171 HydrophobicContact CE2-CD1 3.96Å; Y157-L171 HydrophobicContact CE2-CG 4.3Å; Y157-V208 HydrophobicContact CD1-CG1 4.47Å; Y157-V208 HydrophobicContact CD1-CG2 4.25Å; Y157-V208 HydrophobicContact CD2-CG2 4.03Å; Y157-V208 HydrophobicContact CE1-CG2 4Å; Y157-V208 HydrophobicContact CE2-CG2 3.76Å; Y157-V208 HydrophobicContact CG-CG1 4.37Å; Y157-V208 HydrophobicContact CG-CG2 4.27Å; Y157-S225 CarbonylContact C-O 3.07Å; Y157-S225 VanDerWaalsContact CA-O 3.24Å; Y157-S225 WeakPolarHBondContact CA-O 3.4Å; Y157-P226 HydrophobicContact CD1-CB 4.26Å; Y157-P226 HydrophobicContact CE1-CB 4.22Å
158	Y	95.6	Very high	91.5	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.008	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142	170.1	64.6	-88.3	0	0	0	109.8	L167 F224 S225 P226 V227 H453 H457 Q461	Y158-L167 WeakPolarHBondContact CA-O 3.35Å; Y158-F224 CarbonylContact O-C 3.59Å; Y158-F224 VanDerWaalsContact O-CA 3.29Å; Y158-F224 WeakPolarHBondContact O-CA 3.49Å; Y158-S225 WeakPolarHBondContact CD1-O 3.35Å; Y158-S225 VanDerWaalsContact CZ-CB 3.41Å; Y158-S225 PolarHBondContact N-O 3.24Å; Y158-S225 PolarHBondContact O-N 3.12Å; Y158-P226 WeakPolarHBondContact CE1-O 3.43Å; Y158-V227 HydrophobicContact CD1-CG2 3.89Å; Y158-H453 AromaticContact CD2-NE2 3.75Å; Y158-H457 HydrophobicContact CD2-CB 4.07Å; Y158-H457 HydrophobicContact CE2-CB 3.69Å; Y158-H457 AromaticContact CE2-CG 3.72Å; Y158-H457 AromaticContact CE2-ND1 3.18Å; Y158-H457 WeakPolarHBondContact CE2-ND1 3.37Å; Y158-H457 AromaticContact CZ-ND1 3.38Å; Y158-H457 PolarHBondContact OH-ND1 3.12Å; Y158-Q461 PolarHBondContact OH-NE2 2.88Å; Y158-Q461 VanDerWaalsContact OH-NE2 3.1Å
159	C	92.7	Very high	91.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.2	176.6	-174.5	0	0	0	0	110.9	L167 R223 F224 H453	C159-L167 HydrophobicContact CB-CB 4.05Å; C159-L167 HydrophobicContact CB-CD1 4.45Å; C159-L167 PolarHBondContact N-O 2.83Å; C159-L167 PolarHBondContact O-N 3.49Å; C159-R223 PolarHBondContact SG-N 2.93Å; C159-R223 VanDerWaalsContact SG-N 3.4Å; C159-R223 PolarHBondContact SG-O 2.67Å; C159-F224 HydrophobicContact CB-CD1 3.62Å; C159-F224 HydrophobicContact CB-CD2 4.01Å; C159-F224 HydrophobicContact CB-CE1 3.6Å; C159-F224 HydrophobicContact CB-CE2 4Å; C159-F224 HydrophobicContact CB-CG 3.84Å; C159-F224 HydrophobicContact CB-CZ 3.79Å; C159-H453 PolarHBondContact O-NE2 2.84Å
160	S	82.3	Confident	91.6	Very high	37 Å²	37	43.9 Å²	43.9	26%	0.259	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	133.7	178.4	-42	0	0	0	0	110.1	H453	S160-H453 PolarHBondContact OG-CE1 3.31Å; S160-H453 PolarHBondContact OG-NE2 3.27Å
161	G	72.9	Confident	91.6	Very high	68 Å²	68	42.4 Å²	42.4	70%	0.701	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	81.3	29	176.3	0	0	0	0	0	116
162	S	81.4	Confident	91.7	Very high	14 Å²	14	39.7 Å²	39.7	10%	0.098	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	153.6	169.6	-168.3	0	0	0	0	112.1	I164 G165 T220 L222	S162-I164 PolarHBondContact O-N 3.28Å; S162-I164 VanDerWaalsContact O-N 3.12Å; S162-G165 PolarHBondContact O-N 3.43Å; S162-G165 VanDerWaalsContact O-N 3.09Å; S162-T220 WeakPolarHBondContact CA-O 3.48Å; S162-T220 PolarHBondContact OG-O 3.43Å; S162-L222 WeakPolarHBondContact OG-CD2 3.5Å
163	S	81.9	Confident	91.5	Very high	75 Å²	75	39 Å²	39	52%	0.524	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.3	174.5	46.6	0	0	0	0	114.5	D218 T220	S163-D218 PolarHBondContact OG-O 2.87Å; S163-D218 VanDerWaalsContact OG-O 3.13Å; S163-T220 VanDerWaalsContact CB-OG1 3.27Å; S163-T220 WeakPolarHBondContact CB-OG1 3.39Å; S163-T220 PolarHBondContact N-O 2.86Å; S163-T220 PolarHBondContact OG-N 3.32Å; S163-T220 PolarHBondContact OG-OG1 2.59Å
164	I	83.1	Confident	91.3	Very high	52 Å²	52	31.5 Å²	31.5	27%	0.267	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	11.8	-179.2	61.2	176.6	0	0	0	113.6	S162 L167 C216 D218 A219	S162-I164 PolarHBondContact O-N 3.28Å; S162-I164 VanDerWaalsContact O-N 3.12Å; I164-L167 HydrophobicContact CD1-CD1 3.99Å; I164-L167 HydrophobicContact CD1-CD2 3.81Å; I164-L167 HydrophobicContact CD1-CG 4.4Å; I164-L167 HydrophobicContact CG1-CD1 4.17Å; I164-L167 HydrophobicContact CG1-CD2 4.04Å; I164-L167 HydrophobicContact CG1-CG 4.37Å; I164-C216 HydrophobicContact CD1-CB 4.36Å; I164-C216 WeakPolarHBondContact CD1-SG 3.43Å; I164-D218 HydrophobicContact CG2-CB 4.39Å; I164-A219 HydrophobicContact CD1-CB 3.85Å
165	G	87.4	Confident	90.9	Very high	26 Å²	26	36.4 Å²	36.4	27%	0.268	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	86.8	-157.6	-178.4	0	0	0	0	0	113.7	S162	S162-G165 PolarHBondContact O-N 3.43Å; S162-G165 VanDerWaalsContact O-N 3.09Å
166	N	92.1	Very high	90.4	Very high	30 Å²	30	33.6 Å²	33.6	16%	0.16	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	138.9	-178.8	-66.9	-36.6	0	0	0	111.6	D450 H453	N166-D450 PolarHBondContact ND2-OD1 2.99Å; N166-H453 HydrophobicContact CB-CB 3.94Å; N166-H453 PolarHBondContact OD1-CE1 2.94Å; N166-H453 PolarHBondContact OD1-ND1 3.43Å
167	L	94.2	Very high	89.9	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	145.7	175.9	-54.3	169.8	0	0	0	110.9	Y158 C159 I164 L186 R187 L222 F224	Y158-L167 WeakPolarHBondContact CA-O 3.35Å; C159-L167 HydrophobicContact CB-CB 4.05Å; C159-L167 HydrophobicContact CB-CD1 4.45Å; C159-L167 PolarHBondContact N-O 2.83Å; C159-L167 PolarHBondContact O-N 3.49Å; I164-L167 HydrophobicContact CD1-CD1 3.99Å; I164-L167 HydrophobicContact CD1-CD2 3.81Å; I164-L167 HydrophobicContact CD1-CG 4.4Å; I164-L167 HydrophobicContact CG1-CD1 4.17Å; I164-L167 HydrophobicContact CG1-CD2 4.04Å; I164-L167 HydrophobicContact CG1-CG 4.37Å; L167-L186 HydrophobicContact CB-CD1 4.28Å; L167-R187 WeakPolarHBondContact CA-O 3.37Å; L167-L222 HydrophobicContact CD1-CD2 3.58Å; L167-F224 HydrophobicContact CB-CE1 4.43Å; L167-F224 HydrophobicContact CB-CZ 4.44Å; L167-F224 HydrophobicContact CD1-CZ 4.27Å
168	I	96.4	Very high	89.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	119.6	174	-58.7	173.6	0	0	0	109.2	Y157 R187 I236 L449 L452 H453 L456	Y157-I168 CarbonylContact O-C 3.54Å; Y157-I168 WeakPolarHBondContact O-CA 3.18Å; I168-R187 HydrophobicContact CB-CB 4.43Å; I168-R187 PolarHBondContact N-O 2.75Å; I168-R187 VanDerWaalsContact N-O 3.13Å; I168-R187 WeakPolarHBondContact O-CB 3.33Å; I168-R187 PolarHBondContact O-N 3.15Å; I168-R187 PolarHBondContact O-NH1 2.99Å; I168-I236 HydrophobicContact CG2-CD1 4.3Å; I168-I236 HydrophobicContact CG2-CG1 4.43Å; I168-L449 HydrophobicContact CB-CD1 4.39Å; I168-L449 HydrophobicContact CD1-CD1 3.69Å; I168-L449 HydrophobicContact CG1-CD1 4.07Å; I168-L452 HydrophobicContact CD1-CB 4.1Å; I168-L452 HydrophobicContact CD1-CD2 3.44Å; I168-L452 VanDerWaalsContact CD1-CD2 3.44Å; I168-L452 HydrophobicContact CD1-CG 3.52Å; I168-H453 HydrophobicContact CD1-CB 4.28Å; I168-L456 HydrophobicContact CD1-CD1 3.98Å; I168-L456 HydrophobicContact CG2-CD1 4.3Å
169	M	96.4	Very high	88.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132	-176.6	-167	174.3	65.4	0	0	111.6	N156 Y157 L171 I184 M185 L186 V208 I211 A212 F224	N156-M169 CarbonylContact C-O 3.54Å; N156-M169 WeakPolarHBondContact CA-O 3.18Å; Y157-M169 PolarHBondContact N-O 2.79Å; Y157-M169 PolarHBondContact O-N 3.15Å; M169-L171 HydrophobicContact CE-CD1 3.85Å; M169-L171 HydrophobicContact CE-CD2 3.95Å; M169-L171 HydrophobicContact CE-CG 3.87Å; M169-L171 HydrophobicContact CG-CD2 4.3Å; M169-L171 HydrophobicContact SD-CD2 4.09Å; M169-I184 HydrophobicContact CG-CG2 4.15Å; M169-I184 HydrophobicContact SD-CG2 4.01Å; M169-M185 CarbonylContact C-O 3.51Å; M169-M185 WeakPolarHBondContact CA-O 3.49Å; M169-L186 HydrophobicContact CB-CD1 3.85Å; M169-L186 HydrophobicContact CG-CB 4.3Å; M169-L186 HydrophobicContact CG-CD1 4.11Å; M169-L186 HydrophobicContact SD-CD1 4.32Å; M169-V208 HydrophobicContact CE-CB 4.07Å; M169-V208 HydrophobicContact CE-CG1 3.64Å; M169-V208 HydrophobicContact CE-CG2 3.92Å; M169-I211 HydrophobicContact SD-CG2 4.03Å; M169-A212 HydrophobicContact SD-CB 4.29Å; M169-F224 HydrophobicContact CB-CE1 3.86Å
170	S	97.9	Very high	88.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	133.8	169.3	-51.3	0	0	0	0	109.3	Y145 M155 N156 I184 M185 R187	Y145-S170 VanDerWaalsContact CE2-OG 3.25Å; Y145-S170 WeakPolarHBondContact CE2-OG 3.41Å; M155-S170 WeakPolarHBondContact O-CA 3.41Å; N156-S170 WeakPolarHBondContact OD1-CB 3.47Å; N156-S170 PolarHBondContact OD1-OG 3.07Å; S170-I184 WeakPolarHBondContact O-CA 3.36Å; S170-M185 PolarHBondContact N-O 3.39Å; S170-M185 PolarHBondContact O-N 2.89Å; S170-R187 PolarHBondContact OG-NH1 3.31Å; S170-R187 PolarHBondContact OG-NH2 3.15Å
171	L	96.3	Very high	89.2	Confident	17 Å²	17	52.9 Å²	52.9	9%	0.089	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	138.2	174.9	-65.9	-175.9	0	0	0	110.1	H154 M155 Y157 M169 L182 I184 V208 I211	H154-L171 WeakPolarHBondContact CA-O 3.25Å; H154-L171 WeakPolarHBondContact CB-O 3.42Å; M155-L171 PolarHBondContact N-O 3.47Å; M155-L171 PolarHBondContact O-N 3.31Å; Y157-L171 HydrophobicContact CD2-CD1 4.48Å; Y157-L171 HydrophobicContact CE2-CB 4.5Å; Y157-L171 HydrophobicContact CE2-CD1 3.96Å; Y157-L171 HydrophobicContact CE2-CG 4.3Å; M169-L171 HydrophobicContact CE-CD1 3.85Å; M169-L171 HydrophobicContact CE-CD2 3.95Å; M169-L171 HydrophobicContact CE-CG 3.87Å; M169-L171 HydrophobicContact CG-CD2 4.3Å; M169-L171 HydrophobicContact SD-CD2 4.09Å; L171-L182 HydrophobicContact CB-CD1 4.37Å; L171-L182 HydrophobicContact CD2-CD1 4.45Å; L171-L182 HydrophobicContact CD2-CD2 4.44Å; L171-L182 HydrophobicContact CD2-CG 4.49Å; L171-I184 HydrophobicContact CD2-CB 4.12Å; L171-I184 HydrophobicContact CD2-CG1 3.74Å; L171-I184 HydrophobicContact CD2-CG2 3.8Å; L171-V208 HydrophobicContact CD1-CG2 3.68Å; L171-I211 HydrophobicContact CD1-CD1 3.82Å; L171-I211 HydrophobicContact CD2-CD1 4.32Å; L171-I211 HydrophobicContact CD2-CG2 4.14Å
172	K	95.3	Very high	90.1	Very high	28 Å²	28	50.5 Å²	50.5	12%	0.122	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	132.7	174.8	175.4	173	174.8	-138.6	0	110.9	H148 F149 E153 H154 E174 R183	H148-K172 VanDerWaalsContact O-CD 3.25Å; H148-K172 WeakPolarHBondContact O-CD 3.3Å; H148-K172 WeakPolarHBondContact O-CE 3.29Å; H148-K172 PolarHBondContact O-NZ 2.86Å; F149-K172 HydrophobicContact CD1-CB 3.82Å; F149-K172 HydrophobicContact CE1-CB 3.64Å; F149-K172 HydrophobicContact CZ-CB 4.46Å; E153-K172 WeakPolarHBondContact O-CD 3.4Å; E153-K172 WeakPolarHBondContact O-CG 3.49Å; H154-K172 HydrophobicContact CB-CB 4.04Å; H154-K172 HydrophobicContact CB-CG 4.48Å; K172-E174 HydrophobicContact CD-CG 4.11Å; K172-E174 HydrophobicContact CG-CG 3.94Å; K172-E174 IonicContact NZ-OE1 3.96Å; K172-E174 PolarHBondContact NZ-OE1 2.69Å; K172-R183 PolarHBondContact N-O 3.1Å; K172-R183 PolarHBondContact O-N 3.06Å
173	H	92.4	Very high	90.7	Very high	94 Å²	94	50.9 Å²	50.9	44%	0.435	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	135.8	167.1	-167.2	-119.7	0	0	0	109.7	E180 F181	H173-E180 IonicContact CE1-OE1 3.2Å; H173-E180 IonicContact NE2-OE1 3.39Å; H173-F181 PolarHBondContact CD2-O 2.66Å
174	E	90.9	Very high	91.3	Very high	26 Å²	26	47.4 Å²	47.4	12%	0.121	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	122.3	176.8	-60.2	-170.1	152.2	0	0	109.6	K172 F181 R183	K172-E174 HydrophobicContact CD-CG 4.11Å; K172-E174 HydrophobicContact CG-CG 3.94Å; K172-E174 IonicContact NZ-OE1 3.96Å; K172-E174 PolarHBondContact NZ-OE1 2.69Å; E174-F181 PolarHBondContact N-O 3.45Å; E174-F181 PolarHBondContact O-N 2.79Å; E174-R183 VanDerWaalsContact CD-NE 3.25Å; E174-R183 IonicContact OE1-CZ 2.74Å; E174-R183 IonicContact OE1-NE 3.92Å; E174-R183 PolarHBondContact OE1-NE 2.99Å; E174-R183 VanDerWaalsContact OE1-NE 3.09Å; E174-R183 IonicContact OE1-NH2 2.7Å; E174-R183 IonicContact OE2-CZ 2.88Å; E174-R183 IonicContact OE2-NE 2.72Å; E174-R183 PolarHBondContact OE2-NE 2.86Å; E174-R183 IonicContact OE2-NH2 2.78Å; E174-R183 PolarHBondContact OE2-NH2 2.65Å
175	E	89.3	Confident	91.9	Very high	141 Å²	141	44.9 Å²	44.9	66%	0.659	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93	136.9	166.7	-163.4	-167.5	148.7	0	0	109.4	Q179	E175-Q179 WeakPolarHBondContact CA-O 3.11Å
176	A	86.1	Confident	92.3	Very high	36 Å²	36	44 Å²	44	30%	0.298	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	129.2	172.4	0	0	0	0	0	110.2	G178 Q179 F181	A176-G178 PolarHBondContact O-N 3.2Å; A176-Q179 PolarHBondContact N-O 3.38Å; A176-Q179 PolarHBondContact O-N 2.68Å; A176-F181 HydrophobicContact CB-CE2 4.2Å
177	Q	85.8	Confident	92.4	Very high	204 Å²	204	42.6 Å²	42.6	95%	0.953	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	35	178.6	-59.2	178.2	-13.7	0	0	113.7	Q179	Q177-Q179 VanDerWaalsContact C-N 3.27Å; Q177-Q179 PolarHBondContact O-N 3.48Å
178	G	83.3	Confident	92.3	Very high	66 Å²	66	43.3 Å²	43.3	68%	0.68	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.1	13.5	-176.8	0	0	0	0	0	114.8	A176	A176-G178 PolarHBondContact O-N 3.2Å
179	Q	87.3	Confident	92.1	Very high	104 Å²	104	48.2 Å²	48.2	49%	0.486	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.9	171.8	-64.8	-175.5	8.7	0	0	110.7	E175 A176 Q177 F181	E175-Q179 WeakPolarHBondContact CA-O 3.11Å; A176-Q179 PolarHBondContact N-O 3.38Å; A176-Q179 PolarHBondContact O-N 2.68Å; Q177-Q179 VanDerWaalsContact C-N 3.27Å; Q177-Q179 PolarHBondContact O-N 3.48Å; Q179-F181 HydrophobicContact CB-CD2 4.44Å; Q179-F181 HydrophobicContact CB-CE2 3.56Å; Q179-F181 HydrophobicContact CB-CZ 3.91Å; Q179-F181 VanDerWaalsContact O-CD2 3.27Å; Q179-F181 WeakPolarHBondContact O-CD2 3.11Å; Q179-F181 VanDerWaalsContact O-CE2 3.3Å; Q179-F181 WeakPolarHBondContact O-CE2 3.27Å
180	E	90.8	Very high	91.7	Very high	104 Å²	104	53.5 Å²	53.5	49%	0.486	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	140.6	174.6	-68.4	-174.5	146.8	0	0	111.9	H173 L199	H173-E180 IonicContact CE1-OE1 3.2Å; H173-E180 IonicContact NE2-OE1 3.39Å; E180-L199 HydrophobicContact CB-CB 3.98Å; E180-L199 HydrophobicContact CB-CD1 4.16Å; E180-L199 PolarHBondContact O-N 2.79Å
181	F	91.8	Very high	91.3	Very high	25 Å²	25	58.2 Å²	58.2	11%	0.11	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	147.4	178	-59.6	-96.7	0	0	0	111.3	H173 E174 A176 Q179 R196 I197	H173-F181 PolarHBondContact CD2-O 2.66Å; E174-F181 PolarHBondContact N-O 3.45Å; E174-F181 PolarHBondContact O-N 2.79Å; A176-F181 HydrophobicContact CB-CE2 4.2Å; Q179-F181 HydrophobicContact CB-CD2 4.44Å; Q179-F181 HydrophobicContact CB-CE2 3.56Å; Q179-F181 HydrophobicContact CB-CZ 3.91Å; Q179-F181 VanDerWaalsContact O-CD2 3.27Å; Q179-F181 WeakPolarHBondContact O-CD2 3.11Å; Q179-F181 VanDerWaalsContact O-CE2 3.3Å; Q179-F181 WeakPolarHBondContact O-CE2 3.27Å; F181-R196 HydrophobicContact CB-CG 4.05Å; F181-R196 HydrophobicContact CD1-CG 3.95Å; F181-R196 HydrophobicContact CG-CG 4.26Å; F181-I197 CarbonylContact C-O 3.58Å; F181-I197 VanDerWaalsContact CA-O 3.32Å; F181-I197 WeakPolarHBondContact CA-O 3.44Å
182	L	92.3	Very high	91.1	Very high	18 Å²	18	58.7 Å²	58.7	9%	0.094	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	109.9	165.9	-175.3	67.1	0	0	0	108.8	L171 I184 I197 L199 I211	L171-L182 HydrophobicContact CB-CD1 4.37Å; L171-L182 HydrophobicContact CD2-CD1 4.45Å; L171-L182 HydrophobicContact CD2-CD2 4.44Å; L171-L182 HydrophobicContact CD2-CG 4.49Å; L182-I184 HydrophobicContact CD2-CD1 4.37Å; L182-I184 HydrophobicContact CD2-CG1 4.21Å; L182-I184 HydrophobicContact CG-CG1 4Å; L182-I197 PolarHBondContact N-O 2.94Å; L182-I197 PolarHBondContact O-N 3.18Å; L182-L199 HydrophobicContact CB-CD1 4.31Å; L182-L199 HydrophobicContact CB-CD2 3.98Å; L182-L199 HydrophobicContact CB-CG 4.29Å; L182-I211 HydrophobicContact CD2-CD1 3.77Å; L182-I211 HydrophobicContact CD2-CG1 4.36Å
183	R	94.4	Very high	91	Very high	22 Å²	22	59.3 Å²	59.3	8%	0.083	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	131	169.5	-169.8	-178.1	-65.2	-82.6	-4.9	109.5	H148 F149 K172 E174 H194 D195	H148-R183 VanDerWaalsContact CB-CD 3.41Å; F149-R183 HydrophobicContact CE2-CG 3.94Å; F149-R183 HydrophobicContact CZ-CB 4.28Å; F149-R183 HydrophobicContact CZ-CG 3.76Å; K172-R183 PolarHBondContact N-O 3.1Å; K172-R183 PolarHBondContact O-N 3.06Å; E174-R183 VanDerWaalsContact CD-NE 3.25Å; E174-R183 IonicContact OE1-CZ 2.74Å; E174-R183 IonicContact OE1-NE 3.92Å; E174-R183 PolarHBondContact OE1-NE 2.99Å; E174-R183 VanDerWaalsContact OE1-NE 3.09Å; E174-R183 IonicContact OE1-NH2 2.7Å; E174-R183 IonicContact OE2-CZ 2.88Å; E174-R183 IonicContact OE2-NE 2.72Å; E174-R183 PolarHBondContact OE2-NE 2.86Å; E174-R183 IonicContact OE2-NH2 2.78Å; E174-R183 PolarHBondContact OE2-NH2 2.65Å; R183-H194 PolarHBondContact NH1-CE1 2.87Å; R183-H194 PolarHBondContact NH1-NE2 3.35Å; R183-D195 WeakPolarHBondContact CA-O 3.42Å
184	I	94.6	Very high	91	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	138.6	-173.3	-51.8	155.2	0	0	0	108.5	M169 S170 L171 L182 H194 D195 I197 I211 L215	M169-I184 HydrophobicContact CG-CG2 4.15Å; M169-I184 HydrophobicContact SD-CG2 4.01Å; S170-I184 WeakPolarHBondContact O-CA 3.36Å; L171-I184 HydrophobicContact CD2-CB 4.12Å; L171-I184 HydrophobicContact CD2-CG1 3.74Å; L171-I184 HydrophobicContact CD2-CG2 3.8Å; L182-I184 HydrophobicContact CD2-CD1 4.37Å; L182-I184 HydrophobicContact CD2-CG1 4.21Å; L182-I184 HydrophobicContact CG-CG1 4Å; I184-H194 WeakPolarHBondContact O-CA 3.44Å; I184-D195 PolarHBondContact N-O 3.35Å; I184-D195 PolarHBondContact O-N 3.35Å; I184-I197 HydrophobicContact CD1-CD1 3.54Å; I184-I197 HydrophobicContact CD1-CG1 3.93Å; I184-I211 HydrophobicContact CD1-CG2 3.6Å; I184-I211 HydrophobicContact CG1-CG2 3.97Å; I184-I211 HydrophobicContact CG2-CG2 3.98Å; I184-L215 HydrophobicContact CB-CD1 4.21Å; I184-L215 HydrophobicContact CG2-CD1 3.45Å; I184-L215 VanDerWaalsContact CG2-CD1 3.45Å
185	M	95.8	Very high	91	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	104.1	170.7	-166.8	167	173.2	0	0	109.6	T141 A144 Y145 F149 M169 S170 R187 T192 V193 H194 D240	T141-M185 HydrophobicContact CG2-CE 4.12Å; T141-M185 WeakPolarHBondContact O-CE 3.13Å; A144-M185 HydrophobicContact CB-CE 4.46Å; A144-M185 HydrophobicContact CB-SD 4.31Å; Y145-M185 HydrophobicContact CD2-SD 4.2Å; Y145-M185 HydrophobicContact CG-SD 4.46Å; F149-M185 HydrophobicContact CE2-CB 4.06Å; F149-M185 HydrophobicContact CE2-SD 4.31Å; F149-M185 HydrophobicContact CZ-CB 3.94Å; M169-M185 CarbonylContact C-O 3.51Å; M169-M185 WeakPolarHBondContact CA-O 3.49Å; S170-M185 PolarHBondContact N-O 3.39Å; S170-M185 PolarHBondContact O-N 2.89Å; M185-R187 PolarHBondContact O-NH1 2.93Å; M185-T192 HydrophobicContact CE-CG2 3.75Å; M185-T192 HydrophobicContact CG-CG2 3.92Å; M185-V193 CarbonylContact C-O 3.48Å; M185-V193 VanDerWaalsContact CA-O 3.31Å; M185-V193 WeakPolarHBondContact CA-O 3.46Å; M185-H194 HydrophobicContact CG-CB 4.38Å; M185-D240 HydrophobicContact CE-CB 4.25Å; M185-D240 WeakPolarHBondContact CE-OD2 3.44Å
186	L	94.7	Very high	91.1	Very high	7 Å²	7	57 Å²	57	4%	0.037	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.9	-176.2	177	65.7	0	0	0	110.1	L167 M169 T192 V193 A212 L215 F224	L167-L186 HydrophobicContact CB-CD1 4.28Å; M169-L186 HydrophobicContact CB-CD1 3.85Å; M169-L186 HydrophobicContact CG-CB 4.3Å; M169-L186 HydrophobicContact CG-CD1 4.11Å; M169-L186 HydrophobicContact SD-CD1 4.32Å; L186-T192 CarbonylContact O-C 3.57Å; L186-T192 WeakPolarHBondContact O-CA 3.23Å; L186-V193 PolarHBondContact N-O 3.05Å; L186-V193 PolarHBondContact O-N 2.91Å; L186-A212 HydrophobicContact CD2-CB 4.43Å; L186-L215 HydrophobicContact CB-CD1 3.92Å; L186-L215 HydrophobicContact CD2-CB 3.84Å; L186-L215 HydrophobicContact CD2-CD1 4.28Å; L186-F224 HydrophobicContact CD1-CZ 4.4Å
187	R	94.7	Very high	91.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	129.3	179.6	-58.8	158.8	-168.9	87.9	-3.2	109.6	L167 I168 S170 M185 T192 I236 Y239 D240 L449	L167-R187 WeakPolarHBondContact CA-O 3.37Å; I168-R187 HydrophobicContact CB-CB 4.43Å; I168-R187 PolarHBondContact N-O 2.75Å; I168-R187 VanDerWaalsContact N-O 3.13Å; I168-R187 WeakPolarHBondContact O-CB 3.33Å; I168-R187 PolarHBondContact O-N 3.15Å; I168-R187 PolarHBondContact O-NH1 2.99Å; S170-R187 PolarHBondContact OG-NH1 3.31Å; S170-R187 PolarHBondContact OG-NH2 3.15Å; M185-R187 PolarHBondContact O-NH1 2.93Å; R187-T192 HydrophobicContact CG-CG2 3.74Å; R187-I236 VanDerWaalsContact CZ-CG2 3.42Å; R187-Y239 HydrophobicContact CB-CE1 4.25Å; R187-Y239 HydrophobicContact CG-CE1 4.08Å; R187-D240 WeakPolarHBondContact CD-OD1 3.47Å; R187-D240 IonicContact CZ-OD1 3.74Å; R187-D240 IonicContact CZ-OD2 3.82Å; R187-D240 VanDerWaalsContact CZ-OD2 3.31Å; R187-D240 VanDerWaalsContact NE-CG 3.3Å; R187-D240 IonicContact NE-OD1 2.99Å; R187-D240 PolarHBondContact NE-OD1 3.25Å; R187-D240 IonicContact NE-OD2 3.2Å; R187-D240 PolarHBondContact NE-OD2 2.99Å; R187-D240 VanDerWaalsContact NE-OD2 3.07Å; R187-D240 IonicContact NH2-OD1 3.55Å; R187-D240 IonicContact NH2-OD2 2.72Å; R187-D240 PolarHBondContact NH2-OD2 3.02Å; R187-L449 HydrophobicContact CB-CD1 3.9Å
188	S	92.4	Very high	91.3	Very high	16 Å²	16	48.5 Å²	48.5	11%	0.112	25%	0.254	C	S	.	.			trans	-127	168.3	172.5	85.4	0	0	0	0	110.8	T190 K191 L449	S188-T190 PolarHBondContact O-N 3.38Å; S188-T190 VanDerWaalsContact O-N 3.09Å; S188-T190 PolarHBondContact OG-N 3.32Å; S188-T190 PolarHBondContact OG-OG1 3.29Å; S188-T190 VanDerWaalsContact OG-OG1 3.09Å; S188-K191 PolarHBondContact N-O 3.47Å; S188-K191 PolarHBondContact O-N 3.15Å; S188-K191 PolarHBondContact OG-N 2.85Å; S188-K191 PolarHBondContact OG-O 3.4Å; S188-K191 VanDerWaalsContact OG-O 3.09Å; S188-L449 WeakPolarHBondContact O-CD2 3.19Å
189	R	91.1	Very high	91.5	Very high	103 Å²	103	46 Å²	46	39%	0.389	23%	0.225	S	C	.	.	S	Bend	trans	-62.5	-16.6	-179.5	-58.3	178.4	86.1	-123.2	4.5	113.1	A446 L449 D450	R189-A446 HydrophobicContact CB-CB 3.92Å; R189-A446 HydrophobicContact CG-CB 4.44Å; R189-L449 HydrophobicContact CG-CD2 4.02Å; R189-D450 IonicContact CZ-OD2 3.18Å; R189-D450 IonicContact NE-OD1 2.72Å; R189-D450 PolarHBondContact NE-OD1 3.03Å; R189-D450 IonicContact NE-OD2 2.84Å; R189-D450 PolarHBondContact NE-OD2 3.39Å; R189-D450 IonicContact NH2-OD2 2.94Å; R189-D450 PolarHBondContact NH2-OD2 3.22Å
190	T	88.6	Confident	91.4	Very high	112 Å²	112	43.5 Å²	43.5	69%	0.687	22%	0.221	S	C	*	.	S	Bend	trans	-101.8	-43.4	177.5	52.5	0	0	0	0	113	S188	S188-T190 PolarHBondContact O-N 3.38Å; S188-T190 VanDerWaalsContact O-N 3.09Å; S188-T190 PolarHBondContact OG-N 3.32Å; S188-T190 PolarHBondContact OG-OG1 3.29Å; S188-T190 VanDerWaalsContact OG-OG1 3.09Å
191	K	89.9	Confident	90.7	Very high	98 Å²	98	42.4 Å²	42.4	43%	0.426	24%	0.238	S	C	.	.			trans	-155.5	166.2	-179.1	66.9	178.1	-177.4	-179.7	0	114.5	E113 S188 V193	E113-K191 IonicContact OE1-NZ 3.78Å; E113-K191 PolarHBondContact OE1-NZ 2.98Å; S188-K191 PolarHBondContact N-O 3.47Å; S188-K191 PolarHBondContact O-N 3.15Å; S188-K191 PolarHBondContact OG-N 2.85Å; S188-K191 PolarHBondContact OG-O 3.4Å; S188-K191 VanDerWaalsContact OG-O 3.09Å; K191-V193 HydrophobicContact CG-CG2 4.4Å
192	T	92.4	Very high	90.2	Very high	28 Å²	28	42.9 Å²	42.9	17%	0.172	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.6	168	-58.8	0	0	0	0	109.6	T141 M185 L186 R187	T141-T192 HydrophobicContact CG2-CG2 3.68Å; M185-T192 HydrophobicContact CE-CG2 3.75Å; M185-T192 HydrophobicContact CG-CG2 3.92Å; L186-T192 CarbonylContact O-C 3.57Å; L186-T192 WeakPolarHBondContact O-CA 3.23Å; R187-T192 HydrophobicContact CG-CG2 3.74Å
193	V	91.8	Very high	89.3	Confident	41 Å²	41	48 Å²	48	25%	0.248	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.7	175.4	-179.6	0	0	0	0	108.6	M185 L186 K191 L215	M185-V193 CarbonylContact C-O 3.48Å; M185-V193 VanDerWaalsContact CA-O 3.31Å; M185-V193 WeakPolarHBondContact CA-O 3.46Å; L186-V193 PolarHBondContact N-O 3.05Å; L186-V193 PolarHBondContact O-N 2.91Å; K191-V193 HydrophobicContact CG-CG2 4.4Å; V193-L215 HydrophobicContact CG1-CD1 4.26Å; V193-L215 HydrophobicContact CG1-CD2 4.14Å
194	H	92.9	Very high	88.6	Confident	54 Å²	54	53.2 Å²	53.2	25%	0.25	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	128.3	173	168.5	-132.4	0	0	0	109.1	T141 H148 R183 I184 M185	T141-H194 HydrophobicContact CG2-CB 3.9Å; H148-H194 AromaticContact CD2-CE1 3.89Å; H148-H194 AromaticContact CD2-NE2 3.89Å; R183-H194 PolarHBondContact NH1-CE1 2.87Å; R183-H194 PolarHBondContact NH1-NE2 3.35Å; I184-H194 WeakPolarHBondContact O-CA 3.44Å; M185-H194 HydrophobicContact CG-CB 4.38Å
195	D	90.8	Very high	87.9	Confident	56 Å²	56	58.3 Å²	58.3	30%	0.299	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	158.3	-173.1	-167.5	5.2	0	0	0	110.7	R183 I184 L215	R183-D195 WeakPolarHBondContact CA-O 3.42Å; I184-D195 PolarHBondContact N-O 3.35Å; I184-D195 PolarHBondContact O-N 3.35Å; D195-L215 HydrophobicContact CB-CD2 4.19Å
196	R	91.1	Very high	87.4	Confident	103 Å²	103	59.5 Å²	59.5	39%	0.389	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	94.6	178.8	-176.2	-166.7	176.6	-173.3	-1.2	109.8	F181	F181-R196 HydrophobicContact CB-CG 4.05Å; F181-R196 HydrophobicContact CD1-CG 3.95Å; F181-R196 HydrophobicContact CG-CG 4.26Å
197	I	88.7	Confident	87.2	Confident	28 Å²	28	61.9 Å²	61.9	14%	0.144	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	129.2	-177.5	-58.3	-176.5	0	0	0	109.6	L24 F181 L182 I184 L214	L24-I197 HydrophobicContact CD2-CG2 3.69Å; F181-I197 CarbonylContact C-O 3.58Å; F181-I197 VanDerWaalsContact CA-O 3.32Å; F181-I197 WeakPolarHBondContact CA-O 3.44Å; L182-I197 PolarHBondContact N-O 2.94Å; L182-I197 PolarHBondContact O-N 3.18Å; I184-I197 HydrophobicContact CD1-CD1 3.54Å; I184-I197 HydrophobicContact CD1-CG1 3.93Å; I197-L214 HydrophobicContact CD1-CD2 3.62Å
198	S	88.1	Confident	87	Confident	33 Å²	33	62.9 Å²	62.9	23%	0.231	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	135.2	170.8	-179	0	0	0	0	111.1	A200	S198-A200 VanDerWaalsContact C-N 3.31Å; S198-A200 WeakPolarHBondContact OG-CB 3.45Å; S198-A200 PolarHBondContact OG-N 3.42Å
199	L	87	Confident	86.8	Confident	14 Å²	14	64.5 Å²	64.5	7%	0.073	37%	0.371	C	S	.	.			trans	-87.8	0.9	178.1	-61.2	178.1	0	0	0	112.9	E180 L182 G201 I202 L205	E180-L199 HydrophobicContact CB-CB 3.98Å; E180-L199 HydrophobicContact CB-CD1 4.16Å; E180-L199 PolarHBondContact O-N 2.79Å; L182-L199 HydrophobicContact CB-CD1 4.31Å; L182-L199 HydrophobicContact CB-CD2 3.98Å; L182-L199 HydrophobicContact CB-CG 4.29Å; L199-G201 PolarHBondContact O-N 3.23Å; L199-I202 HydrophobicContact CD2-CD1 4.08Å; L199-I202 WeakPolarHBondContact O-CB 3.48Å; L199-I202 PolarHBondContact O-N 3.2Å; L199-L205 HydrophobicContact CD1-CD2 3.82Å; L199-L205 HydrophobicContact CD2-CD2 3.6Å; L199-L205 HydrophobicContact CG-CD2 4.36Å
200	A	84.8	Confident	86.7	Confident	50 Å²	50	61.3 Å²	61.3	41%	0.413	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	112.4	-179	0	0	0	0	0	112.6	R27 S198	R27-A200 PolarHBondContact NH1-O 2.93Å; R27-A200 PolarHBondContact NH2-O 3.05Å; R27-A200 VanDerWaalsContact NH2-O 3.13Å; S198-A200 VanDerWaalsContact C-N 3.31Å; S198-A200 WeakPolarHBondContact OG-CB 3.45Å; S198-A200 PolarHBondContact OG-N 3.42Å
201	G	77.4	Confident	86.7	Confident	81 Å²	81	56.4 Å²	56.4	84%	0.835	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	6.1	-178.1	0	0	0	0	0	115.5	L199	L199-G201 PolarHBondContact O-N 3.23Å
202	I	79.8	Confident	86.6	Confident	36 Å²	36	51.8 Å²	51.8	19%	0.185	31%	0.311	C	S	.	.			trans	-92.5	105.2	177.3	-57.9	-174.4	0	0	0	109.6	L24 L199 Q204	L24-I202 HydrophobicContact CD2-CD1 3.94Å; L24-I202 HydrophobicContact CG-CD1 4.43Å; L199-I202 HydrophobicContact CD2-CD1 4.08Å; L199-I202 WeakPolarHBondContact O-CB 3.48Å; L199-I202 PolarHBondContact O-N 3.2Å; I202-Q204 VanDerWaalsContact C-N 3.34Å; I202-Q204 WeakPolarHBondContact CG2-O 3.37Å; I202-Q204 PolarHBondContact O-N 2.95Å
203	S	74.4	Confident	86.3	Confident	124 Å²	124	55 Å²	55	87%	0.867	32%	0.322	S	S	*	.	S	Bend	trans	-75.6	-16.9	-179.5	55.2	0	0	0	0	114.8
204	Q	80.1	Confident	85.9	Confident	133 Å²	133	53.6 Å²	53.6	62%	0.621	31%	0.313	S	S	*	.	S	Bend	trans	-145.8	125	175.2	-173.8	179.1	21.5	0	0	110	I202	I202-Q204 VanDerWaalsContact C-N 3.34Å; I202-Q204 WeakPolarHBondContact CG2-O 3.37Å; I202-Q204 PolarHBondContact O-N 2.95Å
205	L	80.3	Confident	85.5	Confident	108 Å²	108	52.3 Å²	52.3	57%	0.565	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-59.3	132.7	176.6	-79.6	168	0	0	0	111.4	L199	L199-L205 HydrophobicContact CD1-CD2 3.82Å; L199-L205 HydrophobicContact CD2-CD2 3.6Å; L199-L205 HydrophobicContact CG-CD2 4.36Å
206	P	84.7	Confident	85	Confident	25 Å²	25	51.2 Å²	51.2	16%	0.162	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-64.8	145.6	174.9	26.9	-33.8	0	0	0	110.8	L24 Q210 I211	L24-P206 HydrophobicContact CD1-CG 4.38Å; P206-Q210 HydrophobicContact CB-CB 4.17Å; P206-I211 HydrophobicContact CB-CG1 4.12Å; P206-I211 HydrophobicContact CG-CD1 4.27Å; P206-I211 HydrophobicContact CG-CG1 3.73Å; P206-I211 WeakPolarHBondContact O-CD1 3.34Å
207	S	89.2	Confident	84.5	Confident	56 Å²	56	49.9 Å²	49.9	39%	0.392	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-67.4	154.5	176.8	66.7	0	0	0	0	112	P209 Q210 I211	S207-P209 VanDerWaalsContact C-N 3.34Å; S207-Q210 WeakPolarHBondContact O-CA 3.23Å; S207-Q210 WeakPolarHBondContact O-CB 3.3Å; S207-Q210 PolarHBondContact O-N 3.45Å; S207-Q210 WeakPolarHBondContact OG-CG 3.41Å; S207-Q210 PolarHBondContact OG-OE1 3.49Å; S207-I211 PolarHBondContact O-N 3.45Å
208	V	90.6	Very high	83.9	Confident	22 Å²	22	54.6 Å²	54.6	13%	0.133	33%	0.33	C	S	.	.	H	α-helix	trans	-45.1	-46.7	177.8	152.9	0	0	0	0	114	Y157 M169 L171 Q210 I211 A212 F224	Y157-V208 HydrophobicContact CD1-CG1 4.47Å; Y157-V208 HydrophobicContact CD1-CG2 4.25Å; Y157-V208 HydrophobicContact CD2-CG2 4.03Å; Y157-V208 HydrophobicContact CE1-CG2 4Å; Y157-V208 HydrophobicContact CE2-CG2 3.76Å; Y157-V208 HydrophobicContact CG-CG1 4.37Å; Y157-V208 HydrophobicContact CG-CG2 4.27Å; M169-V208 HydrophobicContact CE-CB 4.07Å; M169-V208 HydrophobicContact CE-CG1 3.64Å; M169-V208 HydrophobicContact CE-CG2 3.92Å; L171-V208 HydrophobicContact CD1-CG2 3.68Å; V208-Q210 PolarHBondContact O-N 3.34Å; V208-I211 PolarHBondContact O-N 3.46Å; V208-A212 PolarHBondContact O-N 3.23Å; V208-F224 HydrophobicContact CG1-CB 3.33Å; V208-F224 HydrophobicContact CG1-CD1 3.9Å; V208-F224 HydrophobicContact CG1-CD2 3.45Å; V208-F224 VanDerWaalsContact CG1-CD2 3.45Å; V208-F224 HydrophobicContact CG1-CE2 4.16Å; V208-F224 HydrophobicContact CG1-CG 3.28Å
209	P	89.7	Confident	83.2	Confident	49 Å²	49	53.2 Å²	53.2	32%	0.318	32%	0.321	S	S	.	.	H	α-helix	trans	-65.9	-30.9	175.4	-23.4	35.6	0	0	0	114.6	S207 K213 L222 F224	S207-P209 VanDerWaalsContact C-N 3.34Å; P209-K213 WeakPolarHBondContact O-CB 3.32Å; P209-K213 PolarHBondContact O-N 2.89Å; P209-K213 VanDerWaalsContact O-N 3.07Å; P209-L222 HydrophobicContact CB-CB 4.08Å; P209-F224 HydrophobicContact CG-CD2 4.38Å
210	Q	87.7	Confident	82.8	Confident	36 Å²	36	56.3 Å²	56.3	17%	0.168	34%	0.341	C	S	.	.	H	α-helix	trans	-72.3	-39.4	175.4	-68.2	167.8	-67.7	0	0	111.4	P206 S207 V208 K213 L214	P206-Q210 HydrophobicContact CB-CB 4.17Å; S207-Q210 WeakPolarHBondContact O-CA 3.23Å; S207-Q210 WeakPolarHBondContact O-CB 3.3Å; S207-Q210 PolarHBondContact O-N 3.45Å; S207-Q210 WeakPolarHBondContact OG-CG 3.41Å; S207-Q210 PolarHBondContact OG-OE1 3.49Å; V208-Q210 PolarHBondContact O-N 3.34Å; Q210-K213 PolarHBondContact O-N 2.87Å; Q210-L214 PolarHBondContact O-N 3.2Å
211	I	89	Confident	82.4	Confident	9 Å²	9	56.7 Å²	56.7	5%	0.046	35%	0.349	C	S	.	.	H	α-helix	trans	-61	-50.2	173.8	-63.7	161.4	0	0	0	110	M169 L171 L182 I184 P206 S207 V208 K213 L214 L215	M169-I211 HydrophobicContact SD-CG2 4.03Å; L171-I211 HydrophobicContact CD1-CD1 3.82Å; L171-I211 HydrophobicContact CD2-CD1 4.32Å; L171-I211 HydrophobicContact CD2-CG2 4.14Å; L182-I211 HydrophobicContact CD2-CD1 3.77Å; L182-I211 HydrophobicContact CD2-CG1 4.36Å; I184-I211 HydrophobicContact CD1-CG2 3.6Å; I184-I211 HydrophobicContact CG1-CG2 3.97Å; I184-I211 HydrophobicContact CG2-CG2 3.98Å; P206-I211 HydrophobicContact CB-CG1 4.12Å; P206-I211 HydrophobicContact CG-CD1 4.27Å; P206-I211 HydrophobicContact CG-CG1 3.73Å; P206-I211 WeakPolarHBondContact O-CD1 3.34Å; S207-I211 PolarHBondContact O-N 3.45Å; V208-I211 PolarHBondContact O-N 3.46Å; I211-K213 VanDerWaalsContact C-N 3.27Å; I211-K213 PolarHBondContact O-N 2.84Å; I211-L214 WeakPolarHBondContact O-CB 3.45Å; I211-L214 PolarHBondContact O-N 3.47Å; I211-L214 VanDerWaalsContact O-N 3.1Å; I211-L215 PolarHBondContact O-N 2.89Å
212	A	87.9	Confident	82.7	Confident	1 Å²	1	54 Å²	54	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-58.9	-39	177.7	0	0	0	0	0	112.2	M169 L186 V208 L214 L215 C216 L222 F224	M169-A212 HydrophobicContact SD-CB 4.29Å; L186-A212 HydrophobicContact CD2-CB 4.43Å; V208-A212 PolarHBondContact O-N 3.23Å; A212-L214 PolarHBondContact O-N 3.2Å; A212-L215 PolarHBondContact O-N 2.81Å; A212-C216 PolarHBondContact O-N 3.27Å; A212-L222 HydrophobicContact CB-CD1 3.94Å; A212-F224 HydrophobicContact CB-CE2 3.52Å; A212-F224 HydrophobicContact CB-CZ 3.57Å
213	K	85.7	Confident	83.1	Confident	96 Å²	96	61.3 Å²	61.3	42%	0.417	34%	0.341	S	S	.	.	H	α-helix	trans	-69.5	-26.9	176.6	-171.8	161.8	-173.7	164.3	0	114.3	P209 Q210 I211 L215 C216 D217	P209-K213 WeakPolarHBondContact O-CB 3.32Å; P209-K213 PolarHBondContact O-N 2.89Å; P209-K213 VanDerWaalsContact O-N 3.07Å; Q210-K213 PolarHBondContact O-N 2.87Å; I211-K213 VanDerWaalsContact C-N 3.27Å; I211-K213 PolarHBondContact O-N 2.84Å; K213-L215 VanDerWaalsContact C-N 3.27Å; K213-L215 PolarHBondContact O-N 2.89Å; K213-C216 WeakPolarHBondContact CA-O 3.4Å; K213-C216 CarbonylContact O-C 3.5Å; K213-D217 WeakPolarHBondContact CE-O 3.43Å
214	L	84.3	Confident	84	Confident	12 Å²	12	56.8 Å²	56.8	6%	0.063	31%	0.306	C	S	.	.	H	α-helix	trans	-68.7	-27.9	173.4	-176.8	63.1	0	0	0	112.4	L24 K25 K28 I197 Q210 I211 A212	L24-L214 HydrophobicContact CB-CD1 4.33Å; L24-L214 HydrophobicContact CB-CD2 4Å; L24-L214 HydrophobicContact CD1-CD2 4.4Å; L24-L214 HydrophobicContact CD2-CD2 4.25Å; L24-L214 HydrophobicContact CG-CD2 4.46Å; K25-L214 HydrophobicContact CG-CD1 3.81Å; K28-L214 HydrophobicContact CD-CD1 4.48Å; K28-L214 PolarHBondContact NZ-O 3.06Å; I197-L214 HydrophobicContact CD1-CD2 3.62Å; Q210-L214 PolarHBondContact O-N 3.2Å; I211-L214 WeakPolarHBondContact O-CB 3.45Å; I211-L214 PolarHBondContact O-N 3.47Å; I211-L214 VanDerWaalsContact O-N 3.1Å; A212-L214 PolarHBondContact O-N 3.2Å
215	L	83.6	Confident	84.6	Confident	27 Å²	27	52.5 Å²	52.5	14%	0.141	29%	0.29	C	S	.	.	H	α-helix	trans	-91.8	-28.9	177	-60.3	-175.3	0	0	0	113.1	I184 L186 V193 D195 I211 A212 K213	I184-L215 HydrophobicContact CB-CD1 4.21Å; I184-L215 HydrophobicContact CG2-CD1 3.45Å; I184-L215 VanDerWaalsContact CG2-CD1 3.45Å; L186-L215 HydrophobicContact CB-CD1 3.92Å; L186-L215 HydrophobicContact CD2-CB 3.84Å; L186-L215 HydrophobicContact CD2-CD1 4.28Å; V193-L215 HydrophobicContact CG1-CD1 4.26Å; V193-L215 HydrophobicContact CG1-CD2 4.14Å; D195-L215 HydrophobicContact CB-CD2 4.19Å; I211-L215 PolarHBondContact O-N 2.89Å; A212-L215 PolarHBondContact O-N 2.81Å; K213-L215 VanDerWaalsContact C-N 3.27Å; K213-L215 PolarHBondContact O-N 2.89Å
216	C	81.8	Confident	85.4	Confident	33 Å²	33	49.8 Å²	49.8	22%	0.223	28%	0.279	C	S	.	.			trans	-140.1	100.7	176.1	-173.2	0	0	0	0	111	I164 A212 K213 D218 A219	I164-C216 HydrophobicContact CD1-CB 4.36Å; I164-C216 WeakPolarHBondContact CD1-SG 3.43Å; A212-C216 PolarHBondContact O-N 3.27Å; K213-C216 WeakPolarHBondContact CA-O 3.4Å; K213-C216 CarbonylContact O-C 3.5Å; C216-D218 VanDerWaalsContact C-N 3.32Å; C216-D218 PolarHBondContact O-N 3.44Å; C216-A219 HydrophobicContact CB-CB 4.34Å; C216-A219 VanDerWaalsContact O-CB 3.26Å; C216-A219 WeakPolarHBondContact O-CB 3.35Å; C216-A219 PolarHBondContact O-N 3.49Å
217	D	79.3	Confident	86	Confident	75 Å²	75	49.6 Å²	49.6	40%	0.401	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-28.2	-174.8	-95.4	-61.5	0	0	0	113.6	K25 K213 A219	K25-D217 IonicContact NZ-OD1 2.66Å; K25-D217 PolarHBondContact NZ-OD1 3.35Å; K25-D217 IonicContact NZ-OD2 3.1Å; K25-D217 PolarHBondContact NZ-OD2 2.96Å; K213-D217 WeakPolarHBondContact CE-O 3.43Å; D217-A219 PolarHBondContact O-N 3.17Å
218	D	76	Confident	86.3	Confident	126 Å²	126	50 Å²	50	67%	0.674	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-9.4	177.8	-50.8	-61.4	0	0	0	113.7	S163 I164 C216 T220	S163-D218 PolarHBondContact OG-O 2.87Å; S163-D218 VanDerWaalsContact OG-O 3.13Å; I164-D218 HydrophobicContact CG2-CB 4.39Å; C216-D218 VanDerWaalsContact C-N 3.32Å; C216-D218 PolarHBondContact O-N 3.44Å; D218-T220 PolarHBondContact O-N 2.92Å
219	A	74.9	Confident	86.5	Confident	4 Å²	4	50.9 Å²	50.9	3%	0.033	28%	0.276	C	S	.	.			trans	-75.7	112.4	-175.2	0	0	0	0	0	111.6	I164 C216 D217 L222	I164-A219 HydrophobicContact CD1-CB 3.85Å; C216-A219 HydrophobicContact CB-CB 4.34Å; C216-A219 VanDerWaalsContact O-CB 3.26Å; C216-A219 WeakPolarHBondContact O-CB 3.35Å; C216-A219 PolarHBondContact O-N 3.49Å; D217-A219 PolarHBondContact O-N 3.17Å; A219-L222 HydrophobicContact CB-CD1 3.73Å; A219-L222 HydrophobicContact CB-CD2 4.07Å; A219-L222 HydrophobicContact CB-CG 4.03Å
220	T	78.1	Confident	86.5	Confident	80 Å²	80	53.8 Å²	53.8	49%	0.491	30%	0.295	S	S	.	.			trans	-118.2	166.2	174.5	68.8	0	0	0	0	111	S162 S163 D218 L222	S162-T220 WeakPolarHBondContact CA-O 3.48Å; S162-T220 PolarHBondContact OG-O 3.43Å; S163-T220 VanDerWaalsContact CB-OG1 3.27Å; S163-T220 WeakPolarHBondContact CB-OG1 3.39Å; S163-T220 PolarHBondContact N-O 2.86Å; S163-T220 PolarHBondContact OG-N 3.32Å; S163-T220 PolarHBondContact OG-OG1 2.59Å; D218-T220 PolarHBondContact O-N 2.92Å; T220-L222 PolarHBondContact O-N 3.32Å; T220-L222 VanDerWaalsContact O-N 3.11Å
221	G	76.6	Confident	86.8	Confident	57 Å²	57	58.9 Å²	58.9	59%	0.588	31%	0.313	S	S	*	.	S	Bend	trans	67.5	6.9	179.3	0	0	0	0	0	115.7	R223	G221-R223 PolarHBondContact O-N 3.42Å
222	L	84	Confident	87	Confident	24 Å²	24	58.4 Å²	58.4	13%	0.126	31%	0.311	C	S	.	.			trans	-55.3	107.1	-169	-71.5	176	0	0	0	113.8	S162 L167 P209 A212 A219 T220 F224	S162-L222 WeakPolarHBondContact OG-CD2 3.5Å; L167-L222 HydrophobicContact CD1-CD2 3.58Å; P209-L222 HydrophobicContact CB-CB 4.08Å; A212-L222 HydrophobicContact CB-CD1 3.94Å; A219-L222 HydrophobicContact CB-CD1 3.73Å; A219-L222 HydrophobicContact CB-CD2 4.07Å; A219-L222 HydrophobicContact CB-CG 4.03Å; T220-L222 PolarHBondContact O-N 3.32Å; T220-L222 VanDerWaalsContact O-N 3.11Å; L222-F224 HydrophobicContact CB-CD2 4.45Å; L222-F224 HydrophobicContact CB-CE2 4.24Å; L222-F224 HydrophobicContact CD1-CE2 4.3Å; L222-F224 HydrophobicContact CD2-CE2 3.83Å; L222-F224 HydrophobicContact CD2-CZ 4.36Å; L222-F224 HydrophobicContact CG-CE2 4.36Å
223	R	86.9	Confident	87.4	Confident	190 Å²	190	59.5 Å²	59.5	72%	0.717	32%	0.318	S	S	*	.			trans	-120.8	96.6	168.8	-61.2	-159.9	-51.1	144.5	6.8	110	C159 G221	C159-R223 PolarHBondContact SG-N 2.93Å; C159-R223 VanDerWaalsContact SG-N 3.4Å; C159-R223 PolarHBondContact SG-O 2.67Å; G221-R223 PolarHBondContact O-N 3.42Å
224	F	92.8	Very high	87.9	Confident	30 Å²	30	59.7 Å²	59.7	13%	0.132	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	140.7	173.6	-74.4	-95	0	0	0	111.5	Y158 C159 L167 M169 L186 V208 P209 A212 L222	Y158-F224 CarbonylContact O-C 3.59Å; Y158-F224 VanDerWaalsContact O-CA 3.29Å; Y158-F224 WeakPolarHBondContact O-CA 3.49Å; C159-F224 HydrophobicContact CB-CD1 3.62Å; C159-F224 HydrophobicContact CB-CD2 4.01Å; C159-F224 HydrophobicContact CB-CE1 3.6Å; C159-F224 HydrophobicContact CB-CE2 4Å; C159-F224 HydrophobicContact CB-CG 3.84Å; C159-F224 HydrophobicContact CB-CZ 3.79Å; L167-F224 HydrophobicContact CB-CE1 4.43Å; L167-F224 HydrophobicContact CB-CZ 4.44Å; L167-F224 HydrophobicContact CD1-CZ 4.27Å; M169-F224 HydrophobicContact CB-CE1 3.86Å; L186-F224 HydrophobicContact CD1-CZ 4.4Å; V208-F224 HydrophobicContact CG1-CB 3.33Å; V208-F224 HydrophobicContact CG1-CD1 3.9Å; V208-F224 HydrophobicContact CG1-CD2 3.45Å; V208-F224 VanDerWaalsContact CG1-CD2 3.45Å; V208-F224 HydrophobicContact CG1-CE2 4.16Å; V208-F224 HydrophobicContact CG1-CG 3.28Å; P209-F224 HydrophobicContact CG-CD2 4.38Å; A212-F224 HydrophobicContact CB-CE2 3.52Å; A212-F224 HydrophobicContact CB-CZ 3.57Å; L222-F224 HydrophobicContact CB-CD2 4.45Å; L222-F224 HydrophobicContact CB-CE2 4.24Å; L222-F224 HydrophobicContact CD1-CE2 4.3Å; L222-F224 HydrophobicContact CD2-CE2 3.83Å; L222-F224 HydrophobicContact CD2-CZ 4.36Å; L222-F224 HydrophobicContact CG-CE2 4.36Å
225	S	94.6	Very high	88.5	Confident	42 Å²	42	59.7 Å²	59.7	29%	0.294	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	145.7	168.6	-63.4	0	0	0	0	109.3	Y157 Y158	Y157-S225 CarbonylContact C-O 3.07Å; Y157-S225 VanDerWaalsContact CA-O 3.24Å; Y157-S225 WeakPolarHBondContact CA-O 3.4Å; Y158-S225 WeakPolarHBondContact CD1-O 3.35Å; Y158-S225 VanDerWaalsContact CZ-CB 3.41Å; Y158-S225 PolarHBondContact N-O 3.24Å; Y158-S225 PolarHBondContact O-N 3.12Å
226	P	96.2	Very high	89.1	Confident	52 Å²	52	58.4 Å²	58.4	34%	0.338	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	142.3	174.5	29.2	-34.5	0	0	0	110.8	Y157 Y158 L228	Y157-P226 HydrophobicContact CD1-CB 4.26Å; Y157-P226 HydrophobicContact CE1-CB 4.22Å; Y158-P226 WeakPolarHBondContact CE1-O 3.43Å; P226-L228 HydrophobicContact CB-CD2 4.08Å; P226-L228 HydrophobicContact CG-CD2 4.08Å; P226-L228 HydrophobicContact CG-CG 4.32Å; P226-L228 PolarHBondContact O-N 3.44Å
227	V	97.1	Very high	89.7	Confident	20 Å²	20	57.5 Å²	57.5	12%	0.121	31%	0.307	C	S	.	.			trans	-75.1	116.4	165.2	176.3	0	0	0	0	107.5	N156 Y158 L456	N156-V227 HydrophobicContact CB-CB 3.84Å; N156-V227 HydrophobicContact CB-CG2 3.81Å; N156-V227 PolarHBondContact O-N 3.2Å; Y158-V227 HydrophobicContact CD1-CG2 3.89Å; V227-L456 HydrophobicContact CG1-CD2 3.95Å; V227-L456 HydrophobicContact CG2-CB 4.4Å; V227-L456 HydrophobicContact CG2-CD1 4.09Å
228	L	95.6	Very high	90.4	Very high	66 Å²	66	55.2 Å²	55.2	35%	0.346	30%	0.299	S	S	.	.			trans	-105.6	-5.3	179.7	-58.3	177.6	0	0	0	112.6	P226 P230 S460 V463 L464	P226-L228 HydrophobicContact CB-CD2 4.08Å; P226-L228 HydrophobicContact CG-CD2 4.08Å; P226-L228 HydrophobicContact CG-CG 4.32Å; P226-L228 PolarHBondContact O-N 3.44Å; L228-P230 WeakPolarHBondContact O-CD 3.48Å; L228-S460 PolarHBondContact N-OG 3.44Å; L228-V463 HydrophobicContact CB-CB 4.42Å; L228-V463 HydrophobicContact CB-CG1 4.06Å; L228-L464 HydrophobicContact CD1-CD1 3.83Å; L228-L464 HydrophobicContact CD1-CD2 3.61Å; L228-L464 HydrophobicContact CD1-CG 3.65Å
229	Y	94.4	Very high	91.2	Very high	39 Å²	39	49.2 Å²	49.2	15%	0.153	27%	0.267	C	S	.	.			trans	-72.5	118.8	178.7	-177.7	-133.8	0	0	0	111.5	R231 G232 L235 Q459	Y229-R231 HydrophobicContact CD1-CB 4.2Å; Y229-R231 HydrophobicContact CE1-CB 3.59Å; Y229-R231 HydrophobicContact CE2-CB 4.4Å; Y229-R231 PolarHBondContact O-N 2.88Å; Y229-R231 VanDerWaalsContact O-N 3.1Å; Y229-G232 PolarHBondContact O-N 3.25Å; Y229-L235 HydrophobicContact CD1-CD1 4.36Å; Y229-L235 HydrophobicContact CE1-CD1 3.95Å; Y229-Q459 HydrophobicContact CD1-CB 3.93Å; Y229-Q459 HydrophobicContact CD1-CG 4.07Å; Y229-Q459 HydrophobicContact CD2-CB 3.54Å; Y229-Q459 HydrophobicContact CD2-CG 3.99Å; Y229-Q459 HydrophobicContact CE1-CB 4.4Å; Y229-Q459 HydrophobicContact CE1-CG 4.05Å; Y229-Q459 HydrophobicContact CE2-CB 4.03Å; Y229-Q459 HydrophobicContact CE2-CG 3.96Å; Y229-Q459 HydrophobicContact CG-CB 3.47Å; Y229-Q459 VanDerWaalsContact CG-CB 3.47Å; Y229-Q459 HydrophobicContact CG-CG 4.03Å
230	P	90.6	Very high	92.1	Very high	111 Å²	111	49.2 Å²	49.2	72%	0.721	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.4	-174.9	-26.3	36.2	0	0	0	115.2	L228	L228-P230 WeakPolarHBondContact O-CD 3.48Å
231	R	92.5	Very high	92.7	Very high	142 Å²	142	46.9 Å²	46.9	54%	0.536	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	8.8	174.4	-62.9	176.9	62.9	-166.3	-1.2	113.4	Y229 S233 Q234 L235	Y229-R231 HydrophobicContact CD1-CB 4.2Å; Y229-R231 HydrophobicContact CE1-CB 3.59Å; Y229-R231 HydrophobicContact CE2-CB 4.4Å; Y229-R231 PolarHBondContact O-N 2.88Å; Y229-R231 VanDerWaalsContact O-N 3.1Å; R231-S233 PolarHBondContact O-N 3.04Å; R231-Q234 VanDerWaalsContact C-OE1 3.24Å; R231-Q234 VanDerWaalsContact CA-OE1 3.22Å; R231-Q234 PolarHBondContact O-N 3.24Å; R231-Q234 PolarHBondContact O-OE1 3.11Å; R231-L235 PolarHBondContact O-N 2.87Å
232	G	94.9	Very high	93.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.2	-42	-176.2	0	0	0	0	0	112.8	Y229 Q234 L235 I236	Y229-G232 PolarHBondContact O-N 3.25Å; G232-Q234 VanDerWaalsContact C-N 3.27Å; G232-Q234 PolarHBondContact O-N 2.92Å; G232-L235 PolarHBondContact O-N 3.26Å; G232-I236 WeakPolarHBondContact O-CG1 3.23Å; G232-I236 PolarHBondContact O-N 2.95Å
233	S	96.6	Very high	92.9	Very high	24 Å²	24	44.7 Å²	44.7	17%	0.168	22%	0.223	C	C	.	.	H	α-helix	trans	-64.9	-29.2	179.3	-56.6	0	0	0	0	113.2	Y145 H154 N156 R231 I236 V237	Y145-S233 WeakPolarHBondContact CE1-O 3.22Å; Y145-S233 WeakPolarHBondContact OH-CA 3.41Å; Y145-S233 VanDerWaalsContact OH-CB 3.31Å; Y145-S233 WeakPolarHBondContact OH-CB 3.28Å; Y145-S233 PolarHBondContact OH-OG 3.36Å; H154-S233 PolarHBondContact CE1-OG 3.13Å; H154-S233 PolarHBondContact NE2-OG 2.78Å; N156-S233 PolarHBondContact ND2-OG 2.73Å; R231-S233 PolarHBondContact O-N 3.04Å; S233-I236 PolarHBondContact O-N 3.34Å; S233-V237 PolarHBondContact O-N 3.48Å
234	Q	95.6	Very high	92.7	Very high	99 Å²	99	37.1 Å²	37.1	46%	0.463	20%	0.198	S	C	.	.	H	α-helix	trans	-72.3	-31.6	173.4	-67.7	80.2	-4.2	0	0	112.1	R231 G232 A238	R231-Q234 VanDerWaalsContact C-OE1 3.24Å; R231-Q234 VanDerWaalsContact CA-OE1 3.22Å; R231-Q234 PolarHBondContact O-N 3.24Å; R231-Q234 PolarHBondContact O-OE1 3.11Å; G232-Q234 VanDerWaalsContact C-N 3.27Å; G232-Q234 PolarHBondContact O-N 2.92Å; Q234-A238 WeakPolarHBondContact O-CB 3.33Å; Q234-A238 PolarHBondContact O-N 3.42Å
235	L	95.7	Very high	92.1	Very high	12 Å²	12	37 Å²	37	6%	0.063	20%	0.199	C	C	.	.	H	α-helix	trans	-74.7	-36.3	172.6	-56.6	-173.8	0	0	0	111.6	Y229 R231 G232 A238 Y239 L452 E455 L456 L483 L484	Y229-L235 HydrophobicContact CD1-CD1 4.36Å; Y229-L235 HydrophobicContact CE1-CD1 3.95Å; R231-L235 PolarHBondContact O-N 2.87Å; G232-L235 PolarHBondContact O-N 3.26Å; L235-A238 PolarHBondContact O-N 3.13Å; L235-Y239 PolarHBondContact O-N 3.39Å; L235-L452 HydrophobicContact CB-CD1 3.46Å; L235-L452 VanDerWaalsContact CB-CD1 3.46Å; L235-E455 HydrophobicContact CD1-CG 3.71Å; L235-L456 HydrophobicContact CD1-CD2 4.34Å; L235-L483 HydrophobicContact CB-CD2 4.2Å; L235-L483 HydrophobicContact CD1-CD2 4.15Å; L235-L483 HydrophobicContact CD2-CD2 4.32Å; L235-L483 HydrophobicContact CG-CD2 4.46Å; L235-L484 HydrophobicContact CD2-CD2 4.29Å; L235-L484 HydrophobicContact CD2-CG 4.4Å
236	I	96.6	Very high	91.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-45.2	177.4	-66.8	165.9	0	0	0	111.4	Y145 N156 I168 R187 G232 S233 A238 Y239 D240 L452 L456	Y145-I236 HydrophobicContact CD1-CG2 3.98Å; Y145-I236 HydrophobicContact CD2-CG2 4.19Å; Y145-I236 HydrophobicContact CE1-CB 3.93Å; Y145-I236 HydrophobicContact CE1-CG2 3.63Å; Y145-I236 HydrophobicContact CE2-CG2 3.86Å; Y145-I236 HydrophobicContact CG-CG2 4.22Å; N156-I236 HydrophobicContact CB-CD1 3.92Å; N156-I236 VanDerWaalsContact CG-CD1 3.49Å; I168-I236 HydrophobicContact CG2-CD1 4.3Å; I168-I236 HydrophobicContact CG2-CG1 4.43Å; R187-I236 VanDerWaalsContact CZ-CG2 3.42Å; G232-I236 WeakPolarHBondContact O-CG1 3.23Å; G232-I236 PolarHBondContact O-N 2.95Å; S233-I236 PolarHBondContact O-N 3.34Å; I236-A238 VanDerWaalsContact C-N 3.31Å; I236-A238 PolarHBondContact O-N 2.84Å; I236-Y239 WeakPolarHBondContact O-CB 3.32Å; I236-Y239 PolarHBondContact O-N 3.34Å; I236-Y239 VanDerWaalsContact O-N 3.14Å; I236-D240 PolarHBondContact O-N 2.8Å; I236-L452 HydrophobicContact CG1-CD2 4.22Å; I236-L456 HydrophobicContact CD1-CD1 4.04Å; I236-L456 HydrophobicContact CG1-CD1 3.92Å
237	V	95.1	Very high	91.7	Very high	14 Å²	14	37.7 Å²	37.7	9%	0.085	20%	0.198	C	C	.	.	H	α-helix	trans	-66.6	-33.8	176.2	74.8	0	0	0	0	112.3	Y145 R146 L150 S233 Y239 D240 E241	Y145-V237 HydrophobicContact CD1-CB 3.73Å; Y145-V237 HydrophobicContact CD1-CG2 4.13Å; Y145-V237 HydrophobicContact CE1-CB 4.09Å; R146-V237 HydrophobicContact CB-CG2 4.14Å; L150-V237 HydrophobicContact CD1-CG1 4.47Å; L150-V237 HydrophobicContact CD2-CB 4.46Å; L150-V237 HydrophobicContact CD2-CG1 4.24Å; L150-V237 HydrophobicContact CD2-CG2 4.27Å; S233-V237 PolarHBondContact O-N 3.48Å; V237-Y239 VanDerWaalsContact C-N 3.25Å; V237-Y239 PolarHBondContact O-N 3.29Å; V237-D240 PolarHBondContact O-N 3.34Å; V237-E241 HydrophobicContact CG2-CG 4.31Å; V237-E241 WeakPolarHBondContact O-CB 3.45Å; V237-E241 PolarHBondContact O-N 2.05Å
238	A	93	Very high	91.6	Very high	28 Å²	28	36.7 Å²	36.7	23%	0.231	19%	0.192	C	C	.	.	H	α-helix	trans	-67.8	-25.7	174.4	0	0	0	0	0	112.9	Q234 L235 I236 L484 F487	Q234-A238 WeakPolarHBondContact O-CB 3.33Å; Q234-A238 PolarHBondContact O-N 3.42Å; L235-A238 PolarHBondContact O-N 3.13Å; I236-A238 VanDerWaalsContact C-N 3.31Å; I236-A238 PolarHBondContact O-N 2.84Å; A238-L484 HydrophobicContact CB-CD2 4.03Å; A238-F487 HydrophobicContact CB-CD2 3.92Å; A238-F487 HydrophobicContact CB-CE2 3.9Å
239	Y	94.1	Very high	91.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-75.3	-53.2	168.4	171.7	-90.7	0	0	0	112	R187 L235 I236 V237 E241 H242 R445 L448 L449 L452 F487	R187-Y239 HydrophobicContact CB-CE1 4.25Å; R187-Y239 HydrophobicContact CG-CE1 4.08Å; L235-Y239 PolarHBondContact O-N 3.39Å; I236-Y239 WeakPolarHBondContact O-CB 3.32Å; I236-Y239 PolarHBondContact O-N 3.34Å; I236-Y239 VanDerWaalsContact O-N 3.14Å; V237-Y239 VanDerWaalsContact C-N 3.25Å; V237-Y239 PolarHBondContact O-N 3.29Å; Y239-E241 VanDerWaalsContact C-N 3.27Å; Y239-E241 PolarHBondContact O-N 3.19Å; Y239-H242 WeakPolarHBondContact O-CB 3.37Å; Y239-H242 PolarHBondContact O-N 3.17Å; Y239-H242 VanDerWaalsContact O-N 3.11Å; Y239-H242 PolarHBondContact O-ND1 2.93Å; Y239-R445 WeakPolarHBondContact OH-CG 3.49Å; Y239-L448 HydrophobicContact CD2-CB 4.02Å; Y239-L448 HydrophobicContact CE2-CB 4.06Å; Y239-L449 HydrophobicContact CE1-CD1 4.1Å; Y239-L449 HydrophobicContact CE2-CB 3.68Å; Y239-L449 HydrophobicContact CE2-CD1 4.06Å; Y239-L449 HydrophobicContact CE2-CG 4.48Å; Y239-L452 HydrophobicContact CD1-CD2 4.33Å; Y239-L452 HydrophobicContact CD2-CD2 4.3Å; Y239-L452 HydrophobicContact CG-CD2 3.8Å; Y239-F487 HydrophobicContact CD2-CE1 4.19Å; Y239-F487 HydrophobicContact CD2-CZ 4.38Å
240	D	93.2	Very high	91.9	Very high	4 Å²	4	33 Å²	33	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-60.2	-40	-174.9	-69.9	-37	0	0	0	111.5	A142 Y145 M185 R187 I236 V237 H242	A142-D240 WeakPolarHBondContact CA-O 3.09Å; A142-D240 VanDerWaalsContact CB-O 3.27Å; A142-D240 WeakPolarHBondContact CB-O 3.48Å; A142-D240 CarbonylContact O-C 3.59Å; A142-D240 WeakPolarHBondContact O-CB 3.32Å; Y145-D240 WeakPolarHBondContact CB-OD2 3.26Å; M185-D240 HydrophobicContact CE-CB 4.25Å; M185-D240 WeakPolarHBondContact CE-OD2 3.44Å; R187-D240 WeakPolarHBondContact CD-OD1 3.47Å; R187-D240 IonicContact CZ-OD1 3.74Å; R187-D240 IonicContact CZ-OD2 3.82Å; R187-D240 VanDerWaalsContact CZ-OD2 3.31Å; R187-D240 VanDerWaalsContact NE-CG 3.3Å; R187-D240 IonicContact NE-OD1 2.99Å; R187-D240 PolarHBondContact NE-OD1 3.25Å; R187-D240 IonicContact NE-OD2 3.2Å; R187-D240 PolarHBondContact NE-OD2 2.99Å; R187-D240 VanDerWaalsContact NE-OD2 3.07Å; R187-D240 IonicContact NH2-OD1 3.55Å; R187-D240 IonicContact NH2-OD2 2.72Å; R187-D240 PolarHBondContact NH2-OD2 3.02Å; I236-D240 PolarHBondContact O-N 2.8Å; V237-D240 PolarHBondContact O-N 3.34Å; D240-H242 VanDerWaalsContact C-N 3.33Å; D240-H242 PolarHBondContact O-N 3.3Å
241	E	90.9	Very high	92.3	Very high	31 Å²	31	27.7 Å²	27.7	15%	0.145	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-84.7	2.3	-179.5	-66.2	-174.7	-164.2	0	0	114.8	A142 R146 V237 Y239 E243 V244	A142-E241 VanDerWaalsContact O-CG 3.31Å; A142-E241 WeakPolarHBondContact O-CG 3.13Å; R146-E241 WeakPolarHBondContact CB-OE1 3.23Å; R146-E241 IonicContact CZ-OE1 2.92Å; R146-E241 IonicContact CZ-OE2 2.82Å; R146-E241 IonicContact NE-OE1 2.69Å; R146-E241 PolarHBondContact NE-OE1 2.94Å; R146-E241 IonicContact NH1-OE1 3.88Å; R146-E241 PolarHBondContact NH1-OE1 3.25Å; R146-E241 IonicContact NH1-OE2 2.69Å; R146-E241 PolarHBondContact NH1-OE2 3.2Å; R146-E241 IonicContact NH2-OE1 3.14Å; R146-E241 PolarHBondContact NH2-OE1 3.44Å; R146-E241 VanDerWaalsContact NH2-OE1 3.1Å; R146-E241 IonicContact NH2-OE2 2.69Å; R146-E241 PolarHBondContact NH2-OE2 2.77Å; V237-E241 HydrophobicContact CG2-CG 4.31Å; V237-E241 WeakPolarHBondContact O-CB 3.45Å; V237-E241 PolarHBondContact O-N 2.05Å; Y239-E241 VanDerWaalsContact C-N 3.27Å; Y239-E241 PolarHBondContact O-N 3.19Å; E241-E243 PolarHBondContact O-N 3.39Å; E241-V244 HydrophobicContact CB-CG2 4.07Å; E241-V244 HydrophobicContact CG-CG2 4.13Å; E241-V244 PolarHBondContact O-N 2.58Å
242	H	86.6	Confident	92.6	Very high	5 Å²	5	20.9 Å²	20.9	2%	0.023	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-62.3	-17.5	176.2	92.9	-82.4	0	0	0	112.8	Y239 D240 L448 F487 R494	Y239-H242 WeakPolarHBondContact O-CB 3.37Å; Y239-H242 PolarHBondContact O-N 3.17Å; Y239-H242 VanDerWaalsContact O-N 3.11Å; Y239-H242 PolarHBondContact O-ND1 2.93Å; D240-H242 VanDerWaalsContact C-N 3.33Å; D240-H242 PolarHBondContact O-N 3.3Å; H242-L448 HydrophobicContact CB-CD1 4.35Å; H242-L448 WeakPolarHBondContact CD2-CD1 3.33Å; H242-F487 HydrophobicContact CB-CD1 4.02Å; H242-F487 HydrophobicContact CB-CE1 4.41Å; H242-R494 PolarHBondContact CD2-NH1 2.94Å; H242-R494 PolarHBondContact O-NH1 2.72Å
243	E	77.9	Confident	92.8	Very high	29 Å²	29	20.9 Å²	20.9	14%	0.136	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-92.7	-8.7	178.2	-53.8	179.5	-168.9	0	0	113.4	N139 E241 N245 R445	N139-E243 PolarHBondContact ND2-OE2 2.83Å; E241-E243 PolarHBondContact O-N 3.39Å; E243-N245 PolarHBondContact O-N 2.93Å; E243-N245 VanDerWaalsContact O-N 3.09Å; E243-R445 IonicContact OE1-CZ 3.05Å; E243-R445 IonicContact OE1-NE 3.8Å; E243-R445 PolarHBondContact OE1-NE 3.05Å; E243-R445 IonicContact OE1-NH2 2.91Å; E243-R445 PolarHBondContact OE1-NH2 2.92Å; E243-R445 IonicContact OE2-CZ 2.71Å; E243-R445 IonicContact OE2-NH2 2.59Å; E243-R445 PolarHBondContact OE2-NH2 2.68Å
244	V	81.9	Confident	92.8	Very high	32 Å²	32	20.1 Å²	20.1	19%	0.194	11%	0.107	C	C	.	.			trans	-80	95	-177.9	179.2	0	0	0	0	109.8	A142 R143 E241	A142-V244 HydrophobicContact CB-CG2 3.67Å; R143-V244 HydrophobicContact CG-CG2 3.96Å; E241-V244 HydrophobicContact CB-CG2 4.07Å; E241-V244 HydrophobicContact CG-CG2 4.13Å; E241-V244 PolarHBondContact O-N 2.58Å
245	N	80.3	Confident	92.9	Very high	28 Å²	28	15.4 Å²	15.4	15%	0.15	9%	0.085	C	C	.	.			trans	-78	124.7	169.9	-165.4	14.9	0	0	0	111.1	E243 T247 F248 E428	E243-N245 PolarHBondContact O-N 2.93Å; E243-N245 VanDerWaalsContact O-N 3.09Å; N245-T247 PolarHBondContact ND2-O 3.06Å; N245-T247 PolarHBondContact OD1-N 2.87Å; N245-T247 PolarHBondContact OD1-O 2.98Å; N245-T247 PolarHBondContact OD1-OG1 2.88Å; N245-T247 VanDerWaalsContact OD1-OG1 3.11Å; N245-F248 HydrophobicContact CB-CE2 4.27Å; N245-F248 HydrophobicContact CB-CZ 3.88Å; N245-F248 WeakPolarHBondContact O-CE2 3.27Å; N245-E428 PolarHBondContact ND2-OE1 3.46Å
246	N	88.9	Confident	92.9	Very high	67 Å²	67	17.6 Å²	17.6	36%	0.358	9%	0.094	S	C	.	.			trans	-115.4	4.2	170	-57.8	-37	0	0	0	112	R143 R317 E318	R143-N246 PolarHBondContact NH2-OD1 2.8Å; N246-R317 CarbonylContact O-C 3.58Å; N246-R317 WeakPolarHBondContact O-CA 3.18Å; N246-E318 PolarHBondContact O-N 3.5Å
247	T	93.9	Very high	92.7	Very high	40 Å²	40	22.4 Å²	22.4	25%	0.245	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	108.6	-173.8	53	0	0	0	0	110.6	N245 F294 E318	N245-T247 PolarHBondContact ND2-O 3.06Å; N245-T247 PolarHBondContact OD1-N 2.87Å; N245-T247 PolarHBondContact OD1-O 2.98Å; N245-T247 PolarHBondContact OD1-OG1 2.88Å; N245-T247 VanDerWaalsContact OD1-OG1 3.11Å; T247-F294 HydrophobicContact CG2-CB 4.03Å; T247-F294 HydrophobicContact CG2-CD1 4.39Å; T247-F294 HydrophobicContact CG2-CD2 3.7Å; T247-F294 HydrophobicContact CG2-CE2 4.26Å; T247-F294 HydrophobicContact CG2-CG 3.77Å; T247-E318 CarbonylContact C-O 3.55Å; T247-E318 WeakPolarHBondContact CA-O 2.99Å; T247-E318 HydrophobicContact CG2-CB 4.39Å
248	F	96.1	Very high	92.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	152.6	-170.9	-70.6	-93.9	0	0	0	111.3	N245 F250 F294 R317 E318 I319 M320 I425 E428	N245-F248 HydrophobicContact CB-CE2 4.27Å; N245-F248 HydrophobicContact CB-CZ 3.88Å; N245-F248 WeakPolarHBondContact O-CE2 3.27Å; F248-F250 HydrophobicContact CB-CE1 4.34Å; F248-F250 HydrophobicContact CB-CE2 3.96Å; F248-F250 HydrophobicContact CB-CZ 3.68Å; F248-F250 HydrophobicContact CD1-CE1 4.34Å; F248-F250 AromaticContact CD1-CZ 3.9Å; F248-F250 HydrophobicContact CD1-CZ 3.9Å; F248-F250 HydrophobicContact CG-CZ 4.14Å; F248-F294 WeakPolarHBondContact O-CE1 3.22Å; F248-R317 HydrophobicContact CD2-CB 4.13Å; F248-R317 HydrophobicContact CE2-CB 4.33Å; F248-R317 HydrophobicContact CE2-CG 4.22Å; F248-R317 VanDerWaalsContact CE2-NH1 3.31Å; F248-E318 PolarHBondContact N-O 2.82Å; F248-I319 HydrophobicContact CB-CG1 4.36Å; F248-I319 HydrophobicContact CB-CG2 4.44Å; F248-I319 WeakPolarHBondContact O-CA 3.3Å; F248-M320 PolarHBondContact O-N 3.04Å; F248-I425 HydrophobicContact CD1-CG1 4.19Å; F248-I425 HydrophobicContact CD1-CG2 4.29Å; F248-I425 HydrophobicContact CD2-CG1 4.44Å; F248-I425 HydrophobicContact CE1-CG2 3.84Å; F248-I425 HydrophobicContact CE2-CG2 4.37Å; F248-I425 HydrophobicContact CG-CG1 4.15Å; F248-I425 HydrophobicContact CZ-CG2 3.92Å; F248-E428 HydrophobicContact CD1-CB 4.31Å; F248-E428 VanDerWaalsContact CD1-CD 3.44Å; F248-E428 HydrophobicContact CD1-CG 4.42Å; F248-E428 VanDerWaalsContact CD1-OE1 3.27Å; F248-E428 WeakPolarHBondContact CD1-OE1 3.44Å; F248-E428 WeakPolarHBondContact CD1-OE2 3.33Å; F248-E428 HydrophobicContact CE1-CB 4.29Å; F248-E428 HydrophobicContact CE1-CG 4.38Å; F248-E428 WeakPolarHBondContact CE1-OE1 3.35Å
249	K	97.6	Very high	92.5	Very high	26 Å²	26	22.9 Å²	22.9	11%	0.113	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	132.7	175.5	65.2	-173	-154.6	174.2	0	112	F294 G296 M320 D346 S495	K249-F294 HydrophobicContact CB-CE1 4.32Å; K249-G296 WeakPolarHBondContact CD-O 3.44Å; K249-G296 PolarHBondContact NZ-O 2.98Å; K249-M320 VanDerWaalsContact CA-O 3.24Å; K249-M320 WeakPolarHBondContact CA-O 3.38Å; K249-D346 WeakPolarHBondContact CE-OD1 3.38Å; K249-D346 WeakPolarHBondContact CG-OD1 3.45Å; K249-S495 PolarHBondContact NZ-O 2.88Å
250	F	98.7	Very high	92.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	135.4	-172.2	-53.6	-51.5	0	0	0	110.3	F248 I319 M320 F321 H322 V348 L424 I425 E428	F248-F250 HydrophobicContact CB-CE1 4.34Å; F248-F250 HydrophobicContact CB-CE2 3.96Å; F248-F250 HydrophobicContact CB-CZ 3.68Å; F248-F250 HydrophobicContact CD1-CE1 4.34Å; F248-F250 AromaticContact CD1-CZ 3.9Å; F248-F250 HydrophobicContact CD1-CZ 3.9Å; F248-F250 HydrophobicContact CG-CZ 4.14Å; F250-I319 HydrophobicContact CD2-CG2 3.6Å; F250-I319 HydrophobicContact CE2-CD1 4.49Å; F250-I319 HydrophobicContact CE2-CG2 3.66Å; F250-M320 PolarHBondContact N-O 2.84Å; F250-F321 HydrophobicContact CB-CD1 4.05Å; F250-F321 HydrophobicContact CB-CE1 4.17Å; F250-F321 HydrophobicContact CD2-CD1 4.43Å; F250-F321 AromaticContact CD2-CE1 3.84Å; F250-F321 HydrophobicContact CD2-CE1 3.84Å; F250-F321 HydrophobicContact CD2-CZ 4.36Å; F250-F321 CarbonylContact O-C 3.58Å; F250-F321 WeakPolarHBondContact O-CA 3.32Å; F250-H322 PolarHBondContact O-N 3.05Å; F250-V348 WeakPolarHBondContact CA-O 3.18Å; F250-V348 HydrophobicContact CD1-CB 3.94Å; F250-V348 HydrophobicContact CE1-CB 4.29Å; F250-L424 HydrophobicContact CD1-CB 4.42Å; F250-L424 HydrophobicContact CD2-CB 3.92Å; F250-L424 HydrophobicContact CD2-CD1 4Å; F250-L424 HydrophobicContact CD2-CG 4.45Å; F250-L424 HydrophobicContact CE1-CB 4.16Å; F250-L424 HydrophobicContact CE2-CB 3.62Å; F250-L424 HydrophobicContact CE2-CD1 4.41Å; F250-L424 HydrophobicContact CG-CB 4.31Å; F250-L424 HydrophobicContact CG-CD1 4.45Å; F250-L424 HydrophobicContact CZ-CB 3.75Å; F250-I425 HydrophobicContact CE2-CG1 4.3Å; F250-I425 HydrophobicContact CZ-CG1 4.02Å; F250-E428 HydrophobicContact CE1-CB 4.26Å
251	G	98.6	Very high	92.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	143.5	168.6	0	0	0	0	0	110.5	D346 V348 A349 A350	G251-D346 PolarHBondContact N-OD2 3.28Å; G251-V348 PolarHBondContact N-O 2.77Å; G251-V348 VanDerWaalsContact N-O 3.17Å; G251-A349 CarbonylContact O-C 3.53Å; G251-A349 VanDerWaalsContact O-CA 3.27Å; G251-A349 WeakPolarHBondContact O-CA 3.09Å; G251-A350 PolarHBondContact O-N 3.43Å
252	V	98.7	Very high	92.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	111.3	165.7	-174.7	0	0	0	0	107.9	F275 F278 L279 L282 F321 H322 V323 S324 A350	V252-F275 HydrophobicContact CG1-CE2 3.91Å; V252-F275 HydrophobicContact CG1-CZ 4.05Å; V252-F278 HydrophobicContact CG1-CE1 4.04Å; V252-L279 HydrophobicContact CG1-CD2 4.05Å; V252-L282 HydrophobicContact CG1-CD1 4.29Å; V252-L282 HydrophobicContact CG2-CD1 3.76Å; V252-F321 HydrophobicContact CG2-CB 3.92Å; V252-F321 HydrophobicContact CG2-CD1 3.59Å; V252-F321 HydrophobicContact CG2-CG 4.13Å; V252-H322 PolarHBondContact N-O 2.92Å; V252-V323 HydrophobicContact CB-CG2 4.22Å; V252-V323 HydrophobicContact CG2-CG2 4.37Å; V252-S324 WeakPolarHBondContact O-CB 3.38Å; V252-S324 PolarHBondContact O-N 3.03Å; V252-A350 WeakPolarHBondContact CA-O 3.44Å
253	I	98.3	Very high	92.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	134.3	-176.6	-60.9	150	0	0	0	107.9	L265 F266 I343 A349 A350 V351 F352 I364	I253-L265 HydrophobicContact CG2-CB 4.13Å; I253-L265 HydrophobicContact CG2-CD1 4.2Å; I253-L265 HydrophobicContact CG2-CD2 4.22Å; I253-L265 HydrophobicContact CG2-CG 4.43Å; I253-F266 HydrophobicContact CG1-CE1 4.39Å; I253-I343 HydrophobicContact CD1-CG2 3.95Å; I253-I343 HydrophobicContact CG1-CG2 3.85Å; I253-A349 HydrophobicContact CD1-CB 3.81Å; I253-A350 PolarHBondContact N-O 3.33Å; I253-V351 HydrophobicContact CB-CG2 4.46Å; I253-V351 HydrophobicContact CD1-CG2 4.23Å; I253-V351 CarbonylContact O-C 3.38Å; I253-V351 WeakPolarHBondContact O-CA 3.26Å; I253-F352 PolarHBondContact O-N 2.82Å; I253-I364 HydrophobicContact CD1-CD1 3.48Å; I253-I364 VanDerWaalsContact CD1-CD1 3.48Å; I253-I364 HydrophobicContact CG1-CD1 4.46Å
254	Y	98	Very high	93.6	Very high	7 Å²	7	30.9 Å²	30.9	3%	0.027	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.1	172.5	173.4	-143.3	0	0	0	109.5	K256 N268 E270 T272 F275 T325 F352 E354	Y254-K256 HydrophobicContact CE1-CD 4.31Å; Y254-K256 VanDerWaalsContact CE1-CE 3.49Å; Y254-K256 HydrophobicContact CE1-CG 3.86Å; Y254-K256 HydrophobicContact CE2-CG 4.21Å; Y254-N268 HydrophobicContact CD1-CB 4Å; Y254-N268 PolarHBondContact O-ND2 3.44Å; Y254-E270 WeakPolarHBondContact CE1-O 3.47Å; Y254-T272 VanDerWaalsContact OH-CG2 3.23Å; Y254-T272 WeakPolarHBondContact OH-CG2 3.44Å; Y254-F275 HydrophobicContact CD1-CD1 4.34Å; Y254-F275 HydrophobicContact CD2-CG 4.49Å; Y254-F275 HydrophobicContact CG-CD1 4.26Å; Y254-F275 HydrophobicContact CG-CE1 4.35Å; Y254-F275 HydrophobicContact CG-CG 4.46Å; Y254-T325 HydrophobicContact CD1-CG2 4.36Å; Y254-F352 AromaticContact CD2-CD1 3.94Å; Y254-F352 HydrophobicContact CD2-CD1 3.94Å; Y254-F352 HydrophobicContact CE2-CD1 4.27Å; Y254-E354 HydrophobicContact CE2-CG 4.43Å; Y254-E354 VanDerWaalsContact CE2-OE1 3.22Å; Y254-E354 WeakPolarHBondContact CE2-OE1 3.48Å; Y254-E354 VanDerWaalsContact CZ-OE1 3.22Å; Y254-E354 PolarHBondContact OH-OE1 2.82Å
255	Q	97.4	Very high	94.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	117.2	175.4	-177.3	176.9	23.2	0	0	109.4	Q259 L265 V351 F352 Q353 T357 P358	Q255-Q259 HydrophobicContact CG-CB 4.32Å; Q255-Q259 PolarHBondContact NE2-O 3.16Å; Q255-L265 HydrophobicContact CB-CD2 3.53Å; Q255-L265 HydrophobicContact CG-CD2 3.6Å; Q255-V351 HydrophobicContact CB-CG1 4.24Å; Q255-F352 PolarHBondContact N-O 2.72Å; Q255-Q353 HydrophobicContact CB-CG 4.21Å; Q255-T357 HydrophobicContact CG-CG2 4.18Å; Q255-P358 PolarHBondContact NE2-O 3.09Å
256	K	94.8	Very high	95	Very high	58 Å²	58	28 Å²	28	25%	0.252	15%	0.147	S	C	.	.			trans	-81.6	163.2	170.1	-61.7	-173.8	175.7	-172.3	0	110.2	Y254 G258 Q259 N268 E270	Y254-K256 HydrophobicContact CE1-CD 4.31Å; Y254-K256 VanDerWaalsContact CE1-CE 3.49Å; Y254-K256 HydrophobicContact CE1-CG 3.86Å; Y254-K256 HydrophobicContact CE2-CG 4.21Å; K256-G258 PolarHBondContact O-N 2.65Å; K256-Q259 HydrophobicContact CB-CG 4.15Å; K256-Q259 PolarHBondContact O-N 2.69Å; K256-N268 WeakPolarHBondContact CD-OD1 3.47Å; K256-N268 WeakPolarHBondContact CE-OD1 3.36Å; K256-E270 IonicContact NZ-OE2 3.6Å; K256-E270 PolarHBondContact NZ-OE2 2.88Å
257	F	92.8	Very high	95.3	Very high	102 Å²	102	26.1 Å²	26.1	45%	0.447	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	132.6	178.7	-176.3	-107.6	0	0	0	112.4	Y86 Q259 E355	Y86-F257 HydrophobicContact CE2-CE2 4.09Å; Y86-F257 HydrophobicContact CE2-CZ 4.43Å; F257-Q259 VanDerWaalsContact C-N 3.25Å; F257-Q259 PolarHBondContact O-N 2.74Å; F257-E355 HydrophobicContact CB-CB 3.97Å; F257-E355 HydrophobicContact CB-CG 4.39Å; F257-E355 HydrophobicContact CD2-CB 3.86Å; F257-E355 HydrophobicContact CG-CB 4.29Å
258	G	89.4	Confident	95.4	Very high	28 Å²	28	24.7 Å²	24.7	29%	0.289	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	73	1	175	0	0	0	0	0	116.5	K256 T260	K256-G258 PolarHBondContact O-N 2.65Å; G258-T260 PolarHBondContact O-N 3.03Å
259	Q	94.1	Very high	95.1	Very high	23 Å²	23	28.1 Å²	28.1	11%	0.107	15%	0.153	C	C	.	.			trans	-72.4	124.9	175.5	-67.8	-174.1	-43.2	0	0	111	Q255 K256 F257 E264 L265 N268	Q255-Q259 HydrophobicContact CG-CB 4.32Å; Q255-Q259 PolarHBondContact NE2-O 3.16Å; K256-Q259 HydrophobicContact CB-CG 4.15Å; K256-Q259 PolarHBondContact O-N 2.69Å; F257-Q259 VanDerWaalsContact C-N 3.25Å; F257-Q259 PolarHBondContact O-N 2.74Å; Q259-E264 HydrophobicContact CB-CB 3.98Å; Q259-E264 HydrophobicContact CG-CB 3.91Å; Q259-E264 PolarHBondContact NE2-O 2.83Å; Q259-L265 HydrophobicContact CB-CD2 4.47Å; Q259-N268 PolarHBondContact NE2-ND2 2.78Å; Q259-N268 PolarHBondContact NE2-OD1 3.2Å; Q259-N268 VanDerWaalsContact NE2-OD1 3.13Å; Q259-N268 PolarHBondContact OE1-ND2 3.31Å
260	T	91.4	Very high	94.9	Very high	41 Å²	41	32.9 Å²	32.9	25%	0.252	18%	0.176	S	C	.	.			trans	-128.3	-1.6	-175	65.1	0	0	0	0	114.5	I76 L80 G258 E264 M363	I76-T260 HydrophobicContact CD1-CG2 3.62Å; I76-T260 HydrophobicContact CG1-CG2 3.76Å; I76-T260 HydrophobicContact CG2-CG2 4.08Å; L80-T260 HydrophobicContact CD1-CG2 3.65Å; G258-T260 PolarHBondContact O-N 3.03Å; T260-E264 PolarHBondContact N-OE2 3.17Å; T260-M363 WeakPolarHBondContact O-CE 3.42Å
261	S	92.3	Very high	94.7	Very high	37 Å²	37	34.9 Å²	34.9	26%	0.259	19%	0.185	S	C	.	.	S	Bend	trans	-113.8	158.7	178.1	63.9	0	0	0	0	113.8	E263 E264 L265	S261-E263 VanDerWaalsContact C-N 3.3Å; S261-E263 PolarHBondContact O-N 3.25Å; S261-E264 WeakPolarHBondContact CB-OE2 3.47Å; S261-E264 PolarHBondContact N-OE2 3.13Å; S261-E264 PolarHBondContact O-N 2.87Å; S261-E264 WeakPolarHBondContact OG-CB 3.08Å; S261-E264 WeakPolarHBondContact OG-CG 3.28Å; S261-E264 PolarHBondContact OG-N 3.15Å; S261-E264 PolarHBondContact OG-OE2 3.27Å; S261-L265 WeakPolarHBondContact O-CG 3.41Å; S261-L265 PolarHBondContact O-N 2.91Å
262	E	93.4	Very high	94.6	Very high	11 Å²	11	36.4 Å²	36.4	5%	0.051	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-40.2	177	-165.6	-180	70.4	0	0	111.4	E264 L265 F266 K340 M363 I364 A365	E262-E264 VanDerWaalsContact C-N 3.35Å; E262-E264 PolarHBondContact O-N 3.26Å; E262-L265 PolarHBondContact O-N 2.7Å; E262-F266 HydrophobicContact CG-CD2 3.72Å; E262-F266 HydrophobicContact CG-CE2 3.58Å; E262-F266 PolarHBondContact O-N 2.68Å; E262-K340 WeakPolarHBondContact OE1-CD 3.39Å; E262-K340 IonicContact OE1-NZ 2.73Å; E262-K340 PolarHBondContact OE1-NZ 3.03Å; E262-K340 WeakPolarHBondContact OE2-CE 3.38Å; E262-K340 IonicContact OE2-NZ 2.7Å; E262-K340 PolarHBondContact OE2-NZ 2.87Å; E262-M363 WeakPolarHBondContact CB-O 3.04Å; E262-I364 WeakPolarHBondContact OE2-CA 3.5Å; E262-A365 PolarHBondContact OE2-N 3.22Å
263	E	93.9	Very high	94.6	Very high	71 Å²	71	41 Å²	41	33%	0.332	23%	0.225	S	C	.	.	H	α-helix	trans	-60.4	-40.5	179.2	-67.3	75.1	-172.7	0	0	111.9	S261 G267 V334	S261-E263 VanDerWaalsContact C-N 3.3Å; S261-E263 PolarHBondContact O-N 3.25Å; E263-G267 WeakPolarHBondContact O-CA 3.29Å; E263-G267 PolarHBondContact O-N 3.21Å; E263-V334 HydrophobicContact CB-CG1 4.14Å; E263-V334 HydrophobicContact CG-CG1 3.82Å; E263-V334 WeakPolarHBondContact CG-O 3.09Å
264	E	94.8	Very high	94.5	Very high	77 Å²	77	41.2 Å²	41.2	36%	0.36	23%	0.226	S	C	.	.	H	α-helix	trans	-69.2	-44.9	175.4	-75	166.5	136.6	0	0	112.5	Q259 T260 S261 E262 G267	Q259-E264 HydrophobicContact CB-CB 3.98Å; Q259-E264 HydrophobicContact CG-CB 3.91Å; Q259-E264 PolarHBondContact NE2-O 2.83Å; T260-E264 PolarHBondContact N-OE2 3.17Å; S261-E264 WeakPolarHBondContact CB-OE2 3.47Å; S261-E264 PolarHBondContact N-OE2 3.13Å; S261-E264 PolarHBondContact O-N 2.87Å; S261-E264 WeakPolarHBondContact OG-CB 3.08Å; S261-E264 WeakPolarHBondContact OG-CG 3.28Å; S261-E264 PolarHBondContact OG-N 3.15Å; S261-E264 PolarHBondContact OG-OE2 3.27Å; E262-E264 VanDerWaalsContact C-N 3.35Å; E262-E264 PolarHBondContact O-N 3.26Å; E264-G267 PolarHBondContact O-N 3.45Å
265	L	95.3	Very high	94.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-48.9	-179.6	-69.9	-179.9	0	0	0	111.9	I253 Q255 Q259 S261 E262 G267 N268 M363 I364	I253-L265 HydrophobicContact CG2-CB 4.13Å; I253-L265 HydrophobicContact CG2-CD1 4.2Å; I253-L265 HydrophobicContact CG2-CD2 4.22Å; I253-L265 HydrophobicContact CG2-CG 4.43Å; Q255-L265 HydrophobicContact CB-CD2 3.53Å; Q255-L265 HydrophobicContact CG-CD2 3.6Å; Q259-L265 HydrophobicContact CB-CD2 4.47Å; S261-L265 WeakPolarHBondContact O-CG 3.41Å; S261-L265 PolarHBondContact O-N 2.91Å; E262-L265 PolarHBondContact O-N 2.7Å; L265-G267 VanDerWaalsContact C-N 3.33Å; L265-N268 PolarHBondContact O-ND2 2.85Å; L265-M363 HydrophobicContact CD1-CE 3.69Å; L265-M363 HydrophobicContact CD1-CG 4.13Å; L265-M363 HydrophobicContact CD1-SD 3.93Å; L265-M363 HydrophobicContact CG-CE 4.19Å; L265-I364 HydrophobicContact CD1-CD1 3.96Å; L265-I364 HydrophobicContact CD1-CG1 4.05Å
266	F	96.2	Very high	94.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-79.4	-15.3	177.7	-64.2	-48.9	0	0	0	113.2	I253 E262 N268 Q336 R339 K340 I343 I364	I253-F266 HydrophobicContact CG1-CE1 4.39Å; E262-F266 HydrophobicContact CG-CD2 3.72Å; E262-F266 HydrophobicContact CG-CE2 3.58Å; E262-F266 PolarHBondContact O-N 2.68Å; F266-N268 VanDerWaalsContact C-N 3.27Å; F266-N268 PolarHBondContact O-N 2.77Å; F266-Q336 HydrophobicContact CB-CB 3.83Å; F266-Q336 HydrophobicContact CB-CG 4.32Å; F266-R339 HydrophobicContact CB-CB 4.39Å; F266-R339 HydrophobicContact CD1-CB 4.19Å; F266-R339 HydrophobicContact CG-CB 4.4Å; F266-R339 VanDerWaalsContact O-CD 3.26Å; F266-R339 WeakPolarHBondContact O-CD 3.19Å; F266-R339 PolarHBondContact O-NH1 3.01Å; F266-K340 HydrophobicContact CD2-CB 4.19Å; F266-K340 HydrophobicContact CE2-CB 3.94Å; F266-K340 HydrophobicContact CE2-CD 4.32Å; F266-K340 HydrophobicContact CE2-CG 4.15Å; F266-I343 HydrophobicContact CD1-CD1 4.34Å; F266-I343 HydrophobicContact CE1-CB 4.01Å; F266-I343 HydrophobicContact CE1-CD1 3.83Å; F266-I343 HydrophobicContact CE1-CG2 3.9Å; F266-I343 HydrophobicContact CZ-CB 4.31Å; F266-I343 HydrophobicContact CZ-CG2 4.09Å; F266-I364 HydrophobicContact CE2-CG2 4.28Å; F266-I364 HydrophobicContact CZ-CG2 4.18Å
267	G	95.4	Very high	94.6	Very high	28 Å²	28	45.2 Å²	45.2	29%	0.289	24%	0.244	S	C	.	.	H	α-helix	trans	-71.4	-14.4	173.6	0	0	0	0	0	115	E263 E264 L265 N269	E263-G267 WeakPolarHBondContact O-CA 3.29Å; E263-G267 PolarHBondContact O-N 3.21Å; E264-G267 PolarHBondContact O-N 3.45Å; L265-G267 VanDerWaalsContact C-N 3.33Å; G267-N269 PolarHBondContact O-N 3.11Å
268	N	95.3	Very high	94.9	Very high	9 Å²	9	40.4 Å²	40.4	5%	0.048	22%	0.223	C	C	.	.			trans	-65.9	120.7	-178.3	-75.5	-41.2	0	0	0	112.9	Y254 K256 Q259 L265 F266 R339	Y254-N268 HydrophobicContact CD1-CB 4Å; Y254-N268 PolarHBondContact O-ND2 3.44Å; K256-N268 WeakPolarHBondContact CD-OD1 3.47Å; K256-N268 WeakPolarHBondContact CE-OD1 3.36Å; Q259-N268 PolarHBondContact NE2-ND2 2.78Å; Q259-N268 PolarHBondContact NE2-OD1 3.2Å; Q259-N268 VanDerWaalsContact NE2-OD1 3.13Å; Q259-N268 PolarHBondContact OE1-ND2 3.31Å; L265-N268 PolarHBondContact O-ND2 2.85Å; F266-N268 VanDerWaalsContact C-N 3.27Å; F266-N268 PolarHBondContact O-N 2.77Å; N268-R339 PolarHBondContact O-NH1 3.11Å
269	N	91.4	Very high	95.3	Very high	72 Å²	72	39.4 Å²	39.4	39%	0.385	21%	0.211	S	C	.	.			trans	-115	-8.4	-178	-73.7	-26.5	0	0	0	115.1	G267 F329 R339	G267-N269 PolarHBondContact O-N 3.11Å; N269-F329 VanDerWaalsContact ND2-CD1 3.33Å; N269-F329 WeakPolarHBondContact ND2-CD1 3.43Å; N269-F329 WeakPolarHBondContact ND2-CD2 3.44Å; N269-F329 WeakPolarHBondContact ND2-CE1 3.39Å; N269-F329 VanDerWaalsContact ND2-CE2 3.28Å; N269-F329 WeakPolarHBondContact ND2-CE2 3.31Å; N269-F329 WeakPolarHBondContact ND2-CG 3.12Å; N269-F329 WeakPolarHBondContact ND2-CZ 3.47Å; N269-F329 WeakPolarHBondContact OD1-CB 3.43Å; N269-F329 WeakPolarHBondContact OD1-CD2 3.22Å; N269-F329 VanDerWaalsContact OD1-CG 3.32Å; N269-F329 WeakPolarHBondContact OD1-CG 3.37Å; N269-R339 VanDerWaalsContact OD1-CZ 3.27Å; N269-R339 PolarHBondContact OD1-NH1 2.84Å; N269-R339 PolarHBondContact OD1-NH2 2.83Å
270	E	92.1	Very high	95.4	Very high	127 Å²	127	41.9 Å²	41.9	59%	0.593	23%	0.231	S	C	*	.			trans	-108	133.7	-174.5	-63	171	140	0	0	110	Y254 K256	Y254-E270 WeakPolarHBondContact CE1-O 3.47Å; K256-E270 IonicContact NZ-OE2 3.6Å; K256-E270 PolarHBondContact NZ-OE2 2.88Å
271	E	95.4	Very high	95.7	Very high	41 Å²	41	40.8 Å²	40.8	19%	0.192	22%	0.223	C	C	.	.			trans	-103.8	107.9	175.2	-67.6	-177.4	174.9	0	0	109.8	F275 K276 T325 K326	E271-F275 HydrophobicContact CB-CD1 4.37Å; E271-F275 HydrophobicContact CG-CD1 4.1Å; E271-F275 HydrophobicContact CG-CE1 4.36Å; E271-K276 HydrophobicContact CB-CD 4.29Å; E271-K276 HydrophobicContact CB-CG 4.05Å; E271-K276 VanDerWaalsContact O-CE 3.32Å; E271-K276 WeakPolarHBondContact O-CE 3.21Å; E271-K276 VanDerWaalsContact OE2-CE 3.23Å; E271-K276 WeakPolarHBondContact OE2-CE 3.49Å; E271-T325 HydrophobicContact CG-CG2 3.84Å; E271-T325 WeakPolarHBondContact CG-OG1 3.49Å; E271-T325 WeakPolarHBondContact OE1-CB 3.48Å; E271-T325 PolarHBondContact OE1-OG1 3.16Å; E271-K326 WeakPolarHBondContact OE1-CE 3.41Å; E271-K326 WeakPolarHBondContact OE1-CG 3.18Å; E271-K326 IonicContact OE1-NZ 2.86Å; E271-K326 PolarHBondContact OE1-NZ 3.06Å; E271-K326 IonicContact OE2-NZ 2.96Å; E271-K326 PolarHBondContact OE2-NZ 3.43Å
272	T	96.9	Very high	96	Very high	32 Å²	32	39 Å²	39	20%	0.196	21%	0.211	C	C	.	.			trans	-67.6	160.2	175.8	56.4	0	0	0	0	111.7	Y254 A274 F275 K276 E354	Y254-T272 VanDerWaalsContact OH-CG2 3.23Å; Y254-T272 WeakPolarHBondContact OH-CG2 3.44Å; T272-A274 PolarHBondContact O-N 3.4Å; T272-F275 PolarHBondContact O-N 2.93Å; T272-F275 WeakPolarHBondContact OG1-CB 3.5Å; T272-F275 PolarHBondContact OG1-N 2.92Å; T272-K276 WeakPolarHBondContact O-CG 3.43Å; T272-K276 PolarHBondContact O-N 2.82Å; T272-E354 WeakPolarHBondContact CB-OE1 3.49Å; T272-E354 VanDerWaalsContact CG2-OE1 3.26Å; T272-E354 WeakPolarHBondContact CG2-OE1 3.43Å; T272-E354 PolarHBondContact OG1-OE1 2.78Å; T272-E354 PolarHBondContact OG1-OE2 3.45Å
273	P	97.2	Very high	96.1	Very high	98 Å²	98	38.8 Å²	38.8	64%	0.636	21%	0.211	S	C	*	.	H	α-helix	trans	-54.8	-38.4	172.1	-26.9	36.7	0	0	0	112.9	K276 E277 C381	P273-K276 PolarHBondContact O-N 2.92Å; P273-E277 PolarHBondContact O-N 2.91Å; P273-C381 VanDerWaalsContact C-SG 3.56Å
274	A	97.1	Very high	96.3	Very high	3 Å²	3	40 Å²	40	3%	0.025	22%	0.22	C	C	.	.	H	α-helix	trans	-66.4	-42.9	178.6	0	0	0	0	0	112.5	T272 E277 F278 F352 E354 V377 P380	T272-A274 PolarHBondContact O-N 3.4Å; A274-E277 PolarHBondContact O-N 2.77Å; A274-F278 PolarHBondContact O-N 3.1Å; A274-F352 HydrophobicContact CB-CZ 4.3Å; A274-E354 HydrophobicContact CB-CG 3.89Å; A274-E354 VanDerWaalsContact CB-OE2 3.31Å; A274-E354 WeakPolarHBondContact CB-OE2 3.5Å; A274-V377 HydrophobicContact CB-CG1 4.39Å; A274-P380 HydrophobicContact CB-CB 3.52Å; A274-P380 HydrophobicContact CB-CG 4.21Å
275	F	98	Very high	96.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67	-38.4	176	-173.5	-138.8	0	0	0	111.4	V252 Y254 E271 T272 F278 L279 V323 T325 F352	V252-F275 HydrophobicContact CG1-CE2 3.91Å; V252-F275 HydrophobicContact CG1-CZ 4.05Å; Y254-F275 HydrophobicContact CD1-CD1 4.34Å; Y254-F275 HydrophobicContact CD2-CG 4.49Å; Y254-F275 HydrophobicContact CG-CD1 4.26Å; Y254-F275 HydrophobicContact CG-CE1 4.35Å; Y254-F275 HydrophobicContact CG-CG 4.46Å; E271-F275 HydrophobicContact CB-CD1 4.37Å; E271-F275 HydrophobicContact CG-CD1 4.1Å; E271-F275 HydrophobicContact CG-CE1 4.36Å; T272-F275 PolarHBondContact O-N 2.93Å; T272-F275 WeakPolarHBondContact OG1-CB 3.5Å; T272-F275 PolarHBondContact OG1-N 2.92Å; F275-F278 HydrophobicContact CD2-CD1 4.03Å; F275-F278 HydrophobicContact CE2-CD1 4.06Å; F275-F278 HydrophobicContact CE2-CE1 4.49Å; F275-F278 PolarHBondContact O-N 3.09Å; F275-L279 HydrophobicContact CD1-CD1 4.24Å; F275-L279 HydrophobicContact CD2-CG 4.22Å; F275-L279 HydrophobicContact CE1-CD1 4Å; F275-L279 HydrophobicContact CE1-CG 4.45Å; F275-L279 HydrophobicContact CE2-CD1 4.47Å; F275-L279 HydrophobicContact CE2-CD2 3.88Å; F275-L279 HydrophobicContact CE2-CG 4.04Å; F275-L279 HydrophobicContact CZ-CD1 4.14Å; F275-L279 HydrophobicContact CZ-CD2 3.94Å; F275-L279 HydrophobicContact CZ-CG 4.16Å; F275-L279 WeakPolarHBondContact O-CG 3.2Å; F275-L279 PolarHBondContact O-N 2.85Å; F275-V323 HydrophobicContact CE1-CG1 4.11Å; F275-V323 HydrophobicContact CZ-CG1 3.84Å; F275-T325 HydrophobicContact CD1-CG2 4.4Å; F275-T325 HydrophobicContact CE1-CG2 3.83Å; F275-F352 VanDerWaalsContact CA-CE1 3.47Å; F275-F352 HydrophobicContact CB-CD1 3.95Å; F275-F352 HydrophobicContact CB-CE1 3.73Å; F275-F352 HydrophobicContact CD2-CB 3.96Å; F275-F352 AromaticContact CD2-CD1 3.31Å; F275-F352 HydrophobicContact CD2-CD1 3.31Å; F275-F352 AromaticContact CD2-CE1 3.91Å; F275-F352 HydrophobicContact CD2-CE1 3.91Å; F275-F352 AromaticContact CD2-CG 3.71Å; F275-F352 HydrophobicContact CD2-CG 3.71Å; F275-F352 HydrophobicContact CE2-CB 3.91Å; F275-F352 HydrophobicContact CE2-CD1 4.12Å; F275-F352 HydrophobicContact CE2-CG 4.18Å; F275-F352 AromaticContact CG-CD1 3.96Å; F275-F352 HydrophobicContact CG-CD1 3.96Å; F275-F352 HydrophobicContact CG-CE1 4.26Å
276	K	97.6	Very high	96.6	Very high	113 Å²	113	41.8 Å²	41.8	49%	0.491	23%	0.232	S	C	.	.	H	α-helix	trans	-64.3	-39.3	173.8	-69.4	-179.6	-176.6	-178	0	112.9	E271 T272 P273 L279 S280	E271-K276 HydrophobicContact CB-CD 4.29Å; E271-K276 HydrophobicContact CB-CG 4.05Å; E271-K276 VanDerWaalsContact O-CE 3.32Å; E271-K276 WeakPolarHBondContact O-CE 3.21Å; E271-K276 VanDerWaalsContact OE2-CE 3.23Å; E271-K276 WeakPolarHBondContact OE2-CE 3.49Å; T272-K276 WeakPolarHBondContact O-CG 3.43Å; T272-K276 PolarHBondContact O-N 2.82Å; P273-K276 PolarHBondContact O-N 2.92Å; K276-L279 PolarHBondContact O-N 2.73Å; K276-S280 PolarHBondContact O-N 2.95Å; K276-S280 VanDerWaalsContact O-N 3.15Å
277	E	96.9	Very high	96.7	Very high	37 Å²	37	49 Å²	49	17%	0.173	27%	0.266	C	S	.	.	H	α-helix	trans	-57.6	-50.3	171.2	-180	166.3	-106.6	0	0	110.1	P273 A274 L279 S280 I281 C381 T385 K412	P273-E277 PolarHBondContact O-N 2.91Å; A274-E277 PolarHBondContact O-N 2.77Å; E277-L279 PolarHBondContact O-N 2.99Å; E277-S280 PolarHBondContact O-N 2.65Å; E277-S280 PolarHBondContact O-OG 3.24Å; E277-I281 PolarHBondContact O-N 2.82Å; E277-C381 WeakPolarHBondContact OE2-CA 3.34Å; E277-C381 PolarHBondContact OE2-N 3.35Å; E277-T385 WeakPolarHBondContact OE2-CG2 3.44Å; E277-T385 PolarHBondContact OE2-OG1 3.07Å; E277-K412 HydrophobicContact CG-CD 3.96Å; E277-K412 WeakPolarHBondContact OE1-CD 3.46Å; E277-K412 IonicContact OE1-NZ 2.73Å; E277-K412 PolarHBondContact OE1-NZ 3.4Å; E277-K412 IonicContact OE2-NZ 3.13Å
278	F	97.9	Very high	96.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-43.6	176	172.4	-107.2	0	0	0	114.1	V252 A274 F275 S280 I281 L282 F352 V375 Y387 L420	V252-F278 HydrophobicContact CG1-CE1 4.04Å; A274-F278 PolarHBondContact O-N 3.1Å; F275-F278 HydrophobicContact CD2-CD1 4.03Å; F275-F278 HydrophobicContact CE2-CD1 4.06Å; F275-F278 HydrophobicContact CE2-CE1 4.49Å; F275-F278 PolarHBondContact O-N 3.09Å; F278-S280 VanDerWaalsContact C-N 3.27Å; F278-S280 PolarHBondContact O-N 3.23Å; F278-I281 WeakPolarHBondContact O-CB 3.3Å; F278-I281 PolarHBondContact O-N 2.71Å; F278-L282 HydrophobicContact CD1-CD1 4.45Å; F278-L282 HydrophobicContact CE1-CD1 3.77Å; F278-L282 HydrophobicContact CE1-CG 4.27Å; F278-L282 HydrophobicContact CE2-CD2 4.45Å; F278-L282 HydrophobicContact CE2-CG 4.5Å; F278-L282 HydrophobicContact CZ-CD1 3.97Å; F278-L282 HydrophobicContact CZ-CD2 4.11Å; F278-L282 HydrophobicContact CZ-CG 4.11Å; F278-L282 PolarHBondContact O-N 3.18Å; F278-F352 HydrophobicContact CB-CD2 3.74Å; F278-F352 HydrophobicContact CB-CE2 3.43Å; F278-F352 VanDerWaalsContact CB-CE2 3.43Å; F278-F352 HydrophobicContact CB-CG 4.46Å; F278-F352 HydrophobicContact CB-CZ 3.92Å; F278-F352 HydrophobicContact CD1-CB 3.95Å; F278-F352 AromaticContact CD1-CD2 3.49Å; F278-F352 HydrophobicContact CD1-CD2 3.49Å; F278-F352 VanDerWaalsContact CD1-CD2 3.49Å; F278-F352 HydrophobicContact CD1-CE2 4.13Å; F278-F352 AromaticContact CD1-CG 3.78Å; F278-F352 HydrophobicContact CD1-CG 3.78Å; F278-F352 AromaticContact CD2-CD2 3.87Å; F278-F352 HydrophobicContact CD2-CD2 3.87Å; F278-F352 HydrophobicContact CD2-CE2 4.09Å; F278-F352 HydrophobicContact CE1-CB 3.94Å; F278-F352 HydrophobicContact CE1-CD2 4.02Å; F278-F352 HydrophobicContact CE1-CG 4.24Å; F278-F352 HydrophobicContact CE2-CD2 4.37Å; F278-F352 AromaticContact CG-CD2 3.4Å; F278-F352 HydrophobicContact CG-CD2 3.4Å; F278-F352 AromaticContact CG-CE2 3.62Å; F278-F352 HydrophobicContact CG-CE2 3.62Å; F278-F352 HydrophobicContact CG-CG 4.14Å; F278-F352 HydrophobicContact CG-CZ 4.49Å; F278-F352 HydrophobicContact CZ-CD2 4.43Å; F278-V375 HydrophobicContact CD2-CG1 4.05Å; F278-V375 HydrophobicContact CE2-CB 4.03Å; F278-V375 HydrophobicContact CE2-CG1 3.76Å; F278-V375 HydrophobicContact CE2-CG2 4.02Å; F278-V375 HydrophobicContact CZ-CB 4.33Å; F278-V375 HydrophobicContact CZ-CG2 4.24Å; F278-Y387 HydrophobicContact CD2-CE1 4.43Å; F278-L420 HydrophobicContact CE2-CD2 3.77Å; F278-L420 HydrophobicContact CZ-CD2 4.19Å
279	L	98.3	Very high	96.9	Very high	8 Å²	8	52 Å²	52	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-60.1	-37	178.3	-72.5	-179.4	0	0	0	112.2	V252 F275 K276 E277 I281 L282 G283 V310 V323	V252-L279 HydrophobicContact CG1-CD2 4.05Å; F275-L279 HydrophobicContact CD1-CD1 4.24Å; F275-L279 HydrophobicContact CD2-CG 4.22Å; F275-L279 HydrophobicContact CE1-CD1 4Å; F275-L279 HydrophobicContact CE1-CG 4.45Å; F275-L279 HydrophobicContact CE2-CD1 4.47Å; F275-L279 HydrophobicContact CE2-CD2 3.88Å; F275-L279 HydrophobicContact CE2-CG 4.04Å; F275-L279 HydrophobicContact CZ-CD1 4.14Å; F275-L279 HydrophobicContact CZ-CD2 3.94Å; F275-L279 HydrophobicContact CZ-CG 4.16Å; F275-L279 WeakPolarHBondContact O-CG 3.2Å; F275-L279 PolarHBondContact O-N 2.85Å; K276-L279 PolarHBondContact O-N 2.73Å; E277-L279 PolarHBondContact O-N 2.99Å; L279-I281 VanDerWaalsContact C-N 3.27Å; L279-I281 PolarHBondContact O-N 2.59Å; L279-L282 HydrophobicContact CD2-CD1 4.2Å; L279-L282 WeakPolarHBondContact O-CB 3.35Å; L279-L282 PolarHBondContact O-N 2.63Å; L279-L282 VanDerWaalsContact O-N 3.15Å; L279-G283 PolarHBondContact O-N 3.17Å; L279-V310 HydrophobicContact CB-CG2 4.2Å; L279-V310 HydrophobicContact CD1-CG2 4.48Å; L279-V310 HydrophobicContact CD2-CG2 4.27Å; L279-V323 HydrophobicContact CD1-CG1 4.02Å; L279-V323 HydrophobicContact CD2-CG1 3.92Å; L279-V323 HydrophobicContact CD2-CG2 3.97Å
280	S	97.1	Very high	97.2	Very high	75 Å²	75	53.3 Å²	53.3	52%	0.524	28%	0.279	S	S	.	.	H	α-helix	trans	-67.6	-24.6	175	72.7	0	0	0	0	114	K276 E277 F278 R417	K276-S280 PolarHBondContact O-N 2.95Å; K276-S280 VanDerWaalsContact O-N 3.15Å; E277-S280 PolarHBondContact O-N 2.65Å; E277-S280 PolarHBondContact O-OG 3.24Å; F278-S280 VanDerWaalsContact C-N 3.27Å; F278-S280 PolarHBondContact O-N 3.23Å; S280-R417 PolarHBondContact O-NH1 3.03Å
281	I	96.7	Very high	97.4	Very high	17 Å²	17	49.2 Å²	49.2	9%	0.087	26%	0.259	C	S	.	.	H	α-helix	trans	-71.4	-34.1	172.6	-62.2	171.8	0	0	0	110.4	E277 F278 L279 Y387 K412 F416 R417	E277-I281 PolarHBondContact O-N 2.82Å; F278-I281 WeakPolarHBondContact O-CB 3.3Å; F278-I281 PolarHBondContact O-N 2.71Å; L279-I281 VanDerWaalsContact C-N 3.27Å; L279-I281 PolarHBondContact O-N 2.59Å; I281-Y387 HydrophobicContact CD1-CD2 4.42Å; I281-Y387 HydrophobicContact CD1-CE2 3.39Å; I281-Y387 WeakPolarHBondContact CD1-OH 3.42Å; I281-K412 HydrophobicContact CD1-CG 4.07Å; I281-F416 HydrophobicContact CD1-CD1 4.29Å; I281-F416 HydrophobicContact CD1-CE1 4.42Å; I281-F416 HydrophobicContact CG2-CD1 3.9Å; I281-F416 HydrophobicContact CG2-CE1 4.19Å; I281-R417 HydrophobicContact CG2-CB 4.01Å; I281-R417 WeakPolarHBondContact O-CD 3.46Å; I281-R417 VanDerWaalsContact O-CG 3.23Å; I281-R417 WeakPolarHBondContact O-CG 3.21Å; I281-R417 PolarHBondContact O-NE 2.91Å; I281-R417 PolarHBondContact O-NH1 2.75Å
282	L	98	Very high	97.5	Very high	1 Å²	1	55 Å²	55	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-70.8	-45.2	176.7	-65.9	178.6	0	0	0	112.8	V252 F278 L279 V310 F321 L420	V252-L282 HydrophobicContact CG1-CD1 4.29Å; V252-L282 HydrophobicContact CG2-CD1 3.76Å; F278-L282 HydrophobicContact CD1-CD1 4.45Å; F278-L282 HydrophobicContact CE1-CD1 3.77Å; F278-L282 HydrophobicContact CE1-CG 4.27Å; F278-L282 HydrophobicContact CE2-CD2 4.45Å; F278-L282 HydrophobicContact CE2-CG 4.5Å; F278-L282 HydrophobicContact CZ-CD1 3.97Å; F278-L282 HydrophobicContact CZ-CD2 4.11Å; F278-L282 HydrophobicContact CZ-CG 4.11Å; F278-L282 PolarHBondContact O-N 3.18Å; L279-L282 HydrophobicContact CD2-CD1 4.2Å; L279-L282 WeakPolarHBondContact O-CB 3.35Å; L279-L282 PolarHBondContact O-N 2.63Å; L279-L282 VanDerWaalsContact O-N 3.15Å; L282-V310 HydrophobicContact CB-CG1 4.21Å; L282-F321 HydrophobicContact CB-CD2 4.34Å; L282-F321 HydrophobicContact CB-CE1 4.33Å; L282-F321 HydrophobicContact CB-CE2 3.93Å; L282-F321 HydrophobicContact CB-CZ 3.92Å; L282-F321 HydrophobicContact CD1-CD1 4.06Å; L282-F321 HydrophobicContact CD1-CE1 4.08Å; L282-F321 HydrophobicContact CD1-CG 4.45Å; L282-F321 HydrophobicContact CD1-CZ 4.5Å; L282-F321 HydrophobicContact CD2-CE1 4Å; L282-F321 HydrophobicContact CD2-CZ 4.06Å; L282-F321 HydrophobicContact CG-CE1 4.38Å; L282-F321 HydrophobicContact CG-CZ 4.4Å; L282-L420 HydrophobicContact CD2-CD2 3.6Å; L282-L420 HydrophobicContact CD2-CG 4.2Å
283	G	97.6	Very high	97.4	Very high	5 Å²	5	54.8 Å²	54.8	5%	0.052	29%	0.288	C	S	.	.			trans	-177	-174.3	-171.2	0	0	0	0	0	114.6	L279 Y311	L279-G283 PolarHBondContact O-N 3.17Å; G283-Y311 CarbonylContact C-O 3.56Å; G283-Y311 WeakPolarHBondContact CA-O 3.32Å
284	D	98	Very high	97.4	Very high	98 Å²	98	51.6 Å²	51.6	52%	0.524	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	137.3	176.9	-51.3	-74.9	0	0	0	109.3	I286 V310 Y311	D284-I286 PolarHBondContact O-N 3.28Å; D284-V310 WeakPolarHBondContact O-CA 3.28Å; D284-Y311 PolarHBondContact N-O 3.13Å; D284-Y311 PolarHBondContact O-N 2.9Å
285	N	98.1	Very high	97.4	Very high	89 Å²	89	56.4 Å²	56.4	48%	0.476	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.1	172.1	-168.7	57	0	0	0	108.9	E308 S309 K326	N285-E308 PolarHBondContact ND2-OE2 2.93Å; N285-S309 CarbonylContact C-O 3.57Å; N285-S309 WeakPolarHBondContact CA-O 3.43Å; N285-S309 PolarHBondContact OD1-O 3.23Å; N285-K326 VanDerWaalsContact OD1-CE 3.28Å; N285-K326 WeakPolarHBondContact OD1-CE 3.29Å
286	I	98.1	Very high	97.2	Very high	25 Å²	25	56.5 Å²	56.5	13%	0.128	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	150.2	-174.9	57.8	149.7	0	0	0	111.3	D284 L288 F291 E308 S309 Y311 M320	D284-I286 PolarHBondContact O-N 3.28Å; I286-L288 HydrophobicContact CD1-CD2 4.22Å; I286-F291 HydrophobicContact CB-CD2 4.48Å; I286-F291 HydrophobicContact CB-CE2 4.41Å; I286-F291 HydrophobicContact CD1-CD1 3.98Å; I286-F291 HydrophobicContact CD1-CD2 3.58Å; I286-F291 HydrophobicContact CD1-CE1 3.94Å; I286-F291 HydrophobicContact CD1-CE2 3.56Å; I286-F291 HydrophobicContact CD1-CG 3.8Å; I286-F291 HydrophobicContact CD1-CZ 3.75Å; I286-F291 HydrophobicContact CG2-CE2 4.19Å; I286-E308 CarbonylContact O-C 3.57Å; I286-E308 WeakPolarHBondContact O-CA 3.49Å; I286-E308 VanDerWaalsContact O-CB 3.25Å; I286-E308 WeakPolarHBondContact O-CB 3.48Å; I286-S309 VanDerWaalsContact CG1-O 3.22Å; I286-S309 WeakPolarHBondContact CG1-O 3.46Å; I286-S309 PolarHBondContact N-O 2.98Å; I286-S309 PolarHBondContact O-N 3.2Å; I286-Y311 HydrophobicContact CD1-CG 4.43Å; I286-Y311 HydrophobicContact CG2-CD1 4.47Å; I286-M320 HydrophobicContact CD1-CE 3.8Å
287	E	98.1	Very high	97.1	Very high	152 Å²	152	52.5 Å²	52.5	71%	0.71	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	136.4	160.7	-66.5	-178	-175	0	0	109.6
288	L	97.8	Very high	97	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.01	27%	0.266	C	S	.	.			trans	-80.3	-30.4	177.5	-72.1	174.2	0	0	0	112.3	I286 D290 F291 L298 V300 S307	I286-L288 HydrophobicContact CD1-CD2 4.22Å; L288-D290 PolarHBondContact O-N 2.81Å; L288-F291 WeakPolarHBondContact O-CB 3.45Å; L288-F291 PolarHBondContact O-N 3.48Å; L288-F291 VanDerWaalsContact O-N 3.08Å; L288-L298 HydrophobicContact CD1-CB 4.38Å; L288-L298 HydrophobicContact CD1-CD1 4.09Å; L288-L298 HydrophobicContact CD2-CB 4.15Å; L288-L298 HydrophobicContact CD2-CD1 3.7Å; L288-V300 VanDerWaalsContact O-CA 3.22Å; L288-V300 WeakPolarHBondContact O-CA 3.17Å; L288-V300 WeakPolarHBondContact O-CB 3.37Å; L288-V300 WeakPolarHBondContact O-CG1 3.33Å; L288-S307 PolarHBondContact N-O 2.99Å
289	Q	97.6	Very high	96.9	Very high	96 Å²	96	51.9 Å²	51.9	45%	0.449	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	124.3	178.9	-179.9	57.8	45.7	0	0	110	F291	Q289-F291 PolarHBondContact O-N 2.91Å; Q289-F291 VanDerWaalsContact O-N 3.09Å
290	D	96.5	Very high	96.8	Very high	100 Å²	100	52.4 Å²	52.4	54%	0.535	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	19.2	-178.2	-91.2	-80.1	0	0	0	115.2	L288 K292 V300	L288-D290 PolarHBondContact O-N 2.81Å; D290-K292 WeakPolarHBondContact O-CD 3.07Å; D290-K292 WeakPolarHBondContact O-CE 3.21Å; D290-K292 WeakPolarHBondContact O-CG 3.25Å; D290-K292 PolarHBondContact O-N 3.06Å; D290-K292 PolarHBondContact O-NZ 2.63Å; D290-K292 IonicContact OD1-NZ 3.77Å; D290-K292 PolarHBondContact OD1-NZ 2.88Å; D290-V300 PolarHBondContact N-O 2.9Å
291	F	97.3	Very high	96.7	Very high	41 Å²	41	52 Å²	52	18%	0.18	27%	0.272	C	S	.	.			trans	-58.8	139.1	175.2	-175	-112.5	0	0	0	112	I286 L288 Q289 G293 V300 Y311 M320	I286-F291 HydrophobicContact CB-CD2 4.48Å; I286-F291 HydrophobicContact CB-CE2 4.41Å; I286-F291 HydrophobicContact CD1-CD1 3.98Å; I286-F291 HydrophobicContact CD1-CD2 3.58Å; I286-F291 HydrophobicContact CD1-CE1 3.94Å; I286-F291 HydrophobicContact CD1-CE2 3.56Å; I286-F291 HydrophobicContact CD1-CG 3.8Å; I286-F291 HydrophobicContact CD1-CZ 3.75Å; I286-F291 HydrophobicContact CG2-CE2 4.19Å; L288-F291 WeakPolarHBondContact O-CB 3.45Å; L288-F291 PolarHBondContact O-N 3.48Å; L288-F291 VanDerWaalsContact O-N 3.08Å; Q289-F291 PolarHBondContact O-N 2.91Å; Q289-F291 VanDerWaalsContact O-N 3.09Å; F291-G293 VanDerWaalsContact CE1-C 3.42Å; F291-G293 VanDerWaalsContact CE1-CA 3.47Å; F291-V300 HydrophobicContact CB-CG1 4.05Å; F291-Y311 HydrophobicContact CE1-CD2 4.11Å; F291-Y311 HydrophobicContact CE1-CE2 4.19Å; F291-Y311 HydrophobicContact CE1-CG 4.46Å; F291-Y311 HydrophobicContact CE2-CD1 4.36Å; F291-Y311 AromaticContact CZ-CD1 3.82Å; F291-Y311 HydrophobicContact CZ-CD1 3.82Å; F291-Y311 AromaticContact CZ-CD2 3.79Å; F291-Y311 HydrophobicContact CZ-CD2 3.79Å; F291-Y311 AromaticContact CZ-CE1 3.93Å; F291-Y311 HydrophobicContact CZ-CE1 3.93Å; F291-Y311 AromaticContact CZ-CE2 3.88Å; F291-Y311 HydrophobicContact CZ-CE2 3.88Å; F291-Y311 AromaticContact CZ-CG 3.76Å; F291-Y311 HydrophobicContact CZ-CG 3.76Å; F291-Y311 AromaticContact CZ-CZ 3.95Å; F291-M320 HydrophobicContact CD1-CE 4.28Å; F291-M320 HydrophobicContact CE1-CE 3.84Å
292	K	96.3	Very high	96.6	Very high	163 Å²	163	58.1 Å²	58.1	71%	0.709	30%	0.3	S	S	*	.			trans	-111.9	-9.1	-170.2	-58	-61.3	-175.7	-103.5	0	115.1	D290	D290-K292 WeakPolarHBondContact O-CD 3.07Å; D290-K292 WeakPolarHBondContact O-CE 3.21Å; D290-K292 WeakPolarHBondContact O-CG 3.25Å; D290-K292 PolarHBondContact O-N 3.06Å; D290-K292 PolarHBondContact O-NZ 2.63Å; D290-K292 IonicContact OD1-NZ 3.77Å; D290-K292 PolarHBondContact OD1-NZ 2.88Å
293	G	95.4	Very high	96.3	Very high	28 Å²	28	60 Å²	60	29%	0.289	32%	0.319	S	S	.	.	S	Bend	trans	-87.7	-168.4	173.5	0	0	0	0	0	113.3	F291 R295 E318	F291-G293 VanDerWaalsContact CE1-C 3.42Å; F291-G293 VanDerWaalsContact CE1-CA 3.47Å; G293-R295 PolarHBondContact O-N 2.84Å; G293-R295 VanDerWaalsContact O-N 3.07Å; G293-E318 WeakPolarHBondContact CA-OE1 3.36Å
294	F	97	Very high	96	Very high	30 Å²	30	66.2 Å²	66.2	13%	0.132	35%	0.347	C	S	.	.			trans	-63.8	107.8	177.4	176.8	-111.4	0	0	0	112.6	T247 F248 K249 G296 E318 M320	T247-F294 HydrophobicContact CG2-CB 4.03Å; T247-F294 HydrophobicContact CG2-CD1 4.39Å; T247-F294 HydrophobicContact CG2-CD2 3.7Å; T247-F294 HydrophobicContact CG2-CE2 4.26Å; T247-F294 HydrophobicContact CG2-CG 3.77Å; F248-F294 WeakPolarHBondContact O-CE1 3.22Å; K249-F294 HydrophobicContact CB-CE1 4.32Å; F294-G296 PolarHBondContact O-N 3.37Å; F294-E318 HydrophobicContact CB-CB 3.64Å; F294-E318 HydrophobicContact CB-CG 4.24Å; F294-E318 HydrophobicContact CG-CB 4.47Å; F294-E318 PolarHBondContact N-OE1 3.27Å; F294-M320 HydrophobicContact CD1-CB 4.16Å; F294-M320 HydrophobicContact CE1-CB 4.32Å; F294-M320 VanDerWaalsContact O-CE 3.27Å; F294-M320 WeakPolarHBondContact O-CE 3.46Å
295	R	96.4	Very high	95.8	Very high	105 Å²	105	62.1 Å²	62.1	40%	0.396	33%	0.326	S	S	.	.			trans	-76.4	-0.5	-174.7	70.4	-177.8	-173.9	159	5.4	117.2	G293 G297 L298 V300	G293-R295 PolarHBondContact O-N 2.84Å; G293-R295 VanDerWaalsContact O-N 3.07Å; R295-G297 PolarHBondContact O-N 2.72Å; R295-L298 WeakPolarHBondContact CD-O 3.35Å; R295-L298 WeakPolarHBondContact O-CB 3.24Å; R295-L298 PolarHBondContact O-N 3Å; R295-V300 HydrophobicContact CB-CG1 3.85Å
296	G	94.8	Very high	95.7	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.01	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	-24	-176.8	0	0	0	0	0	117.8	K249 F294	K249-G296 WeakPolarHBondContact CD-O 3.44Å; K249-G296 PolarHBondContact NZ-O 2.98Å; F294-G296 PolarHBondContact O-N 3.37Å
297	G	94.5	Very high	95.6	Very high	30 Å²	30	61.7 Å²	61.7	31%	0.309	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	124.9	-5	-164.7	0	0	0	0	0	113	R295	R295-G297 PolarHBondContact O-N 2.72Å
298	L	96.4	Very high	95.6	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.01	31%	0.313	C	S	.	.			trans	-67.9	154.3	173.3	-57.4	177.5	0	0	0	111.7	L288 R295 T305 M320 L327	L288-L298 HydrophobicContact CD1-CB 4.38Å; L288-L298 HydrophobicContact CD1-CD1 4.09Å; L288-L298 HydrophobicContact CD2-CB 4.15Å; L288-L298 HydrophobicContact CD2-CD1 3.7Å; R295-L298 WeakPolarHBondContact CD-O 3.35Å; R295-L298 WeakPolarHBondContact O-CB 3.24Å; R295-L298 PolarHBondContact O-N 3Å; L298-T305 WeakPolarHBondContact CA-OG1 3.26Å; L298-T305 WeakPolarHBondContact CB-OG1 3.41Å; L298-T305 HydrophobicContact CD2-CG2 4.46Å; L298-M320 HydrophobicContact CD1-CG 3.95Å; L298-M320 HydrophobicContact CD1-SD 3.74Å; L298-L327 HydrophobicContact CD2-CD2 3.74Å
299	D	96.1	Very high	95.6	Very high	21 Å²	21	57.4 Å²	57.4	11%	0.112	31%	0.314	C	S	.	.			trans	-82.3	130.4	173.1	177.9	29.2	0	0	0	110.4	S301 H302 G303 Q304 T305	D299-S301 PolarHBondContact OD1-N 2.87Å; D299-H302 PolarHBondContact OD1-N 3.22Å; D299-H302 IonicContact OD1-ND1 3.24Å; D299-H302 PolarHBondContact OD1-ND1 2.94Å; D299-H302 WeakPolarHBondContact OD2-CA 3.1Å; D299-H302 VanDerWaalsContact OD2-CB 3.28Å; D299-H302 WeakPolarHBondContact OD2-CB 3.15Å; D299-H302 IonicContact OD2-CG 2.8Å; D299-H302 PolarHBondContact OD2-N 3.32Å; D299-H302 IonicContact OD2-ND1 2.67Å; D299-G303 PolarHBondContact OD2-N 2.97Å; D299-Q304 HydrophobicContact CB-CB 4.09Å; D299-Q304 WeakPolarHBondContact OD2-CB 3.32Å; D299-Q304 PolarHBondContact OD2-N 2.86Å; D299-T305 HydrophobicContact CB-CG2 4.02Å; D299-T305 PolarHBondContact N-OG1 3.32Å
300	V	96	Very high	95.7	Very high	19 Å²	19	52.9 Å²	52.9	12%	0.115	29%	0.293	C	S	.	.	S	Bend	trans	-117.7	14.4	-178	-60.1	0	0	0	0	111.8	L288 D290 F291 R295	L288-V300 VanDerWaalsContact O-CA 3.22Å; L288-V300 WeakPolarHBondContact O-CA 3.17Å; L288-V300 WeakPolarHBondContact O-CB 3.37Å; L288-V300 WeakPolarHBondContact O-CG1 3.33Å; D290-V300 PolarHBondContact N-O 2.9Å; F291-V300 HydrophobicContact CB-CG1 4.05Å; R295-V300 HydrophobicContact CB-CG1 3.85Å
301	S	94.9	Very high	95.8	Very high	68 Å²	68	49.4 Å²	49.4	48%	0.476	27%	0.272	S	S	.	.	S	Bend	trans	-138.1	-22.2	-169.8	-57	0	0	0	0	115.3	D299	D299-S301 PolarHBondContact OD1-N 2.87Å
302	H	93	Very high	95.8	Very high	144 Å²	144	47.8 Å²	47.8	67%	0.667	27%	0.266	S	S	*	.	S	Bend	trans	-136.8	8.4	-178.8	-37	83.9	0	0	0	113.9	D299 Q304	D299-H302 PolarHBondContact OD1-N 3.22Å; D299-H302 IonicContact OD1-ND1 3.24Å; D299-H302 PolarHBondContact OD1-ND1 2.94Å; D299-H302 WeakPolarHBondContact OD2-CA 3.1Å; D299-H302 VanDerWaalsContact OD2-CB 3.28Å; D299-H302 WeakPolarHBondContact OD2-CB 3.15Å; D299-H302 IonicContact OD2-CG 2.8Å; D299-H302 PolarHBondContact OD2-N 3.32Å; D299-H302 IonicContact OD2-ND1 2.67Å; H302-Q304 VanDerWaalsContact C-N 3.26Å; H302-Q304 HydrophobicContact CB-CG 4.18Å; H302-Q304 PolarHBondContact O-N 2.94Å
303	G	91.8	Very high	95.9	Very high	40 Å²	40	44 Å²	44	41%	0.412	26%	0.257	S	S	.	.			trans	66.6	15.3	179	0	0	0	0	0	115.8	D299 T305 G306	D299-G303 PolarHBondContact OD2-N 2.97Å; G303-T305 PolarHBondContact O-N 3.31Å; G303-T305 VanDerWaalsContact O-N 3.12Å; G303-G306 PolarHBondContact O-N 2.99Å
304	Q	92.1	Very high	95.9	Very high	137 Å²	137	43.9 Å²	43.9	64%	0.64	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-12.5	-171.8	-69.2	179.9	13.5	0	0	114.7	D299 H302	D299-Q304 HydrophobicContact CB-CB 4.09Å; D299-Q304 WeakPolarHBondContact OD2-CB 3.32Å; D299-Q304 PolarHBondContact OD2-N 2.86Å; H302-Q304 VanDerWaalsContact C-N 3.26Å; H302-Q304 HydrophobicContact CB-CG 4.18Å; H302-Q304 PolarHBondContact O-N 2.94Å
305	T	94.9	Very high	95.6	Very high	12 Å²	12	45 Å²	45	7%	0.074	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125	30.2	-177.3	67	0	0	0	0	112	L298 D299 G303 P328 H342	L298-T305 WeakPolarHBondContact CA-OG1 3.26Å; L298-T305 WeakPolarHBondContact CB-OG1 3.41Å; L298-T305 HydrophobicContact CD2-CG2 4.46Å; D299-T305 HydrophobicContact CB-CG2 4.02Å; D299-T305 PolarHBondContact N-OG1 3.32Å; G303-T305 PolarHBondContact O-N 3.31Å; G303-T305 VanDerWaalsContact O-N 3.12Å; T305-P328 VanDerWaalsContact C-CD 3.48Å; T305-H342 VanDerWaalsContact CG2-NE2 3.34Å; T305-H342 WeakPolarHBondContact CG2-NE2 3.47Å
306	G	94.4	Very high	95.4	Very high	13 Å²	13	48.5 Å²	48.5	13%	0.134	27%	0.272	C	S	.	.			trans	99.1	173.2	-175.9	0	0	0	0	0	112.3	G303	G303-G306 PolarHBondContact O-N 2.99Å
307	S	96.7	Very high	95.3	Very high	91 Å²	91	49.1 Å²	49.1	64%	0.636	27%	0.274	S	S	*	.	S	Bend	trans	-94.9	-25.5	176.6	51.5	0	0	0	0	113.3	L288	L288-S307 PolarHBondContact N-O 2.99Å
308	E	97.5	Very high	95.4	Very high	61 Å²	61	50.8 Å²	50.8	29%	0.285	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	161.4	-173	51.5	161.8	-146.2	0	0	112.1	N285 I286 K326	N285-E308 PolarHBondContact ND2-OE2 2.93Å; I286-E308 CarbonylContact O-C 3.57Å; I286-E308 WeakPolarHBondContact O-CA 3.49Å; I286-E308 VanDerWaalsContact O-CB 3.25Å; I286-E308 WeakPolarHBondContact O-CB 3.48Å; E308-K326 HydrophobicContact CG-CD 4.13Å; E308-K326 WeakPolarHBondContact OE1-CE 3.4Å; E308-K326 IonicContact OE1-NZ 2.67Å; E308-K326 PolarHBondContact OE1-NZ 3.05Å
309	S	98.3	Very high	95.5	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	172.1	177.2	-166.3	0	0	0	0	111.1	N285 I286 M320 F321	N285-S309 CarbonylContact C-O 3.57Å; N285-S309 WeakPolarHBondContact CA-O 3.43Å; N285-S309 PolarHBondContact OD1-O 3.23Å; I286-S309 VanDerWaalsContact CG1-O 3.22Å; I286-S309 WeakPolarHBondContact CG1-O 3.46Å; I286-S309 PolarHBondContact N-O 2.98Å; I286-S309 PolarHBondContact O-N 3.2Å; S309-M320 PolarHBondContact OG-SD 3.16Å; S309-F321 PolarHBondContact OG-O 2.97Å
310	V	98.7	Very high	95.6	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.012	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.4	173.9	179.9	0	0	0	0	109.4	L279 L282 D284 F321 V323	L279-V310 HydrophobicContact CB-CG2 4.2Å; L279-V310 HydrophobicContact CD1-CG2 4.48Å; L279-V310 HydrophobicContact CD2-CG2 4.27Å; L282-V310 HydrophobicContact CB-CG1 4.21Å; D284-V310 WeakPolarHBondContact O-CA 3.28Å; V310-F321 HydrophobicContact CB-CB 4.15Å; V310-F321 HydrophobicContact CB-CD2 4.29Å; V310-F321 HydrophobicContact CG1-CD2 3.92Å; V310-F321 WeakPolarHBondContact O-CB 3.34Å; V310-F321 WeakPolarHBondContact O-CD2 3.31Å; V310-F321 PolarHBondContact O-N 3.45Å; V310-V323 HydrophobicContact CB-CG2 4.16Å; V310-V323 HydrophobicContact CG2-CG2 4.02Å
311	Y	98.7	Very high	95.8	Very high	26 Å²	26	48.8 Å²	48.8	10%	0.102	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	150.4	-174.4	171.6	-95.2	0	0	0	110.9	G283 D284 I286 F291 V313 E318 I319 M320	G283-Y311 CarbonylContact C-O 3.56Å; G283-Y311 WeakPolarHBondContact CA-O 3.32Å; D284-Y311 PolarHBondContact N-O 3.13Å; D284-Y311 PolarHBondContact O-N 2.9Å; I286-Y311 HydrophobicContact CD1-CG 4.43Å; I286-Y311 HydrophobicContact CG2-CD1 4.47Å; F291-Y311 HydrophobicContact CE1-CD2 4.11Å; F291-Y311 HydrophobicContact CE1-CE2 4.19Å; F291-Y311 HydrophobicContact CE1-CG 4.46Å; F291-Y311 HydrophobicContact CE2-CD1 4.36Å; F291-Y311 AromaticContact CZ-CD1 3.82Å; F291-Y311 HydrophobicContact CZ-CD1 3.82Å; F291-Y311 AromaticContact CZ-CD2 3.79Å; F291-Y311 HydrophobicContact CZ-CD2 3.79Å; F291-Y311 AromaticContact CZ-CE1 3.93Å; F291-Y311 HydrophobicContact CZ-CE1 3.93Å; F291-Y311 AromaticContact CZ-CE2 3.88Å; F291-Y311 HydrophobicContact CZ-CE2 3.88Å; F291-Y311 AromaticContact CZ-CG 3.76Å; F291-Y311 HydrophobicContact CZ-CG 3.76Å; F291-Y311 AromaticContact CZ-CZ 3.95Å; Y311-V313 HydrophobicContact CE1-CG2 4.02Å; Y311-V313 VanDerWaalsContact OH-CG2 3.31Å; Y311-V313 WeakPolarHBondContact OH-CG2 3.1Å; Y311-E318 HydrophobicContact CE2-CB 4.09Å; Y311-E318 WeakPolarHBondContact OH-CG 3.41Å; Y311-E318 PolarHBondContact OH-OE1 2.77Å; Y311-E318 VanDerWaalsContact OH-OE1 3.12Å; Y311-I319 WeakPolarHBondContact CA-O 3.27Å; Y311-I319 WeakPolarHBondContact CD2-O 3.45Å; Y311-M320 HydrophobicContact CD2-CE 3.75Å; Y311-M320 HydrophobicContact CG-CE 4.34Å
312	T	98.4	Very high	95.9	Very high	8 Å²	8	45.6 Å²	45.6	5%	0.049	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	167.3	165.3	-155.5	0	0	0	0	113.3	I319 R417 L421	T312-I319 HydrophobicContact CG2-CB 4.33Å; T312-I319 HydrophobicContact CG2-CD1 4.19Å; T312-I319 HydrophobicContact CG2-CG1 4.49Å; T312-I319 PolarHBondContact N-O 3.46Å; T312-I319 PolarHBondContact O-N 3.48Å; T312-R417 PolarHBondContact OG1-NH2 3.07Å; T312-L421 HydrophobicContact CG2-CD1 4.2Å
313	V	97.8	Very high	96.2	Very high	84 Å²	84	38.8 Å²	38.8	51%	0.509	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	113.7	166.6	-178.3	0	0	0	0	108.6	Y311 R317	Y311-V313 HydrophobicContact CE1-CG2 4.02Å; Y311-V313 VanDerWaalsContact OH-CG2 3.31Å; Y311-V313 WeakPolarHBondContact OH-CG2 3.1Å; V313-R317 CarbonylContact C-O 3.54Å; V313-R317 WeakPolarHBondContact CA-O 3.26Å
314	F	95.6	Very high	96.5	Very high	24 Å²	24	36.9 Å²	36.9	11%	0.105	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	116.6	178.5	-177	-109.1	0	0	0	109.6	H316 R317 I319 E418 L421 T422 I425	F314-H316 PolarHBondContact O-N 2.93Å; F314-R317 PolarHBondContact N-O 3.05Å; F314-R317 WeakPolarHBondContact O-CB 3.26Å; F314-R317 PolarHBondContact O-N 3.02Å; F314-I319 HydrophobicContact CB-CD1 3.86Å; F314-E418 HydrophobicContact CE2-CG 4.09Å; F314-E418 HydrophobicContact CZ-CG 3.89Å; F314-L421 HydrophobicContact CB-CD1 4.11Å; F314-L421 HydrophobicContact CD1-CB 3.89Å; F314-L421 HydrophobicContact CD2-CB 4.15Å; F314-L421 HydrophobicContact CD2-CD1 3.67Å; F314-L421 HydrophobicContact CE1-CB 3.96Å; F314-L421 HydrophobicContact CE2-CB 4.22Å; F314-L421 HydrophobicContact CE2-CD1 4.24Å; F314-L421 HydrophobicContact CG-CB 3.98Å; F314-L421 HydrophobicContact CG-CD1 3.91Å; F314-L421 HydrophobicContact CZ-CB 4.13Å; F314-T422 WeakPolarHBondContact CZ-OG1 3.17Å; F314-I425 HydrophobicContact CD1-CD1 3.8Å; F314-I425 HydrophobicContact CE1-CD1 4.38Å
315	R	91.8	Very high	96.7	Very high	55 Å²	55	31 Å²	31	21%	0.208	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.6	54.4	-179.5	-55.8	-166	-171	-175.5	8.4	114	E119 S133 Y134 L136 R317 E418	E119-R315 WeakPolarHBondContact OE1-CD 3.16Å; E119-R315 IonicContact OE1-CZ 2.8Å; E119-R315 IonicContact OE1-NH1 2.67Å; E119-R315 PolarHBondContact OE1-NH1 2.84Å; S133-R315 PolarHBondContact OG-NH2 3.34Å; Y134-R315 VanDerWaalsContact O-CZ 3.3Å; Y134-R315 PolarHBondContact O-NH1 2.83Å; Y134-R315 PolarHBondContact O-NH2 3.36Å; L136-R315 HydrophobicContact CD1-CB 4.13Å; R315-R317 PolarHBondContact O-N 2.91Å; R315-E418 IonicContact CZ-OE1 2.73Å; R315-E418 IonicContact NH2-OE1 3Å; R315-E418 PolarHBondContact NH2-OE1 3.47Å
316	H	90.5	Very high	96.8	Very high	177 Å²	177	31.6 Å²	31.6	82%	0.819	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.9	19.3	-178.4	-47.3	98.6	0	0	0	115	F314	F314-H316 PolarHBondContact O-N 2.93Å
317	R	92.9	Very high	96.9	Very high	15 Å²	15	31.2 Å²	31.2	6%	0.057	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	130.3	171	-56.8	172.4	-178.5	-130.3	10.1	109.7	N246 F248 V313 F314 R315	N246-R317 CarbonylContact O-C 3.58Å; N246-R317 WeakPolarHBondContact O-CA 3.18Å; F248-R317 HydrophobicContact CD2-CB 4.13Å; F248-R317 HydrophobicContact CE2-CB 4.33Å; F248-R317 HydrophobicContact CE2-CG 4.22Å; F248-R317 VanDerWaalsContact CE2-NH1 3.31Å; V313-R317 CarbonylContact C-O 3.54Å; V313-R317 WeakPolarHBondContact CA-O 3.26Å; F314-R317 PolarHBondContact N-O 3.05Å; F314-R317 WeakPolarHBondContact O-CB 3.26Å; F314-R317 PolarHBondContact O-N 3.02Å; R315-R317 PolarHBondContact O-N 2.91Å
318	E	97.4	Very high	96.8	Very high	64 Å²	64	28.6 Å²	28.6	30%	0.299	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	135.6	174.2	-56.1	-179.8	84.4	0	0	109.2	N246 T247 F248 G293 F294 Y311	N246-E318 PolarHBondContact O-N 3.5Å; T247-E318 CarbonylContact C-O 3.55Å; T247-E318 WeakPolarHBondContact CA-O 2.99Å; T247-E318 HydrophobicContact CG2-CB 4.39Å; F248-E318 PolarHBondContact N-O 2.82Å; G293-E318 WeakPolarHBondContact CA-OE1 3.36Å; F294-E318 HydrophobicContact CB-CB 3.64Å; F294-E318 HydrophobicContact CB-CG 4.24Å; F294-E318 HydrophobicContact CG-CB 4.47Å; F294-E318 PolarHBondContact N-OE1 3.27Å; Y311-E318 HydrophobicContact CE2-CB 4.09Å; Y311-E318 WeakPolarHBondContact OH-CG 3.41Å; Y311-E318 PolarHBondContact OH-OE1 2.77Å; Y311-E318 VanDerWaalsContact OH-OE1 3.12Å
319	I	98.4	Very high	96.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.8	-179.7	-47.9	179	0	0	0	109.5	F248 F250 Y311 T312 F314 F321 L421 I425	F248-I319 HydrophobicContact CB-CG1 4.36Å; F248-I319 HydrophobicContact CB-CG2 4.44Å; F248-I319 WeakPolarHBondContact O-CA 3.3Å; F250-I319 HydrophobicContact CD2-CG2 3.6Å; F250-I319 HydrophobicContact CE2-CD1 4.49Å; F250-I319 HydrophobicContact CE2-CG2 3.66Å; Y311-I319 WeakPolarHBondContact CA-O 3.27Å; Y311-I319 WeakPolarHBondContact CD2-O 3.45Å; T312-I319 HydrophobicContact CG2-CB 4.33Å; T312-I319 HydrophobicContact CG2-CD1 4.19Å; T312-I319 HydrophobicContact CG2-CG1 4.49Å; T312-I319 PolarHBondContact N-O 3.46Å; T312-I319 PolarHBondContact O-N 3.48Å; F314-I319 HydrophobicContact CB-CD1 3.86Å; I319-F321 HydrophobicContact CB-CE2 4.3Å; I319-F321 HydrophobicContact CG2-CD2 4.24Å; I319-F321 HydrophobicContact CG2-CE1 4.19Å; I319-F321 HydrophobicContact CG2-CE2 3.69Å; I319-F321 HydrophobicContact CG2-CZ 3.66Å; I319-L421 HydrophobicContact CD1-CD2 4.12Å; I319-I425 HydrophobicContact CD1-CD1 4.1Å
320	M	98.6	Very high	96.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	127.9	172.1	-177.8	55.7	68.4	0	0	110.5	F248 K249 F250 I286 F291 F294 L298 S309 Y311	F248-M320 PolarHBondContact O-N 3.04Å; K249-M320 VanDerWaalsContact CA-O 3.24Å; K249-M320 WeakPolarHBondContact CA-O 3.38Å; F250-M320 PolarHBondContact N-O 2.84Å; I286-M320 HydrophobicContact CD1-CE 3.8Å; F291-M320 HydrophobicContact CD1-CE 4.28Å; F291-M320 HydrophobicContact CE1-CE 3.84Å; F294-M320 HydrophobicContact CD1-CB 4.16Å; F294-M320 HydrophobicContact CE1-CB 4.32Å; F294-M320 VanDerWaalsContact O-CE 3.27Å; F294-M320 WeakPolarHBondContact O-CE 3.46Å; L298-M320 HydrophobicContact CD1-CG 3.95Å; L298-M320 HydrophobicContact CD1-SD 3.74Å; S309-M320 PolarHBondContact OG-SD 3.16Å; Y311-M320 HydrophobicContact CD2-CE 3.75Å; Y311-M320 HydrophobicContact CG-CE 4.34Å
321	F	98.8	Very high	96.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	121.2	178.3	-67	-83.3	0	0	0	111.3	F250 V252 L282 S309 V310 I319 V323 L421 L424	F250-F321 HydrophobicContact CB-CD1 4.05Å; F250-F321 HydrophobicContact CB-CE1 4.17Å; F250-F321 HydrophobicContact CD2-CD1 4.43Å; F250-F321 AromaticContact CD2-CE1 3.84Å; F250-F321 HydrophobicContact CD2-CE1 3.84Å; F250-F321 HydrophobicContact CD2-CZ 4.36Å; F250-F321 CarbonylContact O-C 3.58Å; F250-F321 WeakPolarHBondContact O-CA 3.32Å; V252-F321 HydrophobicContact CG2-CB 3.92Å; V252-F321 HydrophobicContact CG2-CD1 3.59Å; V252-F321 HydrophobicContact CG2-CG 4.13Å; L282-F321 HydrophobicContact CB-CD2 4.34Å; L282-F321 HydrophobicContact CB-CE1 4.33Å; L282-F321 HydrophobicContact CB-CE2 3.93Å; L282-F321 HydrophobicContact CB-CZ 3.92Å; L282-F321 HydrophobicContact CD1-CD1 4.06Å; L282-F321 HydrophobicContact CD1-CE1 4.08Å; L282-F321 HydrophobicContact CD1-CG 4.45Å; L282-F321 HydrophobicContact CD1-CZ 4.5Å; L282-F321 HydrophobicContact CD2-CE1 4Å; L282-F321 HydrophobicContact CD2-CZ 4.06Å; L282-F321 HydrophobicContact CG-CE1 4.38Å; L282-F321 HydrophobicContact CG-CZ 4.4Å; S309-F321 PolarHBondContact OG-O 2.97Å; V310-F321 HydrophobicContact CB-CB 4.15Å; V310-F321 HydrophobicContact CB-CD2 4.29Å; V310-F321 HydrophobicContact CG1-CD2 3.92Å; V310-F321 WeakPolarHBondContact O-CB 3.34Å; V310-F321 WeakPolarHBondContact O-CD2 3.31Å; V310-F321 PolarHBondContact O-N 3.45Å; I319-F321 HydrophobicContact CB-CE2 4.3Å; I319-F321 HydrophobicContact CG2-CD2 4.24Å; I319-F321 HydrophobicContact CG2-CE1 4.19Å; I319-F321 HydrophobicContact CG2-CE2 3.69Å; I319-F321 HydrophobicContact CG2-CZ 3.66Å; F321-V323 HydrophobicContact CB-CG2 4.04Å; F321-V323 PolarHBondContact O-N 3.05Å; F321-L421 HydrophobicContact CE2-CD2 4.47Å; F321-L421 HydrophobicContact CZ-CD2 3.72Å; F321-L424 HydrophobicContact CE1-CD1 4.13Å
322	H	98.6	Very high	95.7	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	83.4	172	-64.1	151.3	0	0	0	109.3	F250 V252 L327 H342 I343 D346	F250-H322 PolarHBondContact O-N 3.05Å; V252-H322 PolarHBondContact N-O 2.92Å; H322-L327 HydrophobicContact CB-CD1 4.28Å; H322-H342 HydrophobicContact CB-CB 4.3Å; H322-I343 HydrophobicContact CB-CG1 3.87Å; H322-I343 WeakPolarHBondContact O-CD1 3.16Å; H322-I343 VanDerWaalsContact O-CG1 3.29Å; H322-I343 WeakPolarHBondContact O-CG1 3.33Å; H322-D346 IonicContact CE1-OD1 3.66Å; H322-D346 PolarHBondContact CE1-OD1 2.85Å; H322-D346 IonicContact CE1-OD2 3.81Å; H322-D346 IonicContact CG-OD2 2.74Å; H322-D346 IonicContact ND1-OD1 3.9Å; H322-D346 PolarHBondContact ND1-OD1 3.03Å; H322-D346 IonicContact ND1-OD2 3.07Å; H322-D346 PolarHBondContact ND1-OD2 3.04Å
323	V	98.5	Very high	95.4	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123.3	-177	-172	0	0	0	0	111.1	V252 F275 L279 V310 F321 T325 K326 L327	V252-V323 HydrophobicContact CB-CG2 4.22Å; V252-V323 HydrophobicContact CG2-CG2 4.37Å; F275-V323 HydrophobicContact CE1-CG1 4.11Å; F275-V323 HydrophobicContact CZ-CG1 3.84Å; L279-V323 HydrophobicContact CD1-CG1 4.02Å; L279-V323 HydrophobicContact CD2-CG1 3.92Å; L279-V323 HydrophobicContact CD2-CG2 3.97Å; V310-V323 HydrophobicContact CB-CG2 4.16Å; V310-V323 HydrophobicContact CG2-CG2 4.02Å; F321-V323 HydrophobicContact CB-CG2 4.04Å; F321-V323 PolarHBondContact O-N 3.05Å; V323-T325 VanDerWaalsContact C-N 3.32Å; V323-T325 WeakPolarHBondContact CG1-OG1 3.47Å; V323-T325 PolarHBondContact O-N 2.94Å; V323-K326 HydrophobicContact CB-CB 4.24Å; V323-K326 HydrophobicContact CB-CD 4.42Å; V323-K326 HydrophobicContact CB-CG 4.14Å; V323-K326 HydrophobicContact CG1-CG 4.16Å; V323-K326 PolarHBondContact O-N 2.91Å; V323-K326 VanDerWaalsContact O-N 3.15Å; V323-L327 WeakPolarHBondContact O-CG 3.45Å; V323-L327 PolarHBondContact O-N 3Å; V323-L327 VanDerWaalsContact O-N 3.13Å
324	S	97.4	Very high	95.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-39	-171.9	65.5	0	0	0	0	113.6	V252 R339	V252-S324 WeakPolarHBondContact O-CB 3.38Å; V252-S324 PolarHBondContact O-N 3.03Å; S324-R339 WeakPolarHBondContact O-CD 3.28Å; S324-R339 PolarHBondContact O-NE 3.46Å; S324-R339 PolarHBondContact O-NH2 2.93Å
325	T	97.1	Very high	94.8	Very high	15 Å²	15	48.9 Å²	48.9	9%	0.092	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-34.3	178.7	50.9	0	0	0	0	113.5	Y254 E271 F275 V323 R339	Y254-T325 HydrophobicContact CD1-CG2 4.36Å; E271-T325 HydrophobicContact CG-CG2 3.84Å; E271-T325 WeakPolarHBondContact CG-OG1 3.49Å; E271-T325 WeakPolarHBondContact OE1-CB 3.48Å; E271-T325 PolarHBondContact OE1-OG1 3.16Å; F275-T325 HydrophobicContact CD1-CG2 4.4Å; F275-T325 HydrophobicContact CE1-CG2 3.83Å; V323-T325 VanDerWaalsContact C-N 3.32Å; V323-T325 WeakPolarHBondContact CG1-OG1 3.47Å; V323-T325 PolarHBondContact O-N 2.94Å; T325-R339 PolarHBondContact O-NH2 3.2Å
326	K	97.2	Very high	94.9	Very high	24 Å²	24	46.5 Å²	46.5	10%	0.104	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-23.8	-177.1	-58.1	-165.5	-179.3	-52.6	0	113.1	E271 N285 E308 V323	E271-K326 WeakPolarHBondContact OE1-CE 3.41Å; E271-K326 WeakPolarHBondContact OE1-CG 3.18Å; E271-K326 IonicContact OE1-NZ 2.86Å; E271-K326 PolarHBondContact OE1-NZ 3.06Å; E271-K326 IonicContact OE2-NZ 2.96Å; E271-K326 PolarHBondContact OE2-NZ 3.43Å; N285-K326 VanDerWaalsContact OD1-CE 3.28Å; N285-K326 WeakPolarHBondContact OD1-CE 3.29Å; E308-K326 HydrophobicContact CG-CD 4.13Å; E308-K326 WeakPolarHBondContact OE1-CE 3.4Å; E308-K326 IonicContact OE1-NZ 2.67Å; E308-K326 PolarHBondContact OE1-NZ 3.05Å; V323-K326 HydrophobicContact CB-CB 4.24Å; V323-K326 HydrophobicContact CB-CD 4.42Å; V323-K326 HydrophobicContact CB-CG 4.14Å; V323-K326 HydrophobicContact CG1-CG 4.16Å; V323-K326 PolarHBondContact O-N 2.91Å; V323-K326 VanDerWaalsContact O-N 3.15Å
327	L	97	Very high	95	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	24%	0.236	C	C	.	.	S	Bend	trans	-69.2	145.9	170	-71.2	169.6	0	0	0	110.9	L298 H322 V323 F329 R339 H342 I343	L298-L327 HydrophobicContact CD2-CD2 3.74Å; H322-L327 HydrophobicContact CB-CD1 4.28Å; V323-L327 WeakPolarHBondContact O-CG 3.45Å; V323-L327 PolarHBondContact O-N 3Å; V323-L327 VanDerWaalsContact O-N 3.13Å; L327-F329 PolarHBondContact O-N 3.49Å; L327-R339 HydrophobicContact CB-CB 4.5Å; L327-R339 HydrophobicContact CB-CG 3.87Å; L327-R339 PolarHBondContact O-NE 3.09Å; L327-R339 PolarHBondContact O-NH2 3.41Å; L327-H342 HydrophobicContact CD1-CB 3.86Å; L327-H342 HydrophobicContact CD2-CB 4.32Å; L327-I343 HydrophobicContact CD1-CD1 4Å; L327-I343 HydrophobicContact CD1-CG1 4.02Å
328	P	94.9	Very high	94.9	Very high	37 Å²	37	45.2 Å²	45.2	24%	0.24	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-59.8	131.9	-171.7	-25.5	35.3	0	0	0	113.4	T305	T305-P328 VanDerWaalsContact C-CD 3.48Å
329	F	94.3	Very high	94.8	Very high	87 Å²	87	42.3 Å²	42.3	38%	0.382	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-80.7	138.8	166.5	-173.8	-109.7	0	0	0	110.3	N269 L327 E331 Q336	N269-F329 VanDerWaalsContact ND2-CD1 3.33Å; N269-F329 WeakPolarHBondContact ND2-CD1 3.43Å; N269-F329 WeakPolarHBondContact ND2-CD2 3.44Å; N269-F329 WeakPolarHBondContact ND2-CE1 3.39Å; N269-F329 VanDerWaalsContact ND2-CE2 3.28Å; N269-F329 WeakPolarHBondContact ND2-CE2 3.31Å; N269-F329 WeakPolarHBondContact ND2-CG 3.12Å; N269-F329 WeakPolarHBondContact ND2-CZ 3.47Å; N269-F329 WeakPolarHBondContact OD1-CB 3.43Å; N269-F329 WeakPolarHBondContact OD1-CD2 3.22Å; N269-F329 VanDerWaalsContact OD1-CG 3.32Å; N269-F329 WeakPolarHBondContact OD1-CG 3.37Å; L327-F329 PolarHBondContact O-N 3.49Å; F329-E331 HydrophobicContact CD1-CG 4.24Å; F329-E331 HydrophobicContact CE1-CG 3.87Å; F329-Q336 HydrophobicContact CD2-CG 4.31Å; F329-Q336 HydrophobicContact CE2-CG 4.27Å
330	T	93.1	Very high	94.6	Very high	54 Å²	54	44.3 Å²	44.3	33%	0.331	25%	0.245	S	C	.	.			trans	-118.6	110.4	175.1	-59.4	0	0	0	0	109.8	G332 D333 Q336	T330-G332 PolarHBondContact O-N 3.1Å; T330-D333 HydrophobicContact CG2-CB 3.75Å; T330-D333 PolarHBondContact O-N 2.91Å; T330-Q336 PolarHBondContact O-NE2 2.69Å
331	E	91.3	Very high	94.4	Very high	177 Å²	177	49.5 Å²	49.5	83%	0.827	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	134.3	175.4	-74.4	-178.6	-166.5	0	0	111.3	F329 D333	F329-E331 HydrophobicContact CD1-CG 4.24Å; F329-E331 HydrophobicContact CE1-CG 3.87Å; E331-D333 VanDerWaalsContact C-N 3.26Å; E331-D333 PolarHBondContact O-N 3.47Å
332	G	90.1	Very high	94.2	Very high	80 Å²	80	50.2 Å²	50.2	83%	0.825	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-14.8	-177.6	0	0	0	0	0	115.7	T330 V334	T330-G332 PolarHBondContact O-N 3.1Å; G332-V334 PolarHBondContact O-N 3.26Å
333	D	92.9	Very high	94.1	Very high	36 Å²	36	50.1 Å²	50.1	19%	0.193	27%	0.267	C	S	.	.			trans	-86.3	89.2	170.8	-178.5	6.1	0	0	0	110.3	T330 E331 Q335 Q336 L337	T330-D333 HydrophobicContact CG2-CB 3.75Å; T330-D333 PolarHBondContact O-N 2.91Å; E331-D333 VanDerWaalsContact C-N 3.26Å; E331-D333 PolarHBondContact O-N 3.47Å; D333-Q335 PolarHBondContact O-N 3.4Å; D333-Q335 VanDerWaalsContact O-N 3.13Å; D333-Q335 PolarHBondContact OD1-N 2.83Å; D333-Q335 VanDerWaalsContact OD1-N 3.17Å; D333-Q336 PolarHBondContact O-N 2.92Å; D333-Q336 PolarHBondContact O-NE2 2.72Å; D333-Q336 PolarHBondContact OD1-N 2.69Å; D333-L337 WeakPolarHBondContact OD2-CB 3.28Å; D333-L337 PolarHBondContact OD2-N 3.2Å
334	V	90.7	Very high	93.9	Very high	106 Å²	106	50.4 Å²	50.4	64%	0.642	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.7	-177.8	-172.6	0	0	0	0	112.3	E263 G332	E263-V334 HydrophobicContact CB-CG1 4.14Å; E263-V334 HydrophobicContact CG-CG1 3.82Å; E263-V334 WeakPolarHBondContact CG-O 3.09Å; G332-V334 PolarHBondContact O-N 3.26Å
335	Q	89.2	Confident	93.7	Very high	94 Å²	94	52.2 Å²	52.2	44%	0.439	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-3.6	179	-63.5	-166.2	-38.4	0	0	113.9	D333 L337	D333-Q335 PolarHBondContact O-N 3.4Å; D333-Q335 VanDerWaalsContact O-N 3.13Å; D333-Q335 PolarHBondContact OD1-N 2.83Å; D333-Q335 VanDerWaalsContact OD1-N 3.17Å; Q335-L337 VanDerWaalsContact C-N 3.31Å; Q335-L337 HydrophobicContact CB-CD2 3.88Å; Q335-L337 HydrophobicContact CB-CG 4.17Å; Q335-L337 PolarHBondContact O-N 2.82Å
336	Q	94.4	Very high	93.7	Very high	5 Å²	5	51.5 Å²	51.5	2%	0.023	28%	0.276	C	S	.	.			trans	43.3	55.5	-179.3	-66.3	-62.6	-46.3	0	0	112.3	F266 F329 T330 D333 Q338 R339 K340	F266-Q336 HydrophobicContact CB-CB 3.83Å; F266-Q336 HydrophobicContact CB-CG 4.32Å; F329-Q336 HydrophobicContact CD2-CG 4.31Å; F329-Q336 HydrophobicContact CE2-CG 4.27Å; T330-Q336 PolarHBondContact O-NE2 2.69Å; D333-Q336 PolarHBondContact O-N 2.92Å; D333-Q336 PolarHBondContact O-NE2 2.72Å; D333-Q336 PolarHBondContact OD1-N 2.69Å; Q336-Q338 PolarHBondContact O-N 2.99Å; Q336-R339 HydrophobicContact CB-CB 4.19Å; Q336-R339 HydrophobicContact CB-CG 4.23Å; Q336-R339 WeakPolarHBondContact O-CA 3.49Å; Q336-R339 WeakPolarHBondContact O-CB 3.31Å; Q336-R339 PolarHBondContact O-N 3.29Å; Q336-K340 PolarHBondContact O-N 3.1Å
337	L	91.9	Very high	93.7	Very high	90 Å²	90	51.2 Å²	51.2	47%	0.471	28%	0.275	S	S	.	.	H	α-helix	trans	-58.7	-27	-166.6	-67.5	174.5	0	0	0	113.4	D333 Q335 R341	D333-L337 WeakPolarHBondContact OD2-CB 3.28Å; D333-L337 PolarHBondContact OD2-N 3.2Å; Q335-L337 VanDerWaalsContact C-N 3.31Å; Q335-L337 HydrophobicContact CB-CD2 3.88Å; Q335-L337 HydrophobicContact CB-CG 4.17Å; Q335-L337 PolarHBondContact O-N 2.82Å; L337-R341 WeakPolarHBondContact O-CB 3.2Å; L337-R341 PolarHBondContact O-N 3.25Å
338	Q	90.8	Very high	93.7	Very high	74 Å²	74	51 Å²	51	35%	0.346	27%	0.274	S	S	.	.	H	α-helix	trans	-68	-43.9	172.3	-56	-55.8	-21.3	0	0	111.8	Q336 R341 H342	Q336-Q338 PolarHBondContact O-N 2.99Å; Q338-R341 PolarHBondContact O-N 3.25Å; Q338-H342 PolarHBondContact O-CD2 3.4Å; Q338-H342 VanDerWaalsContact O-CD2 3.28Å; Q338-H342 PolarHBondContact O-N 3.39Å
339	R	95.8	Very high	93.9	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-48.4	176.8	-59.5	-174.1	160.2	176.5	-9.5	110.6	F266 N268 N269 S324 T325 L327 Q336 R341 H342 I343	F266-R339 HydrophobicContact CB-CB 4.39Å; F266-R339 HydrophobicContact CD1-CB 4.19Å; F266-R339 HydrophobicContact CG-CB 4.4Å; F266-R339 VanDerWaalsContact O-CD 3.26Å; F266-R339 WeakPolarHBondContact O-CD 3.19Å; F266-R339 PolarHBondContact O-NH1 3.01Å; N268-R339 PolarHBondContact O-NH1 3.11Å; N269-R339 VanDerWaalsContact OD1-CZ 3.27Å; N269-R339 PolarHBondContact OD1-NH1 2.84Å; N269-R339 PolarHBondContact OD1-NH2 2.83Å; S324-R339 WeakPolarHBondContact O-CD 3.28Å; S324-R339 PolarHBondContact O-NE 3.46Å; S324-R339 PolarHBondContact O-NH2 2.93Å; T325-R339 PolarHBondContact O-NH2 3.2Å; L327-R339 HydrophobicContact CB-CB 4.5Å; L327-R339 HydrophobicContact CB-CG 3.87Å; L327-R339 PolarHBondContact O-NE 3.09Å; L327-R339 PolarHBondContact O-NH2 3.41Å; Q336-R339 HydrophobicContact CB-CB 4.19Å; Q336-R339 HydrophobicContact CB-CG 4.23Å; Q336-R339 WeakPolarHBondContact O-CA 3.49Å; Q336-R339 WeakPolarHBondContact O-CB 3.31Å; Q336-R339 PolarHBondContact O-N 3.29Å; R339-R341 VanDerWaalsContact C-N 3.33Å; R339-R341 PolarHBondContact O-N 3.2Å; R339-H342 PolarHBondContact O-N 3.42Å; R339-I343 PolarHBondContact O-N 3.34Å
340	K	94.1	Very high	94.1	Very high	42 Å²	42	45.1 Å²	45.1	18%	0.183	24%	0.244	C	C	.	.	H	α-helix	trans	-63.5	-32.8	176.1	-178.1	165	176.2	163.9	0	113.4	E262 F266 Q336 H342 G344 A365	E262-K340 WeakPolarHBondContact OE1-CD 3.39Å; E262-K340 IonicContact OE1-NZ 2.73Å; E262-K340 PolarHBondContact OE1-NZ 3.03Å; E262-K340 WeakPolarHBondContact OE2-CE 3.38Å; E262-K340 IonicContact OE2-NZ 2.7Å; E262-K340 PolarHBondContact OE2-NZ 2.87Å; F266-K340 HydrophobicContact CD2-CB 4.19Å; F266-K340 HydrophobicContact CE2-CB 3.94Å; F266-K340 HydrophobicContact CE2-CD 4.32Å; F266-K340 HydrophobicContact CE2-CG 4.15Å; Q336-K340 PolarHBondContact O-N 3.1Å; K340-H342 VanDerWaalsContact C-N 3.31Å; K340-H342 PolarHBondContact O-N 3.41Å; K340-G344 WeakPolarHBondContact O-CA 3.27Å; K340-G344 PolarHBondContact O-N 3.23Å; K340-A365 WeakPolarHBondContact CE-O 3.39Å; K340-A365 PolarHBondContact NZ-O 3.15Å
341	R	94.4	Very high	94.4	Very high	109 Å²	109	42.6 Å²	42.6	41%	0.411	23%	0.229	S	C	.	.	H	α-helix	trans	-65	-29.4	175.9	171.8	-179.1	173.5	-155.3	-4.3	113.5	L337 Q338 R339 N345 E499	L337-R341 WeakPolarHBondContact O-CB 3.2Å; L337-R341 PolarHBondContact O-N 3.25Å; Q338-R341 PolarHBondContact O-N 3.25Å; R339-R341 VanDerWaalsContact C-N 3.33Å; R339-R341 PolarHBondContact O-N 3.2Å; R341-N345 WeakPolarHBondContact O-CB 3.36Å; R341-N345 PolarHBondContact O-ND2 2.88Å; R341-E499 IonicContact CZ-OE1 2.92Å; R341-E499 IonicContact NE-OE1 2.68Å; R341-E499 PolarHBondContact NE-OE1 3.46Å; R341-E499 VanDerWaalsContact NH2-CD 3.3Å; R341-E499 IonicContact NH2-OE1 3.22Å; R341-E499 PolarHBondContact NH2-OE1 2.92Å; R341-E499 IonicContact NH2-OE2 4Å; R341-E499 PolarHBondContact NH2-OE2 3.37Å
342	H	94.1	Very high	94.7	Very high	14 Å²	14	34.1 Å²	34.1	7%	0.065	19%	0.189	C	C	.	.	H	α-helix	trans	-86.5	-64.9	172.6	-70.3	-77.2	0	0	0	110.4	T305 H322 L327 Q338 R339 K340 G344 N345 D346	T305-H342 VanDerWaalsContact CG2-NE2 3.34Å; T305-H342 WeakPolarHBondContact CG2-NE2 3.47Å; H322-H342 HydrophobicContact CB-CB 4.3Å; L327-H342 HydrophobicContact CD1-CB 3.86Å; L327-H342 HydrophobicContact CD2-CB 4.32Å; Q338-H342 PolarHBondContact O-CD2 3.4Å; Q338-H342 VanDerWaalsContact O-CD2 3.28Å; Q338-H342 PolarHBondContact O-N 3.39Å; R339-H342 PolarHBondContact O-N 3.42Å; K340-H342 VanDerWaalsContact C-N 3.31Å; K340-H342 PolarHBondContact O-N 3.41Å; H342-G344 PolarHBondContact O-N 3.02Å; H342-N345 PolarHBondContact O-N 3.28Å; H342-N345 VanDerWaalsContact O-N 3.1Å; H342-D346 PolarHBondContact O-N 2.79Å
343	I	96.5	Very high	95.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64	-44.6	-172.2	-65.6	170.4	0	0	0	112.2	I253 F266 H322 L327 R339 N345 D346	I253-I343 HydrophobicContact CD1-CG2 3.95Å; I253-I343 HydrophobicContact CG1-CG2 3.85Å; F266-I343 HydrophobicContact CD1-CD1 4.34Å; F266-I343 HydrophobicContact CE1-CB 4.01Å; F266-I343 HydrophobicContact CE1-CD1 3.83Å; F266-I343 HydrophobicContact CE1-CG2 3.9Å; F266-I343 HydrophobicContact CZ-CB 4.31Å; F266-I343 HydrophobicContact CZ-CG2 4.09Å; H322-I343 HydrophobicContact CB-CG1 3.87Å; H322-I343 WeakPolarHBondContact O-CD1 3.16Å; H322-I343 VanDerWaalsContact O-CG1 3.29Å; H322-I343 WeakPolarHBondContact O-CG1 3.33Å; L327-I343 HydrophobicContact CD1-CD1 4Å; L327-I343 HydrophobicContact CD1-CG1 4.02Å; R339-I343 PolarHBondContact O-N 3.34Å; I343-N345 PolarHBondContact O-N 3.38Å; I343-N345 VanDerWaalsContact O-N 3.11Å; I343-D346 PolarHBondContact O-N 3.48Å; I343-D346 VanDerWaalsContact O-N 3.16Å
344	G	93.6	Very high	95.1	Very high	6 Å²	6	31 Å²	31	6%	0.062	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-2.8	179	0	0	0	0	0	114.5	K340 H342 S366	K340-G344 WeakPolarHBondContact O-CA 3.27Å; K340-G344 PolarHBondContact O-N 3.23Å; H342-G344 PolarHBondContact O-N 3.02Å; G344-S366 PolarHBondContact O-OG 3.33Å
345	N	94.6	Very high	95.2	Very high	39 Å²	39	31.3 Å²	31.3	21%	0.209	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-2.7	174.6	-86.7	-29.9	0	0	0	113.4	R341 H342 I343 F368 S497	R341-N345 WeakPolarHBondContact O-CB 3.36Å; R341-N345 PolarHBondContact O-ND2 2.88Å; H342-N345 PolarHBondContact O-N 3.28Å; H342-N345 VanDerWaalsContact O-N 3.1Å; I343-N345 PolarHBondContact O-N 3.38Å; I343-N345 VanDerWaalsContact O-N 3.11Å; N345-F368 HydrophobicContact CB-CD2 4.48Å; N345-F368 WeakPolarHBondContact OD1-CD2 3.38Å; N345-F368 VanDerWaalsContact OD1-CE2 3.29Å; N345-F368 WeakPolarHBondContact OD1-CE2 3.49Å; N345-S497 WeakPolarHBondContact O-CB 3.4Å; N345-S497 PolarHBondContact O-OG 3Å
346	D	96.7	Very high	95.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-79.2	165.3	170.8	-60.6	-38	0	0	0	111.2	K249 G251 H322 H342 I343 F368 L369	K249-D346 WeakPolarHBondContact CE-OD1 3.38Å; K249-D346 WeakPolarHBondContact CG-OD1 3.45Å; G251-D346 PolarHBondContact N-OD2 3.28Å; H322-D346 IonicContact CE1-OD1 3.66Å; H322-D346 PolarHBondContact CE1-OD1 2.85Å; H322-D346 IonicContact CE1-OD2 3.81Å; H322-D346 IonicContact CG-OD2 2.74Å; H322-D346 IonicContact ND1-OD1 3.9Å; H322-D346 PolarHBondContact ND1-OD1 3.03Å; H322-D346 IonicContact ND1-OD2 3.07Å; H322-D346 PolarHBondContact ND1-OD2 3.04Å; H342-D346 PolarHBondContact O-N 2.79Å; I343-D346 PolarHBondContact O-N 3.48Å; I343-D346 VanDerWaalsContact O-N 3.16Å; D346-F368 CarbonylContact O-C 3.51Å; D346-F368 VanDerWaalsContact O-CB 3.24Å; D346-F368 WeakPolarHBondContact O-CB 3.24Å; D346-L369 HydrophobicContact CB-CD2 4.39Å; D346-L369 WeakPolarHBondContact O-CD2 3.31Å; D346-L369 PolarHBondContact O-N 2.85Å; D346-L369 VanDerWaalsContact O-N 3.11Å
347	I	96.3	Very high	95.1	Very high	18 Å²	18	28.2 Å²	28.2	9%	0.092	14%	0.136	C	C	.	.	S	Bend	trans	-91	-32.6	-177.8	-60.1	179.6	0	0	0	111.6	F368 H370 A371 E428 C431 Y432 F437	I347-F368 WeakPolarHBondContact CA-O 3.48Å; I347-H370 PolarHBondContact O-N 2.98Å; I347-A371 PolarHBondContact O-N 2.86Å; I347-E428 HydrophobicContact CB-CG 4.2Å; I347-E428 HydrophobicContact CD1-CG 4.08Å; I347-E428 HydrophobicContact CG2-CG 4.19Å; I347-C431 HydrophobicContact CG2-CB 3.28Å; I347-Y432 HydrophobicContact CD1-CE1 3.96Å; I347-Y432 HydrophobicContact CD1-CE2 4.34Å; I347-F437 HydrophobicContact CD1-CE1 4.1Å; I347-F437 HydrophobicContact CD1-CZ 4.16Å; I347-F437 HydrophobicContact CG1-CE1 4.28Å; I347-F437 HydrophobicContact CG1-CZ 3.93Å; I347-F437 HydrophobicContact CG2-CE2 4.22Å; I347-F437 HydrophobicContact CG2-CZ 4.29Å
348	V	98.3	Very high	95.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	142.4	-177.8	-170.6	0	0	0	0	109	F250 G251 A371 L424 A427 E428	F250-V348 WeakPolarHBondContact CA-O 3.18Å; F250-V348 HydrophobicContact CD1-CB 3.94Å; F250-V348 HydrophobicContact CE1-CB 4.29Å; G251-V348 PolarHBondContact N-O 2.77Å; G251-V348 VanDerWaalsContact N-O 3.17Å; V348-A371 WeakPolarHBondContact CA-O 3.43Å; V348-A371 HydrophobicContact CG1-CB 4.25Å; V348-A371 HydrophobicContact CG2-CB 4.34Å; V348-L424 HydrophobicContact CG1-CD2 3.73Å; V348-A427 HydrophobicContact CG1-CB 3.91Å; V348-A427 HydrophobicContact CG2-CB 3.83Å; V348-E428 HydrophobicContact CG2-CB 3.98Å
349	A	98.4	Very high	95.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.6	171.2	0	0	0	0	0	112.6	G251 I253 L369 A371 Y372 V373	G251-A349 CarbonylContact O-C 3.53Å; G251-A349 VanDerWaalsContact O-CA 3.27Å; G251-A349 WeakPolarHBondContact O-CA 3.09Å; I253-A349 HydrophobicContact CD1-CB 3.81Å; A349-L369 HydrophobicContact CB-CD2 3.79Å; A349-A371 PolarHBondContact N-O 3.21Å; A349-Y372 HydrophobicContact CB-CD1 4.16Å; A349-Y372 HydrophobicContact CB-CE1 4.39Å; A349-Y372 WeakPolarHBondContact O-CA 3.48Å; A349-V373 PolarHBondContact O-N 2.84Å
350	A	98.6	Very high	95.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	137.7	164	0	0	0	0	0	109.8	G251 V252 I253 V373	G251-A350 PolarHBondContact O-N 3.43Å; V252-A350 WeakPolarHBondContact CA-O 3.44Å; I253-A350 PolarHBondContact N-O 3.33Å; A350-V373 CarbonylContact C-O 3.59Å; A350-V373 VanDerWaalsContact CA-O 3.25Å; A350-V373 WeakPolarHBondContact CA-O 3.47Å
351	V	98.6	Very high	95.2	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	113.6	175.5	-173.9	0	0	0	0	108.6	I253 Q255 F359 Y372 V373 L374 V375	I253-V351 HydrophobicContact CB-CG2 4.46Å; I253-V351 HydrophobicContact CD1-CG2 4.23Å; I253-V351 CarbonylContact O-C 3.38Å; I253-V351 WeakPolarHBondContact O-CA 3.26Å; Q255-V351 HydrophobicContact CB-CG1 4.24Å; V351-F359 HydrophobicContact CG1-CD2 4.06Å; V351-F359 HydrophobicContact CG1-CE2 4.2Å; V351-F359 HydrophobicContact CG2-CD2 4.37Å; V351-F359 HydrophobicContact CG2-CE2 3.84Å; V351-F359 HydrophobicContact CG2-CZ 3.98Å; V351-Y372 HydrophobicContact CG2-CD1 4.16Å; V351-V373 PolarHBondContact N-O 3.23Å; V351-L374 HydrophobicContact CB-CG 4.23Å; V351-L374 CarbonylContact O-C 3.58Å; V351-L374 WeakPolarHBondContact O-CA 3.38Å; V351-V375 PolarHBondContact O-N 3Å
352	F	98.6	Very high	95	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	133.4	179.4	-176.8	-104.6	0	0	0	111.5	I253 Y254 Q255 A274 F275 F278 E354 V375 V377 Y387	I253-F352 PolarHBondContact O-N 2.82Å; Y254-F352 AromaticContact CD2-CD1 3.94Å; Y254-F352 HydrophobicContact CD2-CD1 3.94Å; Y254-F352 HydrophobicContact CE2-CD1 4.27Å; Q255-F352 PolarHBondContact N-O 2.72Å; A274-F352 HydrophobicContact CB-CZ 4.3Å; F275-F352 VanDerWaalsContact CA-CE1 3.47Å; F275-F352 HydrophobicContact CB-CD1 3.95Å; F275-F352 HydrophobicContact CB-CE1 3.73Å; F275-F352 HydrophobicContact CD2-CB 3.96Å; F275-F352 AromaticContact CD2-CD1 3.31Å; F275-F352 HydrophobicContact CD2-CD1 3.31Å; F275-F352 AromaticContact CD2-CE1 3.91Å; F275-F352 HydrophobicContact CD2-CE1 3.91Å; F275-F352 AromaticContact CD2-CG 3.71Å; F275-F352 HydrophobicContact CD2-CG 3.71Å; F275-F352 HydrophobicContact CE2-CB 3.91Å; F275-F352 HydrophobicContact CE2-CD1 4.12Å; F275-F352 HydrophobicContact CE2-CG 4.18Å; F275-F352 AromaticContact CG-CD1 3.96Å; F275-F352 HydrophobicContact CG-CD1 3.96Å; F275-F352 HydrophobicContact CG-CE1 4.26Å; F278-F352 HydrophobicContact CB-CD2 3.74Å; F278-F352 HydrophobicContact CB-CE2 3.43Å; F278-F352 VanDerWaalsContact CB-CE2 3.43Å; F278-F352 HydrophobicContact CB-CG 4.46Å; F278-F352 HydrophobicContact CB-CZ 3.92Å; F278-F352 HydrophobicContact CD1-CB 3.95Å; F278-F352 AromaticContact CD1-CD2 3.49Å; F278-F352 HydrophobicContact CD1-CD2 3.49Å; F278-F352 VanDerWaalsContact CD1-CD2 3.49Å; F278-F352 HydrophobicContact CD1-CE2 4.13Å; F278-F352 AromaticContact CD1-CG 3.78Å; F278-F352 HydrophobicContact CD1-CG 3.78Å; F278-F352 AromaticContact CD2-CD2 3.87Å; F278-F352 HydrophobicContact CD2-CD2 3.87Å; F278-F352 HydrophobicContact CD2-CE2 4.09Å; F278-F352 HydrophobicContact CE1-CB 3.94Å; F278-F352 HydrophobicContact CE1-CD2 4.02Å; F278-F352 HydrophobicContact CE1-CG 4.24Å; F278-F352 HydrophobicContact CE2-CD2 4.37Å; F278-F352 AromaticContact CG-CD2 3.4Å; F278-F352 HydrophobicContact CG-CD2 3.4Å; F278-F352 AromaticContact CG-CE2 3.62Å; F278-F352 HydrophobicContact CG-CE2 3.62Å; F278-F352 HydrophobicContact CG-CG 4.14Å; F278-F352 HydrophobicContact CG-CZ 4.49Å; F278-F352 HydrophobicContact CZ-CD2 4.43Å; F352-E354 HydrophobicContact CE1-CG 3.68Å; F352-E354 HydrophobicContact CZ-CG 4.21Å; F352-V375 WeakPolarHBondContact CA-O 3.25Å; F352-V375 HydrophobicContact CD2-CG1 4.35Å; F352-V377 HydrophobicContact CE1-CG1 4.42Å; F352-V377 HydrophobicContact CE2-CB 3.95Å; F352-V377 HydrophobicContact CE2-CG1 4Å; F352-V377 HydrophobicContact CZ-CB 3.98Å; F352-V377 HydrophobicContact CZ-CG1 3.54Å; F352-Y387 HydrophobicContact CE2-CE1 4.27Å
353	Q	97.8	Very high	94.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	127.6	-176.9	-62.5	170.7	-35.5	0	0	109.9	Q88 Q255 T357 V375 Q376 V377	Q88-Q353 VanDerWaalsContact CG-OE1 3.23Å; Q255-Q353 HydrophobicContact CB-CG 4.21Å; Q353-T357 PolarHBondContact NE2-O 2.86Å; Q353-V375 PolarHBondContact N-O 3.44Å; Q353-Q376 HydrophobicContact CB-CB 4.18Å; Q353-Q376 HydrophobicContact CB-CG 4.23Å; Q353-Q376 CarbonylContact O-C 3.59Å; Q353-Q376 VanDerWaalsContact O-CA 3.32Å; Q353-Q376 WeakPolarHBondContact O-CA 3.09Å; Q353-V377 PolarHBondContact O-N 3.09Å
354	E	93.8	Very high	94.6	Very high	51 Å²	51	18.7 Å²	18.7	24%	0.238	10%	0.099	C	C	.	.	S	Bend	trans	-87.4	-29.1	172.9	-77.2	177.3	-99.8	0	0	113.2	Y254 T272 A274 F352 V377	Y254-E354 HydrophobicContact CE2-CG 4.43Å; Y254-E354 VanDerWaalsContact CE2-OE1 3.22Å; Y254-E354 WeakPolarHBondContact CE2-OE1 3.48Å; Y254-E354 VanDerWaalsContact CZ-OE1 3.22Å; Y254-E354 PolarHBondContact OH-OE1 2.82Å; T272-E354 WeakPolarHBondContact CB-OE1 3.49Å; T272-E354 VanDerWaalsContact CG2-OE1 3.26Å; T272-E354 WeakPolarHBondContact CG2-OE1 3.43Å; T272-E354 PolarHBondContact OG1-OE1 2.78Å; T272-E354 PolarHBondContact OG1-OE2 3.45Å; A274-E354 HydrophobicContact CB-CG 3.89Å; A274-E354 VanDerWaalsContact CB-OE2 3.31Å; A274-E354 WeakPolarHBondContact CB-OE2 3.5Å; F352-E354 HydrophobicContact CE1-CG 3.68Å; F352-E354 HydrophobicContact CZ-CG 4.21Å; E354-V377 HydrophobicContact CB-CG1 4.47Å; E354-V377 HydrophobicContact CG-CG1 4.11Å
355	E	91.9	Very high	94.5	Very high	111 Å²	111	21.7 Å²	21.7	52%	0.519	12%	0.123	S	C	.	.	S	Bend	trans	-126.4	151.3	179.7	-66.2	-175.6	-110.3	0	0	109.5	F257 T357	F257-E355 HydrophobicContact CB-CB 3.97Å; F257-E355 HydrophobicContact CB-CG 4.39Å; F257-E355 HydrophobicContact CD2-CB 3.86Å; F257-E355 HydrophobicContact CG-CB 4.29Å; E355-T357 PolarHBondContact O-N 2.88Å; E355-T357 PolarHBondContact O-OG1 2.86Å
356	S	90.5	Very high	94.3	Very high	34 Å²	34	20.6 Å²	20.6	24%	0.238	12%	0.118	C	C	.	.			trans	-59.4	107.9	179.7	-172.5	0	0	0	0	109.7	Y86	Y86-S356 VanDerWaalsContact CD2-O 3.29Å; Y86-S356 WeakPolarHBondContact CD2-O 3.48Å
357	T	91.7	Very high	94	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.146	C	C	.	.			trans	-135.3	129.6	-175.3	-48	0	0	0	0	107.8	Q255 Q353 E355	Q255-T357 HydrophobicContact CG-CG2 4.18Å; Q353-T357 PolarHBondContact NE2-O 2.86Å; E355-T357 PolarHBondContact O-N 2.88Å; E355-T357 PolarHBondContact O-OG1 2.86Å
358	P	93.5	Very high	93.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.149	C	C	.	.			trans	-66.4	149.6	173.1	26	-32.1	0	0	0	111.5	I76 L80 P87 I90 Q255	I76-P358 HydrophobicContact CD1-CB 4.07Å; I76-P358 HydrophobicContact CD1-CG 3.94Å; I76-P358 WeakPolarHBondContact CD1-O 3.17Å; I76-P358 HydrophobicContact CG1-CB 3.99Å; I76-P358 HydrophobicContact CG1-CG 3.63Å; L80-P358 HydrophobicContact CD2-CG 3.91Å; L80-P358 HydrophobicContact CG-CG 4.1Å; P87-P358 WeakPolarHBondContact O-CA 3.49Å; I90-P358 HydrophobicContact CD1-CB 3.53Å; I90-P358 HydrophobicContact CD1-CG 4.36Å; I90-P358 HydrophobicContact CG1-CB 4.04Å; Q255-P358 PolarHBondContact NE2-O 3.09Å
359	F	95.1	Very high	93.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-131	139.1	175.4	175.1	-90.4	0	0	0	109.7	Q88 V89 I90 V351 P361 M363 I364 Y372 L374	Q88-F359 PolarHBondContact O-N 3.27Å; Q88-F359 VanDerWaalsContact O-N 3.07Å; V89-F359 CarbonylContact C-O 3.57Å; V89-F359 WeakPolarHBondContact CA-O 3.47Å; I90-F359 PolarHBondContact N-O 2.94Å; V351-F359 HydrophobicContact CG1-CD2 4.06Å; V351-F359 HydrophobicContact CG1-CE2 4.2Å; V351-F359 HydrophobicContact CG2-CD2 4.37Å; V351-F359 HydrophobicContact CG2-CE2 3.84Å; V351-F359 HydrophobicContact CG2-CZ 3.98Å; F359-P361 HydrophobicContact CE1-CG 4.34Å; F359-M363 HydrophobicContact CD2-CG 4.47Å; F359-M363 HydrophobicContact CD2-SD 3.3Å; F359-M363 WeakPolarHBondContact CD2-SD 3.46Å; F359-M363 HydrophobicContact CE2-CG 4.11Å; F359-M363 HydrophobicContact CE2-SD 3.49Å; F359-M363 WeakPolarHBondContact CE2-SD 3.32Å; F359-M363 HydrophobicContact CG-SD 4.02Å; F359-M363 HydrophobicContact CZ-SD 4.35Å; F359-I364 HydrophobicContact CE2-CD1 4.37Å; F359-Y372 HydrophobicContact CE1-CD1 4.17Å; F359-Y372 HydrophobicContact CE1-CD2 4.05Å; F359-Y372 HydrophobicContact CE1-CE2 4.39Å; F359-Y372 AromaticContact CE1-CG 3.91Å; F359-Y372 HydrophobicContact CE1-CG 3.91Å; F359-Y372 AromaticContact CZ-CD1 3.8Å; F359-Y372 HydrophobicContact CZ-CD1 3.8Å; F359-Y372 HydrophobicContact CZ-CD2 4.35Å; F359-Y372 AromaticContact CZ-CE1 3.88Å; F359-Y372 HydrophobicContact CZ-CE1 3.88Å; F359-Y372 HydrophobicContact CZ-CE2 4.41Å; F359-Y372 HydrophobicContact CZ-CG 4.03Å; F359-L374 HydrophobicContact CB-CD2 3.54Å; F359-L374 HydrophobicContact CD1-CD1 4.45Å; F359-L374 HydrophobicContact CD1-CD2 3.81Å; F359-L374 HydrophobicContact CD1-CG 4.43Å; F359-L374 HydrophobicContact CG-CD2 3.78Å
360	V	94.3	Very high	93.5	Very high	23 Å²	23	26.7 Å²	26.7	14%	0.139	15%	0.15	C	C	.	.			trans	-117.8	123.2	175.4	175.1	0	0	0	0	108.2	I76 I90 P92 D362 M363	I76-V360 HydrophobicContact CB-CG2 4.27Å; I76-V360 HydrophobicContact CD1-CG2 4.26Å; I90-V360 HydrophobicContact CB-CG2 3.89Å; I90-V360 HydrophobicContact CG2-CG2 4.29Å; P92-V360 HydrophobicContact CB-CG1 4.43Å; P92-V360 HydrophobicContact CG-CG1 4.1Å; V360-D362 HydrophobicContact CG1-CB 4.4Å; V360-D362 PolarHBondContact O-N 3.37Å; V360-D362 VanDerWaalsContact O-N 3.07Å; V360-M363 HydrophobicContact CB-CB 4.49Å; V360-M363 VanDerWaalsContact O-CB 3.27Å; V360-M363 WeakPolarHBondContact O-CB 3.29Å; V360-M363 WeakPolarHBondContact O-CG 3.2Å; V360-M363 PolarHBondContact O-N 3.49Å
361	P	92.4	Very high	93.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-53.7	-31.5	-177.6	-31.1	37.2	0	0	0	115.9	V89 I90 Y97 F359 M363 Y372 T392	V89-P361 HydrophobicContact CG1-CG 4.48Å; I90-P361 WeakPolarHBondContact O-CD 3.27Å; Y97-P361 HydrophobicContact CD1-CB 3.49Å; Y97-P361 VanDerWaalsContact CD1-CB 3.49Å; Y97-P361 HydrophobicContact CD1-CG 3.93Å; Y97-P361 HydrophobicContact CD2-CB 4.07Å; Y97-P361 HydrophobicContact CE1-CB 3.38Å; Y97-P361 HydrophobicContact CE1-CG 4.32Å; Y97-P361 HydrophobicContact CE2-CB 3.97Å; Y97-P361 HydrophobicContact CG-CB 3.85Å; Y97-P361 HydrophobicContact CG-CG 4.07Å; F359-P361 HydrophobicContact CE1-CG 4.34Å; P361-M363 VanDerWaalsContact C-N 3.33Å; P361-Y372 HydrophobicContact CB-CD2 4.03Å; P361-Y372 HydrophobicContact CB-CE2 3.77Å; P361-Y372 PolarHBondContact O-OH 3.03Å; P361-Y372 VanDerWaalsContact O-OH 3.12Å; P361-T392 HydrophobicContact CG-CG2 3.78Å
362	D	89.8	Confident	93.5	Very high	83 Å²	83	26.8 Å²	26.8	44%	0.444	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-82.9	-1.5	177.5	-79	-14	0	0	0	114.4	P92 Y97 V360 I364	P92-D362 HydrophobicContact CB-CB 4.3Å; P92-D362 WeakPolarHBondContact CB-OD2 3.32Å; P92-D362 HydrophobicContact CG-CB 4.01Å; P92-D362 WeakPolarHBondContact CG-OD2 3.38Å; Y97-D362 WeakPolarHBondContact CE2-OD1 3.49Å; Y97-D362 PolarHBondContact OH-OD1 2.92Å; V360-D362 HydrophobicContact CG1-CB 4.4Å; V360-D362 PolarHBondContact O-N 3.37Å; V360-D362 VanDerWaalsContact O-N 3.07Å; D362-I364 PolarHBondContact O-N 2.94Å
363	M	90.9	Very high	93.5	Very high	24 Å²	24	26.8 Å²	26.8	12%	0.118	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-66.2	-17.1	171.7	82.6	-166.3	-66.7	0	0	112.3	T260 E262 L265 F359 V360 P361	T260-M363 WeakPolarHBondContact O-CE 3.42Å; E262-M363 WeakPolarHBondContact CB-O 3.04Å; L265-M363 HydrophobicContact CD1-CE 3.69Å; L265-M363 HydrophobicContact CD1-CG 4.13Å; L265-M363 HydrophobicContact CD1-SD 3.93Å; L265-M363 HydrophobicContact CG-CE 4.19Å; F359-M363 HydrophobicContact CD2-CG 4.47Å; F359-M363 HydrophobicContact CD2-SD 3.3Å; F359-M363 WeakPolarHBondContact CD2-SD 3.46Å; F359-M363 HydrophobicContact CE2-CG 4.11Å; F359-M363 HydrophobicContact CE2-SD 3.49Å; F359-M363 WeakPolarHBondContact CE2-SD 3.32Å; F359-M363 HydrophobicContact CG-SD 4.02Å; F359-M363 HydrophobicContact CZ-SD 4.35Å; V360-M363 HydrophobicContact CB-CB 4.49Å; V360-M363 VanDerWaalsContact O-CB 3.27Å; V360-M363 WeakPolarHBondContact O-CB 3.29Å; V360-M363 WeakPolarHBondContact O-CG 3.2Å; V360-M363 PolarHBondContact O-N 3.49Å; P361-M363 VanDerWaalsContact C-N 3.33Å
364	I	91.9	Very high	93.5	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.015	15%	0.15	C	C	.	.	S	Bend	trans	-112	109.5	174.2	-55.2	-179.8	0	0	0	108.4	I253 E262 L265 F266 F359 D362 S366 L369 Y372	I253-I364 HydrophobicContact CD1-CD1 3.48Å; I253-I364 VanDerWaalsContact CD1-CD1 3.48Å; I253-I364 HydrophobicContact CG1-CD1 4.46Å; E262-I364 WeakPolarHBondContact OE2-CA 3.5Å; L265-I364 HydrophobicContact CD1-CD1 3.96Å; L265-I364 HydrophobicContact CD1-CG1 4.05Å; F266-I364 HydrophobicContact CE2-CG2 4.28Å; F266-I364 HydrophobicContact CZ-CG2 4.18Å; F359-I364 HydrophobicContact CE2-CD1 4.37Å; D362-I364 PolarHBondContact O-N 2.94Å; I364-S366 VanDerWaalsContact C-N 3.31Å; I364-S366 PolarHBondContact O-N 3.23Å; I364-L369 HydrophobicContact CG2-CD1 3.94Å; I364-Y372 HydrophobicContact CD1-CE1 4.31Å
365	A	90.3	Very high	93.7	Very high	70 Å²	70	24.3 Å²	24.3	58%	0.579	14%	0.139	S	C	*	.			trans	-78.4	78.6	-174.6	0	0	0	0	0	111	E262 K340	E262-A365 PolarHBondContact OE2-N 3.22Å; K340-A365 WeakPolarHBondContact CE-O 3.39Å; K340-A365 PolarHBondContact NZ-O 3.15Å
366	S	91.9	Very high	94	Very high	15 Å²	15	19.9 Å²	19.9	11%	0.105	12%	0.118	C	C	.	.			trans	-112.7	147.3	-178.2	178.2	0	0	0	0	114	G344 I364 F368 L369 R394	G344-S366 PolarHBondContact O-OG 3.33Å; I364-S366 VanDerWaalsContact C-N 3.31Å; I364-S366 PolarHBondContact O-N 3.23Å; S366-F368 PolarHBondContact OG-N 2.78Å; S366-L369 PolarHBondContact OG-N 2.66Å; S366-R394 PolarHBondContact O-NH2 2.9Å
367	N	89.1	Confident	94.3	Very high	107 Å²	107	18.4 Å²	18.4	57%	0.572	11%	0.107	S	C	*	.	S	Bend	trans	-91.7	-13.1	168.9	-102.3	-79.9	0	0	0	113.6	K436	N367-K436 PolarHBondContact O-NZ 3.12Å; N367-K436 PolarHBondContact OD1-NZ 3.47Å
368	F	91.8	Very high	94.5	Very high	38 Å²	38	21.7 Å²	21.7	17%	0.167	12%	0.122	C	C	.	.	S	Bend	trans	-118.5	-33.8	-169.8	-69.7	-82.9	0	0	0	113.4	N345 D346 I347 S366 H370 F437 S497 M498	N345-F368 HydrophobicContact CB-CD2 4.48Å; N345-F368 WeakPolarHBondContact OD1-CD2 3.38Å; N345-F368 VanDerWaalsContact OD1-CE2 3.29Å; N345-F368 WeakPolarHBondContact OD1-CE2 3.49Å; D346-F368 CarbonylContact O-C 3.51Å; D346-F368 VanDerWaalsContact O-CB 3.24Å; D346-F368 WeakPolarHBondContact O-CB 3.24Å; I347-F368 WeakPolarHBondContact CA-O 3.48Å; S366-F368 PolarHBondContact OG-N 2.78Å; F368-H370 PolarHBondContact O-N 3.37Å; F368-H370 PolarHBondContact O-ND1 2.99Å; F368-F437 HydrophobicContact CD1-CE1 4.18Å; F368-F437 HydrophobicContact CD1-CZ 4.25Å; F368-S497 WeakPolarHBondContact CD1-OG 3.45Å; F368-S497 WeakPolarHBondContact CE1-OG 3.29Å; F368-S497 WeakPolarHBondContact CZ-OG 3.49Å; F368-M498 HydrophobicContact CZ-CB 4.31Å; F368-M498 HydrophobicContact CZ-CG 4.35Å; F368-M498 HydrophobicContact CZ-SD 4.46Å
369	L	95.2	Very high	94.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.148	C	C	.	.			trans	-64.5	116.9	174.4	-65.8	168.9	0	0	0	109.5	D346 A349 I364 S366 Y372	D346-L369 HydrophobicContact CB-CD2 4.39Å; D346-L369 WeakPolarHBondContact O-CD2 3.31Å; D346-L369 PolarHBondContact O-N 2.85Å; D346-L369 VanDerWaalsContact O-N 3.11Å; A349-L369 HydrophobicContact CB-CD2 3.79Å; I364-L369 HydrophobicContact CG2-CD1 3.94Å; S366-L369 PolarHBondContact OG-N 2.66Å; L369-Y372 HydrophobicContact CB-CE1 4.35Å; L369-Y372 HydrophobicContact CD1-CE1 3.99Å
370	H	95.8	Very high	94.5	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.009	16%	0.163	C	C	.	.			trans	-121.8	-12.6	177.7	-73.3	57.1	0	0	0	112.4	I347 F368 A393 R394 V397 C431 F437	I347-H370 PolarHBondContact O-N 2.98Å; F368-H370 PolarHBondContact O-N 3.37Å; F368-H370 PolarHBondContact O-ND1 2.99Å; H370-A393 CarbonylContact O-C 3.58Å; H370-A393 WeakPolarHBondContact O-CA 3.47Å; H370-A393 WeakPolarHBondContact O-CB 3.4Å; H370-R394 PolarHBondContact CE1-NH1 3.09Å; H370-R394 PolarHBondContact NE2-NH1 2.78Å; H370-R394 PolarHBondContact O-N 2.93Å; H370-V397 HydrophobicContact CB-CG2 3.92Å; H370-C431 HydrophobicContact CB-CB 4.34Å; H370-F437 AromaticContact CE1-CE2 3.56Å; H370-F437 AromaticContact CG-CE2 3.8Å; H370-F437 AromaticContact ND1-CE2 3.5Å; H370-F437 AromaticContact NE2-CE2 3.91Å
371	A	98	Very high	94.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	146.6	174.3	0	0	0	0	0	112.4	I347 V348 A349 T392 A393 F400 A427	I347-A371 PolarHBondContact O-N 2.86Å; V348-A371 WeakPolarHBondContact CA-O 3.43Å; V348-A371 HydrophobicContact CG1-CB 4.25Å; V348-A371 HydrophobicContact CG2-CB 4.34Å; A349-A371 PolarHBondContact N-O 3.21Å; A371-T392 CarbonylContact C-O 3.56Å; A371-T392 WeakPolarHBondContact CA-O 3.41Å; A371-A393 HydrophobicContact CB-CB 3.69Å; A371-F400 HydrophobicContact CB-CE1 4.43Å; A371-F400 HydrophobicContact CB-CZ 4.27Å; A371-A427 HydrophobicContact CB-CB 4.2Å
372	Y	98.5	Very high	94.5	Very high	1 Å²	1	33.6 Å²	33.6	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	135.7	177.6	-61.2	-83.5	0	0	0	110.3	Y97 A349 V351 F359 P361 I364 L369 T392	Y97-Y372 HydrophobicContact CE1-CE2 4.38Å; A349-Y372 HydrophobicContact CB-CD1 4.16Å; A349-Y372 HydrophobicContact CB-CE1 4.39Å; A349-Y372 WeakPolarHBondContact O-CA 3.48Å; V351-Y372 HydrophobicContact CG2-CD1 4.16Å; F359-Y372 HydrophobicContact CE1-CD1 4.17Å; F359-Y372 HydrophobicContact CE1-CD2 4.05Å; F359-Y372 HydrophobicContact CE1-CE2 4.39Å; F359-Y372 AromaticContact CE1-CG 3.91Å; F359-Y372 HydrophobicContact CE1-CG 3.91Å; F359-Y372 AromaticContact CZ-CD1 3.8Å; F359-Y372 HydrophobicContact CZ-CD1 3.8Å; F359-Y372 HydrophobicContact CZ-CD2 4.35Å; F359-Y372 AromaticContact CZ-CE1 3.88Å; F359-Y372 HydrophobicContact CZ-CE1 3.88Å; F359-Y372 HydrophobicContact CZ-CE2 4.41Å; F359-Y372 HydrophobicContact CZ-CG 4.03Å; P361-Y372 HydrophobicContact CB-CD2 4.03Å; P361-Y372 HydrophobicContact CB-CE2 3.77Å; P361-Y372 PolarHBondContact O-OH 3.03Å; P361-Y372 VanDerWaalsContact O-OH 3.12Å; I364-Y372 HydrophobicContact CD1-CE1 4.31Å; L369-Y372 HydrophobicContact CB-CE1 4.35Å; L369-Y372 HydrophobicContact CD1-CE1 3.99Å; Y372-T392 HydrophobicContact CD2-CG2 4.35Å; Y372-T392 PolarHBondContact N-O 2.86Å; Y372-T392 PolarHBondContact O-N 3.47Å
373	V	98.5	Very high	94.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	108.2	171.9	-178.2	0	0	0	0	108.2	A349 A350 V351 V389 V391 L420 K423 L424	A349-V373 PolarHBondContact O-N 2.84Å; A350-V373 CarbonylContact C-O 3.59Å; A350-V373 VanDerWaalsContact CA-O 3.25Å; A350-V373 WeakPolarHBondContact CA-O 3.47Å; V351-V373 PolarHBondContact N-O 3.23Å; V373-V389 HydrophobicContact CG1-CG1 4Å; V373-V391 HydrophobicContact CG1-CG2 4.27Å; V373-V391 HydrophobicContact CG2-CG2 4.31Å; V373-L420 HydrophobicContact CG1-CD1 3.68Å; V373-K423 HydrophobicContact CG2-CG 4.36Å; V373-L424 HydrophobicContact CB-CD2 4.15Å; V373-L424 HydrophobicContact CG2-CD2 3.86Å
374	L	98.4	Very high	94.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	133.7	-177	-61.2	83.4	0	0	0	109.5	Q88 V89 V351 F359 V389 S390 T392	Q88-L374 HydrophobicContact CG-CB 4.48Å; Q88-L374 HydrophobicContact CG-CD2 4.19Å; V89-L374 HydrophobicContact CG2-CD1 3.6Å; V89-L374 HydrophobicContact CG2-CD2 3.63Å; V89-L374 HydrophobicContact CG2-CG 4.25Å; V351-L374 HydrophobicContact CB-CG 4.23Å; V351-L374 CarbonylContact O-C 3.58Å; V351-L374 WeakPolarHBondContact O-CA 3.38Å; F359-L374 HydrophobicContact CB-CD2 3.54Å; F359-L374 HydrophobicContact CD1-CD1 4.45Å; F359-L374 HydrophobicContact CD1-CD2 3.81Å; F359-L374 HydrophobicContact CD1-CG 4.43Å; F359-L374 HydrophobicContact CG-CD2 3.78Å; L374-V389 VanDerWaalsContact O-CA 3.27Å; L374-V389 WeakPolarHBondContact O-CA 3.27Å; L374-S390 PolarHBondContact N-O 3.5Å; L374-S390 PolarHBondContact O-N 3.05Å; L374-S390 VanDerWaalsContact O-N 3.07Å; L374-T392 HydrophobicContact CD1-CG2 3.88Å
375	V	98.3	Very high	94.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	102	-178.9	-178.8	0	0	0	0	108.1	F278 V351 F352 Q353 Y387 F416 L420	F278-V375 HydrophobicContact CD2-CG1 4.05Å; F278-V375 HydrophobicContact CE2-CB 4.03Å; F278-V375 HydrophobicContact CE2-CG1 3.76Å; F278-V375 HydrophobicContact CE2-CG2 4.02Å; F278-V375 HydrophobicContact CZ-CB 4.33Å; F278-V375 HydrophobicContact CZ-CG2 4.24Å; V351-V375 PolarHBondContact O-N 3Å; F352-V375 WeakPolarHBondContact CA-O 3.25Å; F352-V375 HydrophobicContact CD2-CG1 4.35Å; Q353-V375 PolarHBondContact N-O 3.44Å; V375-Y387 HydrophobicContact CG1-CD1 3.66Å; V375-Y387 HydrophobicContact CG1-CG 4.16Å; V375-F416 HydrophobicContact CG1-CE1 4.49Å; V375-F416 HydrophobicContact CG1-CZ 3.84Å; V375-F416 HydrophobicContact CG2-CZ 4.33Å; V375-L420 HydrophobicContact CG2-CD1 4.34Å; V375-L420 HydrophobicContact CG2-CD2 4.44Å
376	Q	97.8	Very high	95.2	Very high	18 Å²	18	40.9 Å²	40.9	8%	0.084	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	126.7	170.6	-174.5	-165.5	-27.8	0	0	108.5	Q353 Y387 K388	Q353-Q376 HydrophobicContact CB-CB 4.18Å; Q353-Q376 HydrophobicContact CB-CG 4.23Å; Q353-Q376 CarbonylContact O-C 3.59Å; Q353-Q376 VanDerWaalsContact O-CA 3.32Å; Q353-Q376 WeakPolarHBondContact O-CA 3.09Å; Q376-Y387 CarbonylContact O-C 3.49Å; Q376-Y387 WeakPolarHBondContact O-CA 3.32Å; Q376-K388 HydrophobicContact CB-CB 4.38Å; Q376-K388 PolarHBondContact N-O 2.76Å; Q376-K388 PolarHBondContact O-N 2.76Å
377	V	97.4	Very high	95.5	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	148.2	174.2	65.7	0	0	0	0	111.6	A274 F352 Q353 E354 P380 T385 T386 Y387	A274-V377 HydrophobicContact CB-CG1 4.39Å; F352-V377 HydrophobicContact CE1-CG1 4.42Å; F352-V377 HydrophobicContact CE2-CB 3.95Å; F352-V377 HydrophobicContact CE2-CG1 4Å; F352-V377 HydrophobicContact CZ-CB 3.98Å; F352-V377 HydrophobicContact CZ-CG1 3.54Å; Q353-V377 PolarHBondContact O-N 3.09Å; E354-V377 HydrophobicContact CB-CG1 4.47Å; E354-V377 HydrophobicContact CG-CG1 4.11Å; V377-P380 HydrophobicContact CG1-CB 4.1Å; V377-P380 HydrophobicContact CG1-CG 4.4Å; V377-P380 HydrophobicContact CG2-CB 3.78Å; V377-T385 HydrophobicContact CG2-CG2 3.53Å; V377-T386 WeakPolarHBondContact CA-O 3.5Å; V377-Y387 HydrophobicContact CB-CD1 3.9Å; V377-Y387 HydrophobicContact CB-CE1 3.75Å; V377-Y387 HydrophobicContact CG2-CD1 3.91Å; V377-Y387 HydrophobicContact CG2-CE1 3.48Å; V377-Y387 VanDerWaalsContact CG2-CE1 3.48Å
378	E	95.5	Very high	95.8	Very high	68 Å²	68	38 Å²	38	32%	0.318	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	141.7	173.4	-65.8	171.8	157.4	0	0	108.2	P380 T385 T386	E378-P380 VanDerWaalsContact C-CD 3.5Å; E378-T385 WeakPolarHBondContact O-CA 3.42Å; E378-T386 WeakPolarHBondContact CB-OG1 3.27Å; E378-T386 PolarHBondContact N-O 3.11Å; E378-T386 PolarHBondContact O-N 2.9Å; E378-T386 PolarHBondContact OE2-OG1 2.85Å
379	N	94.9	Very high	96.1	Very high	99 Å²	99	36.3 Å²	36.3	53%	0.529	19%	0.194	S	C	.	.	S	Bend	trans	49.1	46	-174.9	-46.4	-67.7	0	0	0	114.1	T382 T385	N379-T382 PolarHBondContact O-OG1 2.76Å; N379-T385 WeakPolarHBondContact O-CA 3.33Å; N379-T385 PolarHBondContact O-OG1 3.31Å
380	P	93.8	Very high	96.2	Very high	49 Å²	49	37.3 Å²	37.3	32%	0.318	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	151.1	-173	24.6	-35	0	0	0	113.3	A274 V377 E378 T382	A274-P380 HydrophobicContact CB-CB 3.52Å; A274-P380 HydrophobicContact CB-CG 4.21Å; V377-P380 HydrophobicContact CG1-CB 4.1Å; V377-P380 HydrophobicContact CG1-CG 4.4Å; V377-P380 HydrophobicContact CG2-CB 3.78Å; E378-P380 VanDerWaalsContact C-CD 3.5Å; P380-T382 VanDerWaalsContact C-N 3.26Å; P380-T382 PolarHBondContact O-N 3.3Å
381	C	92.3	Very high	96.3	Very high	68 Å²	68	37.2 Å²	37.2	46%	0.459	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	28.8	179.4	-53.5	0	0	0	0	114.3	P273 E277 T385	P273-C381 VanDerWaalsContact C-SG 3.56Å; E277-C381 WeakPolarHBondContact OE2-CA 3.34Å; E277-C381 PolarHBondContact OE2-N 3.35Å; C381-T385 PolarHBondContact N-OG1 3.02Å
382	T	93.8	Very high	96.3	Very high	58 Å²	58	37.2 Å²	37.2	36%	0.356	20%	0.201	S	C	.	.	S	Bend	trans	-126.2	169.2	176.9	72.8	0	0	0	0	112.3	N379 P380 H384 T385 K412	N379-T382 PolarHBondContact O-OG1 2.76Å; P380-T382 VanDerWaalsContact C-N 3.26Å; P380-T382 PolarHBondContact O-N 3.3Å; T382-H384 PolarHBondContact O-N 2.86Å; T382-H384 VanDerWaalsContact O-N 3.1Å; T382-H384 WeakPolarHBondContact OG1-CA 3.36Å; T382-H384 PolarHBondContact OG1-N 3.01Å; T382-T385 PolarHBondContact N-OG1 2.89Å; T382-T385 PolarHBondContact O-N 3.44Å; T382-T385 PolarHBondContact O-OG1 3.09Å; T382-T385 PolarHBondContact OG1-N 2.9Å; T382-K412 PolarHBondContact O-NZ 2.99Å
383	D	90.4	Very high	96.2	Very high	160 Å²	160	37.2 Å²	37.2	86%	0.856	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-0.3	168.6	-61.2	-36.3	0	0	0	113.1
384	H	93.4	Very high	96.1	Very high	146 Å²	146	39.7 Å²	39.7	68%	0.676	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.8	15	178.9	-58.3	-16.9	0	0	0	112.2	T382 T386	T382-H384 PolarHBondContact O-N 2.86Å; T382-H384 VanDerWaalsContact O-N 3.1Å; T382-H384 WeakPolarHBondContact OG1-CA 3.36Å; T382-H384 PolarHBondContact OG1-N 3.01Å; H384-T386 PolarHBondContact O-N 3.34Å; H384-T386 VanDerWaalsContact O-N 3.13Å
385	T	96.8	Very high	95.9	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.018	25%	0.245	C	C	.	.			trans	-53.8	118.8	173.8	-53.8	0	0	0	0	110.2	E277 V377 E378 N379 C381 T382 Y387 K412	E277-T385 WeakPolarHBondContact OE2-CG2 3.44Å; E277-T385 PolarHBondContact OE2-OG1 3.07Å; V377-T385 HydrophobicContact CG2-CG2 3.53Å; E378-T385 WeakPolarHBondContact O-CA 3.42Å; N379-T385 WeakPolarHBondContact O-CA 3.33Å; N379-T385 PolarHBondContact O-OG1 3.31Å; C381-T385 PolarHBondContact N-OG1 3.02Å; T382-T385 PolarHBondContact N-OG1 2.89Å; T382-T385 PolarHBondContact O-N 3.44Å; T382-T385 PolarHBondContact O-OG1 3.09Å; T382-T385 PolarHBondContact OG1-N 2.9Å; T385-Y387 HydrophobicContact CG2-CE1 4.08Å; T385-Y387 HydrophobicContact CG2-CE2 3.81Å; T385-Y387 WeakPolarHBondContact CG2-OH 3.45Å; T385-K412 HydrophobicContact CG2-CB 4.34Å; T385-K412 HydrophobicContact CG2-CD 4.37Å; T385-K412 WeakPolarHBondContact O-CB 3.45Å; T385-K412 PolarHBondContact O-N 3.02Å; T385-K412 PolarHBondContact OG1-NZ 2.73Å; T385-K412 VanDerWaalsContact OG1-NZ 3.14Å
386	T	97.3	Very high	95.6	Very high	24 Å²	24	50 Å²	50	15%	0.147	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	155.7	170.7	40.9	0	0	0	0	111.1	V377 E378 H384 V409 F410 K411	V377-T386 WeakPolarHBondContact CA-O 3.5Å; E378-T386 WeakPolarHBondContact CB-OG1 3.27Å; E378-T386 PolarHBondContact N-O 3.11Å; E378-T386 PolarHBondContact O-N 2.9Å; E378-T386 PolarHBondContact OE2-OG1 2.85Å; H384-T386 PolarHBondContact O-N 3.34Å; H384-T386 VanDerWaalsContact O-N 3.13Å; T386-V409 HydrophobicContact CG2-CG1 4.14Å; T386-F410 CarbonylContact C-O 3.44Å; T386-F410 VanDerWaalsContact CA-O 3.25Å; T386-F410 WeakPolarHBondContact CA-O 3.25Å; T386-F410 WeakPolarHBondContact CB-O 3.13Å; T386-K411 HydrophobicContact CG2-CG 4.17Å
387	Y	97.8	Very high	95.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	110.5	-179.2	-64.7	-71.7	0	0	0	109.6	F278 I281 F352 V375 Q376 V377 T385 V409 F410 K412 F416	F278-Y387 HydrophobicContact CD2-CE1 4.43Å; I281-Y387 HydrophobicContact CD1-CD2 4.42Å; I281-Y387 HydrophobicContact CD1-CE2 3.39Å; I281-Y387 WeakPolarHBondContact CD1-OH 3.42Å; F352-Y387 HydrophobicContact CE2-CE1 4.27Å; V375-Y387 HydrophobicContact CG1-CD1 3.66Å; V375-Y387 HydrophobicContact CG1-CG 4.16Å; Q376-Y387 CarbonylContact O-C 3.49Å; Q376-Y387 WeakPolarHBondContact O-CA 3.32Å; V377-Y387 HydrophobicContact CB-CD1 3.9Å; V377-Y387 HydrophobicContact CB-CE1 3.75Å; V377-Y387 HydrophobicContact CG2-CD1 3.91Å; V377-Y387 HydrophobicContact CG2-CE1 3.48Å; V377-Y387 VanDerWaalsContact CG2-CE1 3.48Å; T385-Y387 HydrophobicContact CG2-CE1 4.08Å; T385-Y387 HydrophobicContact CG2-CE2 3.81Å; T385-Y387 WeakPolarHBondContact CG2-OH 3.45Å; Y387-V409 WeakPolarHBondContact O-CA 3.39Å; Y387-F410 PolarHBondContact N-O 2.93Å; Y387-F410 PolarHBondContact O-N 2.73Å; Y387-K412 HydrophobicContact CE2-CB 3.85Å; Y387-K412 HydrophobicContact CE2-CG 4.22Å; Y387-F416 HydrophobicContact CD1-CE1 4.13Å; Y387-F416 HydrophobicContact CD1-CZ 4.45Å; Y387-F416 AromaticContact CD2-CD1 3.42Å; Y387-F416 HydrophobicContact CD2-CD1 3.42Å; Y387-F416 VanDerWaalsContact CD2-CD1 3.42Å; Y387-F416 AromaticContact CD2-CE1 3.31Å; Y387-F416 HydrophobicContact CD2-CE1 3.31Å; Y387-F416 HydrophobicContact CD2-CG 4.26Å; Y387-F416 HydrophobicContact CD2-CZ 4.07Å; Y387-F416 AromaticContact CE2-CD1 3.93Å; Y387-F416 HydrophobicContact CE2-CD1 3.93Å; Y387-F416 AromaticContact CE2-CE1 3.87Å; Y387-F416 HydrophobicContact CE2-CE1 3.87Å; Y387-F416 HydrophobicContact CG-CD1 4.03Å; Y387-F416 AromaticContact CG-CE1 3.46Å; Y387-F416 HydrophobicContact CG-CE1 3.46Å; Y387-F416 VanDerWaalsContact CG-CE1 3.46Å; Y387-F416 AromaticContact CG-CZ 3.8Å; Y387-F416 HydrophobicContact CG-CZ 3.8Å
388	K	97	Very high	95.3	Very high	61 Å²	61	51.3 Å²	51.3	27%	0.265	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	127.3	172.2	177	-174.5	170.9	-171.4	0	109.2	Q376 A408 V409	Q376-K388 HydrophobicContact CB-CB 4.38Å; Q376-K388 PolarHBondContact N-O 2.76Å; Q376-K388 PolarHBondContact O-N 2.76Å; K388-A408 WeakPolarHBondContact CA-O 3.48Å; K388-V409 HydrophobicContact CB-CG2 4.19Å; K388-V409 HydrophobicContact CG-CG2 4.34Å
389	V	97.6	Very high	95.2	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.012	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.7	-175.1	-175.3	0	0	0	0	111	V373 L374 V391 L404 A408 F410 F416 F419	V373-V389 HydrophobicContact CG1-CG1 4Å; L374-V389 VanDerWaalsContact O-CA 3.27Å; L374-V389 WeakPolarHBondContact O-CA 3.27Å; V389-V391 HydrophobicContact CG1-CG2 4.28Å; V389-L404 HydrophobicContact CB-CD2 3.88Å; V389-L404 HydrophobicContact CG1-CD2 3.7Å; V389-A408 PolarHBondContact N-O 2.92Å; V389-A408 WeakPolarHBondContact O-CB 3.37Å; V389-F410 HydrophobicContact CB-CD2 4.43Å; V389-F410 HydrophobicContact CB-CE2 4.13Å; V389-F410 HydrophobicContact CG2-CD2 3.65Å; V389-F410 HydrophobicContact CG2-CE2 3.73Å; V389-F416 HydrophobicContact CG2-CE2 3.83Å; V389-F416 HydrophobicContact CG2-CZ 4.49Å; V389-F419 HydrophobicContact CG1-CE1 4.29Å
390	S	97.3	Very high	95.3	Very high	22 Å²	22	48.9 Å²	48.9	15%	0.154	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.1	164	-64.2	0	0	0	0	109.5	Q88 L374	Q88-S390 PolarHBondContact OE1-OG 3.34Å; L374-S390 PolarHBondContact N-O 3.5Å; L374-S390 PolarHBondContact O-N 3.05Å; L374-S390 VanDerWaalsContact O-N 3.07Å
391	V	98	Very high	95.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	139.3	178.6	177.2	0	0	0	0	109.1	W98 I99 E100 V373 V389 F400 L404	W98-V391 HydrophobicContact CZ3-CG1 4.49Å; I99-V391 WeakPolarHBondContact CA-O 3.44Å; E100-V391 HydrophobicContact CB-CB 3.87Å; E100-V391 HydrophobicContact CB-CG1 4.43Å; E100-V391 PolarHBondContact N-O 3.07Å; E100-V391 WeakPolarHBondContact OE2-CB 3.17Å; E100-V391 WeakPolarHBondContact OE2-CG1 3.26Å; V373-V391 HydrophobicContact CG1-CG2 4.27Å; V373-V391 HydrophobicContact CG2-CG2 4.31Å; V389-V391 HydrophobicContact CG1-CG2 4.28Å; V391-F400 HydrophobicContact CG1-CE2 3.85Å; V391-F400 HydrophobicContact CG1-CZ 3.6Å; V391-L404 HydrophobicContact CG2-CD1 4.43Å; V391-L404 HydrophobicContact CG2-CD2 4.45Å
392	T	97.5	Very high	95.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	138.6	175.8	178.8	0	0	0	0	110.5	V89 W98 P361 A371 Y372 L374	V89-T392 HydrophobicContact CG1-CG2 3.89Å; V89-T392 HydrophobicContact CG2-CG2 4.1Å; W98-T392 WeakPolarHBondContact O-CA 3.36Å; W98-T392 VanDerWaalsContact O-CB 3.26Å; W98-T392 WeakPolarHBondContact O-CB 3.41Å; W98-T392 PolarHBondContact O-OG1 3.21Å; P361-T392 HydrophobicContact CG-CG2 3.78Å; A371-T392 CarbonylContact C-O 3.56Å; A371-T392 WeakPolarHBondContact CA-O 3.41Å; Y372-T392 HydrophobicContact CD2-CG2 4.35Å; Y372-T392 PolarHBondContact N-O 2.86Å; Y372-T392 PolarHBondContact O-N 3.47Å; L374-T392 HydrophobicContact CD1-CG2 3.88Å
393	A	97.1	Very high	95.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	167.1	180	0	0	0	0	0	110.6	Y97 W98 H370 A371 V397 F400	Y97-A393 CarbonylContact C-O 3.5Å; Y97-A393 WeakPolarHBondContact CA-O 3.39Å; Y97-A393 WeakPolarHBondContact CB-O 3.44Å; W98-A393 HydrophobicContact CD2-CB 4.46Å; W98-A393 HydrophobicContact CH2-CB 4.13Å; W98-A393 HydrophobicContact CZ2-CB 3.67Å; W98-A393 PolarHBondContact N-O 3.38Å; W98-A393 PolarHBondContact O-N 2.67Å; H370-A393 CarbonylContact O-C 3.58Å; H370-A393 WeakPolarHBondContact O-CA 3.47Å; H370-A393 WeakPolarHBondContact O-CB 3.4Å; A371-A393 HydrophobicContact CB-CB 3.69Å; A393-V397 HydrophobicContact CB-CB 4.09Å; A393-V397 HydrophobicContact CB-CG1 4.13Å; A393-V397 HydrophobicContact CB-CG2 4.47Å; A393-F400 HydrophobicContact CB-CE1 4.09Å
394	R	95.3	Very high	95.4	Very high	52 Å²	52	38.5 Å²	38.5	20%	0.196	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	153.1	-179	-74.4	-172.7	177	172.8	-0.7	112.6	G96 Y97 W98 S366 H370 D396 V397	G96-R394 CarbonylContact O-C 3.58Å; G96-R394 VanDerWaalsContact O-CA 3.29Å; G96-R394 WeakPolarHBondContact O-CA 3.47Å; Y97-R394 HydrophobicContact CD1-CB 4.42Å; Y97-R394 HydrophobicContact CD1-CG 3.69Å; Y97-R394 HydrophobicContact CE1-CB 4.46Å; Y97-R394 HydrophobicContact CE1-CG 3.31Å; Y97-R394 HydrophobicContact CE2-CG 4.23Å; Y97-R394 HydrophobicContact CG-CG 4.28Å; Y97-R394 PolarHBondContact OH-NE 3.32Å; Y97-R394 VanDerWaalsContact OH-NE 3.12Å; Y97-R394 PolarHBondContact OH-NH2 2.84Å; W98-R394 VanDerWaalsContact CD1-O 3.31Å; W98-R394 PolarHBondContact NE1-O 3.39Å; S366-R394 PolarHBondContact O-NH2 2.9Å; H370-R394 PolarHBondContact CE1-NH1 3.09Å; H370-R394 PolarHBondContact NE2-NH1 2.78Å; H370-R394 PolarHBondContact O-N 2.93Å; R394-D396 WeakPolarHBondContact CB-OD1 3.4Å; R394-D396 PolarHBondContact O-N 2.88Å; R394-D396 VanDerWaalsContact O-N 3.12Å; R394-V397 HydrophobicContact CB-CG2 4.14Å; R394-V397 WeakPolarHBondContact O-CB 3.43Å; R394-V397 PolarHBondContact O-N 3.12Å
395	E	93.9	Very high	95.3	Very high	157 Å²	157	33.9 Å²	33.9	73%	0.734	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-36.1	176.7	-174.3	-176.6	131.3	0	0	113.4	G96 V397	G96-E395 PolarHBondContact O-N 3.18Å; E395-V397 VanDerWaalsContact C-N 3.34Å
396	D	93	Very high	94.8	Very high	60 Å²	60	38.4 Å²	38.4	32%	0.321	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-1.6	-180	74	-37.4	0	0	0	114.4	R394 S434 D435	R394-D396 WeakPolarHBondContact CB-OD1 3.4Å; R394-D396 PolarHBondContact O-N 2.88Å; R394-D396 VanDerWaalsContact O-N 3.12Å; D396-S434 WeakPolarHBondContact O-CA 3.38Å; D396-S434 WeakPolarHBondContact OD2-CB 3.47Å; D396-S434 PolarHBondContact OD2-OG 3.04Å; D396-D435 HydrophobicContact CB-CB 4.24Å; D396-D435 PolarHBondContact OD2-N 3.25Å
397	V	94.9	Very high	94.5	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.018	24%	0.236	C	C	.	.	S	Bend	trans	-92.2	120.1	172.9	-177.4	0	0	0	0	108.9	W98 H370 A393 R394 E395 F400 A430	W98-V397 PolarHBondContact NE1-O 2.91Å; H370-V397 HydrophobicContact CB-CG2 3.92Å; A393-V397 HydrophobicContact CB-CB 4.09Å; A393-V397 HydrophobicContact CB-CG1 4.13Å; A393-V397 HydrophobicContact CB-CG2 4.47Å; R394-V397 HydrophobicContact CB-CG2 4.14Å; R394-V397 WeakPolarHBondContact O-CB 3.43Å; R394-V397 PolarHBondContact O-N 3.12Å; E395-V397 VanDerWaalsContact C-N 3.34Å; V397-F400 HydrophobicContact CG1-CD1 4.28Å; V397-F400 HydrophobicContact CG1-CE1 4.17Å; V397-A430 HydrophobicContact CG1-CB 3.95Å
398	P	94.4	Very high	94.4	Very high	46 Å²	46	42.5 Å²	42.5	30%	0.299	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-71	155.4	176.4	29.7	-34.2	0	0	0	111.5	F400 A430 K433	P398-F400 WeakPolarHBondContact O-CD1 3.34Å; P398-A430 HydrophobicContact CG-CB 4.33Å; P398-K433 HydrophobicContact CG-CB 4.04Å; P398-K433 HydrophobicContact CG-CD 3.62Å; P398-K433 HydrophobicContact CG-CG 4.45Å
399	P	93.9	Very high	94.3	Very high	107 Å²	107	42.1 Å²	42.1	70%	0.695	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-54.8	146.9	174.8	-26.3	35.2	0	0	0	113.2
400	F	95.3	Very high	94.2	Very high	9 Å²	9	42.9 Å²	42.9	4%	0.039	25%	0.25	C	S	.	.			trans	-138.6	139.8	-174.4	49.6	-95.4	0	0	0	112.1	W98 A371 V391 A393 V397 P398 K423 N426 A427 A430	W98-F400 HydrophobicContact CH2-CD1 4.04Å; W98-F400 AromaticContact CH2-CE1 3.55Å; W98-F400 HydrophobicContact CH2-CE1 3.55Å; W98-F400 HydrophobicContact CH2-CZ 4.07Å; W98-F400 HydrophobicContact CZ2-CD1 4.24Å; W98-F400 AromaticContact CZ2-CE1 3.83Å; W98-F400 HydrophobicContact CZ2-CE1 3.83Å; A371-F400 HydrophobicContact CB-CE1 4.43Å; A371-F400 HydrophobicContact CB-CZ 4.27Å; V391-F400 HydrophobicContact CG1-CE2 3.85Å; V391-F400 HydrophobicContact CG1-CZ 3.6Å; A393-F400 HydrophobicContact CB-CE1 4.09Å; V397-F400 HydrophobicContact CG1-CD1 4.28Å; V397-F400 HydrophobicContact CG1-CE1 4.17Å; P398-F400 WeakPolarHBondContact O-CD1 3.34Å; F400-K423 HydrophobicContact CD2-CD 3.99Å; F400-K423 HydrophobicContact CE2-CD 4.03Å; F400-K423 HydrophobicContact CE2-CG 4.32Å; F400-K423 PolarHBondContact O-NZ 2.89Å; F400-N426 HydrophobicContact CB-CB 4.27Å; F400-A427 HydrophobicContact CD1-CB 4.46Å; F400-A427 HydrophobicContact CD2-CB 3.87Å; F400-A427 HydrophobicContact CE1-CB 4.11Å; F400-A427 HydrophobicContact CE2-CB 3.47Å; F400-A427 VanDerWaalsContact CE2-CB 3.47Å; F400-A427 HydrophobicContact CG-CB 4.36Å; F400-A427 HydrophobicContact CZ-CB 3.61Å; F400-A430 HydrophobicContact CB-CB 3.84Å; F400-A430 HydrophobicContact CD1-CB 3.7Å; F400-A430 HydrophobicContact CG-CB 4.13Å
401	G	92.3	Very high	94.2	Very high	18 Å²	18	49.7 Å²	49.7	19%	0.186	28%	0.277	C	S	.	.	S	Bend	trans	-81.5	176.8	179.7	0	0	0	0	0	113.8	E137 N426	E137-G401 PolarHBondContact OE1-N 3.26Å; G401-N426 WeakPolarHBondContact O-CB 3.27Å; G401-N426 PolarHBondContact O-ND2 3.1Å
402	P	95.1	Very high	94	Very high	9 Å²	9	53.1 Å²	53.1	6%	0.058	29%	0.292	C	S	.	.	S	Bend	cis	-66.5	148.1	-12.1	28.8	-35.8	0	0	0	111.8	Y134 F419 K423	Y134-P402 HydrophobicContact CD1-CB 3.34Å; Y134-P402 HydrophobicContact CD1-CG 3.73Å; Y134-P402 HydrophobicContact CE1-CB 3.89Å; Y134-P402 HydrophobicContact CE1-CG 4.26Å; Y134-P402 HydrophobicContact CG-CB 4.03Å; Y134-P402 HydrophobicContact CG-CG 3.96Å; P402-F419 HydrophobicContact CB-CD2 4.19Å; P402-F419 HydrophobicContact CB-CE2 4.16Å; P402-F419 HydrophobicContact CG-CD2 3.48Å; P402-F419 VanDerWaalsContact CG-CD2 3.48Å; P402-F419 HydrophobicContact CG-CE2 3.6Å; P402-F419 HydrophobicContact CG-CG 4.35Å; P402-K423 WeakPolarHBondContact O-CD 3.47Å; P402-K423 WeakPolarHBondContact O-CE 3.45Å; P402-K423 PolarHBondContact O-NZ 3.14Å
403	P	92.8	Very high	93.7	Very high	75 Å²	75	54.6 Å²	54.6	49%	0.487	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-64.7	150.7	178.3	29	-35.5	0	0	0	111.3	A106	A106-P403 HydrophobicContact CB-CG 4.39Å
404	L	92.7	Very high	93.6	Very high	15 Å²	15	59.9 Å²	59.9	8%	0.079	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-60.9	141.8	169.2	-69.6	169.1	0	0	0	111.2	E100 A102 V389 V391 A408 F419	E100-L404 HydrophobicContact CB-CD1 3.9Å; E100-L404 HydrophobicContact CG-CD1 3.91Å; E100-L404 HydrophobicContact CG-CG 4.33Å; E100-L404 PolarHBondContact OE1-N 3.02Å; E100-L404 VanDerWaalsContact OE1-N 3.1Å; A102-L404 HydrophobicContact CB-CB 4.19Å; V389-L404 HydrophobicContact CB-CD2 3.88Å; V389-L404 HydrophobicContact CG1-CD2 3.7Å; V391-L404 HydrophobicContact CG2-CD1 4.43Å; V391-L404 HydrophobicContact CG2-CD2 4.45Å; L404-A408 HydrophobicContact CB-CB 4.32Å; L404-A408 HydrophobicContact CD1-CB 4.5Å; L404-A408 HydrophobicContact CD2-CB 4.38Å; L404-F419 HydrophobicContact CD2-CE1 4.39Å; L404-F419 HydrophobicContact CD2-CZ 3.8Å
405	P	91.9	Very high	93.5	Very high	49 Å²	49	64 Å²	64	32%	0.318	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-73.2	164.1	168.6	30.8	-32.9	0	0	0	110.8	P407 A408 F410	P405-P407 CarbonylContact C-O 3.54Å; P405-P407 CarbonylContact O-C 3.1Å; P405-A408 WeakPolarHBondContact O-CA 3.23Å; P405-A408 PolarHBondContact O-N 3.13Å; P405-F410 HydrophobicContact CG-CE1 4.08Å; P405-F410 HydrophobicContact CG-CE2 3.9Å; P405-F410 HydrophobicContact CG-CZ 3.62Å
406	N	86.8	Confident	93.7	Very high	97 Å²	97	56.6 Å²	56.6	52%	0.519	33%	0.328	S	S	.	.	S	Bend	trans	-112.8	118.2	167.7	-174.5	2.9	0	0	0	110.2	E103	E103-N406 PolarHBondContact OE1-ND2 3.12Å; E103-N406 PolarHBondContact OE2-ND2 3.24Å
407	P	90.9	Very high	93.9	Very high	90 Å²	90	56.7 Å²	56.7	58%	0.584	32%	0.324	S	S	*	.	S	Bend	cis	-68.4	157.6	-7.3	31	-36.5	0	0	0	111.8	P405 V409	P405-P407 CarbonylContact C-O 3.54Å; P405-P407 CarbonylContact O-C 3.1Å; P407-V409 HydrophobicContact CB-CG2 4.39Å; P407-V409 PolarHBondContact O-N 2.74Å
408	A	94.4	Very high	93.9	Very high	21 Å²	21	58.9 Å²	58.9	17%	0.174	33%	0.334	C	S	.	.			trans	-75.6	51.2	-177.7	0	0	0	0	0	113.2	A102 K388 V389 L404 P405	A102-A408 HydrophobicContact CB-CB 4.44Å; K388-A408 WeakPolarHBondContact CA-O 3.48Å; V389-A408 PolarHBondContact N-O 2.92Å; V389-A408 WeakPolarHBondContact O-CB 3.37Å; L404-A408 HydrophobicContact CB-CB 4.32Å; L404-A408 HydrophobicContact CD1-CB 4.5Å; L404-A408 HydrophobicContact CD2-CB 4.38Å; P405-A408 WeakPolarHBondContact O-CA 3.23Å; P405-A408 PolarHBondContact O-N 3.13Å
409	V	95.4	Very high	94.1	Very high	52 Å²	52	56.7 Å²	56.7	32%	0.315	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	126.4	-173.4	-177.1	0	0	0	0	110.2	T386 Y387 K388 P407	T386-V409 HydrophobicContact CG2-CG1 4.14Å; Y387-V409 WeakPolarHBondContact O-CA 3.39Å; K388-V409 HydrophobicContact CB-CG2 4.19Å; K388-V409 HydrophobicContact CG-CG2 4.34Å; P407-V409 HydrophobicContact CB-CG2 4.39Å; P407-V409 PolarHBondContact O-N 2.74Å
410	F	96.3	Very high	94.3	Very high	18 Å²	18	51.7 Å²	51.7	8%	0.079	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	155.1	179.4	-62.1	-99.7	0	0	0	110.8	T386 Y387 V389 P405 F416 F419	T386-F410 CarbonylContact C-O 3.44Å; T386-F410 VanDerWaalsContact CA-O 3.25Å; T386-F410 WeakPolarHBondContact CA-O 3.25Å; T386-F410 WeakPolarHBondContact CB-O 3.13Å; Y387-F410 PolarHBondContact N-O 2.93Å; Y387-F410 PolarHBondContact O-N 2.73Å; V389-F410 HydrophobicContact CB-CD2 4.43Å; V389-F410 HydrophobicContact CB-CE2 4.13Å; V389-F410 HydrophobicContact CG2-CD2 3.65Å; V389-F410 HydrophobicContact CG2-CE2 3.73Å; P405-F410 HydrophobicContact CG-CE1 4.08Å; P405-F410 HydrophobicContact CG-CE2 3.9Å; P405-F410 HydrophobicContact CG-CZ 3.62Å; F410-F416 HydrophobicContact CB-CB 3.98Å; F410-F416 HydrophobicContact CB-CD2 3.49Å; F410-F416 VanDerWaalsContact CB-CD2 3.49Å; F410-F416 HydrophobicContact CB-CE2 4.24Å; F410-F416 HydrophobicContact CB-CG 3.89Å; F410-F416 HydrophobicContact CD1-CD2 4.02Å; F410-F416 AromaticContact CD2-CD2 3.96Å; F410-F416 HydrophobicContact CD2-CD2 3.96Å; F410-F416 HydrophobicContact CD2-CE2 4.19Å; F410-F416 AromaticContact CG-CD2 3.56Å; F410-F416 HydrophobicContact CG-CD2 3.56Å; F410-F416 HydrophobicContact CG-CE2 4.24Å; F410-F416 HydrophobicContact CG-CG 4.37Å; F410-F419 HydrophobicContact CD1-CB 4.47Å; F410-F419 HydrophobicContact CD1-CG 4.42Å; F410-F419 HydrophobicContact CE1-CB 3.85Å; F410-F419 AromaticContact CE1-CD1 3.88Å; F410-F419 HydrophobicContact CE1-CD1 3.88Å; F410-F419 AromaticContact CE1-CD2 3.66Å; F410-F419 HydrophobicContact CE1-CD2 3.66Å; F410-F419 HydrophobicContact CE1-CE1 4.43Å; F410-F419 HydrophobicContact CE1-CE2 4.22Å; F410-F419 AromaticContact CE1-CG 3.49Å; F410-F419 HydrophobicContact CE1-CG 3.49Å; F410-F419 VanDerWaalsContact CE1-CG 3.49Å; F410-F419 AromaticContact CE2-CD1 3.96Å; F410-F419 HydrophobicContact CE2-CD1 3.96Å; F410-F419 AromaticContact CE2-CE1 3.85Å; F410-F419 HydrophobicContact CE2-CE1 3.85Å; F410-F419 HydrophobicContact CE2-CE2 4.48Å; F410-F419 HydrophobicContact CE2-CG 4.37Å; F410-F419 HydrophobicContact CE2-CZ 4.14Å; F410-F419 HydrophobicContact CZ-CB 4.32Å; F410-F419 AromaticContact CZ-CD1 3.49Å; F410-F419 HydrophobicContact CZ-CD1 3.49Å; F410-F419 VanDerWaalsContact CZ-CD1 3.49Å; F410-F419 AromaticContact CZ-CD2 3.47Å; F410-F419 HydrophobicContact CZ-CD2 3.47Å; F410-F419 VanDerWaalsContact CZ-CD2 3.47Å; F410-F419 AromaticContact CZ-CE1 3.59Å; F410-F419 HydrophobicContact CZ-CE1 3.59Å; F410-F419 AromaticContact CZ-CE2 3.56Å; F410-F419 HydrophobicContact CZ-CE2 3.56Å; F410-F419 AromaticContact CZ-CG 3.46Å; F410-F419 HydrophobicContact CZ-CG 3.46Å; F410-F419 VanDerWaalsContact CZ-CG 3.46Å; F410-F419 AromaticContact CZ-CZ 3.64Å; F410-F419 HydrophobicContact CZ-CZ 3.64Å
411	K	95.8	Very high	94.4	Very high	165 Å²	165	51.3 Å²	51.3	72%	0.717	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	149.5	168.1	-68.5	177.1	179.6	176.2	0	110.3	T386 G413 F416	T386-K411 HydrophobicContact CG2-CG 4.17Å; K411-G413 PolarHBondContact O-N 3.28Å; K411-G413 VanDerWaalsContact O-N 3.17Å; K411-F416 WeakPolarHBondContact O-CB 3.34Å
412	K	94.3	Very high	94.6	Very high	73 Å²	73	50.4 Å²	50.4	32%	0.317	28%	0.277	S	S	.	.	S	Bend	trans	-55.9	118	167.7	-177.7	173.2	71.8	-163.5	0	110.4	E277 I281 T382 T385 Y387	E277-K412 HydrophobicContact CG-CD 3.96Å; E277-K412 WeakPolarHBondContact OE1-CD 3.46Å; E277-K412 IonicContact OE1-NZ 2.73Å; E277-K412 PolarHBondContact OE1-NZ 3.4Å; E277-K412 IonicContact OE2-NZ 3.13Å; I281-K412 HydrophobicContact CD1-CG 4.07Å; T382-K412 PolarHBondContact O-NZ 2.99Å; T385-K412 HydrophobicContact CG2-CB 4.34Å; T385-K412 HydrophobicContact CG2-CD 4.37Å; T385-K412 WeakPolarHBondContact O-CB 3.45Å; T385-K412 PolarHBondContact O-N 3.02Å; T385-K412 PolarHBondContact OG1-NZ 2.73Å; T385-K412 VanDerWaalsContact OG1-NZ 3.14Å; Y387-K412 HydrophobicContact CE2-CB 3.85Å; Y387-K412 HydrophobicContact CE2-CG 4.22Å
413	G	92.1	Very high	94.8	Very high	30 Å²	30	50 Å²	50	31%	0.309	27%	0.274	S	S	.	.	S	Bend	trans	168.5	179.2	-176.8	0	0	0	0	0	113.6	K411 E415 F416 R417	K411-G413 PolarHBondContact O-N 3.28Å; K411-G413 VanDerWaalsContact O-N 3.17Å; G413-E415 VanDerWaalsContact C-N 3.33Å; G413-E415 PolarHBondContact O-N 2.85Å; G413-F416 PolarHBondContact O-N 2.91Å; G413-R417 PolarHBondContact O-N 3.1Å
414	P	93.9	Very high	95	Very high	111 Å²	111	46.4 Å²	46.4	72%	0.721	25%	0.251	S	S	*	.	H	α-helix	trans	-64.3	-34.3	-178.1	25.9	-34.1	0	0	0	112.9	F416 R417 E418	P414-F416 VanDerWaalsContact C-N 3.33Å; P414-F416 PolarHBondContact O-N 2.7Å; P414-R417 WeakPolarHBondContact O-CB 3.34Å; P414-R417 PolarHBondContact O-N 3Å; P414-E418 PolarHBondContact O-N 3.3Å
415	E	94.3	Very high	95.2	Very high	139 Å²	139	45.7 Å²	45.7	65%	0.65	25%	0.247	S	C	*	.	H	α-helix	trans	-57.9	-44	176.9	-62.6	175.5	170.8	0	0	111.8	G413 E418 F419	G413-E415 VanDerWaalsContact C-N 3.33Å; G413-E415 PolarHBondContact O-N 2.85Å; E415-E418 PolarHBondContact O-N 2.82Å; E415-F419 WeakPolarHBondContact O-CB 3.46Å; E415-F419 PolarHBondContact O-N 3.08Å
416	F	96.5	Very high	95.4	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-67.4	-38.7	177.2	177.7	-125.8	0	0	0	112.4	I281 V375 Y387 V389 F410 K411 G413 P414 F419 L420	I281-F416 HydrophobicContact CD1-CD1 4.29Å; I281-F416 HydrophobicContact CD1-CE1 4.42Å; I281-F416 HydrophobicContact CG2-CD1 3.9Å; I281-F416 HydrophobicContact CG2-CE1 4.19Å; V375-F416 HydrophobicContact CG1-CE1 4.49Å; V375-F416 HydrophobicContact CG1-CZ 3.84Å; V375-F416 HydrophobicContact CG2-CZ 4.33Å; Y387-F416 HydrophobicContact CD1-CE1 4.13Å; Y387-F416 HydrophobicContact CD1-CZ 4.45Å; Y387-F416 AromaticContact CD2-CD1 3.42Å; Y387-F416 HydrophobicContact CD2-CD1 3.42Å; Y387-F416 VanDerWaalsContact CD2-CD1 3.42Å; Y387-F416 AromaticContact CD2-CE1 3.31Å; Y387-F416 HydrophobicContact CD2-CE1 3.31Å; Y387-F416 HydrophobicContact CD2-CG 4.26Å; Y387-F416 HydrophobicContact CD2-CZ 4.07Å; Y387-F416 AromaticContact CE2-CD1 3.93Å; Y387-F416 HydrophobicContact CE2-CD1 3.93Å; Y387-F416 AromaticContact CE2-CE1 3.87Å; Y387-F416 HydrophobicContact CE2-CE1 3.87Å; Y387-F416 HydrophobicContact CG-CD1 4.03Å; Y387-F416 AromaticContact CG-CE1 3.46Å; Y387-F416 HydrophobicContact CG-CE1 3.46Å; Y387-F416 VanDerWaalsContact CG-CE1 3.46Å; Y387-F416 AromaticContact CG-CZ 3.8Å; Y387-F416 HydrophobicContact CG-CZ 3.8Å; V389-F416 HydrophobicContact CG2-CE2 3.83Å; V389-F416 HydrophobicContact CG2-CZ 4.49Å; F410-F416 HydrophobicContact CB-CB 3.98Å; F410-F416 HydrophobicContact CB-CD2 3.49Å; F410-F416 VanDerWaalsContact CB-CD2 3.49Å; F410-F416 HydrophobicContact CB-CE2 4.24Å; F410-F416 HydrophobicContact CB-CG 3.89Å; F410-F416 HydrophobicContact CD1-CD2 4.02Å; F410-F416 AromaticContact CD2-CD2 3.96Å; F410-F416 HydrophobicContact CD2-CD2 3.96Å; F410-F416 HydrophobicContact CD2-CE2 4.19Å; F410-F416 AromaticContact CG-CD2 3.56Å; F410-F416 HydrophobicContact CG-CD2 3.56Å; F410-F416 HydrophobicContact CG-CE2 4.24Å; F410-F416 HydrophobicContact CG-CG 4.37Å; K411-F416 WeakPolarHBondContact O-CB 3.34Å; G413-F416 PolarHBondContact O-N 2.91Å; P414-F416 VanDerWaalsContact C-N 3.33Å; P414-F416 PolarHBondContact O-N 2.7Å; F416-F419 PolarHBondContact O-N 3.09Å; F416-L420 HydrophobicContact CE1-CD2 4.29Å; F416-L420 HydrophobicContact CE2-CB 4.39Å; F416-L420 HydrophobicContact CE2-CD2 4.41Å; F416-L420 HydrophobicContact CZ-CD2 3.89Å; F416-L420 VanDerWaalsContact O-CB 3.26Å; F416-L420 WeakPolarHBondContact O-CB 3.44Å; F416-L420 PolarHBondContact O-N 3.21Å
417	R	97.2	Very high	95.9	Very high	63 Å²	63	38.8 Å²	38.8	24%	0.238	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-46.5	172.5	178.3	174.4	-176.9	126.5	-13.7	111.1	S280 I281 T312 G413 P414 L420 L421	S280-R417 PolarHBondContact O-NH1 3.03Å; I281-R417 HydrophobicContact CG2-CB 4.01Å; I281-R417 WeakPolarHBondContact O-CD 3.46Å; I281-R417 VanDerWaalsContact O-CG 3.23Å; I281-R417 WeakPolarHBondContact O-CG 3.21Å; I281-R417 PolarHBondContact O-NE 2.91Å; I281-R417 PolarHBondContact O-NH1 2.75Å; T312-R417 PolarHBondContact OG1-NH2 3.07Å; G413-R417 PolarHBondContact O-N 3.1Å; P414-R417 WeakPolarHBondContact O-CB 3.34Å; P414-R417 PolarHBondContact O-N 3Å; R417-L420 PolarHBondContact O-N 2.82Å; R417-L421 HydrophobicContact CG-CD1 3.66Å; R417-L421 HydrophobicContact CG-CG 4.2Å; R417-L421 WeakPolarHBondContact O-CB 3.4Å; R417-L421 VanDerWaalsContact O-CG 3.3Å; R417-L421 WeakPolarHBondContact O-CG 3.41Å; R417-L421 PolarHBondContact O-N 2.71Å
418	E	96.4	Very high	96.1	Very high	49 Å²	49	34.7 Å²	34.7	23%	0.229	18%	0.18	C	C	.	.	H	α-helix	trans	-65.1	-41.3	-180	-161.8	-178.3	167.3	0	0	111.4	S133 Y134 F314 R315 P414 E415 T422	S133-E418 WeakPolarHBondContact CA-OE1 3.35Å; S133-E418 PolarHBondContact OG-OE1 3.35Å; Y134-E418 HydrophobicContact CD2-CB 4.09Å; Y134-E418 HydrophobicContact CD2-CG 4.02Å; Y134-E418 HydrophobicContact CE2-CB 4.47Å; Y134-E418 PolarHBondContact N-OE1 3.19Å; F314-E418 HydrophobicContact CE2-CG 4.09Å; F314-E418 HydrophobicContact CZ-CG 3.89Å; R315-E418 IonicContact CZ-OE1 2.73Å; R315-E418 IonicContact NH2-OE1 3Å; R315-E418 PolarHBondContact NH2-OE1 3.47Å; P414-E418 PolarHBondContact O-N 3.3Å; E415-E418 PolarHBondContact O-N 2.82Å; E418-T422 VanDerWaalsContact O-CB 3.23Å; E418-T422 WeakPolarHBondContact O-CB 3.46Å; E418-T422 PolarHBondContact O-N 3.46Å; E418-T422 VanDerWaalsContact O-N 3.15Å; E418-T422 PolarHBondContact O-OG1 2.94Å
419	F	97.2	Very high	96.1	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-56.6	-57.7	171.8	174.6	-92.1	0	0	0	110.8	Y134 V389 P402 L404 F410 E415 F416 T422 K423	Y134-F419 HydrophobicContact CD2-CB 4.14Å; Y134-F419 HydrophobicContact CE1-CD2 4.13Å; Y134-F419 HydrophobicContact CE2-CB 3.56Å; Y134-F419 HydrophobicContact CE2-CD2 4.4Å; Y134-F419 AromaticContact CZ-CD2 3.97Å; V389-F419 HydrophobicContact CG1-CE1 4.29Å; P402-F419 HydrophobicContact CB-CD2 4.19Å; P402-F419 HydrophobicContact CB-CE2 4.16Å; P402-F419 HydrophobicContact CG-CD2 3.48Å; P402-F419 VanDerWaalsContact CG-CD2 3.48Å; P402-F419 HydrophobicContact CG-CE2 3.6Å; P402-F419 HydrophobicContact CG-CG 4.35Å; L404-F419 HydrophobicContact CD2-CE1 4.39Å; L404-F419 HydrophobicContact CD2-CZ 3.8Å; F410-F419 HydrophobicContact CD1-CB 4.47Å; F410-F419 HydrophobicContact CD1-CG 4.42Å; F410-F419 HydrophobicContact CE1-CB 3.85Å; F410-F419 AromaticContact CE1-CD1 3.88Å; F410-F419 HydrophobicContact CE1-CD1 3.88Å; F410-F419 AromaticContact CE1-CD2 3.66Å; F410-F419 HydrophobicContact CE1-CD2 3.66Å; F410-F419 HydrophobicContact CE1-CE1 4.43Å; F410-F419 HydrophobicContact CE1-CE2 4.22Å; F410-F419 AromaticContact CE1-CG 3.49Å; F410-F419 HydrophobicContact CE1-CG 3.49Å; F410-F419 VanDerWaalsContact CE1-CG 3.49Å; F410-F419 AromaticContact CE2-CD1 3.96Å; F410-F419 HydrophobicContact CE2-CD1 3.96Å; F410-F419 AromaticContact CE2-CE1 3.85Å; F410-F419 HydrophobicContact CE2-CE1 3.85Å; F410-F419 HydrophobicContact CE2-CE2 4.48Å; F410-F419 HydrophobicContact CE2-CG 4.37Å; F410-F419 HydrophobicContact CE2-CZ 4.14Å; F410-F419 HydrophobicContact CZ-CB 4.32Å; F410-F419 AromaticContact CZ-CD1 3.49Å; F410-F419 HydrophobicContact CZ-CD1 3.49Å; F410-F419 VanDerWaalsContact CZ-CD1 3.49Å; F410-F419 AromaticContact CZ-CD2 3.47Å; F410-F419 HydrophobicContact CZ-CD2 3.47Å; F410-F419 VanDerWaalsContact CZ-CD2 3.47Å; F410-F419 AromaticContact CZ-CE1 3.59Å; F410-F419 HydrophobicContact CZ-CE1 3.59Å; F410-F419 AromaticContact CZ-CE2 3.56Å; F410-F419 HydrophobicContact CZ-CE2 3.56Å; F410-F419 AromaticContact CZ-CG 3.46Å; F410-F419 HydrophobicContact CZ-CG 3.46Å; F410-F419 VanDerWaalsContact CZ-CG 3.46Å; F410-F419 AromaticContact CZ-CZ 3.64Å; F410-F419 HydrophobicContact CZ-CZ 3.64Å; E415-F419 WeakPolarHBondContact O-CB 3.46Å; E415-F419 PolarHBondContact O-N 3.08Å; F416-F419 PolarHBondContact O-N 3.09Å; F419-T422 PolarHBondContact O-N 2.68Å; F419-K423 HydrophobicContact CE1-CB 4.29Å; F419-K423 HydrophobicContact CE1-CG 4.33Å; F419-K423 HydrophobicContact CZ-CB 4.43Å; F419-K423 HydrophobicContact CZ-CD 4.19Å; F419-K423 HydrophobicContact CZ-CG 4.22Å; F419-K423 VanDerWaalsContact O-CB 3.28Å; F419-K423 WeakPolarHBondContact O-CB 3.25Å; F419-K423 PolarHBondContact O-N 2.96Å
420	L	98.1	Very high	96	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-65.5	-44.6	-170	-178.3	56.5	0	0	0	112.2	F278 L282 V373 V375 F416 R417 K423 L424	F278-L420 HydrophobicContact CE2-CD2 3.77Å; F278-L420 HydrophobicContact CZ-CD2 4.19Å; L282-L420 HydrophobicContact CD2-CD2 3.6Å; L282-L420 HydrophobicContact CD2-CG 4.2Å; V373-L420 HydrophobicContact CG1-CD1 3.68Å; V375-L420 HydrophobicContact CG2-CD1 4.34Å; V375-L420 HydrophobicContact CG2-CD2 4.44Å; F416-L420 HydrophobicContact CE1-CD2 4.29Å; F416-L420 HydrophobicContact CE2-CB 4.39Å; F416-L420 HydrophobicContact CE2-CD2 4.41Å; F416-L420 HydrophobicContact CZ-CD2 3.89Å; F416-L420 VanDerWaalsContact O-CB 3.26Å; F416-L420 WeakPolarHBondContact O-CB 3.44Å; F416-L420 PolarHBondContact O-N 3.21Å; R417-L420 PolarHBondContact O-N 2.82Å; L420-K423 PolarHBondContact O-N 3.41Å; L420-L424 HydrophobicContact CD1-CD1 4.22Å; L420-L424 HydrophobicContact CD1-CG 4.29Å; L420-L424 HydrophobicContact CG-CD1 4.24Å; L420-L424 VanDerWaalsContact O-CG 3.32Å; L420-L424 WeakPolarHBondContact O-CG 3.18Å; L420-L424 PolarHBondContact O-N 3.26Å
421	L	98.1	Very high	95.9	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-66.6	-38.2	177.5	-63.5	-180	0	0	0	111.8	T312 F314 I319 F321 R417 I425	T312-L421 HydrophobicContact CG2-CD1 4.2Å; F314-L421 HydrophobicContact CB-CD1 4.11Å; F314-L421 HydrophobicContact CD1-CB 3.89Å; F314-L421 HydrophobicContact CD2-CB 4.15Å; F314-L421 HydrophobicContact CD2-CD1 3.67Å; F314-L421 HydrophobicContact CE1-CB 3.96Å; F314-L421 HydrophobicContact CE2-CB 4.22Å; F314-L421 HydrophobicContact CE2-CD1 4.24Å; F314-L421 HydrophobicContact CG-CB 3.98Å; F314-L421 HydrophobicContact CG-CD1 3.91Å; F314-L421 HydrophobicContact CZ-CB 4.13Å; I319-L421 HydrophobicContact CD1-CD2 4.12Å; F321-L421 HydrophobicContact CE2-CD2 4.47Å; F321-L421 HydrophobicContact CZ-CD2 3.72Å; R417-L421 HydrophobicContact CG-CD1 3.66Å; R417-L421 HydrophobicContact CG-CG 4.2Å; R417-L421 WeakPolarHBondContact O-CB 3.4Å; R417-L421 VanDerWaalsContact O-CG 3.3Å; R417-L421 WeakPolarHBondContact O-CG 3.41Å; R417-L421 PolarHBondContact O-N 2.71Å; L421-I425 WeakPolarHBondContact O-CD1 3.44Å; L421-I425 WeakPolarHBondContact O-CG1 3.41Å; L421-I425 PolarHBondContact O-N 2.85Å
422	T	97.4	Very high	95.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.5	-42.9	174.5	-53	0	0	0	0	111.2	R135 L136 F314 E418 F419 I425 N426	R135-T422 WeakPolarHBondContact O-CG2 3.44Å; L136-T422 HydrophobicContact CD2-CG2 3.94Å; L136-T422 HydrophobicContact CG-CG2 4.38Å; F314-T422 WeakPolarHBondContact CZ-OG1 3.17Å; E418-T422 VanDerWaalsContact O-CB 3.23Å; E418-T422 WeakPolarHBondContact O-CB 3.46Å; E418-T422 PolarHBondContact O-N 3.46Å; E418-T422 VanDerWaalsContact O-N 3.15Å; E418-T422 PolarHBondContact O-OG1 2.94Å; F419-T422 PolarHBondContact O-N 2.68Å; T422-I425 PolarHBondContact O-N 3.07Å; T422-N426 WeakPolarHBondContact O-CB 3.4Å; T422-N426 VanDerWaalsContact O-CG 3.29Å; T422-N426 PolarHBondContact O-N 2.74Å
423	K	97.8	Very high	95.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-44	-179.8	-166.9	68	167.7	-177.1	0	112.1	E100 V373 F400 P402 F419 L420 N426 A427	E100-K423 IonicContact OE1-NZ 2.88Å; E100-K423 PolarHBondContact OE1-NZ 2.98Å; E100-K423 WeakPolarHBondContact OE2-CE 3.42Å; E100-K423 IonicContact OE2-NZ 2.69Å; E100-K423 PolarHBondContact OE2-NZ 3.43Å; V373-K423 HydrophobicContact CG2-CG 4.36Å; F400-K423 HydrophobicContact CD2-CD 3.99Å; F400-K423 HydrophobicContact CE2-CD 4.03Å; F400-K423 HydrophobicContact CE2-CG 4.32Å; F400-K423 PolarHBondContact O-NZ 2.89Å; P402-K423 WeakPolarHBondContact O-CD 3.47Å; P402-K423 WeakPolarHBondContact O-CE 3.45Å; P402-K423 PolarHBondContact O-NZ 3.14Å; F419-K423 HydrophobicContact CE1-CB 4.29Å; F419-K423 HydrophobicContact CE1-CG 4.33Å; F419-K423 HydrophobicContact CZ-CB 4.43Å; F419-K423 HydrophobicContact CZ-CD 4.19Å; F419-K423 HydrophobicContact CZ-CG 4.22Å; F419-K423 VanDerWaalsContact O-CB 3.28Å; F419-K423 WeakPolarHBondContact O-CB 3.25Å; F419-K423 PolarHBondContact O-N 2.96Å; L420-K423 PolarHBondContact O-N 3.41Å; K423-N426 PolarHBondContact O-N 2.74Å; K423-A427 VanDerWaalsContact O-CB 3.28Å; K423-A427 WeakPolarHBondContact O-CB 3.42Å; K423-A427 PolarHBondContact O-N 2.95Å
424	L	98.4	Very high	95.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.8	-43	176.9	-70.8	168.6	0	0	0	112.4	F250 F321 V348 V373 L420 A427 E428	F250-L424 HydrophobicContact CD1-CB 4.42Å; F250-L424 HydrophobicContact CD2-CB 3.92Å; F250-L424 HydrophobicContact CD2-CD1 4Å; F250-L424 HydrophobicContact CD2-CG 4.45Å; F250-L424 HydrophobicContact CE1-CB 4.16Å; F250-L424 HydrophobicContact CE2-CB 3.62Å; F250-L424 HydrophobicContact CE2-CD1 4.41Å; F250-L424 HydrophobicContact CG-CB 4.31Å; F250-L424 HydrophobicContact CG-CD1 4.45Å; F250-L424 HydrophobicContact CZ-CB 3.75Å; F321-L424 HydrophobicContact CE1-CD1 4.13Å; V348-L424 HydrophobicContact CG1-CD2 3.73Å; V373-L424 HydrophobicContact CB-CD2 4.15Å; V373-L424 HydrophobicContact CG2-CD2 3.86Å; L420-L424 HydrophobicContact CD1-CD1 4.22Å; L420-L424 HydrophobicContact CD1-CG 4.29Å; L420-L424 HydrophobicContact CG-CD1 4.24Å; L420-L424 VanDerWaalsContact O-CG 3.32Å; L420-L424 WeakPolarHBondContact O-CG 3.18Å; L420-L424 PolarHBondContact O-N 3.26Å; L424-A427 WeakPolarHBondContact O-CB 3.39Å; L424-A427 PolarHBondContact O-N 2.86Å; L424-E428 PolarHBondContact O-N 3.11Å; L424-E428 VanDerWaalsContact O-N 3.16Å
425	I	96.6	Very high	95.1	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-66.3	-44.2	177.1	-67.5	163.8	0	0	0	111.2	L136 F248 F250 F314 I319 L421 T422 A427 E428 N429	L136-I425 HydrophobicContact CD2-CB 3.91Å; L136-I425 HydrophobicContact CD2-CD1 3.93Å; L136-I425 HydrophobicContact CD2-CG2 3.68Å; F248-I425 HydrophobicContact CD1-CG1 4.19Å; F248-I425 HydrophobicContact CD1-CG2 4.29Å; F248-I425 HydrophobicContact CD2-CG1 4.44Å; F248-I425 HydrophobicContact CE1-CG2 3.84Å; F248-I425 HydrophobicContact CE2-CG2 4.37Å; F248-I425 HydrophobicContact CG-CG1 4.15Å; F248-I425 HydrophobicContact CZ-CG2 3.92Å; F250-I425 HydrophobicContact CE2-CG1 4.3Å; F250-I425 HydrophobicContact CZ-CG1 4.02Å; F314-I425 HydrophobicContact CD1-CD1 3.8Å; F314-I425 HydrophobicContact CE1-CD1 4.38Å; I319-I425 HydrophobicContact CD1-CD1 4.1Å; L421-I425 WeakPolarHBondContact O-CD1 3.44Å; L421-I425 WeakPolarHBondContact O-CG1 3.41Å; L421-I425 PolarHBondContact O-N 2.85Å; T422-I425 PolarHBondContact O-N 3.07Å; I425-A427 VanDerWaalsContact C-N 3.33Å; I425-A427 PolarHBondContact O-N 3.13Å; I425-E428 PolarHBondContact O-N 3.28Å; I425-N429 WeakPolarHBondContact CG2-ND2 3.4Å; I425-N429 PolarHBondContact O-N 3.02Å; I425-N429 PolarHBondContact O-ND2 3.15Å
426	N	96.2	Very high	94.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-67.3	-34.3	178.7	-71.9	-8.7	0	0	0	111.9	R135 L136 E137 F400 G401 T422 K423 N429 A430	R135-N426 PolarHBondContact O-ND2 2.97Å; L136-N426 WeakPolarHBondContact CA-OD1 3.49Å; E137-N426 PolarHBondContact N-OD1 3.19Å; F400-N426 HydrophobicContact CB-CB 4.27Å; G401-N426 WeakPolarHBondContact O-CB 3.27Å; G401-N426 PolarHBondContact O-ND2 3.1Å; T422-N426 WeakPolarHBondContact O-CB 3.4Å; T422-N426 VanDerWaalsContact O-CG 3.29Å; T422-N426 PolarHBondContact O-N 2.74Å; K423-N426 PolarHBondContact O-N 2.74Å; N426-N429 PolarHBondContact O-N 3.42Å; N426-A430 WeakPolarHBondContact O-CB 3.2Å; N426-A430 PolarHBondContact O-N 3.06Å
427	A	96.9	Very high	94.3	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58.4	-47.6	170.5	0	0	0	0	0	111.7	V348 A371 F400 K423 L424 I425 N429 A430 C431	V348-A427 HydrophobicContact CG1-CB 3.91Å; V348-A427 HydrophobicContact CG2-CB 3.83Å; A371-A427 HydrophobicContact CB-CB 4.2Å; F400-A427 HydrophobicContact CD1-CB 4.46Å; F400-A427 HydrophobicContact CD2-CB 3.87Å; F400-A427 HydrophobicContact CE1-CB 4.11Å; F400-A427 HydrophobicContact CE2-CB 3.47Å; F400-A427 VanDerWaalsContact CE2-CB 3.47Å; F400-A427 HydrophobicContact CG-CB 4.36Å; F400-A427 HydrophobicContact CZ-CB 3.61Å; K423-A427 VanDerWaalsContact O-CB 3.28Å; K423-A427 WeakPolarHBondContact O-CB 3.42Å; K423-A427 PolarHBondContact O-N 2.95Å; L424-A427 WeakPolarHBondContact O-CB 3.39Å; L424-A427 PolarHBondContact O-N 2.86Å; I425-A427 VanDerWaalsContact C-N 3.33Å; I425-A427 PolarHBondContact O-N 3.13Å; A427-N429 PolarHBondContact O-N 2.88Å; A427-A430 PolarHBondContact O-N 2.93Å; A427-C431 WeakPolarHBondContact O-CB 3.22Å; A427-C431 PolarHBondContact O-N 3.13Å; A427-C431 PolarHBondContact O-SG 3.21Å
428	E	95.6	Very high	93.8	Very high	5 Å²	5	21.1 Å²	21.1	2%	0.023	11%	0.105	C	C	.	.	H	α-helix	trans	-63	-43.1	176.9	-170.4	-176.4	113.5	0	0	111.4	N245 F248 F250 I347 V348 L424 I425 A430 C431 Y432	N245-E428 PolarHBondContact ND2-OE1 3.46Å; F248-E428 HydrophobicContact CD1-CB 4.31Å; F248-E428 VanDerWaalsContact CD1-CD 3.44Å; F248-E428 HydrophobicContact CD1-CG 4.42Å; F248-E428 VanDerWaalsContact CD1-OE1 3.27Å; F248-E428 WeakPolarHBondContact CD1-OE1 3.44Å; F248-E428 WeakPolarHBondContact CD1-OE2 3.33Å; F248-E428 HydrophobicContact CE1-CB 4.29Å; F248-E428 HydrophobicContact CE1-CG 4.38Å; F248-E428 WeakPolarHBondContact CE1-OE1 3.35Å; F250-E428 HydrophobicContact CE1-CB 4.26Å; I347-E428 HydrophobicContact CB-CG 4.2Å; I347-E428 HydrophobicContact CD1-CG 4.08Å; I347-E428 HydrophobicContact CG2-CG 4.19Å; V348-E428 HydrophobicContact CG2-CB 3.98Å; L424-E428 PolarHBondContact O-N 3.11Å; L424-E428 VanDerWaalsContact O-N 3.16Å; I425-E428 PolarHBondContact O-N 3.28Å; E428-A430 PolarHBondContact O-N 3.21Å; E428-C431 PolarHBondContact O-N 3.02Å; E428-Y432 HydrophobicContact CG-CD2 4.28Å; E428-Y432 HydrophobicContact CG-CE2 3.81Å; E428-Y432 VanDerWaalsContact O-CD2 3.3Å; E428-Y432 WeakPolarHBondContact O-CD2 3.43Å; E428-Y432 PolarHBondContact O-N 3.46Å
429	N	92.8	Very high	93.4	Very high	28 Å²	28	24.4 Å²	24.4	15%	0.15	12%	0.119	C	C	.	.	H	α-helix	trans	-64.9	-26.5	177.3	-61.8	-33	0	0	0	112.9	E137 I425 N426 A427 K433	E137-N429 PolarHBondContact O-ND2 3.37Å; I425-N429 WeakPolarHBondContact CG2-ND2 3.4Å; I425-N429 PolarHBondContact O-N 3.02Å; I425-N429 PolarHBondContact O-ND2 3.15Å; N426-N429 PolarHBondContact O-N 3.42Å; A427-N429 PolarHBondContact O-N 2.88Å; N429-K433 WeakPolarHBondContact O-CE 3.33Å
430	A	94.1	Very high	92.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-80.6	-40.6	171.3	0	0	0	0	0	112.2	V397 P398 F400 N426 A427 E428 Y432 K433	V397-A430 HydrophobicContact CG1-CB 3.95Å; P398-A430 HydrophobicContact CG-CB 4.33Å; F400-A430 HydrophobicContact CB-CB 3.84Å; F400-A430 HydrophobicContact CD1-CB 3.7Å; F400-A430 HydrophobicContact CG-CB 4.13Å; N426-A430 WeakPolarHBondContact O-CB 3.2Å; N426-A430 PolarHBondContact O-N 3.06Å; A427-A430 PolarHBondContact O-N 2.93Å; E428-A430 PolarHBondContact O-N 3.21Å; A430-Y432 PolarHBondContact O-N 2.94Å; A430-K433 WeakPolarHBondContact O-CA 3.45Å; A430-K433 VanDerWaalsContact O-CB 3.22Å; A430-K433 WeakPolarHBondContact O-CB 3.36Å; A430-K433 PolarHBondContact O-N 3.27Å
431	C	93.9	Very high	92.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.1	-31.9	174.1	-70.5	0	0	0	0	112.5	I347 H370 A427 E428 K433 S434 F437	I347-C431 HydrophobicContact CG2-CB 3.28Å; H370-C431 HydrophobicContact CB-CB 4.34Å; A427-C431 WeakPolarHBondContact O-CB 3.22Å; A427-C431 PolarHBondContact O-N 3.13Å; A427-C431 PolarHBondContact O-SG 3.21Å; E428-C431 PolarHBondContact O-N 3.02Å; C431-K433 PolarHBondContact O-N 3.39Å; C431-S434 VanDerWaalsContact O-CB 3.25Å; C431-S434 WeakPolarHBondContact O-CB 3.38Å; C431-S434 PolarHBondContact O-N 3.26Å; C431-F437 WeakPolarHBondContact O-CD2 3.33Å
432	Y	89.8	Confident	91.8	Very high	37 Å²	37	31.2 Å²	31.2	15%	0.145	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.7	171.6	-78.9	-58.6	0	0	0	114.3	I347 E428 A430 S434 F437 A438	I347-Y432 HydrophobicContact CD1-CE1 3.96Å; I347-Y432 HydrophobicContact CD1-CE2 4.34Å; E428-Y432 HydrophobicContact CG-CD2 4.28Å; E428-Y432 HydrophobicContact CG-CE2 3.81Å; E428-Y432 VanDerWaalsContact O-CD2 3.3Å; E428-Y432 WeakPolarHBondContact O-CD2 3.43Å; E428-Y432 PolarHBondContact O-N 3.46Å; A430-Y432 PolarHBondContact O-N 2.94Å; Y432-S434 VanDerWaalsContact C-N 3.32Å; Y432-F437 HydrophobicContact CD1-CB 4.25Å; Y432-A438 PolarHBondContact O-N 2.94Å
433	K	89.5	Confident	91.5	Very high	87 Å²	87	40.4 Å²	40.4	38%	0.378	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-11.9	174.3	-50.1	167.2	-169.4	164.6	0	112.4	E137 P398 N429 A430 C431	E137-K433 IonicContact OE2-NZ 3.3Å; E137-K433 PolarHBondContact OE2-NZ 2.91Å; P398-K433 HydrophobicContact CG-CB 4.04Å; P398-K433 HydrophobicContact CG-CD 3.62Å; P398-K433 HydrophobicContact CG-CG 4.45Å; N429-K433 WeakPolarHBondContact O-CE 3.33Å; A430-K433 WeakPolarHBondContact O-CA 3.45Å; A430-K433 VanDerWaalsContact O-CB 3.22Å; A430-K433 WeakPolarHBondContact O-CB 3.36Å; A430-K433 PolarHBondContact O-N 3.27Å; C431-K433 PolarHBondContact O-N 3.39Å
434	S	91.6	Very high	91.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	-66.1	153.5	-180	125.8	0	0	0	0	112.3	D396 C431 Y432 K436 F437 A438	D396-S434 WeakPolarHBondContact O-CA 3.38Å; D396-S434 WeakPolarHBondContact OD2-CB 3.47Å; D396-S434 PolarHBondContact OD2-OG 3.04Å; C431-S434 VanDerWaalsContact O-CB 3.25Å; C431-S434 WeakPolarHBondContact O-CB 3.38Å; C431-S434 PolarHBondContact O-N 3.26Å; Y432-S434 VanDerWaalsContact C-N 3.32Å; S434-K436 PolarHBondContact O-N 3.4Å; S434-K436 VanDerWaalsContact O-N 3.09Å; S434-F437 PolarHBondContact O-N 3.26Å; S434-F437 VanDerWaalsContact O-N 3.1Å; S434-A438 VanDerWaalsContact O-CB 3.26Å; S434-A438 WeakPolarHBondContact O-CB 3.39Å; S434-A438 PolarHBondContact O-N 3.11Å
435	D	88.3	Confident	90.8	Very high	93 Å²	93	43.7 Å²	43.7	50%	0.497	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-20.9	-169.5	-165.9	40	0	0	0	112.6	D396 K439	D396-D435 HydrophobicContact CB-CB 4.24Å; D396-D435 PolarHBondContact OD2-N 3.25Å; D435-K439 WeakPolarHBondContact O-CD 3.2Å; D435-K439 WeakPolarHBondContact O-CE 3.47Å; D435-K439 VanDerWaalsContact O-CG 3.26Å; D435-K439 WeakPolarHBondContact O-CG 3.28Å; D435-K439 PolarHBondContact O-NZ 3.48Å; D435-K439 WeakPolarHBondContact OD1-CE 3.33Å; D435-K439 IonicContact OD1-NZ 3.45Å; D435-K439 PolarHBondContact OD1-NZ 2.98Å; D435-K439 IonicContact OD2-NZ 3.84Å; D435-K439 PolarHBondContact OD2-NZ 3.49Å
436	K	86.8	Confident	90.7	Very high	86 Å²	86	44.2 Å²	44.2	37%	0.374	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-48.8	172.3	-169.8	176.5	-169.7	170.5	0	112.7	N367 S434	N367-K436 PolarHBondContact O-NZ 3.12Å; N367-K436 PolarHBondContact OD1-NZ 3.47Å; S434-K436 PolarHBondContact O-N 3.4Å; S434-K436 VanDerWaalsContact O-N 3.09Å
437	F	87.7	Confident	90.5	Very high	18 Å²	18	46.5 Å²	46.5	8%	0.079	23%	0.234	C	C	.	.	H	α-helix	trans	-77.8	-40.3	-175.1	-70.6	-71.6	0	0	0	112.3	I347 F368 H370 C431 Y432 S434 K439 L440 E441	I347-F437 HydrophobicContact CD1-CE1 4.1Å; I347-F437 HydrophobicContact CD1-CZ 4.16Å; I347-F437 HydrophobicContact CG1-CE1 4.28Å; I347-F437 HydrophobicContact CG1-CZ 3.93Å; I347-F437 HydrophobicContact CG2-CE2 4.22Å; I347-F437 HydrophobicContact CG2-CZ 4.29Å; F368-F437 HydrophobicContact CD1-CE1 4.18Å; F368-F437 HydrophobicContact CD1-CZ 4.25Å; H370-F437 AromaticContact CE1-CE2 3.56Å; H370-F437 AromaticContact CG-CE2 3.8Å; H370-F437 AromaticContact ND1-CE2 3.5Å; H370-F437 AromaticContact NE2-CE2 3.91Å; C431-F437 WeakPolarHBondContact O-CD2 3.33Å; Y432-F437 HydrophobicContact CD1-CB 4.25Å; S434-F437 PolarHBondContact O-N 3.26Å; S434-F437 VanDerWaalsContact O-N 3.1Å; F437-K439 PolarHBondContact O-N 2.94Å; F437-L440 PolarHBondContact O-N 3.5Å; F437-E441 PolarHBondContact O-N 2.91Å
438	A	87.3	Confident	90.4	Very high	39 Å²	39	46.9 Å²	46.9	32%	0.322	24%	0.236	S	C	.	.	H	α-helix	trans	-58.1	-34.8	177.2	0	0	0	0	0	112.6	Y432 S434 G442	Y432-A438 PolarHBondContact O-N 2.94Å; S434-A438 VanDerWaalsContact O-CB 3.26Å; S434-A438 WeakPolarHBondContact O-CB 3.39Å; S434-A438 PolarHBondContact O-N 3.11Å; A438-G442 PolarHBondContact O-N 3.18Å
439	K	88	Confident	90.4	Very high	118 Å²	118	46.7 Å²	46.7	51%	0.513	24%	0.235	S	C	.	.	H	α-helix	trans	-70.1	-34.2	175.2	-70.9	173.2	-164.2	153.4	0	113.3	D435 F437 R443	D435-K439 WeakPolarHBondContact O-CD 3.2Å; D435-K439 WeakPolarHBondContact O-CE 3.47Å; D435-K439 VanDerWaalsContact O-CG 3.26Å; D435-K439 WeakPolarHBondContact O-CG 3.28Å; D435-K439 PolarHBondContact O-NZ 3.48Å; D435-K439 WeakPolarHBondContact OD1-CE 3.33Å; D435-K439 IonicContact OD1-NZ 3.45Å; D435-K439 PolarHBondContact OD1-NZ 2.98Å; D435-K439 IonicContact OD2-NZ 3.84Å; D435-K439 PolarHBondContact OD2-NZ 3.49Å; F437-K439 PolarHBondContact O-N 2.94Å; K439-R443 VanDerWaalsContact O-CG 3.32Å; K439-R443 WeakPolarHBondContact O-CG 3.37Å; K439-R443 PolarHBondContact O-N 3.45Å
440	L	85.3	Confident	90.5	Very high	88 Å²	88	46.6 Å²	46.6	46%	0.461	24%	0.235	S	C	.	.	H	α-helix	trans	-74.1	-40.7	174.6	-179.7	60	0	0	0	111.2	F437 T444	F437-L440 PolarHBondContact O-N 3.5Å; L440-T444 PolarHBondContact O-N 2.91Å; L440-T444 PolarHBondContact O-OG1 3.2Å; L440-T444 VanDerWaalsContact O-OG1 3.04Å
441	E	85.7	Confident	90.5	Very high	34 Å²	34	50.5 Å²	50.5	16%	0.159	26%	0.255	C	S	.	.	H	α-helix	trans	-64.7	-50.2	176	-173.9	-178.8	-105.9	0	0	111.5	F437 R443 T444 R445 R494	F437-E441 PolarHBondContact O-N 2.91Å; E441-R443 PolarHBondContact O-N 3.39Å; E441-T444 CarbonylContact O-C 3.56Å; E441-T444 WeakPolarHBondContact O-CA 3.43Å; E441-T444 WeakPolarHBondContact O-CB 3.4Å; E441-T444 PolarHBondContact O-N 2.89Å; E441-R445 WeakPolarHBondContact O-CB 3.41Å; E441-R445 PolarHBondContact O-N 3.41Å; E441-R445 IonicContact OE1-NH2 2.68Å; E441-R445 IonicContact OE2-CZ 2.63Å; E441-R445 IonicContact OE2-NH1 3.21Å; E441-R445 PolarHBondContact OE2-NH1 2.82Å; E441-R445 IonicContact OE2-NH2 2.63Å; E441-R445 PolarHBondContact OE2-NH2 3.1Å; E441-R494 IonicContact OE1-CZ 3.31Å; E441-R494 IonicContact OE1-NH2 3.69Å; E441-R494 PolarHBondContact OE1-NH2 3.3Å
442	G	89.1	Confident	90.6	Very high	23 Å²	23	50.5 Å²	50.5	24%	0.237	26%	0.255	C	S	.	.	H	α-helix	trans	-56.5	-35.3	-180	0	0	0	0	0	113.2	A438 A446	A438-G442 PolarHBondContact O-N 3.18Å; G442-A446 VanDerWaalsContact O-CB 3.23Å; G442-A446 WeakPolarHBondContact O-CB 3.46Å; G442-A446 PolarHBondContact O-N 3.21Å
443	R	89.6	Confident	90.9	Very high	193 Å²	193	49 Å²	49	73%	0.728	25%	0.25	S	C	*	.	H	α-helix	trans	-65.9	-42	172	-72.6	174.1	64.7	179.2	-0.3	112.5	K439 E441 A447	K439-R443 VanDerWaalsContact O-CG 3.32Å; K439-R443 WeakPolarHBondContact O-CG 3.37Å; K439-R443 PolarHBondContact O-N 3.45Å; E441-R443 PolarHBondContact O-N 3.39Å; R443-A447 WeakPolarHBondContact O-CB 3.47Å; R443-A447 PolarHBondContact O-N 3.48Å; R443-A447 VanDerWaalsContact O-N 3.1Å
444	T	90.7	Very high	91.1	Very high	43 Å²	43	49 Å²	49	26%	0.264	25%	0.254	S	S	.	.	H	α-helix	trans	-67.5	-49	177.8	-56.6	0	0	0	0	111.1	L440 E441 A446 A447 L448 A490	L440-T444 PolarHBondContact O-N 2.91Å; L440-T444 PolarHBondContact O-OG1 3.2Å; L440-T444 VanDerWaalsContact O-OG1 3.04Å; E441-T444 CarbonylContact O-C 3.56Å; E441-T444 WeakPolarHBondContact O-CA 3.43Å; E441-T444 WeakPolarHBondContact O-CB 3.4Å; E441-T444 PolarHBondContact O-N 2.89Å; T444-A446 PolarHBondContact O-N 3.09Å; T444-A447 PolarHBondContact O-N 2.98Å; T444-L448 HydrophobicContact CG2-CD1 3.83Å; T444-L448 HydrophobicContact CG2-CG 4.39Å; T444-L448 WeakPolarHBondContact O-CB 3.37Å; T444-L448 WeakPolarHBondContact O-CG 3.31Å; T444-L448 PolarHBondContact O-N 3.18Å; T444-A490 HydrophobicContact CG2-CB 4.11Å
445	R	92.1	Very high	91.3	Very high	26 Å²	26	51 Å²	51	10%	0.098	26%	0.263	C	S	.	.	H	α-helix	trans	-54.3	-52	175.1	-178.3	-179	-74.3	119.3	-3.4	111.4	Y239 E243 E441 A447 L448 L449	Y239-R445 WeakPolarHBondContact OH-CG 3.49Å; E243-R445 IonicContact OE1-CZ 3.05Å; E243-R445 IonicContact OE1-NE 3.8Å; E243-R445 PolarHBondContact OE1-NE 3.05Å; E243-R445 IonicContact OE1-NH2 2.91Å; E243-R445 PolarHBondContact OE1-NH2 2.92Å; E243-R445 IonicContact OE2-CZ 2.71Å; E243-R445 IonicContact OE2-NH2 2.59Å; E243-R445 PolarHBondContact OE2-NH2 2.68Å; E441-R445 WeakPolarHBondContact O-CB 3.41Å; E441-R445 PolarHBondContact O-N 3.41Å; E441-R445 IonicContact OE1-NH2 2.68Å; E441-R445 IonicContact OE2-CZ 2.63Å; E441-R445 IonicContact OE2-NH1 3.21Å; E441-R445 PolarHBondContact OE2-NH1 2.82Å; E441-R445 IonicContact OE2-NH2 2.63Å; E441-R445 PolarHBondContact OE2-NH2 3.1Å; R445-A447 PolarHBondContact O-N 2.92Å; R445-L448 PolarHBondContact O-N 3.09Å; R445-L449 WeakPolarHBondContact O-CB 3.47Å; R445-L449 PolarHBondContact O-N 3.18Å
446	A	93	Very high	91.7	Very high	11 Å²	11	46.6 Å²	46.6	9%	0.091	24%	0.239	C	C	.	.	H	α-helix	trans	-58.8	-49.5	177.4	0	0	0	0	0	112.3	R189 G442 T444 L448 L449 D450	R189-A446 HydrophobicContact CB-CB 3.92Å; R189-A446 HydrophobicContact CG-CB 4.44Å; G442-A446 VanDerWaalsContact O-CB 3.23Å; G442-A446 WeakPolarHBondContact O-CB 3.46Å; G442-A446 PolarHBondContact O-N 3.21Å; T444-A446 PolarHBondContact O-N 3.09Å; A446-L448 PolarHBondContact O-N 3.37Å; A446-L449 PolarHBondContact O-N 2.9Å; A446-D450 PolarHBondContact O-N 2.77Å; A446-D450 VanDerWaalsContact O-OD2 3.12Å
447	A	93.4	Very high	92	Very high	47 Å²	47	45.8 Å²	45.8	39%	0.388	24%	0.237	S	C	.	.	H	α-helix	trans	-63.3	-40.5	-179.9	0	0	0	0	0	112.5	R443 T444 R445 N451	R443-A447 WeakPolarHBondContact O-CB 3.47Å; R443-A447 PolarHBondContact O-N 3.48Å; R443-A447 VanDerWaalsContact O-N 3.1Å; T444-A447 PolarHBondContact O-N 2.98Å; R445-A447 PolarHBondContact O-N 2.92Å; A447-N451 PolarHBondContact O-N 3.31Å; A447-N451 VanDerWaalsContact O-N 3.1Å; A447-N451 PolarHBondContact O-ND2 2.65Å
448	L	94.6	Very high	92.3	Very high	9 Å²	9	51.3 Å²	51.3	5%	0.047	26%	0.257	C	S	.	.	H	α-helix	trans	-69.2	-34.7	176.6	-70	174	0	0	0	112.3	Y239 H242 T444 R445 A446 L452 F487 A490	Y239-L448 HydrophobicContact CD2-CB 4.02Å; Y239-L448 HydrophobicContact CE2-CB 4.06Å; H242-L448 HydrophobicContact CB-CD1 4.35Å; H242-L448 WeakPolarHBondContact CD2-CD1 3.33Å; T444-L448 HydrophobicContact CG2-CD1 3.83Å; T444-L448 HydrophobicContact CG2-CG 4.39Å; T444-L448 WeakPolarHBondContact O-CB 3.37Å; T444-L448 WeakPolarHBondContact O-CG 3.31Å; T444-L448 PolarHBondContact O-N 3.18Å; R445-L448 PolarHBondContact O-N 3.09Å; A446-L448 PolarHBondContact O-N 3.37Å; L448-L452 WeakPolarHBondContact O-CB 3.24Å; L448-L452 PolarHBondContact O-N 3.02Å; L448-F487 HydrophobicContact CB-CE1 3.97Å; L448-F487 HydrophobicContact CD1-CD1 3.92Å; L448-F487 HydrophobicContact CD1-CE1 3.98Å; L448-F487 HydrophobicContact CD2-CD1 3.76Å; L448-F487 HydrophobicContact CD2-CE1 3.8Å; L448-F487 HydrophobicContact CG-CD1 4.32Å; L448-F487 HydrophobicContact CG-CE1 4.13Å; L448-A490 HydrophobicContact CD1-CB 3.97Å
449	L	95.2	Very high	92.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.5	-42.7	175.9	-174.3	68.3	0	0	0	111.7	I168 R187 S188 R189 Y239 R445 A446 L452 H453	I168-L449 HydrophobicContact CB-CD1 4.39Å; I168-L449 HydrophobicContact CD1-CD1 3.69Å; I168-L449 HydrophobicContact CG1-CD1 4.07Å; R187-L449 HydrophobicContact CB-CD1 3.9Å; S188-L449 WeakPolarHBondContact O-CD2 3.19Å; R189-L449 HydrophobicContact CG-CD2 4.02Å; Y239-L449 HydrophobicContact CE1-CD1 4.1Å; Y239-L449 HydrophobicContact CE2-CB 3.68Å; Y239-L449 HydrophobicContact CE2-CD1 4.06Å; Y239-L449 HydrophobicContact CE2-CG 4.48Å; R445-L449 WeakPolarHBondContact O-CB 3.47Å; R445-L449 PolarHBondContact O-N 3.18Å; A446-L449 PolarHBondContact O-N 2.9Å; L449-L452 PolarHBondContact O-N 3.2Å; L449-H453 WeakPolarHBondContact O-CB 3.27Å; L449-H453 PolarHBondContact O-N 2.94Å
450	D	94	Very high	93	Very high	27 Å²	27	45.8 Å²	45.8	14%	0.144	23%	0.227	C	C	.	.	H	α-helix	trans	-62.7	-47.2	177.7	-65.7	-33.4	0	0	0	110.4	N166 R189 A446 L452 H453 D454	N166-D450 PolarHBondContact ND2-OD1 2.99Å; R189-D450 IonicContact CZ-OD2 3.18Å; R189-D450 IonicContact NE-OD1 2.72Å; R189-D450 PolarHBondContact NE-OD1 3.03Å; R189-D450 IonicContact NE-OD2 2.84Å; R189-D450 PolarHBondContact NE-OD2 3.39Å; R189-D450 IonicContact NH2-OD2 2.94Å; R189-D450 PolarHBondContact NH2-OD2 3.22Å; A446-D450 PolarHBondContact O-N 2.77Å; A446-D450 VanDerWaalsContact O-OD2 3.12Å; D450-L452 VanDerWaalsContact C-N 3.33Å; D450-L452 PolarHBondContact O-N 3.41Å; D450-H453 PolarHBondContact O-N 3.07Å; D450-D454 PolarHBondContact O-N 3.06Å
451	N	95	Very high	93.3	Very high	82 Å²	82	43.7 Å²	43.7	44%	0.439	21%	0.214	S	C	.	.	H	α-helix	trans	-62.3	-36.3	174.6	-75.9	-74.2	0	0	0	113	A447 E455 L483	A447-N451 PolarHBondContact O-N 3.31Å; A447-N451 VanDerWaalsContact O-N 3.1Å; A447-N451 PolarHBondContact O-ND2 2.65Å; N451-E455 PolarHBondContact O-N 2.83Å; N451-L483 HydrophobicContact CB-CD1 3.48Å; N451-L483 VanDerWaalsContact CB-CD1 3.48Å
452	L	96.2	Very high	93.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.8	-45.2	174.8	175.4	65.8	0	0	0	111.4	I168 L235 I236 Y239 L448 L449 D450 D454 E455 L456 L483	I168-L452 HydrophobicContact CD1-CB 4.1Å; I168-L452 HydrophobicContact CD1-CD2 3.44Å; I168-L452 VanDerWaalsContact CD1-CD2 3.44Å; I168-L452 HydrophobicContact CD1-CG 3.52Å; L235-L452 HydrophobicContact CB-CD1 3.46Å; L235-L452 VanDerWaalsContact CB-CD1 3.46Å; I236-L452 HydrophobicContact CG1-CD2 4.22Å; Y239-L452 HydrophobicContact CD1-CD2 4.33Å; Y239-L452 HydrophobicContact CD2-CD2 4.3Å; Y239-L452 HydrophobicContact CG-CD2 3.8Å; L448-L452 WeakPolarHBondContact O-CB 3.24Å; L448-L452 PolarHBondContact O-N 3.02Å; L449-L452 PolarHBondContact O-N 3.2Å; D450-L452 VanDerWaalsContact C-N 3.33Å; D450-L452 PolarHBondContact O-N 3.41Å; L452-D454 VanDerWaalsContact C-N 3.32Å; L452-D454 PolarHBondContact O-N 3.49Å; L452-E455 PolarHBondContact O-N 2.69Å; L452-L456 HydrophobicContact CD1-CD1 3.93Å; L452-L456 HydrophobicContact CD1-CD2 4.37Å; L452-L456 HydrophobicContact CD1-CG 3.89Å; L452-L456 HydrophobicContact CD2-CD1 4.49Å; L452-L456 HydrophobicContact CG-CD1 3.95Å; L452-L456 HydrophobicContact CG-CG 4.27Å; L452-L456 WeakPolarHBondContact O-CB 3.33Å; L452-L456 VanDerWaalsContact O-CG 3.26Å; L452-L456 WeakPolarHBondContact O-CG 3.37Å; L452-L456 PolarHBondContact O-N 2.83Å; L452-L483 HydrophobicContact CB-CD2 4.25Å; L452-L483 HydrophobicContact CD1-CD2 3.76Å
453	H	96	Very high	93.7	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.028	24%	0.239	C	C	.	.	H	α-helix	trans	-56	-49.3	177.4	165.4	-83.3	0	0	0	110.6	Y158 C159 S160 N166 I168 L449 D450 E455 L456 H457	Y158-H453 AromaticContact CD2-NE2 3.75Å; C159-H453 PolarHBondContact O-NE2 2.84Å; S160-H453 PolarHBondContact OG-CE1 3.31Å; S160-H453 PolarHBondContact OG-NE2 3.27Å; N166-H453 HydrophobicContact CB-CB 3.94Å; N166-H453 PolarHBondContact OD1-CE1 2.94Å; N166-H453 PolarHBondContact OD1-ND1 3.43Å; I168-H453 HydrophobicContact CD1-CB 4.28Å; L449-H453 WeakPolarHBondContact O-CB 3.27Å; L449-H453 PolarHBondContact O-N 2.94Å; D450-H453 PolarHBondContact O-N 3.07Å; H453-E455 PolarHBondContact O-N 2.96Å; H453-L456 PolarHBondContact O-N 3.15Å; H453-H457 VanDerWaalsContact O-CB 3.29Å; H453-H457 WeakPolarHBondContact O-CB 3.33Å; H453-H457 PolarHBondContact O-N 2.98Å
454	D	94.4	Very high	93.7	Very high	86 Å²	86	42.7 Å²	42.7	46%	0.46	23%	0.228	S	C	.	.	H	α-helix	trans	-67.8	-38.3	-174.7	-68.3	-8	0	0	0	111.9	D450 L452 H457 R458	D450-D454 PolarHBondContact O-N 3.06Å; L452-D454 VanDerWaalsContact C-N 3.32Å; L452-D454 PolarHBondContact O-N 3.49Å; D454-H457 PolarHBondContact O-N 3.15Å; D454-R458 WeakPolarHBondContact O-CB 3.5Å; D454-R458 PolarHBondContact O-N 3.34Å
455	E	95.1	Very high	93.4	Very high	42 Å²	42	43.8 Å²	43.8	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-68.1	-43.6	174.2	-179	60.6	-174	0	0	112.2	L235 N451 L452 H453 H457 R458 Q459	L235-E455 HydrophobicContact CD1-CG 3.71Å; N451-E455 PolarHBondContact O-N 2.83Å; L452-E455 PolarHBondContact O-N 2.69Å; H453-E455 PolarHBondContact O-N 2.96Å; E455-H457 VanDerWaalsContact C-N 3.32Å; E455-H457 PolarHBondContact O-N 3.17Å; E455-R458 IonicContact OE1-CZ 2.76Å; E455-R458 IonicContact OE1-NH2 2.74Å; E455-R458 PolarHBondContact OE1-NH2 2.8Å; E455-R458 IonicContact OE2-CZ 3.09Å; E455-R458 VanDerWaalsContact OE2-CZ 3.24Å; E455-R458 IonicContact OE2-NE 2.93Å; E455-R458 PolarHBondContact OE2-NE 3.45Å; E455-R458 IonicContact OE2-NH2 3.22Å; E455-R458 PolarHBondContact OE2-NH2 3.38Å; E455-Q459 HydrophobicContact CG-CG 4.31Å; E455-Q459 VanDerWaalsContact O-CB 3.31Å; E455-Q459 WeakPolarHBondContact O-CB 3.29Å; E455-Q459 WeakPolarHBondContact O-CG 3.26Å; E455-Q459 PolarHBondContact O-N 3.45Å; E455-Q459 VanDerWaalsContact OE1-CG 3.29Å; E455-Q459 WeakPolarHBondContact OE1-CG 3.26Å; E455-Q459 PolarHBondContact OE1-NE2 3.47Å
456	L	96	Very high	92.6	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-38.9	175.4	-69	-179.7	0	0	0	111.9	I168 V227 L235 I236 L452 H453 S460	I168-L456 HydrophobicContact CD1-CD1 3.98Å; I168-L456 HydrophobicContact CG2-CD1 4.3Å; V227-L456 HydrophobicContact CG1-CD2 3.95Å; V227-L456 HydrophobicContact CG2-CB 4.4Å; V227-L456 HydrophobicContact CG2-CD1 4.09Å; L235-L456 HydrophobicContact CD1-CD2 4.34Å; I236-L456 HydrophobicContact CD1-CD1 4.04Å; I236-L456 HydrophobicContact CG1-CD1 3.92Å; L452-L456 HydrophobicContact CD1-CD1 3.93Å; L452-L456 HydrophobicContact CD1-CD2 4.37Å; L452-L456 HydrophobicContact CD1-CG 3.89Å; L452-L456 HydrophobicContact CD2-CD1 4.49Å; L452-L456 HydrophobicContact CG-CD1 3.95Å; L452-L456 HydrophobicContact CG-CG 4.27Å; L452-L456 WeakPolarHBondContact O-CB 3.33Å; L452-L456 VanDerWaalsContact O-CG 3.26Å; L452-L456 WeakPolarHBondContact O-CG 3.37Å; L452-L456 PolarHBondContact O-N 2.83Å; H453-L456 PolarHBondContact O-N 3.15Å; L456-S460 WeakPolarHBondContact O-CB 3.43Å; L456-S460 PolarHBondContact O-N 3.4Å; L456-S460 PolarHBondContact O-OG 3.46Å
457	H	94.1	Very high	91	Very high	69 Å²	69	49.5 Å²	49.5	32%	0.319	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-57.9	175.1	173.8	52.5	0	0	0	110.9	Y158 H453 D454 E455 Q459 S460 Q461	Y158-H457 HydrophobicContact CD2-CB 4.07Å; Y158-H457 HydrophobicContact CE2-CB 3.69Å; Y158-H457 AromaticContact CE2-CG 3.72Å; Y158-H457 AromaticContact CE2-ND1 3.18Å; Y158-H457 WeakPolarHBondContact CE2-ND1 3.37Å; Y158-H457 AromaticContact CZ-ND1 3.38Å; Y158-H457 PolarHBondContact OH-ND1 3.12Å; H453-H457 VanDerWaalsContact O-CB 3.29Å; H453-H457 WeakPolarHBondContact O-CB 3.33Å; H453-H457 PolarHBondContact O-N 2.98Å; D454-H457 PolarHBondContact O-N 3.15Å; E455-H457 VanDerWaalsContact C-N 3.32Å; E455-H457 PolarHBondContact O-N 3.17Å; H457-Q459 PolarHBondContact O-N 3.17Å; H457-S460 PolarHBondContact O-N 3.37Å; H457-S460 VanDerWaalsContact O-N 3.09Å; H457-Q461 WeakPolarHBondContact O-CG 3.38Å; H457-Q461 PolarHBondContact O-N 3.02Å
458	R	94.3	Very high	89.1	Confident	135 Å²	135	56.6 Å²	56.6	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-54	-48.8	-177.9	-173.3	-175.1	72.5	80.4	-0.1	111.9	D454 E455 Q461 A462	D454-R458 WeakPolarHBondContact O-CB 3.5Å; D454-R458 PolarHBondContact O-N 3.34Å; E455-R458 IonicContact OE1-CZ 2.76Å; E455-R458 IonicContact OE1-NH2 2.74Å; E455-R458 PolarHBondContact OE1-NH2 2.8Å; E455-R458 IonicContact OE2-CZ 3.09Å; E455-R458 VanDerWaalsContact OE2-CZ 3.24Å; E455-R458 IonicContact OE2-NE 2.93Å; E455-R458 PolarHBondContact OE2-NE 3.45Å; E455-R458 IonicContact OE2-NH2 3.22Å; E455-R458 PolarHBondContact OE2-NH2 3.38Å; R458-Q461 PolarHBondContact O-N 3.39Å; R458-A462 PolarHBondContact O-N 3.42Å
459	Q	94.8	Very high	86.7	Confident	39 Å²	39	65.9 Å²	65.9	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-67.3	-37.5	178.7	-65.6	-76.7	6.7	0	0	112.4	Y229 E455 H457 A462 V463	Y229-Q459 HydrophobicContact CD1-CB 3.93Å; Y229-Q459 HydrophobicContact CD1-CG 4.07Å; Y229-Q459 HydrophobicContact CD2-CB 3.54Å; Y229-Q459 HydrophobicContact CD2-CG 3.99Å; Y229-Q459 HydrophobicContact CE1-CB 4.4Å; Y229-Q459 HydrophobicContact CE1-CG 4.05Å; Y229-Q459 HydrophobicContact CE2-CB 4.03Å; Y229-Q459 HydrophobicContact CE2-CG 3.96Å; Y229-Q459 HydrophobicContact CG-CB 3.47Å; Y229-Q459 VanDerWaalsContact CG-CB 3.47Å; Y229-Q459 HydrophobicContact CG-CG 4.03Å; E455-Q459 HydrophobicContact CG-CG 4.31Å; E455-Q459 VanDerWaalsContact O-CB 3.31Å; E455-Q459 WeakPolarHBondContact O-CB 3.29Å; E455-Q459 WeakPolarHBondContact O-CG 3.26Å; E455-Q459 PolarHBondContact O-N 3.45Å; E455-Q459 VanDerWaalsContact OE1-CG 3.29Å; E455-Q459 WeakPolarHBondContact OE1-CG 3.26Å; E455-Q459 PolarHBondContact OE1-NE2 3.47Å; H457-Q459 PolarHBondContact O-N 3.17Å; Q459-A462 PolarHBondContact O-N 3.04Å; Q459-V463 WeakPolarHBondContact O-CG2 3.33Å; Q459-V463 PolarHBondContact O-N 2.9Å
460	S	94.3	Very high	84.4	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.007	39%	0.389	C	S	.	.	H	α-helix	trans	-69.3	-31.5	177.1	-58.2	0	0	0	0	112.7	L228 L456 H457 L464	L228-S460 PolarHBondContact N-OG 3.44Å; L456-S460 WeakPolarHBondContact O-CB 3.43Å; L456-S460 PolarHBondContact O-N 3.4Å; L456-S460 PolarHBondContact O-OG 3.46Å; H457-S460 PolarHBondContact O-N 3.37Å; H457-S460 VanDerWaalsContact O-N 3.09Å; S460-L464 WeakPolarHBondContact O-CG 3.48Å; S460-L464 PolarHBondContact O-N 3.1Å
461	Q	92.1	Very high	82	Confident	44 Å²	44	77 Å²	77	21%	0.206	43%	0.427	C	S	.	.	H	α-helix	trans	-72.2	-37.9	171.8	-63.2	-55.9	-36.3	0	0	111.9	Y158 H457 R458 V463 L464 G465 L466 G467	Y158-Q461 PolarHBondContact OH-NE2 2.88Å; Y158-Q461 VanDerWaalsContact OH-NE2 3.1Å; H457-Q461 WeakPolarHBondContact O-CG 3.38Å; H457-Q461 PolarHBondContact O-N 3.02Å; R458-Q461 PolarHBondContact O-N 3.39Å; Q461-V463 PolarHBondContact O-N 2.96Å; Q461-L464 PolarHBondContact O-N 2.74Å; Q461-L464 VanDerWaalsContact O-N 3.11Å; Q461-G465 PolarHBondContact O-N 2.89Å; Q461-L466 HydrophobicContact CB-CB 4.37Å; Q461-L466 WeakPolarHBondContact O-CA 3.42Å; Q461-L466 PolarHBondContact O-N 3.1Å; Q461-G467 PolarHBondContact O-N 3.33Å
462	A	91.7	Very high	79.8	Confident	50 Å²	50	82.5 Å²	82.5	41%	0.413	45%	0.45	S	S	.	.	H	α-helix	trans	-59.9	-43.4	173.9	0	0	0	0	0	112	R458 Q459 L464 G465	R458-A462 PolarHBondContact O-N 3.42Å; Q459-A462 PolarHBondContact O-N 3.04Å; A462-L464 PolarHBondContact O-N 2.79Å; A462-G465 PolarHBondContact O-N 3.28Å
463	V	91.8	Very high	77.3	Confident	82 Å²	82	89.9 Å²	89.9	50%	0.497	49%	0.489	S	S	.	.	H	α-helix	trans	-60	-28	174.6	169.8	0	0	0	0	113	L228 Q459 Q461 G465	L228-V463 HydrophobicContact CB-CB 4.42Å; L228-V463 HydrophobicContact CB-CG1 4.06Å; Q459-V463 WeakPolarHBondContact O-CG2 3.33Å; Q459-V463 PolarHBondContact O-N 2.9Å; Q461-V463 PolarHBondContact O-N 2.96Å; V463-G465 VanDerWaalsContact C-N 3.35Å
464	L	89.4	Confident	74.6	Confident	97 Å²	97	99.3 Å²	99.3	51%	0.508	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-0.7	176	-69.1	172.9	0	0	0	114.1	L228 S460 Q461 A462 L466	L228-L464 HydrophobicContact CD1-CD1 3.83Å; L228-L464 HydrophobicContact CD1-CD2 3.61Å; L228-L464 HydrophobicContact CD1-CG 3.65Å; S460-L464 WeakPolarHBondContact O-CG 3.48Å; S460-L464 PolarHBondContact O-N 3.1Å; Q461-L464 PolarHBondContact O-N 2.74Å; Q461-L464 VanDerWaalsContact O-N 3.11Å; A462-L464 PolarHBondContact O-N 2.79Å; L464-L466 HydrophobicContact CB-CB 4.43Å; L464-L466 HydrophobicContact CB-CD1 4.04Å; L464-L466 HydrophobicContact CB-CG 4.02Å; L464-L466 HydrophobicContact CD1-CD1 4.33Å; L464-L466 PolarHBondContact O-N 3.18Å
465	G	84.3	Confident	72.3	Confident	67 Å²	67	103.2 Å²	103.2	69%	0.691	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.4	21.3	-170.9	0	0	0	0	0	113.5	Q461 A462 V463	Q461-G465 PolarHBondContact O-N 2.89Å; A462-G465 PolarHBondContact O-N 3.28Å; V463-G465 VanDerWaalsContact C-N 3.35Å
466	L	75.1	Confident	69.7	Low	114 Å²	114	110 Å²	110	60%	0.597	58%	0.582	S	S	*	*			trans	-107.6	10.2	-179.8	-60.8	178	0	0	0	112.8	Q461 L464	Q461-L466 HydrophobicContact CB-CB 4.37Å; Q461-L466 WeakPolarHBondContact O-CA 3.42Å; Q461-L466 PolarHBondContact O-N 3.1Å; L464-L466 HydrophobicContact CB-CB 4.43Å; L464-L466 HydrophobicContact CB-CD1 4.04Å; L464-L466 HydrophobicContact CB-CG 4.02Å; L464-L466 HydrophobicContact CD1-CD1 4.33Å; L464-L466 PolarHBondContact O-N 3.18Å
467	G	58.7	Low	66.7	Low	43 Å²	43	117.8 Å²	117.8	44%	0.443	62%	0.624	S	S	.	*	S	Bend	trans	-62.7	148.4	165.7	0	0	0	0	0	111.1	Q461 M469	Q461-G467 PolarHBondContact O-N 3.33Å; G467-M469 PolarHBondContact O-N 3.43Å
468	Q	54.8	Low	64.1	Low	196 Å²	196	118.2 Å²	118.2	92%	0.916	65%	0.647	S	S	*	*			trans	-64.9	120.8	177.2	-73.2	178.6	-37.8	0	0	110.2	G470	Q468-G470 VanDerWaalsContact C-N 3.31Å; Q468-G470 PolarHBondContact O-N 2.96Å
469	M	43.7	Very low	61.4	Low	203 Å²	203	115.6 Å²	115.6	100%	1	66%	0.661	S	S	*	*			trans	-80.9	81.7	173	-162.4	168.5	88.1	0	0	109.4	G467	G467-M469 PolarHBondContact O-N 3.43Å
470	G	47.2	Very low	58.9	Low	59 Å²	59	123 Å²	123	61%	0.608	70%	0.695	S	S	*	*			trans	-161.3	133	176.9	0	0	0	0	0	110.1	Q468	Q468-G470 VanDerWaalsContact C-N 3.31Å; Q468-G470 PolarHBondContact O-N 2.96Å
471	E	43.8	Very low	56.6	Low	203 Å²	203	125.1 Å²	125.1	95%	0.949	72%	0.718	S	S	*	*			trans	61.6	56.1	-173.2	-60.5	-162.9	102.5	0	0	116.4
472	E	49	Very low	55.1	Low	197 Å²	197	124.8 Å²	124.8	92%	0.921	73%	0.726	S	S	*	*			trans	-90.5	80.9	141.7	-77.8	-163.3	124.5	0	0	109.7
473	D	43.4	Very low	53.9	Low	155 Å²	155	123.4 Å²	123.4	83%	0.829	71%	0.712	S	S	*	*			trans	-162.4	63.4	146	-145.2	-1.1	0	0	0	113.5
474	K	37.8	Very low	52.5	Low	203 Å²	203	123.3 Å²	123.3	88%	0.883	71%	0.708	S	S	*	*			trans	-161.7	61.8	163.4	-122.2	168.1	-169.5	171.9	0	114.9
475	L	47.1	Very low	51.4	Low	168 Å²	168	122.2 Å²	122.2	88%	0.88	70%	0.7	S	S	*	*			trans	-72.9	157.8	155.4	-70.9	164.5	0	0	0	109.3
476	E	41.5	Very low	50.7	Low	185 Å²	185	120.9 Å²	120.9	86%	0.864	68%	0.68	S	S	*	*	S	Bend	trans	61.6	72	-178.1	-56.9	-160	119.1	0	0	117.8
477	N	32.1	Very low	50.3	Low	164 Å²	164	115.8 Å²	115.8	88%	0.877	65%	0.654	S	S	*	*				-175.6	130.6	102.9	-115.6	-55.2	0	0	0	114.5
478	G	38.5	Very low	50.7	Low	78 Å²	78	120.2 Å²	120.2	80%	0.804	66%	0.661	S	S	*	*	S	Bend	trans	66.2	125.3	154.7	0	0	0	0	0	119.9
479	G	37.8	Very low	51.2	Low	79 Å²	79	118 Å²	118	81%	0.814	64%	0.644	S	S	*	*			trans	110.8	24	148.9	0	0	0	0	0	119.6	G481	G479-G481 VanDerWaalsContact C-N 3.34Å; G479-G481 PolarHBondContact O-N 2.65Å
480	H	42.1	Very low	51.8	Low	194 Å²	194	109 Å²	109	90%	0.898	60%	0.601	S	S	*	*			trans	-72.5	82	173.2	-86.1	-61.5	0	0	0	113.7	G482	H480-G482 PolarHBondContact O-N 3Å
481	G	46.9	Very low	52.2	Low	46 Å²	46	110.8 Å²	110.8	47%	0.474	60%	0.595	S	S	.	*			trans	-71.1	66.5	164.6	0	0	0	0	0	112.1	G479 E485	G479-G481 VanDerWaalsContact C-N 3.34Å; G479-G481 PolarHBondContact O-N 2.65Å; G481-E485 WeakPolarHBondContact CA-OE2 3.39Å
482	G	60.5	Low	52.6	Low	37 Å²	37	108.6 Å²	108.6	38%	0.381	58%	0.578	S	S	.	*			trans	-71.3	176.4	-175.7	0	0	0	0	0	114.1	H480 L484 E485 S486	H480-G482 PolarHBondContact O-N 3Å; G482-L484 PolarHBondContact O-N 3.35Å; G482-E485 WeakPolarHBondContact O-CA 3.4Å; G482-E485 WeakPolarHBondContact O-CB 3.18Å; G482-E485 PolarHBondContact O-N 3.1Å; G482-S486 PolarHBondContact O-N 3.46Å
483	L	65.4	Low	52.7	Low	22 Å²	22	103.8 Å²	103.8	12%	0.115	56%	0.562	C	S	.	*	H	α-helix	trans	-49.6	-37.9	-177.5	-172.1	72	0	0	0	113.9	L235 N451 L452 E485 S486 F487	L235-L483 HydrophobicContact CB-CD2 4.2Å; L235-L483 HydrophobicContact CD1-CD2 4.15Å; L235-L483 HydrophobicContact CD2-CD2 4.32Å; L235-L483 HydrophobicContact CG-CD2 4.46Å; N451-L483 HydrophobicContact CB-CD1 3.48Å; N451-L483 VanDerWaalsContact CB-CD1 3.48Å; L452-L483 HydrophobicContact CB-CD2 4.25Å; L452-L483 HydrophobicContact CD1-CD2 3.76Å; L483-E485 VanDerWaalsContact C-N 3.29Å; L483-E485 PolarHBondContact O-N 3.48Å; L483-S486 WeakPolarHBondContact O-CB 3.21Å; L483-S486 PolarHBondContact O-N 2.83Å; L483-S486 VanDerWaalsContact O-N 3.15Å; L483-F487 HydrophobicContact CD1-CE2 4.25Å; L483-F487 HydrophobicContact CD1-CZ 4.32Å; L483-F487 HydrophobicContact CD2-CE2 3.75Å; L483-F487 HydrophobicContact CD2-CZ 4.19Å; L483-F487 HydrophobicContact CG-CD2 4.16Å; L483-F487 HydrophobicContact CG-CE2 3.54Å; L483-F487 HydrophobicContact CG-CZ 4.06Å; L483-F487 VanDerWaalsContact O-CD2 3.26Å; L483-F487 WeakPolarHBondContact O-CD2 3.42Å; L483-F487 PolarHBondContact O-N 3.07Å
484	L	63.8	Low	53.3	Low	79 Å²	79	99.1 Å²	99.1	41%	0.414	53%	0.533	S	S	.	.	H	α-helix	trans	-66.5	-26.3	176.4	-64.5	175	0	0	0	113.6	L235 A238 G482 F487 K488	L235-L484 HydrophobicContact CD2-CD2 4.29Å; L235-L484 HydrophobicContact CD2-CG 4.4Å; A238-L484 HydrophobicContact CB-CD2 4.03Å; G482-L484 PolarHBondContact O-N 3.35Å; L484-F487 HydrophobicContact CD2-CD2 4.29Å; L484-K488 VanDerWaalsContact O-CG 3.27Å; L484-K488 WeakPolarHBondContact O-CG 3.43Å; L484-K488 PolarHBondContact O-N 3.49Å; L484-K488 VanDerWaalsContact O-N 3.17Å
485	E	66.6	Low	53.6	Low	74 Å²	74	91 Å²	91	35%	0.346	50%	0.502	S	S	.	.	H	α-helix	trans	-76.9	-37.4	169.8	-153.8	-165.4	125.7	0	0	111.3	G481 G482 L483 F487 K488 R489	G481-E485 WeakPolarHBondContact CA-OE2 3.39Å; G482-E485 WeakPolarHBondContact O-CA 3.4Å; G482-E485 WeakPolarHBondContact O-CB 3.18Å; G482-E485 PolarHBondContact O-N 3.1Å; L483-E485 VanDerWaalsContact C-N 3.29Å; L483-E485 PolarHBondContact O-N 3.48Å; E485-F487 VanDerWaalsContact C-N 3.32Å; E485-F487 PolarHBondContact O-N 3.05Å; E485-K488 CarbonylContact O-C 3.56Å; E485-K488 PolarHBondContact O-N 3.21Å; E485-K488 VanDerWaalsContact O-N 3.15Å; E485-R489 WeakPolarHBondContact O-CB 3.17Å; E485-R489 WeakPolarHBondContact O-CG 3.31Å; E485-R489 PolarHBondContact O-N 3Å; E485-R489 IonicContact OE1-CZ 3.53Å; E485-R489 IonicContact OE1-NE 2.86Å; E485-R489 PolarHBondContact OE1-NE 2.8Å; E485-R489 IonicContact OE1-NH2 2.72Å; E485-R489 PolarHBondContact OE1-NH2 3.22Å
486	S	68.4	Low	53.4	Low	39 Å²	39	86.2 Å²	86.2	27%	0.273	48%	0.475	S	S	.	.	H	α-helix	trans	-58.5	-42.3	171.7	-59.7	0	0	0	0	112	G482 L483 R489 A490	G482-S486 PolarHBondContact O-N 3.46Å; L483-S486 WeakPolarHBondContact O-CB 3.21Å; L483-S486 PolarHBondContact O-N 2.83Å; L483-S486 VanDerWaalsContact O-N 3.15Å; S486-R489 PolarHBondContact O-N 2.67Å; S486-A490 WeakPolarHBondContact O-CB 3.29Å; S486-A490 PolarHBondContact O-N 3.39Å
487	F	67.5	Low	53.2	Low	8 Å²	8	78.3 Å²	78.3	4%	0.035	44%	0.44	C	S	.	.	H	α-helix	trans	-62.3	-46.5	171.1	-68.5	-54.9	0	0	0	112.4	A238 Y239 H242 L448 L483 L484 E485 R489 A490 M491	A238-F487 HydrophobicContact CB-CD2 3.92Å; A238-F487 HydrophobicContact CB-CE2 3.9Å; Y239-F487 HydrophobicContact CD2-CE1 4.19Å; Y239-F487 HydrophobicContact CD2-CZ 4.38Å; H242-F487 HydrophobicContact CB-CD1 4.02Å; H242-F487 HydrophobicContact CB-CE1 4.41Å; L448-F487 HydrophobicContact CB-CE1 3.97Å; L448-F487 HydrophobicContact CD1-CD1 3.92Å; L448-F487 HydrophobicContact CD1-CE1 3.98Å; L448-F487 HydrophobicContact CD2-CD1 3.76Å; L448-F487 HydrophobicContact CD2-CE1 3.8Å; L448-F487 HydrophobicContact CG-CD1 4.32Å; L448-F487 HydrophobicContact CG-CE1 4.13Å; L483-F487 HydrophobicContact CD1-CE2 4.25Å; L483-F487 HydrophobicContact CD1-CZ 4.32Å; L483-F487 HydrophobicContact CD2-CE2 3.75Å; L483-F487 HydrophobicContact CD2-CZ 4.19Å; L483-F487 HydrophobicContact CG-CD2 4.16Å; L483-F487 HydrophobicContact CG-CE2 3.54Å; L483-F487 HydrophobicContact CG-CZ 4.06Å; L483-F487 VanDerWaalsContact O-CD2 3.26Å; L483-F487 WeakPolarHBondContact O-CD2 3.42Å; L483-F487 PolarHBondContact O-N 3.07Å; L484-F487 HydrophobicContact CD2-CD2 4.29Å; E485-F487 VanDerWaalsContact C-N 3.32Å; E485-F487 PolarHBondContact O-N 3.05Å; F487-R489 VanDerWaalsContact C-N 3.29Å; F487-R489 PolarHBondContact O-N 3.24Å; F487-A490 PolarHBondContact O-N 2.78Å; F487-A490 VanDerWaalsContact O-N 3.17Å; F487-M491 WeakPolarHBondContact O-CG 3.17Å; F487-M491 PolarHBondContact O-N 3.33Å
488	K	65.8	Low	53.3	Low	136 Å²	136	77.3 Å²	77.3	59%	0.591	43%	0.432	S	S	*	.	H	α-helix	trans	-60	-36.5	176.2	-74.6	171.6	-179.6	-175.2	0	112.8	L484 E485 R492	L484-K488 VanDerWaalsContact O-CG 3.27Å; L484-K488 WeakPolarHBondContact O-CG 3.43Å; L484-K488 PolarHBondContact O-N 3.49Å; L484-K488 VanDerWaalsContact O-N 3.17Å; E485-K488 CarbonylContact O-C 3.56Å; E485-K488 PolarHBondContact O-N 3.21Å; E485-K488 VanDerWaalsContact O-N 3.15Å; K488-R492 WeakPolarHBondContact O-CB 3.34Å; K488-R492 PolarHBondContact O-N 3.09Å; K488-R492 VanDerWaalsContact O-N 3.13Å
489	R	66.3	Low	53	Low	148 Å²	148	77.7 Å²	77.7	56%	0.558	41%	0.413	S	S	*	.	H	α-helix	trans	-67.9	-45.3	173.5	-70.8	175.6	-175.8	-153.7	6.5	111	E485 S486 F487 R492 V493	E485-R489 WeakPolarHBondContact O-CB 3.17Å; E485-R489 WeakPolarHBondContact O-CG 3.31Å; E485-R489 PolarHBondContact O-N 3Å; E485-R489 IonicContact OE1-CZ 3.53Å; E485-R489 IonicContact OE1-NE 2.86Å; E485-R489 PolarHBondContact OE1-NE 2.8Å; E485-R489 IonicContact OE1-NH2 2.72Å; E485-R489 PolarHBondContact OE1-NH2 3.22Å; S486-R489 PolarHBondContact O-N 2.67Å; F487-R489 VanDerWaalsContact C-N 3.29Å; F487-R489 PolarHBondContact O-N 3.24Å; R489-R492 PolarHBondContact O-N 3.35Å; R489-V493 WeakPolarHBondContact O-CG2 3.39Å; R489-V493 PolarHBondContact O-N 2.89Å
490	A	57.1	Low	52.7	Low	14 Å²	14	80.5 Å²	80.5	12%	0.116	41%	0.414	C	S	.	.	H	α-helix	trans	-61.1	-44.8	177.7	0	0	0	0	0	112.7	T444 L448 S486 F487 R492 V493 R494	T444-A490 HydrophobicContact CG2-CB 4.11Å; L448-A490 HydrophobicContact CD1-CB 3.97Å; S486-A490 WeakPolarHBondContact O-CB 3.29Å; S486-A490 PolarHBondContact O-N 3.39Å; F487-A490 PolarHBondContact O-N 2.78Å; F487-A490 VanDerWaalsContact O-N 3.17Å; A490-R492 VanDerWaalsContact C-N 3.34Å; A490-R492 PolarHBondContact O-N 3.03Å; A490-V493 PolarHBondContact O-N 3.06Å; A490-R494 PolarHBondContact O-N 2.76Å
491	M	54.5	Low	52.1	Low	97 Å²	97	77.7 Å²	77.7	48%	0.478	41%	0.41	S	S	.	.	H	α-helix	trans	-62.7	-39.8	174.3	-65.4	-169.2	-56.8	0	0	112	F487 V493 R494 S495	F487-M491 WeakPolarHBondContact O-CG 3.17Å; F487-M491 PolarHBondContact O-N 3.33Å; M491-V493 VanDerWaalsContact C-N 3.27Å; M491-V493 PolarHBondContact O-N 2.94Å; M491-R494 PolarHBondContact O-N 3.39Å; M491-R494 VanDerWaalsContact O-N 3.15Å; M491-S495 PolarHBondContact O-N 2.93Å
492	R	53.2	Low	51.2	Low	158 Å²	158	82.6 Å²	82.6	60%	0.596	43%	0.431	S	S	*	.	H	α-helix	trans	-64.3	-29.6	175.1	-171.6	-180	-65.7	159.4	-1.6	113	K488 R489 A490 S495 H496	K488-R492 WeakPolarHBondContact O-CB 3.34Å; K488-R492 PolarHBondContact O-N 3.09Å; K488-R492 VanDerWaalsContact O-N 3.13Å; R489-R492 PolarHBondContact O-N 3.35Å; A490-R492 VanDerWaalsContact C-N 3.34Å; A490-R492 PolarHBondContact O-N 3.03Å; R492-S495 PolarHBondContact O-N 2.88Å; R492-S495 PolarHBondContact O-OG 3.11Å; R492-H496 WeakPolarHBondContact O-CB 3.49Å; R492-H496 PolarHBondContact O-N 3.45Å
493	V	50.9	Low	49.6	Very low	96 Å²	96	83.8 Å²	83.8	58%	0.582	44%	0.443	S	S	*	.	H	α-helix	trans	-75.1	-23.8	174.9	171	0	0	0	0	112.4	R489 A490 M491 H496	R489-V493 WeakPolarHBondContact O-CG2 3.39Å; R489-V493 PolarHBondContact O-N 2.89Å; A490-V493 PolarHBondContact O-N 3.06Å; M491-V493 VanDerWaalsContact C-N 3.27Å; M491-V493 PolarHBondContact O-N 2.94Å; V493-H496 VanDerWaalsContact O-O 3.11Å
494	R	54.8	Low	47.7	Very low	56 Å²	56	88.9 Å²	88.9	21%	0.211	48%	0.48	C	S	.	.	H	α-helix	trans	-70.7	-39.9	168.2	-80.6	-171.2	169.6	105.4	-6.5	112	H242 E441 A490 M491	H242-R494 PolarHBondContact CD2-NH1 2.94Å; H242-R494 PolarHBondContact O-NH1 2.72Å; E441-R494 IonicContact OE1-CZ 3.31Å; E441-R494 IonicContact OE1-NH2 3.69Å; E441-R494 PolarHBondContact OE1-NH2 3.3Å; A490-R494 PolarHBondContact O-N 2.76Å; M491-R494 PolarHBondContact O-N 3.39Å; M491-R494 VanDerWaalsContact O-N 3.15Å
495	S	45.2	Very low	45.9	Very low	33 Å²	33	92.9 Å²	92.9	23%	0.231	50%	0.497	C	S	.	.	H	α-helix	trans	-78.9	-34.3	178.7	57.5	0	0	0	0	114	K249 M491 R492 S497	K249-S495 PolarHBondContact NZ-O 2.88Å; M491-S495 PolarHBondContact O-N 2.93Å; R492-S495 PolarHBondContact O-N 2.88Å; R492-S495 PolarHBondContact O-OG 3.11Å; S495-S497 PolarHBondContact O-N 3.24Å
496	H	41.7	Very low	44.1	Very low	68 Å²	68	100.9 Å²	100.9	32%	0.315	52%	0.524	S	S	.	.	S	Bend	trans	-88.9	89.9	168.5	-76.6	-96.1	0	0	0	111.4	R492 V493	R492-H496 WeakPolarHBondContact O-CB 3.49Å; R492-H496 PolarHBondContact O-N 3.45Å; V493-H496 VanDerWaalsContact O-O 3.11Å
497	S	38.5	Very low	42.3	Very low	18 Å²	18	107 Å²	107	13%	0.126	55%	0.547	C	S	.	.			trans	-49	144.2	153.4	-167.6	0	0	0	0	109.8	N345 F368 S495 E499	N345-S497 WeakPolarHBondContact O-CB 3.4Å; N345-S497 PolarHBondContact O-OG 3Å; F368-S497 WeakPolarHBondContact CD1-OG 3.45Å; F368-S497 WeakPolarHBondContact CE1-OG 3.29Å; F368-S497 WeakPolarHBondContact CZ-OG 3.49Å; S495-S497 PolarHBondContact O-N 3.24Å; S497-E499 PolarHBondContact O-N 3.47Å
498	M	33.5	Very low	40.3	Very low	143 Å²	143	118.2 Å²	118.2	70%	0.704	59%	0.59	S	S	*	*	S	Bend	trans	-63.4	93.8	-145.1	-75.4	174.3	45.7	0	0	116.6	F368	F368-M498 HydrophobicContact CZ-CB 4.31Å; F368-M498 HydrophobicContact CZ-CG 4.35Å; F368-M498 HydrophobicContact CZ-SD 4.46Å
499	E	33.3	Very low	38.4	Very low	87 Å²	87	117.3 Å²	117.3	41%	0.407	60%	0.6	S	S	.	*			trans	-102.2	69	173	-61.9	-153.6	141.8	0	0	114.2	R341 S497	R341-E499 IonicContact CZ-OE1 2.92Å; R341-E499 IonicContact NE-OE1 2.68Å; R341-E499 PolarHBondContact NE-OE1 3.46Å; R341-E499 VanDerWaalsContact NH2-CD 3.3Å; R341-E499 IonicContact NH2-OE1 3.22Å; R341-E499 PolarHBondContact NH2-OE1 2.92Å; R341-E499 IonicContact NH2-OE2 4Å; R341-E499 PolarHBondContact NH2-OE2 3.37Å; S497-E499 PolarHBondContact O-N 3.47Å
500	T	30.6	Very low	36.9	Very low	138 Å²	138	116.4 Å²	116.4	85%	0.847	61%	0.614	S	S	*	*			trans	-160.7	65.8	162.2	40.4	0	0	0	0	115
501	V	30.3	Very low	35.4	Very low	134 Å²	134	119.4 Å²	119.4	81%	0.812	65%	0.646	S	S	*	*	S	Bend	trans	-148.6	149.4	149.2	-174.9	0	0	0	0	108.8
502	V	26.7	Very low	34.2	Very low	149 Å²	149	122.1 Å²	122.1	90%	0.903	67%	0.668	S	S	*	*	S	Bend	trans	72.7	137	-177	-164.3	0	0	0	0	113.7
503	G	26.8	Very low	32.9	Very low	63 Å²	63	119.5 Å²	119.5	65%	0.649	68%	0.68	S	S	*	*			trans	128.6	7.5	163.6	0	0	0	0	0	119.5	H505	G503-H505 VanDerWaalsContact C-N 3.28Å; G503-H505 PolarHBondContact O-N 3.43Å
504	S	26.5	Very low	31.8	Very low	128 Å²	128	118.9 Å²	118.9	90%	0.895	69%	0.693	S	S	*	*			trans	-71.4	74.1	178	-62.1	0	0	0	0	114
505	H	26.4	Very low	30.4	Very low	163 Å²	163	120 Å²	120	76%	0.755	72%	0.722	S	S	*	*			trans	-88	110.2	172.2	-107.9	44.1	0	0	0	111.8	G503 H507	G503-H505 VanDerWaalsContact C-N 3.28Å; G503-H505 PolarHBondContact O-N 3.43Å; H505-H507 PolarHBondContact O-N 3.24Å
506	R	29.2	Very low	29.6	Very low	243 Å²	243	124.9 Å²	124.9	92%	0.917	75%	0.75	S	S	*	*			trans	-79.5	94	173.5	-73.1	-179	171.6	-176.8	-2.8	110.6	R508	R506-R508 PolarHBondContact O-N 3.03Å
507	H	29.3	Very low	29.5	Very low	166 Å²	166	127.6 Å²	127.6	77%	0.769	77%	0.774	S	S	*	*			trans	-74.6	118.9	164.6	-80.8	-90.4	0	0	0	110.7	H505	H505-H507 PolarHBondContact O-N 3.24Å
508	R	25.5	Very low	28.8	Very low	244 Å²	244	130.6 Å²	130.6	92%	0.921	80%	0.8	S	S	*	*			trans	-86.4	135.5	162.5	-84.7	178.2	160.6	-177	-5.6	108.6	R506	R506-R508 PolarHBondContact O-N 3.03Å
509	S	27.3	Very low	28.5	Very low	117 Å²	117	129.3 Å²	129.3	82%	0.818	81%	0.805	S	S	*	*			trans	-124	144.9	159.5	-64.5	0	0	0	0	109.4
510	P	34.2	Very low	28.2	Very low	130 Å²	130	133 Å²	133	84%	0.844	83%	0.826	S	S	*	*			trans	-101.5	146.1	-169.2	37	-33.6	0	0	0	114.8
511	G	25.7	Very low	28.1	Very low	77 Å²	77	132.1 Å²	132.1	79%	0.794	83%	0.826	S	S	*	*			trans	68.8	95.4	136.7	0	0	0	0	0	120
512	V	29	Very low	27.7	Very low	154 Å²	154	129.5 Å²	129.5	93%	0.933	83%	0.826	S	S	*	*			trans	-130.3	144.8	142.1	179.6	0	0	0	0	107.3
513	A	26.2	Very low	27.6	Very low	103 Å²	103	126.5 Å²	126.5	85%	0.851	83%	0.825	S	S	*	*			trans	-117.3	145.4	-174.3	0	0	0	0	0	112.6
514	G	26.8	Very low	27.5	Very low	82 Å²	82	127.3 Å²	127.3	85%	0.845	83%	0.834	S	S	*	*			trans	157.2	133.5	168.1	0	0	0	0	0	114.2
515	G	25.3	Very low	27.6	Very low	81 Å²	81	129.3 Å²	129.3	84%	0.835	83%	0.834	S	S	*	*			trans	105.1	108.8	164.7	0	0	0	0	0	117.2
516	V	29.3	Very low	28.2	Very low	134 Å²	134	127.3 Å²	127.3	81%	0.812	84%	0.835	S	S	*	*			trans	-146.2	134.3	170.9	177.8	0	0	0	0	104.4	A518	V516-A518 HydrophobicContact CG1-CB 4.27Å
517	P	38.3	Very low	28.1	Very low	125 Å²	125	124.2 Å²	124.2	81%	0.812	83%	0.831	S	S	*	*				-132.5	166.1	57.1	21	4	0	0	0	114.7
518	A	25.5	Very low	27.9	Very low	82 Å²	82	121 Å²	121	68%	0.678	83%	0.828	S	S	*	*			cis	102.6	107.8	20.7	0	0	0	0	0	115.4	V516	V516-A518 HydrophobicContact CG1-CB 4.27Å
519	S	27.3	Very low	27.9	Very low	116 Å²	116	116.4 Å²	116.4	81%	0.811	83%	0.827	S	S	*	*			trans	-171.7	129.1	156.6	-76.9	0	0	0	0	106.3
520	L	26.2	Very low	28	Very low	163 Å²	163	116.1 Å²	116.1	85%	0.853	82%	0.824	S	S	*	*			cis	114.6	141	26.3	-86	174.7	0	0	0	110.5
521	S	27.6	Very low	27.5	Very low	121 Å²	121	119.2 Å²	119.2	85%	0.846	83%	0.828	S	S	*	*			trans	84.4	122.1	-169.8	-49.8	0	0	0	0	114.4
522	G	23.6	Very low	27.5	Very low	79 Å²	79	121.2 Å²	121.2	81%	0.814	83%	0.828	S	S	*	*			cis	80.7	124.2	1.6	0	0	0	0	0	113.4
523	G	23.5	Very low	27.4	Very low	85 Å²	85	120 Å²	120	88%	0.876	82%	0.822	S	S	*	*			cis	170.3	158	-5.8	0	0	0	0	0	110.1
524	G	24.8	Very low	27.6	Very low	81 Å²	81	125 Å²	125	84%	0.835	82%	0.824	S	S	*	*			trans	160.3	122.6	175	0	0	0	0	0	115.9
525	L	29.5	Very low	27.5	Very low	169 Å²	169	126.2 Å²	126.2	89%	0.885	82%	0.819	S	S	*	*			trans	-109.1	154	156.3	-90.2	162.7	0	0	0	107.2
526	P	38.3	Very low	27.6	Very low	121 Å²	121	127.5 Å²	127.5	79%	0.786	81%	0.811	S	S	*	*				-141.8	169.1	99.8	36	-21.1	0	0	0	116.5
527	Q	26.9	Very low	27.3	Very low	179 Å²	179	130.4 Å²	130.4	84%	0.836	81%	0.814	S	S	*	*			trans	-47.1	164.9	161.8	-68.8	160.9	-6.6	0	0	114.1
528	S	24.9	Very low	26.9	Very low	99 Å²	99	130.1 Å²	130.1	69%	0.692	81%	0.81	S	S	*	*			cis	-174.4	168.1	-13.4	52.8	0	0	0	0	109.8
529	T	25.2	Very low	27.6	Very low	147 Å²	147	131.6 Å²	131.6	90%	0.902	81%	0.812	S	S	*	*			trans	-169.9	167.2	134.2	14.2	0	0	0	0	109.8
530	S	29.8	Very low	28.2	Very low	110 Å²	110	131.7 Å²	131.7	77%	0.769	81%	0.81	S	S	*	*			trans	-147.7	140	-160.1	57.7	0	0	0	0	114.9
531	E	24.6	Very low	28.3	Very low	195 Å²	195	130 Å²	130	91%	0.911	81%	0.806	S	S	*	*			trans	-164.4	149.2	147	-104.7	159.1	-161.5	0	0	106.3
532	C	25.1	Very low	28.4	Very low	120 Å²	120	131.9 Å²	131.9	81%	0.811	81%	0.806	S	S	*	*			cis	-133.1	-167.7	33.1	-164.2	0	0	0	0	113.1
533	T	26.6	Very low	28.5	Very low	129 Å²	129	133.1 Å²	133.1	79%	0.791	80%	0.802	S	S	*	*			trans	-101.2	168.8	-149.9	51.8	0	0	0	0	117.5
534	K	31	Very low	28.7	Very low	206 Å²	206	133.2 Å²	133.2	90%	0.896	79%	0.794	S	S	*	*			trans	-125.4	142.1	170.5	-76.5	-176.3	175.8	179.6	0	111.6
535	S	24.8	Very low	28.8	Very low	108 Å²	108	139.6 Å²	139.6	76%	0.755	80%	0.799	S	S	*	*			trans	-163.4	124.2	150.8	-163	0	0	0	0	107
536	T	27.2	Very low	28.6	Very low	109 Å²	109	136.8 Å²	136.8	67%	0.669	79%	0.794	S	S	*	*			cis	88.7	110.5	39.6	-56.8	0	0	0	0	113.3
537	F	23	Very low	28.8	Very low	195 Å²	195	136 Å²	136	86%	0.855	79%	0.789	S	S	*	*				179.8	166.5	126.7	-110.4	-81.6	0	0	0	113.9
538	T	28.7	Very low	28.8	Very low	119 Å²	119	135.2 Å²	135.2	73%	0.73	79%	0.79	S	S	*	*			trans	-135.6	-171.5	-179	57.6	0	0	0	0	109.2
539	P	41.8	Very low	29	Very low	112 Å²	112	140.4 Å²	140.4	73%	0.727	80%	0.799	S	S	*	*			cis	-112.5	-110.3	-2.8	29.8	-4.6	0	0	0	112.8
540	P	39.6	Very low	28.9	Very low	119 Å²	119	138.7 Å²	138.7	77%	0.773	79%	0.793	S	S	*	*			cis	-116.6	-161.7	4.6	44.6	-30.1	0	0	0	115
541	V	27.5	Very low	29.7	Very low	126 Å²	126	138.6 Å²	138.6	76%	0.764	79%	0.79	S	S	*	*			trans	-150.3	165.9	-174.5	-161.9	0	0	0	0	112.8
542	L	29.5	Very low	29.8	Very low	161 Å²	161	136.3 Å²	136.3	84%	0.843	79%	0.789	S	S	*	*			trans	88	156.3	166.8	-50.4	174.6	0	0	0	116.8
543	S	26	Very low	30.1	Very low	106 Å²	106	140.2 Å²	140.2	74%	0.741	79%	0.792	S	S	*	*			cis	-155.8	145.8	14.7	-158.2	0	0	0	0	117.3
544	A	27.8	Very low	30.3	Very low	86 Å²	86	145.6 Å²	145.6	71%	0.711	80%	0.798	S	S	*	*			trans	36.2	132	146.1	0	0	0	0	0	125.8
545	K	26.5	Very low	30.1	Very low	215 Å²	215	147.4 Å²	147.4	94%	0.935	80%	0.799	S	S	*	*				-167.6	168.9	112.1	-102.4	166	-174.9	176.8	0	113.3
546	S	25.5	Very low	30.4	Very low	110 Å²	110	147.9 Å²	147.9	77%	0.769	80%	0.803	S	S	*	*			trans	-123.7	-172.6	-167.5	65.3	0	0	0	0	110.8
547	P	42.1	Very low	30.4	Very low	105 Å²	105	145.9 Å²	145.9	68%	0.682	80%	0.804	S	S	*	*			cis	-149.4	168.3	20.4	44.4	-23	0	0	0	121.4
548	L	27.7	Very low	30.6	Very low	163 Å²	163	144.8 Å²	144.8	85%	0.853	81%	0.806	S	S	*	*			trans	51.4	114.8	141.9	-68.7	166.2	0	0	0	122.9
549	K	28.1	Very low	30.7	Very low	207 Å²	207	148.7 Å²	148.7	90%	0.9	81%	0.813	S	S	*	*				-173.3	159.5	99.8	-99.1	173.2	-174.7	177.9	0	112.8
550	S	24.2	Very low	31	Very low	111 Å²	111	148.3 Å²	148.3	78%	0.776	81%	0.811	S	S	*	*			trans	-169.8	-172.3	-177.8	71.1	0	0	0	0	109.2
551	P	47.1	Very low	30.5	Very low	108 Å²	108	153.4 Å²	153.4	70%	0.701	82%	0.815	S	S	*	*			cis	-129.6	173.9	-37.1	36.7	-22.3	0	0	0	113
552	V	26	Very low	30.5	Very low	147 Å²	147	153.5 Å²	153.5	89%	0.891	81%	0.81	S	S	*	*			trans	-139.6	131.4	146.1	-177.6	0	0	0	0	110.2
553	K	31.9	Very low	30.4	Very low	202 Å²	202	153.3 Å²	153.3	88%	0.878	81%	0.805	S	S	*	*			trans	-155.8	131.1	167.2	-164.9	176.7	-172.5	176.3	0	110.5
554	R	30	Very low	30.4	Very low	243 Å²	243	152.2 Å²	152.2	92%	0.917	80%	0.797	S	S	*	*			trans	-151.9	150.1	168.5	-75.9	-172.4	177.8	-179.8	0.3	109
555	R	26.9	Very low	30.2	Very low	243 Å²	243	153.3 Å²	153.3	92%	0.917	80%	0.799	S	S	*	*			cis	-162.7	145.2	-29.4	-171.1	-177.8	-173.7	-165.5	3.6	106
556	S	31.5	Very low	30.2	Very low	118 Å²	118	148.8 Å²	148.8	83%	0.825	79%	0.79	S	S	*	*			trans	-123	158.5	177.9	53.3	0	0	0	0	112.8
557	G	26.4	Very low	30.2	Very low	67 Å²	67	151 Å²	151	69%	0.691	79%	0.793	S	S	*	*			trans	111.6	123	160.3	0	0	0	0	0	116.5
558	L	28.3	Very low	29.5	Very low	173 Å²	173	150.2 Å²	150.2	91%	0.906	80%	0.796	S	S	*	*				167.6	143.2	101.3	-85.5	160.1	0	0	0	113
559	F	31.1	Very low	30.5	Very low	201 Å²	201	148.1 Å²	148.1	88%	0.882	79%	0.792	S	S	*	*			trans	-126	-170.7	163.2	-78.9	-72.8	0	0	0	106
560	P	48.4	Very low	30.6	Very low	104 Å²	104	143.9 Å²	143.9	68%	0.675	79%	0.789	S	S	*	*			cis	-143	-166.4	4.1	42.2	-21.2	0	0	0	116.6
561	R	27.9	Very low	31	Very low	225 Å²	225	145.3 Å²	145.3	85%	0.849	79%	0.787	S	S	*	*			trans	75.3	144.7	160.6	-67.5	176.1	172.1	173.5	-3.6	116.7
562	L	28	Very low	30.2	Very low	129 Å²	129	148.6 Å²	148.6	68%	0.675	79%	0.791	S	S	*	*			cis	-152.7	-166.9	-2.1	-110.7	164	0	0	0	107.5
563	H	27	Very low	30.6	Very low	157 Å²	157	149.4 Å²	149.4	73%	0.727	78%	0.784	S	S	*	*			cis	-136.4	-119.5	15.6	-143.3	-66.3	0	0	0	115.1
564	S	25.5	Very low	30.5	Very low	83 Å²	83	144.9 Å²	144.9	58%	0.58	77%	0.774	S	S	*	*			trans	-161.4	148.5	-161.6	60.4	0	0	0	0	117.2
565	S	25	Very low	30.5	Very low	108 Å²	108	144.2 Å²	144.2	76%	0.755	77%	0.771	S	S	*	*			trans	85.1	148.9	146.1	-55.9	0	0	0	0	123.1
566	T	26.5	Very low	30.7	Very low	121 Å²	121	137.1 Å²	137.1	74%	0.742	76%	0.759	S	S	*	*			trans	92.9	128.7	149.7	10.9	0	0	0	0	121.9
567	D	25.4	Very low	30.8	Very low	155 Å²	155	138 Å²	138	83%	0.829	75%	0.754	S	S	*	*			trans	72.3	153.1	152.6	-57.5	-36.5	0	0	0	124.1
568	A	25.7	Very low	31	Very low	90 Å²	90	143 Å²	143	74%	0.744	76%	0.759	S	S	*	*			trans	-132.5	-160.9	179.4	0	0	0	0	0	107
569	P	49.9	Very low	31.2	Very low	118 Å²	118	144.1 Å²	144.1	77%	0.766	76%	0.757	S	S	*	*			cis	-129.9	-177.7	-13.4	42.5	-27	0	0	0	113.3
570	S	30.1	Very low	31.9	Very low	119 Å²	119	140.3 Å²	140.3	83%	0.832	75%	0.752	S	S	*	*			trans	161.1	168.6	136.8	48.2	0	0	0	0	112.8
571	D	31.5	Very low	31.1	Very low	141 Å²	141	139.6 Å²	139.6	75%	0.754	76%	0.756	S	S	*	*				-168.9	168	-54.1	-153.6	-19	0	0	0	108.6
572	K	31.4	Very low	31.5	Very low	176 Å²	176	137.4 Å²	137.4	77%	0.765	76%	0.755	S	S	*	*			trans	108.4	92.8	164.4	-63.3	174.4	178	173.6	0	119.1
573	H	33.5	Very low	31.5	Very low	164 Å²	164	138.7 Å²	138.7	76%	0.759	76%	0.761	S	S	*	*				73.2	148.1	114	-74.2	-6.2	0	0	0	120.8
574	T	29.9	Very low	31.4	Very low	108 Å²	108	136.3 Å²	136.3	66%	0.663	76%	0.761	S	S	*	*			cis	-155.1	144	14.4	-9.7	0	0	0	0	114
575	R	29.8	Very low	32.5	Very low	229 Å²	229	137.8 Å²	137.8	86%	0.864	77%	0.768	S	S	*	*			trans	50.8	136.3	150.8	-73.6	176.6	156	161.7	-6.1	121.6
576	S	31.9	Very low	32.8	Very low	94 Å²	94	140.9 Å²	140.9	66%	0.657	77%	0.771	S	S	*	*			cis	87	132.3	15.5	89.9	0	0	0	0	116.9
577	D	33.5	Very low	32.9	Very low	135 Å²	135	139.7 Å²	139.7	72%	0.722	77%	0.767	S	S	*	*			cis	-174.4	-171.7	-7.5	-144.8	-88.9	0	0	0	113.9
578	H	31	Very low	33.1	Very low	173 Å²	173	140 Å²	140	80%	0.801	76%	0.763	S	S	*	*			trans	96.1	156.2	148.6	-67.8	-8	0	0	0	124.6
579	K	32.8	Very low	33.3	Very low	196 Å²	196	142.9 Å²	142.9	85%	0.852	76%	0.762	S	S	*	*			trans	-118.2	175.7	-177.8	-62.3	-179.8	176.4	179.2	0	112.3
580	P	44.9	Very low	32.3	Very low	121 Å²	121	143.2 Å²	143.2	79%	0.786	76%	0.761	S	S	*	*				-131.1	167.3	98.5	13.1	9.9	0	0	0	112.5
581	A	33	Very low	32.2	Very low	90 Å²	90	148.4 Å²	148.4	74%	0.744	76%	0.762	S	S	*	*			cis	71.5	140.8	44.4	0	0	0	0	0	113.5
582	E	35.8	Very low	32.1	Very low	178 Å²	178	147.6 Å²	147.6	83%	0.832	77%	0.768	S	S	*	*			cis	-155	167.9	11.4	-144.6	169.9	-123.3	0	0	108.9
583	I	26.6	Very low	31.9	Very low	157 Å²	157	147.7 Å²	147.7	81%	0.805	77%	0.771	S	S	*	*				-175.3	158	76.2	-75.9	-173.8	0	0	0	109.3
584	C	26.7	Very low	31.7	Very low	107 Å²	107	145.7 Å²	145.7	72%	0.723	77%	0.77	S	S	*	*			trans	-113.6	178.3	-178.6	-153.3	0	0	0	0	112.8
585	P	48.5	Very low	31.6	Very low	114 Å²	114	146 Å²	146	74%	0.74	78%	0.777	S	S	*	*				-154.2	162.1	80.3	39.6	-18.6	0	0	0	119.4
586	H	29.8	Very low	31.5	Very low	173 Å²	173	140.5 Å²	140.5	80%	0.801	77%	0.773	S	S	*	*			trans	5.8	159	140.2	-76.3	-52.2	0	0	0	123.2
587	S	29.5	Very low	31.4	Very low	95 Å²	95	143.4 Å²	143.4	66%	0.664	78%	0.782	S	S	*	*			cis	-172.1	169.8	1.9	43.9	0	0	0	0	114.1
588	Q	29.3	Very low	31.8	Very low	162 Å²	162	142.2 Å²	142.2	76%	0.757	78%	0.781	S	S	*	*			trans	4.7	151	141.3	-88	173.3	-64.3	0	0	120.7
589	E	29.7	Very low	31.7	Very low	151 Å²	151	139.2 Å²	139.2	71%	0.706	78%	0.78	S	S	*	*			cis	-174	-179.5	2.2	-163.4	173.3	-100.5	0	0	111.6
590	V	28.2	Very low	31.6	Very low	124 Å²	124	135.4 Å²	135.4	75%	0.752	78%	0.778	S	S	*	*			trans	86.8	145.7	157.4	-174.8	0	0	0	0	121
591	R	29.2	Very low	31.8	Very low	229 Å²	229	134.9 Å²	134.9	86%	0.864	78%	0.775	S	S	*	*			trans	-69.5	161.1	-178.2	-51.7	161.1	171.3	165	-6.3	115.6
592	S	28.8	Very low	31.5	Very low	124 Å²	124	139.3 Å²	139.3	87%	0.867	78%	0.78	S	S	*	*				-180	-176.1	120	39.6	0	0	0	0	112.3
593	E	28.4	Very low	31.3	Very low	178 Å²	178	137.6 Å²	137.6	83%	0.832	78%	0.775	S	S	*	*			trans	-124.2	172.4	-153	-55.6	173	108.2	0	0	116
594	T	27.8	Very low	31.3	Very low	122 Å²	122	135.6 Å²	135.6	75%	0.748	77%	0.773	S	S	*	*			trans	83.5	131.4	153.1	67.7	0	0	0	0	122.8
595	S	27.7	Very low	32.5	Very low	115 Å²	115	135.2 Å²	135.2	80%	0.804	77%	0.77	S	S	*	*			trans	67.3	146.7	156.6	77.3	0	0	0	0	117.5
596	S	29.3	Very low	31.6	Very low	112 Å²	112	136.4 Å²	136.4	78%	0.783	77%	0.77	S	S	*	*			cis	-157	162.2	28.8	49.5	0	0	0	0	113.8
597	N	29.6	Very low	31.8	Very low	155 Å²	155	135.6 Å²	135.6	83%	0.829	76%	0.764	S	S	*	*			trans	-89.8	153.4	163.7	-109.8	-13.2	0	0	0	108.6
598	P	41.6	Very low	32.1	Very low	111 Å²	111	138.1 Å²	138.1	72%	0.721	77%	0.765	S	S	*	*				-154.7	163.9	70	40.8	-21.8	0	0	0	118
599	S	27.5	Very low	32.6	Very low	109 Å²	109	141.6 Å²	141.6	76%	0.762	77%	0.771	S	S	*	*				167.7	148.8	118.8	-73.8	0	0	0	0	114.4
600	S	31.3	Very low	32.8	Very low	117 Å²	117	140.2 Å²	140.2	82%	0.818	78%	0.779	S	S	*	*			trans	-152.9	165.6	165.6	-42.9	0	0	0	0	106.4
601	P	48.9	Very low	33.6	Very low	110 Å²	110	139.4 Å²	139.4	71%	0.714	79%	0.785	S	S	*	*				-154.8	177.9	66	41.8	-21.3	0	0	0	117
602	E	27.7	Very low	34.2	Very low	182 Å²	182	132.3 Å²	132.3	85%	0.85	78%	0.783	S	S	*	*			trans	163.3	105.3	140.4	-91.8	176.8	-179.8	0	0	107.9
603	I	30.2	Very low	35	Very low	143 Å²	143	135.7 Å²	135.7	73%	0.733	81%	0.807	S	S	*	*				73.1	86.7	70.3	-61.8	172.9	0	0	0	111.4
604	C	28.5	Very low	35.3	Very low	114 Å²	114	133.6 Å²	133.6	77%	0.77	81%	0.805	S	S	*	*				88.1	167.3	82.4	-79.5	0	0	0	0	114.4
605	P	51.3	Low	35.7	Very low	100 Å²	100	134.2 Å²	134.2	65%	0.649	81%	0.808	S	S	*	*			cis	-140.3	172.7	-41.4	40	-25	0	0	0	114.2
606	N	29.6	Very low	36.2	Very low	138 Å²	138	135.3 Å²	135.3	74%	0.738	81%	0.809	S	S	*	*				171.8	143.6	120.6	-104.2	-46.7	0	0	0	117.4
607	K	34.3	Very low	36.6	Very low	156 Å²	156	136.6 Å²	136.6	68%	0.678	81%	0.81	S	S	*	*			trans	40.1	153	135.5	-84.6	172.2	161.9	-120.9	0	122.7
608	E	34.2	Very low	37	Very low	148 Å²	148	135.5 Å²	135.5	69%	0.692	81%	0.809	S	S	*	*			cis	-147.4	179.2	4.5	-157.9	124	-147.5	0	0	112.7
609	R	40.3	Very low	36.7	Very low	235 Å²	235	137.1 Å²	137.1	89%	0.887	82%	0.815	S	S	*	*			trans	-84.4	162.1	175.8	-57.3	166.2	169.9	165.4	-6.5	112.4
610	S	34.3	Very low	37.4	Very low	123 Å²	123	139.1 Å²	139.1	86%	0.86	82%	0.819	S	S	*	*				-156.2	152.9	125.1	52	0	0	0	0	111.9
611	A	45.1	Very low	37.9	Very low	106 Å²	106	140.8 Å²	140.8	88%	0.876	82%	0.819	S	S	*	*			trans	-154.7	157.1	172.1	0	0	0	0	0	108.7
612	G	42.4	Very low	36.9	Very low	80 Å²	80	143.4 Å²	143.4	83%	0.825	83%	0.827	S	S	*	*			trans	111.4	150.4	-172	0	0	0	0	0	111.4
613	S	45.4	Very low	37.8	Very low	196 Å²	196	139.9 Å²	139.9	100%	1.371	83%	0.825	S	S	*	*			cis	-120.6	0	7.4	59.9	0	0	0	0	112.9

Retrieved 613 of 613 residues in 586.4 ms (Link to these results)

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