A0A060X123_ONCMY Loading...

Glycosyltransferase 2-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A060X123, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC118936293, Length 474 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36	Very low	40.4	Very low	247 Å²	247	150.7 Å²	150.7	100%	1.217	81%	0.811	S	S	*	*				0	85.2	0	-72.7	156.9	76.1	0	0	106.4
2	G	32.8	Very low	40.7	Very low	78 Å²	78	147.3 Å²	147.3	80%	0.804	79%	0.791	S	S	*	*				92.6	130.4	91.1	0	0	0	0	0	107.8
3	R	34.2	Very low	40.7	Very low	243 Å²	243	148 Å²	148	92%	0.917	78%	0.783	S	S	*	*			cis	-164.7	136.4	17.2	-99.5	171.6	165.1	174.2	-4.8	104.9
4	C	43.2	Very low	40.9	Very low	115 Å²	115	144 Å²	144	78%	0.777	77%	0.771	S	S	*	*				59.2	102.4	97.8	-152.2	0	0	0	0	114.6
5	K	44.7	Very low	41.1	Very low	198 Å²	198	142.5 Å²	142.5	86%	0.861	76%	0.762	S	S	*	*			trans	145.7	88.2	145.1	-82	177.1	180	-173.3	0	111.6
6	Q	41.1	Very low	41.6	Very low	182 Å²	182	137.9 Å²	137.9	85%	0.85	75%	0.745	S	S	*	*			trans	-165.1	19.3	151.9	-113	170.3	10.1	0	0	115.1
7	V	44.3	Very low	42	Very low	139 Å²	139	133.4 Å²	133.4	84%	0.842	73%	0.731	S	S	*	*	S	Bend	trans	-93.7	1.7	178.2	179.3	0	0	0	0	112.8
8	L	42.4	Very low	42.3	Very low	138 Å²	138	130.3 Å²	130.3	72%	0.723	72%	0.72	S	S	*	*	S	Bend	trans	-100	3.1	-173.7	-149.3	75.9	0	0	0	115.8	I12	L8-I12 WeakPolarHBondContact O-CD1 3.5Å
9	V	43.1	Very low	42.7	Very low	105 Å²	105	127.6 Å²	127.6	64%	0.636	71%	0.707	S	S	*	*	S	Bend	trans	-106	-22.3	-177.1	-177.4	0	0	0	0	113.4
10	L	40.2	Very low	42.8	Very low	153 Å²	153	127.5 Å²	127.5	80%	0.801	70%	0.703	S	S	*	*	H	α-helix	trans	-87.1	-18.5	177.3	-95.1	122	0	0	0	114.6
11	A	42.8	Very low	42.8	Very low	60 Å²	60	129.4 Å²	129.4	50%	0.496	70%	0.701	S	S	.	*	H	α-helix	trans	-81.5	-22.1	177.3	0	0	0	0	0	113.6
12	I	43.8	Very low	43.1	Very low	110 Å²	110	121 Å²	121	56%	0.564	67%	0.667	S	S	*	*	H	α-helix	trans	-80.8	-25.8	-177.8	-63.8	172.3	0	0	0	111.6	L8 S16	L8-I12 WeakPolarHBondContact O-CD1 3.5Å; I12-S16 PolarHBondContact O-OG 3.1Å
13	F	41.3	Very low	43.4	Very low	156 Å²	156	123.9 Å²	123.9	68%	0.684	66%	0.657	S	S	*	*	H	α-helix	trans	-79.8	-22	179.1	-93	-83.7	0	0	0	114.6	S16	F13-S16 PolarHBondContact O-OG 3.17Å
14	C	43.4	Very low	43.8	Very low	92 Å²	92	117 Å²	117	62%	0.622	64%	0.637	S	S	*	*	H	α-helix	trans	-85.6	-23.9	175.8	-74.5	0	0	0	0	113.4	S18	C14-S18 PolarHBondContact O-OG 2.75Å
15	L	43	Very low	43.4	Very low	122 Å²	122	119.3 Å²	119.3	64%	0.639	63%	0.631	S	S	*	*	H	α-helix	trans	-81.1	-29.5	177.4	-96.6	138.2	0	0	0	112.9	V19	L15-V19 WeakPolarHBondContact O-CG2 3.3Å; L15-V19 PolarHBondContact O-N 3.37Å
16	S	49.1	Very low	42.8	Very low	69 Å²	69	116.5 Å²	116.5	48%	0.483	62%	0.62	S	S	.	*	H	α-helix	trans	-73.9	-33.3	176.6	57.9	0	0	0	0	113.4	I12 F13 M20	I12-S16 PolarHBondContact O-OG 3.1Å; F13-S16 PolarHBondContact O-OG 3.17Å; S16-M20 PolarHBondContact O-N 2.91Å; S16-M20 VanDerWaalsContact O-N 3.14Å
17	A	48.3	Very low	42.4	Very low	61 Å²	61	117 Å²	117	50%	0.504	62%	0.616	S	S	.	*	H	α-helix	trans	-70.4	-36.4	176.7	0	0	0	0	0	112.7	Y21	A17-Y21 PolarHBondContact O-N 3.1Å; A17-Y21 VanDerWaalsContact O-N 3.08Å
18	S	48.4	Very low	41.8	Very low	78 Å²	78	114.7 Å²	114.7	55%	0.545	61%	0.606	S	S	.	*	H	α-helix	trans	-74.3	-34.6	-179.4	-51.2	0	0	0	0	112.2	C14 S22	C14-S18 PolarHBondContact O-OG 2.75Å; S18-S22 PolarHBondContact O-N 3.05Å; S18-S22 VanDerWaalsContact O-N 3.11Å
19	V	48.8	Very low	41.4	Very low	78 Å²	78	112.7 Å²	112.7	47%	0.473	60%	0.6	S	S	.	*	H	α-helix	trans	-74.2	-36	175.5	176.8	0	0	0	0	111.3	L15 F23	L15-V19 WeakPolarHBondContact O-CG2 3.3Å; L15-V19 PolarHBondContact O-N 3.37Å; V19-F23 HydrophobicContact CG1-CD2 3.86Å; V19-F23 HydrophobicContact CG1-CE2 4.09Å; V19-F23 WeakPolarHBondContact O-CB 3.01Å; V19-F23 WeakPolarHBondContact O-CD2 3.45Å; V19-F23 PolarHBondContact O-N 2.83Å
20	M	45.4	Very low	40.7	Very low	125 Å²	125	112.9 Å²	112.9	62%	0.616	60%	0.601	S	S	*	*	H	α-helix	trans	-66	-37.2	172	-101.7	-152.1	84.2	0	0	112.8	S16 F23 I24	S16-M20 PolarHBondContact O-N 2.91Å; S16-M20 VanDerWaalsContact O-N 3.14Å; M20-F23 PolarHBondContact O-N 3.27Å; M20-I24 HydrophobicContact CE-CD1 3.76Å; M20-I24 HydrophobicContact CE-CG1 4.47Å; M20-I24 VanDerWaalsContact O-CG1 3.31Å; M20-I24 WeakPolarHBondContact O-CG1 2.91Å; M20-I24 PolarHBondContact O-N 3.06Å
21	Y	43.6	Very low	40.1	Very low	168 Å²	168	114.8 Å²	114.8	66%	0.659	61%	0.606	S	S	*	*	H	α-helix	trans	-69.9	-39.4	178.5	-142.5	-92	0	0	0	111.8	A17 I24 Y25	A17-Y21 PolarHBondContact O-N 3.1Å; A17-Y21 VanDerWaalsContact O-N 3.08Å; Y21-I24 PolarHBondContact O-N 2.99Å; Y21-Y25 HydrophobicContact CE1-CD2 4.25Å; Y21-Y25 WeakPolarHBondContact O-CB 3.4Å; Y21-Y25 PolarHBondContact O-N 2.81Å
22	S	41.7	Very low	39.3	Very low	72 Å²	72	119.8 Å²	119.8	50%	0.503	62%	0.619	S	S	.	*	H	α-helix	trans	-66.9	-35.4	172.2	-102.5	0	0	0	0	112.9	S18 Y25 H26	S18-S22 PolarHBondContact O-N 3.05Å; S18-S22 VanDerWaalsContact O-N 3.11Å; S22-Y25 PolarHBondContact O-N 3.48Å; S22-H26 WeakPolarHBondContact O-CB 3.45Å; S22-H26 PolarHBondContact O-N 2.98Å
23	F	38.7	Very low	38.5	Very low	137 Å²	137	122.9 Å²	122.9	60%	0.601	63%	0.631	S	S	*	*	H	α-helix	trans	-69	-35.8	175	-98.9	-84.3	0	0	0	112.6	V19 M20 Y27	V19-F23 HydrophobicContact CG1-CD2 3.86Å; V19-F23 HydrophobicContact CG1-CE2 4.09Å; V19-F23 WeakPolarHBondContact O-CB 3.01Å; V19-F23 WeakPolarHBondContact O-CD2 3.45Å; V19-F23 PolarHBondContact O-N 2.83Å; M20-F23 PolarHBondContact O-N 3.27Å; F23-Y27 WeakPolarHBondContact O-CB 3.24Å; F23-Y27 PolarHBondContact O-N 3.35Å
24	I	42	Very low	37.8	Very low	98 Å²	98	120.4 Å²	120.4	50%	0.503	63%	0.629	S	S	.	*	H	α-helix	trans	-72	-36.3	175.3	-68.3	168	0	0	0	111.3	M20 Y21 S28	M20-I24 HydrophobicContact CE-CD1 3.76Å; M20-I24 HydrophobicContact CE-CG1 4.47Å; M20-I24 VanDerWaalsContact O-CG1 3.31Å; M20-I24 WeakPolarHBondContact O-CG1 2.91Å; M20-I24 PolarHBondContact O-N 3.06Å; Y21-I24 PolarHBondContact O-N 2.99Å; I24-S28 PolarHBondContact O-OG 3.02Å
25	Y	35.2	Very low	37	Very low	165 Å²	165	122.8 Å²	122.8	65%	0.647	64%	0.635	S	S	*	*	H	α-helix	trans	-74.8	-36.3	177.3	-129.7	-91.9	0	0	0	112.6	Y21 S22 S28	Y21-Y25 HydrophobicContact CE1-CD2 4.25Å; Y21-Y25 WeakPolarHBondContact O-CB 3.4Å; Y21-Y25 PolarHBondContact O-N 2.81Å; S22-Y25 PolarHBondContact O-N 3.48Å; Y25-S28 PolarHBondContact O-N 3.13Å
26	H	33.1	Very low	36.1	Very low	138 Å²	138	125.1 Å²	125.1	64%	0.639	64%	0.643	S	S	*	*	H	α-helix	trans	-78.7	-23.6	176.5	-100.3	-48	0	0	0	114.6	S22 S28	S22-H26 WeakPolarHBondContact O-CB 3.45Å; S22-H26 PolarHBondContact O-N 2.98Å; H26-S28 PolarHBondContact O-N 3.35Å
27	Y	31.7	Very low	35	Very low	193 Å²	193	129.8 Å²	129.8	76%	0.757	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-8.6	167.8	-113.2	-93	0	0	0	113.3	F23	F23-Y27 WeakPolarHBondContact O-CB 3.24Å; F23-Y27 PolarHBondContact O-N 3.35Å
28	S	32.8	Very low	34	Very low	91 Å²	91	131.8 Å²	131.8	64%	0.636	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	5	178.8	-59.4	0	0	0	0	113.5	I24 Y25 H26	I24-S28 PolarHBondContact O-OG 3.02Å; Y25-S28 PolarHBondContact O-N 3.13Å; H26-S28 PolarHBondContact O-N 3.35Å
29	T	32.9	Very low	33	Very low	95 Å²	95	133.8 Å²	133.8	58%	0.583	68%	0.678	S	S	*	*			trans	-142.5	64.2	177.2	58.4	0	0	0	0	111.3
30	T	27.7	Very low	31.9	Very low	110 Å²	110	138.3 Å²	138.3	68%	0.675	69%	0.694	S	S	*	*			trans	-123.8	99.6	152.3	42.4	0	0	0	0	106.1	E32	T30-E32 PolarHBondContact O-N 3.18Å
31	E	28.2	Very low	30.9	Very low	192 Å²	192	140.9 Å²	140.9	90%	0.897	71%	0.705	S	S	*	*			trans	-61.4	90.3	163.7	-77.4	179.7	146.5	0	0	107.4	H33	E31-H33 PolarHBondContact O-N 3.06Å; E31-H33 VanDerWaalsContact O-N 3.14Å
32	E	26.3	Very low	30.2	Very low	165 Å²	165	140.6 Å²	140.6	77%	0.771	71%	0.713	S	S	*	*			trans	-61	111.2	149.5	-94.5	-176.5	160.2	0	0	105.9	T30 T34	T30-E32 PolarHBondContact O-N 3.18Å; E32-T34 PolarHBondContact O-N 3.02Å; E32-T34 PolarHBondContact O-OG1 2.92Å
33	H	27.7	Very low	29.6	Very low	176 Å²	176	147.9 Å²	147.9	82%	0.815	73%	0.729	S	S	*	*			trans	-62.6	70.5	164.9	-132.7	-73.7	0	0	0	107.7	E31 D35	E31-H33 PolarHBondContact O-N 3.06Å; E31-H33 VanDerWaalsContact O-N 3.14Å; H33-D35 PolarHBondContact O-N 2.7Å; H33-D35 VanDerWaalsContact O-N 3.15Å
34	T	26	Very low	29.2	Very low	103 Å²	103	145.4 Å²	145.4	63%	0.632	73%	0.734	S	S	*	*			trans	-67.1	104.9	157.2	31.3	0	0	0	0	103.6	E32 Q36	E32-T34 PolarHBondContact O-N 3.02Å; E32-T34 PolarHBondContact O-OG1 2.92Å; T34-Q36 VanDerWaalsContact C-N 3.26Å; T34-Q36 PolarHBondContact O-N 2.73Å
35	D	25.5	Very low	28.9	Very low	142 Å²	142	144 Å²	144	76%	0.759	73%	0.727	S	S	*	*			trans	-46.9	106.7	160.4	-91.8	-25.8	0	0	0	105.7	H33 L37	H33-D35 PolarHBondContact O-N 2.7Å; H33-D35 VanDerWaalsContact O-N 3.15Å; D35-L37 PolarHBondContact O-N 2.87Å
36	Q	24.4	Very low	28.7	Very low	172 Å²	172	141.3 Å²	141.3	80%	0.804	73%	0.73	S	S	*	*			trans	-58.6	97.5	169.4	-76.5	179.4	-14	0	0	104.2	T34 V38	T34-Q36 VanDerWaalsContact C-N 3.26Å; T34-Q36 PolarHBondContact O-N 2.73Å; Q36-V38 PolarHBondContact O-N 3.34Å
37	L	26.6	Very low	28.9	Very low	166 Å²	166	137.8 Å²	137.8	87%	0.869	72%	0.721	S	S	*	*			trans	-57.4	85.3	147.6	-85.3	158.2	0	0	0	104.3	D35 P39	D35-L37 PolarHBondContact O-N 2.87Å; L37-P39 WeakPolarHBondContact O-CD 3.14Å; L37-P39 VanDerWaalsContact O-N 3.07Å
38	V	26.8	Very low	29.3	Very low	104 Å²	104	132.4 Å²	132.4	63%	0.63	71%	0.708	S	S	*	*			trans	-39.8	121.3	157.2	176.1	0	0	0	0	103.7	Q36 Q40	Q36-V38 PolarHBondContact O-N 3.34Å; V38-Q40 PolarHBondContact O-N 3.15Å
39	P	27.4	Very low	29.6	Very low	119 Å²	119	132.9 Å²	132.9	77%	0.773	71%	0.712	S	S	*	*			trans	-56.4	100.7	169.8	-18.1	29.1	0	0	0	104.4	L37 Q41	L37-P39 WeakPolarHBondContact O-CD 3.14Å; L37-P39 VanDerWaalsContact O-N 3.07Å; P39-Q41 VanDerWaalsContact C-N 3.33Å; P39-Q41 PolarHBondContact O-N 2.98Å
40	Q	26.1	Very low	30.4	Very low	174 Å²	174	134.7 Å²	134.7	81%	0.813	72%	0.717	S	S	*	*			trans	-53.4	115.6	165.4	-85.4	-174.4	-11.3	0	0	102.2	V38 I42	V38-Q40 PolarHBondContact O-N 3.15Å; Q40-I42 VanDerWaalsContact C-N 3.32Å; Q40-I42 PolarHBondContact O-N 3.06Å
41	Q	25.3	Very low	31.4	Very low	178 Å²	178	140.6 Å²	140.6	83%	0.832	73%	0.727	S	S	*	*			trans	-41.4	111.4	165.7	-87.5	176.5	-29.2	0	0	104.6	P39 R43	P39-Q41 VanDerWaalsContact C-N 3.33Å; P39-Q41 PolarHBondContact O-N 2.98Å; Q41-R43 PolarHBondContact O-N 3.38Å
42	I	29.3	Very low	32.8	Very low	163 Å²	163	139.9 Å²	139.9	84%	0.836	72%	0.724	S	S	*	*			trans	-57.9	98.5	167.2	-63.8	173.4	0	0	0	101.7	Q40 A44	Q40-I42 VanDerWaalsContact C-N 3.32Å; Q40-I42 PolarHBondContact O-N 3.06Å; I42-A44 PolarHBondContact O-N 2.91Å
43	R	27.7	Very low	34.5	Very low	224 Å²	224	137.8 Å²	137.8	85%	0.845	73%	0.725	S	S	*	*			trans	-53.9	113	176.3	-95.7	-177.6	173.1	-176.1	-1.6	103.1	Q41 L45	Q41-R43 PolarHBondContact O-N 3.38Å; R43-L45 PolarHBondContact O-N 3.42Å
44	A	30.3	Very low	36.6	Very low	85 Å²	85	137 Å²	137	70%	0.702	73%	0.727	S	S	*	*			trans	-47.8	117.8	175.8	0	0	0	0	0	106.3	I42	I42-A44 PolarHBondContact O-N 2.91Å
45	L	35.5	Very low	39.2	Very low	68 Å²	68	138.1 Å²	138.1	36%	0.356	74%	0.737	S	S	.	*			trans	-53.2	130.1	-179.4	-76.3	162.4	0	0	0	107.2	R43 S47 I100 P103	R43-L45 PolarHBondContact O-N 3.42Å; L45-S47 PolarHBondContact O-N 3.16Å; L45-I100 HydrophobicContact CD1-CG2 3.42Å; L45-I100 VanDerWaalsContact CD1-CG2 3.42Å; L45-P103 HydrophobicContact CD2-CB 4.47Å; L45-P103 HydrophobicContact CD2-CG 4.07Å
46	P	32.7	Very low	41.7	Very low	110 Å²	110	136.5 Å²	136.5	71%	0.714	73%	0.732	S	S	*	*			trans	-55.6	113.5	-173.8	17.1	-28.2	0	0	0	109.6	T48	P46-T48 PolarHBondContact O-N 3.43Å; P46-T48 VanDerWaalsContact O-N 3.17Å
47	S	37.3	Very low	44.4	Very low	64 Å²	64	133.3 Å²	133.3	45%	0.448	73%	0.728	S	S	.	*			trans	-77.4	98.3	178.1	-165	0	0	0	0	108.6	L45 S49 R98	L45-S47 PolarHBondContact O-N 3.16Å; S47-S49 VanDerWaalsContact C-N 3.33Å; S47-S49 PolarHBondContact O-N 3.32Å; S47-S49 VanDerWaalsContact O-N 3.13Å; S47-R98 VanDerWaalsContact CB-NH2 3.27Å; S47-R98 PolarHBondContact OG-NE 2.82Å; S47-R98 VanDerWaalsContact OG-NE 3.11Å; S47-R98 PolarHBondContact OG-NH2 3.03Å
48	T	39.6	Very low	47.1	Very low	79 Å²	79	133.8 Å²	133.8	49%	0.485	73%	0.726	S	S	.	*			trans	-81.7	88	164.8	39.6	0	0	0	0	107.9	P46 L50	P46-T48 PolarHBondContact O-N 3.43Å; P46-T48 VanDerWaalsContact O-N 3.17Å; T48-L50 PolarHBondContact O-N 2.96Å
49	S	39.6	Very low	49.6	Very low	101 Å²	101	131.8 Å²	131.8	71%	0.706	73%	0.726	S	S	*	*			trans	-67	95.5	157.4	175.7	0	0	0	0	106	S47 R51	S47-S49 VanDerWaalsContact C-N 3.33Å; S47-S49 PolarHBondContact O-N 3.32Å; S47-S49 VanDerWaalsContact O-N 3.13Å; S49-R51 VanDerWaalsContact C-N 3.35Å; S49-R51 PolarHBondContact O-N 3.29Å
50	L	47.8	Very low	52.2	Low	134 Å²	134	130.3 Å²	130.3	70%	0.702	73%	0.733	S	S	*	*			trans	-60	103.2	167.3	-79.5	159.5	0	0	0	106.3	T48 Q52	T48-L50 PolarHBondContact O-N 2.96Å; L50-Q52 PolarHBondContact O-N 3.02Å
51	R	49.6	Very low	55	Low	233 Å²	233	125.8 Å²	125.8	88%	0.879	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-53.4	116.7	170.7	-78.3	-173.8	178.7	-164.1	0.2	106.8	S49	S49-R51 VanDerWaalsContact C-N 3.35Å; S49-R51 PolarHBondContact O-N 3.29Å
52	Q	58.4	Low	58	Low	178 Å²	178	120.5 Å²	120.5	83%	0.832	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-62.4	127.9	175.6	-70.9	-173.8	-17	0	0	108	L50	L50-Q52 PolarHBondContact O-N 3.02Å
53	P	60.3	Low	60.8	Low	121 Å²	121	118.5 Å²	118.5	79%	0.786	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-63.7	152.5	177.1	25.9	-32.3	0	0	0	110.1	C55	P53-C55 PolarHBondContact O-N 3.48Å
54	N	72.3	Confident	63.7	Low	160 Å²	160	111 Å²	111	86%	0.856	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-55.9	126.1	173.9	-71	-13.9	0	0	0	109.7
55	C	80.4	Confident	66.6	Low	126 Å²	126	113.4 Å²	113.4	85%	0.851	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-78.2	140.9	173.7	60.3	0	0	0	0	110.2	P53	P53-C55 PolarHBondContact O-N 3.48Å
56	T	79.1	Confident	69.2	Low	107 Å²	107	115.7 Å²	115.7	66%	0.656	69%	0.689	S	S	*	*			trans	-129.3	129.8	172.3	53	0	0	0	0	108.7
57	C	80.8	Confident	71.9	Confident	106 Å²	106	115.8 Å²	115.8	72%	0.716	68%	0.684	S	S	*	*			trans	-85.6	123.9	167.5	-66	0	0	0	0	107.2	V62	C57-V62 HydrophobicContact CB-CG1 3.9Å; C57-V62 HydrophobicContact CB-CG2 4.04Å
58	Q	82.2	Confident	74.5	Confident	175 Å²	175	118.7 Å²	118.7	82%	0.818	69%	0.69	S	S	*	*			trans	-107.7	148	179.3	-62.5	-176.7	-5.5	0	0	110.2
59	G	81	Confident	77	Confident	62 Å²	62	117.6 Å²	117.6	64%	0.639	68%	0.681	S	S	*	*	S	Bend	trans	121.5	165.2	176.1	0	0	0	0	0	114.4	V62	G59-V62 VanDerWaalsContact O-CG2 3.3Å; G59-V62 WeakPolarHBondContact O-CG2 3.46Å
60	G	82.1	Confident	79.5	Confident	89 Å²	89	116 Å²	116	92%	0.918	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	142.3	174	0	0	0	0	0	111.7
61	G	84.5	Confident	81.6	Confident	79 Å²	79	119.3 Å²	119.3	81%	0.814	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.2	5.9	179.7	0	0	0	0	0	115.6	L63	G61-L63 PolarHBondContact O-N 3Å
62	V	88.2	Confident	83.7	Confident	66 Å²	66	114.6 Å²	114.6	40%	0.4	67%	0.669	S	S	.	*			trans	-67.7	121.9	173.1	173.1	0	0	0	0	110.2	C57 G59	C57-V62 HydrophobicContact CB-CG1 3.9Å; C57-V62 HydrophobicContact CB-CG2 4.04Å; G59-V62 VanDerWaalsContact O-CG2 3.3Å; G59-V62 WeakPolarHBondContact O-CG2 3.46Å
63	L	88.5	Confident	85.2	Confident	122 Å²	122	111.9 Å²	111.9	64%	0.639	65%	0.651	S	S	*	*			trans	-95.1	121.9	172.7	-64.9	175.3	0	0	0	110.4	G61 L65	G61-L63 PolarHBondContact O-N 3Å; L63-L65 PolarHBondContact O-N 3.26Å
64	V	88.6	Confident	86.7	Confident	66 Å²	66	109.9 Å²	109.9	40%	0.4	63%	0.628	S	S	.	*			trans	-85.9	94.9	174.5	178.7	0	0	0	0	108.3	K66 D67 H68	V64-K66 HydrophobicContact CG1-CD 4.14Å; V64-K66 VanDerWaalsContact CG1-CE 3.46Å; V64-K66 HydrophobicContact CG1-CG 3.53Å; V64-K66 PolarHBondContact O-N 3.29Å; V64-D67 WeakPolarHBondContact CB-OD2 3.46Å; V64-D67 VanDerWaalsContact CG1-OD2 3.26Å; V64-D67 WeakPolarHBondContact CG1-OD2 3.39Å; V64-D67 WeakPolarHBondContact O-CB 3.27Å; V64-D67 PolarHBondContact O-N 3.32Å; V64-H68 PolarHBondContact O-CD2 2.87Å
65	L	90.9	Very high	87.7	Confident	135 Å²	135	108.2 Å²	108.2	71%	0.707	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-54.1	-32.4	-168	-61	-179.4	0	0	0	115	L63 D67 H68	L63-L65 PolarHBondContact O-N 3.26Å; L65-D67 PolarHBondContact O-N 2.89Å; L65-H68 PolarHBondContact O-N 3.28Å
66	K	89.3	Confident	88.3	Confident	117 Å²	117	106.3 Å²	106.3	51%	0.509	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-61.6	-29.4	177.6	57.4	162.9	-169.5	175.3	0	113	V64 H68 L69 Y74	V64-K66 HydrophobicContact CG1-CD 4.14Å; V64-K66 VanDerWaalsContact CG1-CE 3.46Å; V64-K66 HydrophobicContact CG1-CG 3.53Å; V64-K66 PolarHBondContact O-N 3.29Å; K66-H68 PolarHBondContact O-N 3.4Å; K66-L69 PolarHBondContact O-N 2.95Å; K66-Y74 HydrophobicContact CB-CE2 4.14Å
67	D	90.1	Very high	89	Confident	112 Å²	112	102.7 Å²	102.7	60%	0.599	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-78.9	-10.5	-176.5	-57.9	-21.5	0	0	0	111.7	V64 L65	V64-D67 WeakPolarHBondContact CB-OD2 3.46Å; V64-D67 VanDerWaalsContact CG1-OD2 3.26Å; V64-D67 WeakPolarHBondContact CG1-OD2 3.39Å; V64-D67 WeakPolarHBondContact O-CB 3.27Å; V64-D67 PolarHBondContact O-N 3.32Å; L65-D67 PolarHBondContact O-N 2.89Å
68	H	91.7	Very high	89.6	Confident	125 Å²	125	100.4 Å²	100.4	58%	0.579	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-101.5	3.9	177.9	-62.6	-83.2	0	0	0	113.4	V64 L65 K66	V64-H68 PolarHBondContact O-CD2 2.87Å; L65-H68 PolarHBondContact O-N 3.28Å; K66-H68 PolarHBondContact O-N 3.4Å
69	L	92	Very high	90.2	Very high	56 Å²	56	99.6 Å²	99.6	29%	0.293	55%	0.554	S	S	.	*	S	Bend	trans	-79.9	144.7	178.1	-63.8	179.9	0	0	0	111.1	K66 K71 Y74 I77	K66-L69 PolarHBondContact O-N 2.95Å; L69-K71 PolarHBondContact O-N 2.99Å; L69-Y74 HydrophobicContact CB-CD2 3.97Å; L69-Y74 HydrophobicContact CD1-CD2 3.92Å; L69-Y74 HydrophobicContact CD1-CE2 3.99Å; L69-I77 HydrophobicContact CD1-CG2 4.16Å; L69-I77 HydrophobicContact CD2-CD1 4.49Å; L69-I77 HydrophobicContact CD2-CG2 4.45Å
70	P	92.6	Very high	90.8	Very high	68 Å²	68	98.2 Å²	98.2	44%	0.442	53%	0.529	S	S	.	.			trans	-58.1	125.9	171.5	-21.7	32.5	0	0	0	111	D72 R73 Y74	P70-D72 VanDerWaalsContact C-N 3.3Å; P70-D72 VanDerWaalsContact CB-OD1 3.23Å; P70-D72 WeakPolarHBondContact CB-OD1 3.48Å; P70-D72 PolarHBondContact O-N 2.93Å; P70-R73 HydrophobicContact CB-CB 4.49Å; P70-R73 CarbonylContact O-C 3.52Å; P70-R73 PolarHBondContact O-N 2.8Å; P70-R73 VanDerWaalsContact O-N 3.12Å; P70-Y74 PolarHBondContact O-N 3.25Å; P70-Y74 VanDerWaalsContact O-N 3.08Å
71	K	92.1	Very high	91.4	Very high	202 Å²	202	102.3 Å²	102.3	88%	0.878	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-62.3	-36.6	-172.7	-68.5	-175.8	179.1	179.4	0	112.9	L69 R73	L69-K71 PolarHBondContact O-N 2.99Å; K71-R73 PolarHBondContact O-N 2.78Å
72	D	93.4	Very high	91.9	Very high	135 Å²	135	101.5 Å²	101.5	72%	0.722	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-66.6	-22.2	178.4	62.4	-48	0	0	0	113.4	P70	P70-D72 VanDerWaalsContact C-N 3.3Å; P70-D72 VanDerWaalsContact CB-OD1 3.23Å; P70-D72 WeakPolarHBondContact CB-OD1 3.48Å; P70-D72 PolarHBondContact O-N 2.93Å
73	R	88.8	Confident	92.3	Very high	121 Å²	121	101.8 Å²	101.8	46%	0.457	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-116	5.9	-178.6	-67.7	-178.1	58.7	178	-2.6	113.9	P70 K71 D76 I77	P70-R73 HydrophobicContact CB-CB 4.49Å; P70-R73 CarbonylContact O-C 3.52Å; P70-R73 PolarHBondContact O-N 2.8Å; P70-R73 VanDerWaalsContact O-N 3.12Å; K71-R73 PolarHBondContact O-N 2.78Å; R73-D76 PolarHBondContact O-N 2.8Å; R73-I77 HydrophobicContact CB-CD1 3.99Å; R73-I77 HydrophobicContact CB-CG1 4.42Å; R73-I77 VanDerWaalsContact O-CG1 3.28Å; R73-I77 WeakPolarHBondContact O-CG1 3.46Å; R73-I77 PolarHBondContact O-N 2.9Å
74	Y	92.8	Very high	92.6	Very high	78 Å²	78	96.5 Å²	96.5	31%	0.306	47%	0.471	S	S	.	.	H	α-helix	trans	-58.3	-57	-170.7	-179.9	-89.3	0	0	0	112.3	K66 L69 P70 D76 I77 V78	K66-Y74 HydrophobicContact CB-CE2 4.14Å; L69-Y74 HydrophobicContact CB-CD2 3.97Å; L69-Y74 HydrophobicContact CD1-CD2 3.92Å; L69-Y74 HydrophobicContact CD1-CE2 3.99Å; P70-Y74 PolarHBondContact O-N 3.25Å; P70-Y74 VanDerWaalsContact O-N 3.08Å; Y74-D76 VanDerWaalsContact C-N 3.28Å; Y74-D76 PolarHBondContact O-N 3.4Å; Y74-I77 PolarHBondContact O-N 2.88Å; Y74-V78 HydrophobicContact CD1-CG2 4.15Å; Y74-V78 HydrophobicContact CE1-CG2 3.75Å; Y74-V78 HydrophobicContact CE2-CG2 4.24Å; Y74-V78 WeakPolarHBondContact O-CG2 3.47Å; Y74-V78 PolarHBondContact O-N 3.01Å
75	D	93.6	Very high	92.9	Very high	126 Å²	126	98.8 Å²	98.8	67%	0.674	47%	0.474	S	S	*	.	H	α-helix	trans	-61.5	-40	-175.1	-69.5	-32.1	0	0	0	111.8	V78 K79	D75-V78 PolarHBondContact O-N 2.92Å; D75-K79 VanDerWaalsContact O-CB 3.29Å; D75-K79 WeakPolarHBondContact O-CB 3.42Å; D75-K79 PolarHBondContact O-N 2.89Å
76	D	91.9	Very high	93.2	Very high	85 Å²	85	98 Å²	98	46%	0.455	46%	0.461	S	S	.	.	H	α-helix	trans	-63.4	-45.5	177.1	-85	-6.5	0	0	0	112.5	R73 Y74 R80	R73-D76 PolarHBondContact O-N 2.8Å; Y74-D76 VanDerWaalsContact C-N 3.28Å; Y74-D76 PolarHBondContact O-N 3.4Å; D76-R80 WeakPolarHBondContact O-CG 3.49Å; D76-R80 PolarHBondContact O-N 3.02Å; D76-R80 PolarHBondContact O-NH1 3.04Å
77	I	93.3	Very high	93.4	Very high	32 Å²	32	93.6 Å²	93.6	16%	0.164	44%	0.442	C	S	.	.	H	α-helix	trans	-64.1	-45.6	176.3	-70	167.3	0	0	0	110.2	L69 R73 Y74 K79 R80 R81	L69-I77 HydrophobicContact CD1-CG2 4.16Å; L69-I77 HydrophobicContact CD2-CD1 4.49Å; L69-I77 HydrophobicContact CD2-CG2 4.45Å; R73-I77 HydrophobicContact CB-CD1 3.99Å; R73-I77 HydrophobicContact CB-CG1 4.42Å; R73-I77 VanDerWaalsContact O-CG1 3.28Å; R73-I77 WeakPolarHBondContact O-CG1 3.46Å; R73-I77 PolarHBondContact O-N 2.9Å; Y74-I77 PolarHBondContact O-N 2.88Å; I77-K79 VanDerWaalsContact C-N 3.35Å; I77-K79 PolarHBondContact O-N 3.24Å; I77-R80 PolarHBondContact O-N 2.82Å; I77-R81 WeakPolarHBondContact O-CB 2.99Å; I77-R81 PolarHBondContact O-N 2.95Å
78	V	94.4	Very high	93.6	Very high	57 Å²	57	89.6 Å²	89.6	35%	0.345	42%	0.42	S	S	.	.	H	α-helix	trans	-61.8	-44.2	-180	170.7	0	0	0	0	110.9	Y74 D75 R81 A82	Y74-V78 HydrophobicContact CD1-CG2 4.15Å; Y74-V78 HydrophobicContact CE1-CG2 3.75Å; Y74-V78 HydrophobicContact CE2-CG2 4.24Å; Y74-V78 WeakPolarHBondContact O-CG2 3.47Å; Y74-V78 PolarHBondContact O-N 3.01Å; D75-V78 PolarHBondContact O-N 2.92Å; V78-R81 PolarHBondContact O-N 3.39Å; V78-A82 WeakPolarHBondContact O-CB 3.36Å; V78-A82 PolarHBondContact O-N 2.75Å
79	K	94.1	Very high	93.6	Very high	158 Å²	158	88.6 Å²	88.6	69%	0.687	42%	0.415	S	S	*	.	H	α-helix	trans	-62.2	-50.5	177.2	-175.8	-179.6	178.1	-176.8	0	111.9	D75 I77 A82 E83	D75-K79 VanDerWaalsContact O-CB 3.29Å; D75-K79 WeakPolarHBondContact O-CB 3.42Å; D75-K79 PolarHBondContact O-N 2.89Å; I77-K79 VanDerWaalsContact C-N 3.35Å; I77-K79 PolarHBondContact O-N 3.24Å; K79-A82 PolarHBondContact O-N 3.44Å; K79-E83 PolarHBondContact O-N 2.9Å; K79-E83 VanDerWaalsContact O-N 3.09Å
80	R	93.9	Very high	93.5	Very high	33 Å²	33	88.8 Å²	88.8	13%	0.125	42%	0.416	C	S	.	.	H	α-helix	trans	-63.8	-41.5	178.6	-70.7	-164	-54.1	-76.6	-7.5	111.9	D76 I77 A82 E83 E84 D224	D76-R80 WeakPolarHBondContact O-CG 3.49Å; D76-R80 PolarHBondContact O-N 3.02Å; D76-R80 PolarHBondContact O-NH1 3.04Å; I77-R80 PolarHBondContact O-N 2.82Å; R80-A82 VanDerWaalsContact C-N 3.34Å; R80-A82 PolarHBondContact O-N 3.08Å; R80-E83 PolarHBondContact O-N 2.84Å; R80-E84 WeakPolarHBondContact O-CB 3.35Å; R80-E84 WeakPolarHBondContact O-CG 3.5Å; R80-E84 PolarHBondContact O-N 2.91Å; R80-D224 IonicContact CZ-OD1 3.84Å; R80-D224 IonicContact CZ-OD2 2.87Å; R80-D224 IonicContact NE-OD1 3.13Å; R80-D224 PolarHBondContact NE-OD1 3.12Å; R80-D224 IonicContact NE-OD2 3.49Å; R80-D224 IonicContact NH2-OD1 3.64Å; R80-D224 PolarHBondContact NH2-OD1 3.26Å; R80-D224 IonicContact NH2-OD2 2.79Å; R80-D224 PolarHBondContact NH2-OD2 3.41Å
81	R	95.3	Very high	93.4	Very high	176 Å²	176	88.3 Å²	88.3	66%	0.664	41%	0.405	S	S	*	.	H	α-helix	trans	-58.3	-45.3	175.4	177.4	-179.7	175.1	-117.2	-1.7	111.8	I77 V78 Y85 L222	I77-R81 WeakPolarHBondContact O-CB 2.99Å; I77-R81 PolarHBondContact O-N 2.95Å; V78-R81 PolarHBondContact O-N 3.39Å; R81-Y85 VanDerWaalsContact O-CB 3.28Å; R81-Y85 WeakPolarHBondContact O-CB 3.49Å; R81-Y85 PolarHBondContact O-N 2.72Å; R81-L222 HydrophobicContact CG-CD1 4.37Å
82	A	95.4	Very high	93.2	Very high	61 Å²	61	82 Å²	82	50%	0.504	38%	0.383	S	S	.	.	H	α-helix	trans	-63.4	-43.8	179	0	0	0	0	0	111.6	V78 K79 R80 Y85 R86	V78-A82 WeakPolarHBondContact O-CB 3.36Å; V78-A82 PolarHBondContact O-N 2.75Å; K79-A82 PolarHBondContact O-N 3.44Å; R80-A82 VanDerWaalsContact C-N 3.34Å; R80-A82 PolarHBondContact O-N 3.08Å; A82-Y85 PolarHBondContact O-N 2.8Å; A82-R86 PolarHBondContact O-N 2.87Å
83	E	95.1	Very high	92.8	Very high	73 Å²	73	78 Å²	78	34%	0.341	37%	0.366	S	S	.	.	H	α-helix	trans	-66.9	-43.6	178.9	179.3	56.4	-165.5	0	0	112.5	K79 R80 Y85 R86 K87	K79-E83 PolarHBondContact O-N 2.9Å; K79-E83 VanDerWaalsContact O-N 3.09Å; R80-E83 PolarHBondContact O-N 2.84Å; E83-Y85 VanDerWaalsContact C-N 3.32Å; E83-Y85 PolarHBondContact O-N 2.88Å; E83-R86 WeakPolarHBondContact O-CB 3.36Å; E83-R86 PolarHBondContact O-N 3.42Å; E83-R86 IonicContact OE1-CZ 2.74Å; E83-R86 IonicContact OE1-NE 2.96Å; E83-R86 IonicContact OE1-NH2 3.58Å; E83-R86 PolarHBondContact OE1-NH2 3.04Å; E83-R86 IonicContact OE2-CZ 3.97Å; E83-R86 IonicContact OE2-NE 3.31Å; E83-R86 PolarHBondContact OE2-NE 2.92Å; E83-R86 IonicContact OE2-NH2 2.7Å; E83-K87 WeakPolarHBondContact O-CG 3.39Å; E83-K87 PolarHBondContact O-N 2.88Å; E83-K87 WeakPolarHBondContact OE1-CE 3.14Å; E83-K87 IonicContact OE1-NZ 2.65Å
84	E	96.2	Very high	92.4	Very high	11 Å²	11	74.8 Å²	74.8	5%	0.051	36%	0.362	C	S	.	.	H	α-helix	trans	-65.4	-36.4	175.9	-72.4	-59.8	115.6	0	0	112.2	R80 K87 H88 I225 K304	R80-E84 WeakPolarHBondContact O-CB 3.35Å; R80-E84 WeakPolarHBondContact O-CG 3.5Å; R80-E84 PolarHBondContact O-N 2.91Å; E84-K87 PolarHBondContact O-N 3.47Å; E84-K87 IonicContact OE1-NZ 2.59Å; E84-K87 PolarHBondContact OE1-NZ 3.25Å; E84-H88 WeakPolarHBondContact O-CB 3.44Å; E84-H88 PolarHBondContact O-N 3.42Å; E84-I225 WeakPolarHBondContact OE1-CD1 3.43Å; E84-K304 IonicContact OE1-NZ 2.77Å; E84-K304 PolarHBondContact OE1-NZ 2.75Å; E84-K304 VanDerWaalsContact OE2-CE 3.3Å; E84-K304 WeakPolarHBondContact OE2-CE 3.23Å; E84-K304 IonicContact OE2-NZ 3.68Å; E84-K304 PolarHBondContact OE2-NZ 3.11Å
85	Y	95.4	Very high	91.9	Very high	114 Å²	114	75.9 Å²	75.9	45%	0.447	38%	0.381	S	S	.	.	H	α-helix	trans	-66.1	-39.2	173.3	-173.6	-112.8	0	0	0	112.2	R81 A82 E83 K87 H88 H89 P220 L222	R81-Y85 VanDerWaalsContact O-CB 3.28Å; R81-Y85 WeakPolarHBondContact O-CB 3.49Å; R81-Y85 PolarHBondContact O-N 2.72Å; A82-Y85 PolarHBondContact O-N 2.8Å; E83-Y85 VanDerWaalsContact C-N 3.32Å; E83-Y85 PolarHBondContact O-N 2.88Å; Y85-K87 PolarHBondContact O-N 2.97Å; Y85-H88 WeakPolarHBondContact O-CB 3.44Å; Y85-H88 PolarHBondContact O-N 3.42Å; Y85-H89 WeakPolarHBondContact O-CB 3.32Å; Y85-H89 PolarHBondContact O-N 3.37Å; Y85-P220 HydrophobicContact CD2-CB 4.27Å; Y85-P220 HydrophobicContact CD2-CG 4.32Å; Y85-P220 HydrophobicContact CE2-CB 4.08Å; Y85-P220 HydrophobicContact CE2-CG 3.95Å; Y85-L222 HydrophobicContact CD2-CD1 4.27Å; Y85-L222 HydrophobicContact CD2-CD2 4.42Å
86	R	95.3	Very high	91.4	Very high	119 Å²	119	74.9 Å²	74.9	45%	0.449	38%	0.375	S	S	.	.	H	α-helix	trans	-59.4	-46.6	174.6	-172.5	-169.2	69.1	78.4	1.8	111.3	A82 E83 H89 I90	A82-R86 PolarHBondContact O-N 2.87Å; E83-R86 WeakPolarHBondContact O-CB 3.36Å; E83-R86 PolarHBondContact O-N 3.42Å; E83-R86 IonicContact OE1-CZ 2.74Å; E83-R86 IonicContact OE1-NE 2.96Å; E83-R86 IonicContact OE1-NH2 3.58Å; E83-R86 PolarHBondContact OE1-NH2 3.04Å; E83-R86 IonicContact OE2-CZ 3.97Å; E83-R86 IonicContact OE2-NE 3.31Å; E83-R86 PolarHBondContact OE2-NE 2.92Å; E83-R86 IonicContact OE2-NH2 2.7Å; R86-H89 WeakPolarHBondContact O-CB 3.45Å; R86-H89 PolarHBondContact O-N 3.22Å; R86-I90 WeakPolarHBondContact O-CG1 3.4Å; R86-I90 PolarHBondContact O-N 3.3Å
87	K	94.8	Very high	91	Very high	24 Å²	24	74.9 Å²	74.9	10%	0.104	38%	0.376	C	S	.	.	H	α-helix	trans	-63.7	-42.7	175.9	-67.4	174.8	-167.2	158.6	0	112.1	E83 E84 Y85 H89 I90 R91 E329 P332	E83-K87 WeakPolarHBondContact O-CG 3.39Å; E83-K87 PolarHBondContact O-N 2.88Å; E83-K87 WeakPolarHBondContact OE1-CE 3.14Å; E83-K87 IonicContact OE1-NZ 2.65Å; E84-K87 PolarHBondContact O-N 3.47Å; E84-K87 IonicContact OE1-NZ 2.59Å; E84-K87 PolarHBondContact OE1-NZ 3.25Å; Y85-K87 PolarHBondContact O-N 2.97Å; K87-H89 VanDerWaalsContact C-N 3.28Å; K87-H89 PolarHBondContact O-N 2.81Å; K87-I90 PolarHBondContact O-N 3.26Å; K87-R91 PolarHBondContact O-N 3.03Å; K87-R91 VanDerWaalsContact O-N 3.08Å; K87-E329 IonicContact NZ-OE2 3.07Å; K87-E329 PolarHBondContact NZ-OE2 3.05Å; K87-P332 HydrophobicContact CB-CB 4.1Å; K87-P332 HydrophobicContact CB-CG 4.31Å; K87-P332 HydrophobicContact CG-CB 4.45Å; K87-P332 HydrophobicContact CG-CG 4.13Å
88	H	93.8	Very high	90.7	Very high	28 Å²	28	79.5 Å²	79.5	13%	0.13	39%	0.391	C	S	.	.	H	α-helix	trans	-58.8	-41.3	174.3	-179.6	97.4	0	0	0	111.6	E84 Y85 R91 T92 L222	E84-H88 WeakPolarHBondContact O-CB 3.44Å; E84-H88 PolarHBondContact O-N 3.42Å; Y85-H88 WeakPolarHBondContact O-CB 3.44Å; Y85-H88 PolarHBondContact O-N 3.42Å; H88-R91 PolarHBondContact O-N 3.49Å; H88-T92 WeakPolarHBondContact O-CB 3.37Å; H88-T92 WeakPolarHBondContact O-CG2 3.46Å; H88-T92 PolarHBondContact O-N 3.33Å; H88-T92 PolarHBondContact O-OG1 2.92Å; H88-L222 HydrophobicContact CB-CD2 3.67Å
89	H	91.3	Very high	90.5	Very high	104 Å²	104	78 Å²	78	48%	0.481	38%	0.381	S	S	.	.	H	α-helix	trans	-63.2	-49.2	177.2	-168.5	69.6	0	0	0	110.9	Y85 R86 K87 R91 T92 S93	Y85-H89 WeakPolarHBondContact O-CB 3.32Å; Y85-H89 PolarHBondContact O-N 3.37Å; R86-H89 WeakPolarHBondContact O-CB 3.45Å; R86-H89 PolarHBondContact O-N 3.22Å; K87-H89 VanDerWaalsContact C-N 3.28Å; K87-H89 PolarHBondContact O-N 2.81Å; H89-R91 VanDerWaalsContact C-N 3.26Å; H89-R91 PolarHBondContact O-N 3.17Å; H89-T92 PolarHBondContact O-N 3.39Å; H89-T92 VanDerWaalsContact O-N 3.08Å; H89-T92 PolarHBondContact O-OG1 2.97Å; H89-S93 WeakPolarHBondContact O-CA 3.27Å; H89-S93 WeakPolarHBondContact O-CB 3.47Å; H89-S93 PolarHBondContact O-N 2.96Å; H89-S93 PolarHBondContact O-OG 3.03Å
90	I	91.3	Very high	90.4	Very high	59 Å²	59	72.8 Å²	72.8	30%	0.303	36%	0.36	S	S	.	.	H	α-helix	trans	-52.8	-46.1	176.5	-69.1	166.6	0	0	0	111.2	R86 K87 T92 S93 P332 E333	R86-I90 WeakPolarHBondContact O-CG1 3.4Å; R86-I90 PolarHBondContact O-N 3.3Å; K87-I90 PolarHBondContact O-N 3.26Å; I90-T92 VanDerWaalsContact C-N 3.35Å; I90-T92 PolarHBondContact O-N 3.43Å; I90-S93 PolarHBondContact O-OG 2.81Å; I90-P332 HydrophobicContact CB-CB 4.38Å; I90-P332 HydrophobicContact CD1-CG 4.44Å; I90-P332 HydrophobicContact CG2-CB 4.17Å; I90-P332 HydrophobicContact CG2-CG 4.35Å; I90-E333 HydrophobicContact CG2-CG 4.42Å
91	R	90.3	Very high	90.4	Very high	58 Å²	58	73 Å²	73	22%	0.219	36%	0.364	C	S	.	.	H	α-helix	trans	-65.2	-34.6	-179.9	-174.5	-179.9	74.6	149.5	-5.2	113.9	K87 H88 H89 D335 R394 D396	K87-R91 PolarHBondContact O-N 3.03Å; K87-R91 VanDerWaalsContact O-N 3.08Å; H88-R91 PolarHBondContact O-N 3.49Å; H89-R91 VanDerWaalsContact C-N 3.26Å; H89-R91 PolarHBondContact O-N 3.17Å; R91-D335 IonicContact NH1-OD1 3.86Å; R91-R394 VanDerWaalsContact NH1-CD 3.29Å; R91-D396 IonicContact CZ-OD2 3.5Å; R91-D396 IonicContact NH1-OD1 3.15Å; R91-D396 IonicContact NH1-OD2 2.89Å; R91-D396 PolarHBondContact NH1-OD2 3.38Å; R91-D396 VanDerWaalsContact NH1-OD2 3.13Å; R91-D396 IonicContact NH2-OD2 3.28Å; R91-D396 PolarHBondContact NH2-OD2 2.9Å
92	T	87.4	Confident	90.3	Very high	69 Å²	69	65 Å²	65	42%	0.423	33%	0.334	S	S	.	.	H	α-helix	trans	-102.3	-16.5	-171.2	54.5	0	0	0	0	113.1	H88 H89 I90	H88-T92 WeakPolarHBondContact O-CB 3.37Å; H88-T92 WeakPolarHBondContact O-CG2 3.46Å; H88-T92 PolarHBondContact O-N 3.33Å; H88-T92 PolarHBondContact O-OG1 2.92Å; H89-T92 PolarHBondContact O-N 3.39Å; H89-T92 VanDerWaalsContact O-N 3.08Å; H89-T92 PolarHBondContact O-OG1 2.97Å; I90-T92 VanDerWaalsContact C-N 3.35Å; I90-T92 PolarHBondContact O-N 3.43Å
93	S	84.3	Confident	89.8	Confident	52 Å²	52	64.9 Å²	64.9	36%	0.364	33%	0.329	S	S	.	.			trans	-80.7	123.9	178.3	66.2	0	0	0	0	110.4	H89 I90	H89-S93 WeakPolarHBondContact O-CA 3.27Å; H89-S93 WeakPolarHBondContact O-CB 3.47Å; H89-S93 PolarHBondContact O-N 2.96Å; H89-S93 PolarHBondContact O-OG 3.03Å; I90-S93 PolarHBondContact O-OG 2.81Å
94	S	81.4	Confident	88.9	Confident	53 Å²	53	63.5 Å²	63.5	37%	0.371	33%	0.327	S	S	.	.			trans	-99.6	144.2	166.3	-177.6	0	0	0	0	110	L96 N97	S94-L96 PolarHBondContact O-N 2.91Å; S94-L96 VanDerWaalsContact O-N 3.17Å; S94-L96 WeakPolarHBondContact OG-CB 3.1Å; S94-L96 PolarHBondContact OG-N 2.97Å; S94-L96 VanDerWaalsContact OG-N 3.13Å; S94-N97 WeakPolarHBondContact O-CB 3.38Å; S94-N97 PolarHBondContact O-N 2.83Å
95	S	82.3	Confident	88	Confident	101 Å²	101	70.2 Å²	70.2	71%	0.706	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-57.1	-24.8	166.5	56.6	0	0	0	0	112	N97 R98	S95-N97 PolarHBondContact O-N 2.84Å; S95-R98 VanDerWaalsContact O-CB 3.3Å; S95-R98 WeakPolarHBondContact O-CB 3.38Å; S95-R98 PolarHBondContact O-N 2.75Å
96	L	82.5	Confident	87.2	Confident	105 Å²	105	67.7 Å²	67.7	55%	0.55	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-67.7	-20.1	175.2	-59.8	179.1	0	0	0	113.4	S94 R98 Q113	S94-L96 PolarHBondContact O-N 2.91Å; S94-L96 VanDerWaalsContact O-N 3.17Å; S94-L96 WeakPolarHBondContact OG-CB 3.1Å; S94-L96 PolarHBondContact OG-N 2.97Å; S94-L96 VanDerWaalsContact OG-N 3.13Å; L96-R98 VanDerWaalsContact C-N 3.26Å; L96-R98 PolarHBondContact O-N 2.89Å; L96-Q113 VanDerWaalsContact O-CG 3.31Å; L96-Q113 WeakPolarHBondContact O-CG 3.36Å; L96-Q113 PolarHBondContact O-NE2 2.96Å; L96-Q113 VanDerWaalsContact O-NE2 3.15Å
97	N	82.9	Confident	87.1	Confident	86 Å²	86	62.8 Å²	62.8	46%	0.46	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-80.5	-8.9	176.9	-61.1	-15.6	0	0	0	112.3	S94 S95 L99	S94-N97 WeakPolarHBondContact O-CB 3.38Å; S94-N97 PolarHBondContact O-N 2.83Å; S95-N97 PolarHBondContact O-N 2.84Å; N97-L99 PolarHBondContact O-N 3.09Å
98	R	87.1	Confident	87.1	Confident	128 Å²	128	61.7 Å²	61.7	48%	0.483	34%	0.339	S	S	.	.	S	Bend	trans	-70.3	129.1	178.9	-177	172	170.3	-175.1	-12.5	110	S47 S95 L96 I100	S47-R98 VanDerWaalsContact CB-NH2 3.27Å; S47-R98 PolarHBondContact OG-NE 2.82Å; S47-R98 VanDerWaalsContact OG-NE 3.11Å; S47-R98 PolarHBondContact OG-NH2 3.03Å; S95-R98 VanDerWaalsContact O-CB 3.3Å; S95-R98 WeakPolarHBondContact O-CB 3.38Å; S95-R98 PolarHBondContact O-N 2.75Å; L96-R98 VanDerWaalsContact C-N 3.26Å; L96-R98 PolarHBondContact O-N 2.89Å; R98-I100 PolarHBondContact O-N 2.94Å
99	L	90.8	Very high	87.2	Confident	26 Å²	26	62.5 Å²	62.5	14%	0.136	34%	0.343	C	S	.	.			trans	-64.4	123.1	174.2	-179.7	65.4	0	0	0	110.1	N97 L101 P111 Q113 P126	N97-L99 PolarHBondContact O-N 3.09Å; L99-L101 HydrophobicContact CD1-CD2 4.11Å; L99-L101 HydrophobicContact CD2-CD2 4.48Å; L99-L101 HydrophobicContact CG-CD2 4.26Å; L99-P111 HydrophobicContact CD1-CB 3.91Å; L99-Q113 WeakPolarHBondContact CA-O 3.36Å; L99-P126 HydrophobicContact CD1-CB 4.39Å; L99-P126 HydrophobicContact CD1-CG 3.66Å; L99-P126 HydrophobicContact CD2-CB 3.79Å; L99-P126 HydrophobicContact CD2-CG 3.91Å; L99-P126 HydrophobicContact CG-CG 4.46Å
100	I	92.8	Very high	87.4	Confident	49 Å²	49	59.7 Å²	59.7	25%	0.251	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	128	175.6	-59.5	177.5	0	0	0	107.8	L45 R98 P111 I112 Q113	L45-I100 HydrophobicContact CD1-CG2 3.42Å; L45-I100 VanDerWaalsContact CD1-CG2 3.42Å; R98-I100 PolarHBondContact O-N 2.94Å; I100-P111 CarbonylContact O-C 3.49Å; I100-I112 PolarHBondContact O-N 3.12Å; I100-Q113 HydrophobicContact CB-CB 4.26Å; I100-Q113 HydrophobicContact CD1-CB 4.49Å; I100-Q113 PolarHBondContact N-O 2.95Å; I100-Q113 PolarHBondContact O-N 2.92Å
101	L	93.8	Very high	87.6	Confident	38 Å²	38	56.9 Å²	56.9	20%	0.199	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.1	176.8	-56.1	-179.1	0	0	0	110	L99 P103 Y110 P111	L99-L101 HydrophobicContact CD1-CD2 4.11Å; L99-L101 HydrophobicContact CD2-CD2 4.48Å; L99-L101 HydrophobicContact CG-CD2 4.26Å; L101-P103 WeakPolarHBondContact O-CD 3.32Å; L101-Y110 CarbonylContact C-O 3.48Å; L101-Y110 WeakPolarHBondContact CA-O 3.3Å; L101-P111 HydrophobicContact CD2-CB 3.85Å
102	A	92.3	Very high	87.7	Confident	6 Å²	6	57.8 Å²	57.8	5%	0.05	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	119.9	164.7	0	0	0	0	0	108.3	Q109 Y110 I112	A102-Q109 WeakPolarHBondContact O-CG 3.34Å; A102-Y110 HydrophobicContact CB-CD1 3.89Å; A102-Y110 HydrophobicContact CB-CD2 4.09Å; A102-Y110 HydrophobicContact CB-CE1 3.6Å; A102-Y110 HydrophobicContact CB-CE2 3.85Å; A102-Y110 HydrophobicContact CB-CG 4.12Å; A102-Y110 PolarHBondContact N-O 3.37Å; A102-I112 HydrophobicContact CB-CD1 3.47Å; A102-I112 VanDerWaalsContact CB-CD1 3.47Å; A102-I112 HydrophobicContact CB-CG1 3.57Å
103	P	84.1	Confident	87.9	Confident	60 Å²	60	57.2 Å²	57.2	39%	0.39	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-69.3	162	167.9	32.4	-33.4	0	0	0	109.7	L45 L101 N105	L45-P103 HydrophobicContact CD2-CB 4.47Å; L45-P103 HydrophobicContact CD2-CG 4.07Å; L101-P103 WeakPolarHBondContact O-CD 3.32Å; P103-N105 PolarHBondContact O-N 2.84Å
104	S	77.3	Confident	88.2	Confident	44 Å²	44	55.7 Å²	55.7	31%	0.308	31%	0.307	S	S	.	.	S	Bend	trans	-75.3	51.6	-172.9	-32.3	0	0	0	0	114.2	T106 H131	S104-T106 CarbonylContact C-O 3.5Å; S104-T106 WeakPolarHBondContact CA-O 3.41Å; S104-H131 PolarHBondContact OG-CD2 3.33Å; S104-H131 PolarHBondContact OG-CE1 3.47Å; S104-H131 PolarHBondContact OG-NE2 2.94Å
105	N	76.6	Confident	88.8	Confident	152 Å²	152	53.6 Å²	53.6	81%	0.813	29%	0.291	S	S	*	.	S	Bend	trans	-73.1	-18.6	168.7	-63	-12.7	0	0	0	111.3	P103	P103-N105 PolarHBondContact O-N 2.84Å
106	T	78.8	Confident	89.3	Confident	61 Å²	61	51.4 Å²	51.4	37%	0.374	27%	0.274	S	S	.	.	S	Bend	trans	-112.2	167.2	160	69.3	0	0	0	0	107.3	S104 L108	S104-T106 CarbonylContact C-O 3.5Å; S104-T106 WeakPolarHBondContact CA-O 3.41Å; T106-L108 PolarHBondContact O-N 3.36Å; T106-L108 PolarHBondContact OG1-N 2.79Å; T106-L108 PolarHBondContact OG1-O 3.29Å
107	P	93.3	Very high	89.8	Confident	16 Å²	16	46.6 Å²	46.6	10%	0.104	25%	0.248	C	C	.	.	S	Bend	trans	-62.1	-10.8	176.4	26.1	-34.8	0	0	0	113	L130 H131 A132 F203 H206	P107-L130 HydrophobicContact CB-CD1 3.98Å; P107-L130 CarbonylContact O-C 3.45Å; P107-L130 VanDerWaalsContact O-CA 3.31Å; P107-L130 WeakPolarHBondContact O-CA 3.32Å; P107-L130 WeakPolarHBondContact O-CD1 3.48Å; P107-H131 VanDerWaalsContact CA-O 3.31Å; P107-H131 WeakPolarHBondContact CA-O 3.15Å; P107-H131 WeakPolarHBondContact CB-O 3.33Å; P107-H131 PolarHBondContact O-N 3.34Å; P107-A132 HydrophobicContact CB-CB 4.4Å; P107-F203 HydrophobicContact CB-CD1 4.11Å; P107-F203 HydrophobicContact CB-CE1 4.45Å; P107-F203 HydrophobicContact CG-CD1 3.9Å; P107-F203 HydrophobicContact CG-CE1 4.49Å; P107-H206 VanDerWaalsContact CD-CD2 3.4Å; P107-H206 WeakPolarHBondContact CD-CD2 3.34Å; P107-H206 HydrophobicContact CG-CB 4.07Å
108	L	95.4	Very high	90.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	124.7	-177.3	-56.3	178.9	0	0	0	111.6	T106 Y110 L130 F201 F203 H206 A208	T106-L108 PolarHBondContact O-N 3.36Å; T106-L108 PolarHBondContact OG1-N 2.79Å; T106-L108 PolarHBondContact OG1-O 3.29Å; L108-Y110 HydrophobicContact CB-CD1 4.1Å; L108-Y110 HydrophobicContact CB-CE1 4.4Å; L108-Y110 WeakPolarHBondContact O-CD1 3.39Å; L108-L130 HydrophobicContact CD2-CD1 3.91Å; L108-F201 HydrophobicContact CB-CD1 3.88Å; L108-F201 HydrophobicContact CB-CE1 3.92Å; L108-F201 HydrophobicContact CD1-CD1 4.14Å; L108-F201 HydrophobicContact CD1-CG 4.33Å; L108-F201 WeakPolarHBondContact CD1-O 3.43Å; L108-F201 HydrophobicContact CD2-CD1 3.87Å; L108-F201 HydrophobicContact CD2-CD2 4.47Å; L108-F201 HydrophobicContact CD2-CE1 3.59Å; L108-F201 HydrophobicContact CD2-CE2 4.21Å; L108-F201 HydrophobicContact CD2-CG 4.31Å; L108-F201 HydrophobicContact CD2-CZ 3.76Å; L108-F201 HydrophobicContact CG-CD1 4.19Å; L108-F201 HydrophobicContact CG-CE1 4.25Å; L108-F203 HydrophobicContact CD2-CB 3.63Å; L108-F203 HydrophobicContact CG-CB 4.45Å; L108-H206 HydrophobicContact CD1-CB 4.24Å; L108-A208 HydrophobicContact CB-CB 4.42Å; L108-A208 HydrophobicContact CD1-CB 3.92Å
109	Q	96	Very high	90.7	Very high	45 Å²	45	38.1 Å²	38.1	21%	0.21	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	131	166.4	-165.4	-169.6	-78.5	0	0	108.5	A102 G127 L128 A129 H131	A102-Q109 WeakPolarHBondContact O-CG 3.34Å; Q109-G127 CarbonylContact C-O 3.58Å; Q109-G127 WeakPolarHBondContact CG-O 3.34Å; Q109-G127 PolarHBondContact NE2-O 2.83Å; Q109-L128 WeakPolarHBondContact O-CA 3.38Å; Q109-A129 HydrophobicContact CB-CB 3.96Å; Q109-A129 PolarHBondContact N-O 2.96Å; Q109-A129 PolarHBondContact O-N 2.79Å; Q109-A129 VanDerWaalsContact O-N 3.09Å; Q109-H131 PolarHBondContact OE1-NE2 3.21Å
110	Y	95.3	Very high	90.8	Very high	45 Å²	45	41.4 Å²	41.4	18%	0.176	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	160.5	-173.4	56.6	-87.4	0	0	0	111.7	L101 A102 L108 I112 A208 F210	L101-Y110 CarbonylContact C-O 3.48Å; L101-Y110 WeakPolarHBondContact CA-O 3.3Å; A102-Y110 HydrophobicContact CB-CD1 3.89Å; A102-Y110 HydrophobicContact CB-CD2 4.09Å; A102-Y110 HydrophobicContact CB-CE1 3.6Å; A102-Y110 HydrophobicContact CB-CE2 3.85Å; A102-Y110 HydrophobicContact CB-CG 4.12Å; A102-Y110 PolarHBondContact N-O 3.37Å; L108-Y110 HydrophobicContact CB-CD1 4.1Å; L108-Y110 HydrophobicContact CB-CE1 4.4Å; L108-Y110 WeakPolarHBondContact O-CD1 3.39Å; Y110-I112 HydrophobicContact CD2-CG1 4.24Å; Y110-I112 HydrophobicContact CE2-CG1 3.81Å; Y110-I112 PolarHBondContact O-N 3.08Å; Y110-A208 HydrophobicContact CD1-CB 3.5Å; Y110-A208 VanDerWaalsContact CD1-CB 3.5Å; Y110-A208 HydrophobicContact CD2-CB 4.31Å; Y110-A208 HydrophobicContact CE1-CB 3.21Å; Y110-A208 HydrophobicContact CE2-CB 4.06Å; Y110-A208 HydrophobicContact CG-CB 4.05Å; Y110-F210 HydrophobicContact CD2-CB 3.93Å; Y110-F210 AromaticContact CD2-CD1 3.89Å; Y110-F210 HydrophobicContact CD2-CD1 3.89Å; Y110-F210 HydrophobicContact CD2-CG 4.18Å; Y110-F210 HydrophobicContact CE2-CB 4.4Å; Y110-F210 HydrophobicContact CG-CD1 4.18Å
111	P	95.3	Very high	90.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	117.6	177	30.1	-30.9	0	0	0	110.6	L99 I100 L101 F115 I125 P126 F210	L99-P111 HydrophobicContact CD1-CB 3.91Å; I100-P111 CarbonylContact O-C 3.49Å; L101-P111 HydrophobicContact CD2-CB 3.85Å; P111-F115 HydrophobicContact CB-CB 4.13Å; P111-F115 HydrophobicContact CG-CB 4.25Å; P111-F115 HydrophobicContact CG-CD1 4.44Å; P111-I125 HydrophobicContact CG-CG2 4.14Å; P111-P126 HydrophobicContact CB-CG 4.25Å; P111-P126 WeakPolarHBondContact CD-O 3.47Å; P111-P126 HydrophobicContact CG-CG 4.43Å; P111-F210 HydrophobicContact CG-CD2 3.77Å; P111-F210 HydrophobicContact CG-CE2 3.65Å; P111-F210 HydrophobicContact CG-CG 4.44Å; P111-F210 HydrophobicContact CG-CZ 4.24Å; P111-F210 WeakPolarHBondContact O-CB 3.26Å; P111-F210 WeakPolarHBondContact O-CD2 3.44Å; P111-F210 WeakPolarHBondContact O-CG 3.34Å
112	I	92.4	Very high	90.9	Very high	77 Å²	77	47.8 Å²	47.8	40%	0.395	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-34.4	178.3	-59.5	164.5	0	0	0	110.8	I100 A102 Y110 P211	I100-I112 PolarHBondContact O-N 3.12Å; A102-I112 HydrophobicContact CB-CD1 3.47Å; A102-I112 VanDerWaalsContact CB-CD1 3.47Å; A102-I112 HydrophobicContact CB-CG1 3.57Å; Y110-I112 HydrophobicContact CD2-CG1 4.24Å; Y110-I112 HydrophobicContact CE2-CG1 3.81Å; Y110-I112 PolarHBondContact O-N 3.08Å; I112-P211 WeakPolarHBondContact O-CD 3.44Å
113	Q	91.9	Very high	90.9	Very high	58 Å²	58	49.1 Å²	49.1	27%	0.271	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	154.7	-173	-168.7	-172.1	-83.7	0	0	110.4	L96 L99 I100 F115	L96-Q113 VanDerWaalsContact O-CG 3.31Å; L96-Q113 WeakPolarHBondContact O-CG 3.36Å; L96-Q113 PolarHBondContact O-NE2 2.96Å; L96-Q113 VanDerWaalsContact O-NE2 3.15Å; L99-Q113 WeakPolarHBondContact CA-O 3.36Å; I100-Q113 HydrophobicContact CB-CB 4.26Å; I100-Q113 HydrophobicContact CD1-CB 4.49Å; I100-Q113 PolarHBondContact N-O 2.95Å; I100-Q113 PolarHBondContact O-N 2.92Å; Q113-F115 VanDerWaalsContact C-N 3.28Å; Q113-F115 PolarHBondContact O-N 3.17Å
114	G	89.8	Confident	91.4	Very high	19 Å²	19	50.2 Å²	50.2	20%	0.196	27%	0.267	C	S	.	.			trans	81.3	3.7	168.4	0	0	0	0	0	114.4	T116	G114-T116 PolarHBondContact O-N 3.13Å; G114-T116 VanDerWaalsContact O-N 3.12Å
115	F	94.2	Very high	92.3	Very high	9 Å²	9	48.2 Å²	48.2	4%	0.039	25%	0.253	C	S	.	.			trans	-77.1	98.5	169	-178.2	-138.5	0	0	0	110	P111 Q113 V117 T123 L124 I125 P126 F210 I212 V213	P111-F115 HydrophobicContact CB-CB 4.13Å; P111-F115 HydrophobicContact CG-CB 4.25Å; P111-F115 HydrophobicContact CG-CD1 4.44Å; Q113-F115 VanDerWaalsContact C-N 3.28Å; Q113-F115 PolarHBondContact O-N 3.17Å; F115-V117 HydrophobicContact CD2-CG1 4.33Å; F115-V117 HydrophobicContact CE1-CG1 4.19Å; F115-V117 HydrophobicContact CE2-CG1 3.61Å; F115-V117 HydrophobicContact CZ-CG1 3.52Å; F115-T123 HydrophobicContact CE2-CG2 4.04Å; F115-L124 WeakPolarHBondContact CE2-O 3.32Å; F115-I125 HydrophobicContact CD1-CG2 4.33Å; F115-I125 HydrophobicContact CE1-CB 4.28Å; F115-I125 HydrophobicContact CE1-CG1 3.98Å; F115-I125 HydrophobicContact CE1-CG2 3.93Å; F115-I125 HydrophobicContact CZ-CB 4.21Å; F115-I125 HydrophobicContact CZ-CG1 3.91Å; F115-I125 HydrophobicContact CZ-CG2 4.3Å; F115-P126 HydrophobicContact CB-CG 4.49Å; F115-P126 HydrophobicContact CD2-CG 3.86Å; F115-P126 VanDerWaalsContact CE2-CD 3.46Å; F115-P126 HydrophobicContact CE2-CG 4.41Å; F115-P126 HydrophobicContact CG-CG 4.28Å; F115-F210 HydrophobicContact CD1-CE2 4.39Å; F115-I212 HydrophobicContact CD1-CB 4.24Å; F115-I212 HydrophobicContact CD1-CG1 3.83Å; F115-I212 HydrophobicContact CD1-CG2 3.93Å; F115-I212 HydrophobicContact CE1-CB 4.35Å; F115-I212 HydrophobicContact CE1-CD1 4.04Å; F115-I212 HydrophobicContact CE1-CG1 3.85Å; F115-I212 HydrophobicContact CE1-CG2 3.77Å; F115-V213 PolarHBondContact O-N 3.15Å
116	T	93	Very high	93.2	Very high	56 Å²	56	42.3 Å²	42.3	34%	0.344	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.6	179.7	-53	0	0	0	0	110.3	G114 V213 Q215	G114-T116 PolarHBondContact O-N 3.13Å; G114-T116 VanDerWaalsContact O-N 3.12Å; T116-V213 CarbonylContact C-O 3.49Å; T116-V213 VanDerWaalsContact CA-O 3.25Å; T116-V213 WeakPolarHBondContact CA-O 3.47Å; T116-V213 HydrophobicContact CG2-CB 4.33Å; T116-V213 HydrophobicContact CG2-CG1 4.23Å; T116-Q215 HydrophobicContact CG2-CB 3.98Å
117	V	93.3	Very high	93.9	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	145.7	179.1	-55.4	0	0	0	0	110.7	F115 T123 Y186 I212 V213 I214 Q215	F115-V117 HydrophobicContact CD2-CG1 4.33Å; F115-V117 HydrophobicContact CE1-CG1 4.19Å; F115-V117 HydrophobicContact CE2-CG1 3.61Å; F115-V117 HydrophobicContact CZ-CG1 3.52Å; V117-T123 HydrophobicContact CG1-CG2 3.97Å; V117-Y186 HydrophobicContact CB-CD1 4.5Å; V117-Y186 HydrophobicContact CG1-CD1 4.18Å; V117-Y186 HydrophobicContact CG2-CD1 3.91Å; V117-Y186 HydrophobicContact CG2-CE1 3.85Å; V117-I212 HydrophobicContact CG1-CG2 4.04Å; V117-I212 HydrophobicContact CG2-CG2 3.92Å; V117-V213 PolarHBondContact N-O 2.95Å; V117-I214 HydrophobicContact CG2-CB 4.26Å; V117-I214 HydrophobicContact CG2-CG1 3.66Å; V117-I214 WeakPolarHBondContact O-CA 3.41Å; V117-Q215 PolarHBondContact O-N 3.25Å
118	V	93.7	Very high	94	Very high	29 Å²	29	40.2 Å²	40.2	18%	0.176	22%	0.215	C	C	.	.			trans	-78.2	138.5	171.3	177	0	0	0	0	108.5	L120 Q121	V118-L120 PolarHBondContact O-N 3.12Å; V118-Q121 HydrophobicContact CB-CB 3.88Å; V118-Q121 VanDerWaalsContact CB-OE1 3.23Å; V118-Q121 HydrophobicContact CG1-CB 4.29Å; V118-Q121 WeakPolarHBondContact O-CB 3.45Å; V118-Q121 PolarHBondContact O-N 3.46Å
119	P	95.1	Very high	94	Very high	8 Å²	8	40.8 Å²	40.8	5%	0.052	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	137	179.5	-25.5	32.4	0	0	0	112.4	Q121 S188 Y191 R192 I214	P119-Q121 PolarHBondContact O-N 3.34Å; P119-S188 WeakPolarHBondContact CA-OG 3.29Å; P119-Y191 HydrophobicContact CB-CD2 3.83Å; P119-Y191 HydrophobicContact CB-CE2 4.19Å; P119-R192 VanDerWaalsContact CG-O 3.28Å; P119-R192 WeakPolarHBondContact CG-O 3.33Å; P119-I214 HydrophobicContact CB-CG2 4.23Å; P119-I214 HydrophobicContact CG-CG2 3.84Å
120	L	93.8	Very high	94	Very high	94 Å²	94	38.7 Å²	38.7	49%	0.492	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	3	-179.3	-48.1	-179.6	0	0	0	114.8	V118 T187 S188 Y191	V118-L120 PolarHBondContact O-N 3.12Å; L120-T187 WeakPolarHBondContact O-CG2 3.46Å; L120-S188 WeakPolarHBondContact CD2-O 3.49Å; L120-S188 PolarHBondContact N-OG 3.29Å; L120-Y191 HydrophobicContact CD1-CD2 4.38Å
121	Q	93	Very high	94	Very high	106 Å²	106	40.8 Å²	40.8	50%	0.495	22%	0.221	S	C	.	.			trans	-94.2	120.6	179.7	-171.5	170.7	-3.6	0	0	110.9	V118 P119 T123	V118-Q121 HydrophobicContact CB-CB 3.88Å; V118-Q121 VanDerWaalsContact CB-OE1 3.23Å; V118-Q121 HydrophobicContact CG1-CB 4.29Å; V118-Q121 WeakPolarHBondContact O-CB 3.45Å; V118-Q121 PolarHBondContact O-N 3.46Å; P119-Q121 PolarHBondContact O-N 3.34Å; Q121-T123 PolarHBondContact O-N 2.98Å; Q121-T123 PolarHBondContact O-OG1 3.36Å
122	K	93.6	Very high	93.8	Very high	115 Å²	115	41.8 Å²	41.8	50%	0.5	23%	0.229	S	C	.	.			trans	-63.1	115.6	174.1	-171.8	172.2	-170.5	170.5	0	110.4	T185 T187	K122-T185 WeakPolarHBondContact CE-OG1 3.31Å; K122-T185 HydrophobicContact CG-CG2 4.09Å; K122-T187 WeakPolarHBondContact CA-OG1 3.28Å; K122-T187 WeakPolarHBondContact CB-OG1 3.48Å
123	T	93.8	Very high	93.7	Very high	34 Å²	34	41.3 Å²	41.3	21%	0.209	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.3	-173.5	-52.8	0	0	0	0	110.5	F115 V117 Q121 T185 Y186	F115-T123 HydrophobicContact CE2-CG2 4.04Å; V117-T123 HydrophobicContact CG1-CG2 3.97Å; Q121-T123 PolarHBondContact O-N 2.98Å; Q121-T123 PolarHBondContact O-OG1 3.36Å; T123-T185 CarbonylContact O-C 3.59Å; T123-T185 WeakPolarHBondContact O-CA 3.23Å; T123-T185 WeakPolarHBondContact O-CB 3.43Å; T123-Y186 PolarHBondContact N-O 3.41Å; T123-Y186 PolarHBondContact O-N 3.41Å
124	L	94.8	Very high	93.7	Very high	84 Å²	84	47.8 Å²	47.8	44%	0.44	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	136.1	174.8	-74.6	164.1	0	0	0	110.5	F115 P126 L184 T185	F115-L124 WeakPolarHBondContact CE2-O 3.32Å; L124-P126 WeakPolarHBondContact O-CD 3.39Å; L124-L184 WeakPolarHBondContact CA-O 3.42Å; L124-T185 HydrophobicContact CD2-CG2 3.61Å; L124-T185 HydrophobicContact CG-CG2 4.06Å
125	I	96.3	Very high	93.7	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.01	27%	0.273	C	S	.	.			trans	-82	114.2	174.1	-51.1	178.5	0	0	0	107.7	P111 F115 L128 L142 L149 L184 F210	P111-I125 HydrophobicContact CG-CG2 4.14Å; F115-I125 HydrophobicContact CD1-CG2 4.33Å; F115-I125 HydrophobicContact CE1-CB 4.28Å; F115-I125 HydrophobicContact CE1-CG1 3.98Å; F115-I125 HydrophobicContact CE1-CG2 3.93Å; F115-I125 HydrophobicContact CZ-CB 4.21Å; F115-I125 HydrophobicContact CZ-CG1 3.91Å; F115-I125 HydrophobicContact CZ-CG2 4.3Å; I125-L128 HydrophobicContact CB-CD1 3.81Å; I125-L128 HydrophobicContact CB-CG 4.27Å; I125-L128 HydrophobicContact CD1-CD1 4.19Å; I125-L128 HydrophobicContact CG2-CD1 3.69Å; I125-L128 HydrophobicContact CG2-CD2 4.27Å; I125-L128 HydrophobicContact CG2-CG 3.78Å; I125-L142 HydrophobicContact CD1-CD2 3.58Å; I125-L149 HydrophobicContact CD1-CD2 3.88Å; I125-L184 HydrophobicContact CD1-CB 4.41Å; I125-L184 PolarHBondContact N-O 3.32Å; I125-F210 HydrophobicContact CG2-CE2 4.15Å; I125-F210 HydrophobicContact CG2-CZ 4.08Å
126	P	94.8	Very high	93.5	Very high	28 Å²	28	60.3 Å²	60.3	18%	0.182	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	139.3	-172.2	30.4	-34.9	0	0	0	111.7	L99 P111 F115 L124 L128	L99-P126 HydrophobicContact CD1-CB 4.39Å; L99-P126 HydrophobicContact CD1-CG 3.66Å; L99-P126 HydrophobicContact CD2-CB 3.79Å; L99-P126 HydrophobicContact CD2-CG 3.91Å; L99-P126 HydrophobicContact CG-CG 4.46Å; P111-P126 HydrophobicContact CB-CG 4.25Å; P111-P126 WeakPolarHBondContact CD-O 3.47Å; P111-P126 HydrophobicContact CG-CG 4.43Å; F115-P126 HydrophobicContact CB-CG 4.49Å; F115-P126 HydrophobicContact CD2-CG 3.86Å; F115-P126 VanDerWaalsContact CE2-CD 3.46Å; F115-P126 HydrophobicContact CE2-CG 4.41Å; F115-P126 HydrophobicContact CG-CG 4.28Å; L124-P126 WeakPolarHBondContact O-CD 3.39Å; P126-L128 VanDerWaalsContact C-N 3.33Å; P126-L128 PolarHBondContact O-N 3.27Å
127	G	93	Very high	93.5	Very high	26 Å²	26	59.7 Å²	59.7	27%	0.268	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	13.3	163.6	0	0	0	0	0	116.3	Q109 A129	Q109-G127 CarbonylContact C-O 3.58Å; Q109-G127 WeakPolarHBondContact CG-O 3.34Å; Q109-G127 PolarHBondContact NE2-O 2.83Å; G127-A129 PolarHBondContact O-N 2.77Å
128	L	95.3	Very high	93.6	Very high	7 Å²	7	60.2 Å²	60.2	4%	0.037	31%	0.313	C	S	.	.			trans	-65.1	124.8	170.1	-68.2	178.4	0	0	0	110.6	Q109 I125 P126 L142 L181 L184 F201 F210	Q109-L128 WeakPolarHBondContact O-CA 3.38Å; I125-L128 HydrophobicContact CB-CD1 3.81Å; I125-L128 HydrophobicContact CB-CG 4.27Å; I125-L128 HydrophobicContact CD1-CD1 4.19Å; I125-L128 HydrophobicContact CG2-CD1 3.69Å; I125-L128 HydrophobicContact CG2-CD2 4.27Å; I125-L128 HydrophobicContact CG2-CG 3.78Å; P126-L128 VanDerWaalsContact C-N 3.33Å; P126-L128 PolarHBondContact O-N 3.27Å; L128-L142 HydrophobicContact CD1-CD2 3.98Å; L128-L181 HydrophobicContact CB-CB 4.12Å; L128-L184 HydrophobicContact CD1-CB 4.06Å; L128-L184 HydrophobicContact CD1-CD1 3.78Å; L128-F201 HydrophobicContact CD2-CD1 4.03Å; L128-F201 HydrophobicContact CD2-CE1 4.07Å; L128-F201 HydrophobicContact CD2-CG 4.49Å; L128-F210 HydrophobicContact CD2-CE1 4.17Å; L128-F210 HydrophobicContact CD2-CZ 4.13Å
129	A	95.9	Very high	93.7	Very high	12 Å²	12	64.2 Å²	64.2	10%	0.099	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	154.5	171.6	0	0	0	0	0	111.6	Q109 G127 N178	Q109-A129 HydrophobicContact CB-CB 3.96Å; Q109-A129 PolarHBondContact N-O 2.96Å; Q109-A129 PolarHBondContact O-N 2.79Å; Q109-A129 VanDerWaalsContact O-N 3.09Å; G127-A129 PolarHBondContact O-N 2.77Å; A129-N178 WeakPolarHBondContact CA-OD1 3.42Å
130	L	95.8	Very high	93.7	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.7	169.4	-175.4	71.9	0	0	0	109.8	P107 L108 A132 Y138 V140 L174 L177 N178 L181 F203	P107-L130 HydrophobicContact CB-CD1 3.98Å; P107-L130 CarbonylContact O-C 3.45Å; P107-L130 VanDerWaalsContact O-CA 3.31Å; P107-L130 WeakPolarHBondContact O-CA 3.32Å; P107-L130 WeakPolarHBondContact O-CD1 3.48Å; L108-L130 HydrophobicContact CD2-CD1 3.91Å; L130-A132 HydrophobicContact CD1-CB 4.3Å; L130-A132 HydrophobicContact CD2-CB 4.18Å; L130-A132 HydrophobicContact CG-CB 4.04Å; L130-Y138 HydrophobicContact CD2-CD1 3.63Å; L130-Y138 HydrophobicContact CD2-CG 4.15Å; L130-V140 HydrophobicContact CB-CG1 4.46Å; L130-V140 HydrophobicContact CD1-CG1 4.15Å; L130-V140 HydrophobicContact CD2-CG1 3.96Å; L130-V140 HydrophobicContact CG-CG1 4.43Å; L130-L174 HydrophobicContact CB-CD1 4Å; L130-L174 HydrophobicContact CD2-CD1 3.76Å; L130-L174 HydrophobicContact CG-CD1 3.96Å; L130-L177 HydrophobicContact CB-CD2 3.79Å; L130-L177 HydrophobicContact CD2-CD2 3.37Å; L130-L177 HydrophobicContact CG-CD2 4.21Å; L130-N178 PolarHBondContact N-OD1 3.46Å; L130-N178 PolarHBondContact O-ND2 2.98Å; L130-N178 PolarHBondContact O-OD1 3.34Å; L130-L181 HydrophobicContact CB-CD1 4.31Å; L130-F203 HydrophobicContact CD1-CB 3.88Å; L130-F203 HydrophobicContact CD1-CD1 3.72Å; L130-F203 HydrophobicContact CD1-CD2 3.74Å; L130-F203 HydrophobicContact CD1-CE1 4.18Å; L130-F203 HydrophobicContact CD1-CE2 4.22Å; L130-F203 HydrophobicContact CD1-CG 3.48Å; L130-F203 VanDerWaalsContact CD1-CG 3.48Å; L130-F203 HydrophobicContact CD1-CZ 4.42Å; L130-F203 HydrophobicContact CD2-CD2 3.79Å; L130-F203 HydrophobicContact CD2-CE2 3.69Å; L130-F203 HydrophobicContact CD2-CG 4.38Å; L130-F203 HydrophobicContact CD2-CZ 4.19Å; L130-F203 HydrophobicContact CG-CD2 4.47Å
131	H	94.7	Very high	93.9	Very high	90 Å²	90	60.7 Å²	60.7	42%	0.417	31%	0.31	S	S	.	.			trans	-123.9	81.3	176	-64.4	-101.9	0	0	0	108.4	S104 P107 Q109	S104-H131 PolarHBondContact OG-CD2 3.33Å; S104-H131 PolarHBondContact OG-CE1 3.47Å; S104-H131 PolarHBondContact OG-NE2 2.94Å; P107-H131 VanDerWaalsContact CA-O 3.31Å; P107-H131 WeakPolarHBondContact CA-O 3.15Å; P107-H131 WeakPolarHBondContact CB-O 3.33Å; P107-H131 PolarHBondContact O-N 3.34Å; Q109-H131 PolarHBondContact OE1-NE2 3.21Å
132	A	91.8	Very high	94.1	Very high	21 Å²	21	55.8 Å²	55.8	17%	0.174	29%	0.287	C	S	.	.			trans	-120.1	153.7	-177.1	0	0	0	0	0	111	P107 L130 Y138 F203	P107-A132 HydrophobicContact CB-CB 4.4Å; L130-A132 HydrophobicContact CD1-CB 4.3Å; L130-A132 HydrophobicContact CD2-CB 4.18Å; L130-A132 HydrophobicContact CG-CB 4.04Å; A132-Y138 HydrophobicContact CB-CD1 4.32Å; A132-Y138 HydrophobicContact CB-CE1 3.99Å; A132-F203 HydrophobicContact CB-CE1 3.91Å; A132-F203 HydrophobicContact CB-CZ 3.96Å
133	A	90.8	Very high	94.3	Very high	66 Å²	66	56.7 Å²	56.7	55%	0.545	29%	0.287	S	S	.	.			trans	-60.3	170.3	170.2	0	0	0	0	0	111.2	R135 Y138	A133-R135 PolarHBondContact O-N 3Å; A133-Y138 WeakPolarHBondContact O-CE1 3.29Å; A133-Y138 PolarHBondContact O-OH 2.9Å; A133-Y138 VanDerWaalsContact O-OH 3.04Å
134	K	91.3	Very high	94.5	Very high	195 Å²	195	55.2 Å²	55.2	85%	0.848	28%	0.278	S	S	*	.			trans	-56.4	130	180	-164.4	171.7	-179.3	178.3	0	110.8	Y138	K134-Y138 WeakPolarHBondContact CA-OH 3.4Å
135	R	89.7	Confident	94.6	Very high	102 Å²	102	53.7 Å²	53.7	39%	0.385	28%	0.275	S	S	.	.			trans	-129	160.5	174	-63.7	-66.7	-174.7	-99.9	3.3	109.2	A133 S137 Y138 E204	A133-R135 PolarHBondContact O-N 3Å; R135-S137 VanDerWaalsContact C-N 3.33Å; R135-S137 WeakPolarHBondContact CB-O 3.38Å; R135-Y138 HydrophobicContact CB-CD1 4.01Å; R135-Y138 HydrophobicContact CB-CE1 3.67Å; R135-Y138 HydrophobicContact CB-CE2 4.31Å; R135-Y138 HydrophobicContact CB-CG 4.49Å; R135-Y138 HydrophobicContact CG-CD1 4.01Å; R135-Y138 HydrophobicContact CG-CE1 3.64Å; R135-Y138 PolarHBondContact N-OH 3.41Å; R135-Y138 VanDerWaalsContact N-OH 3.12Å; R135-E204 IonicContact CZ-OE1 2.68Å; R135-E204 IonicContact NE-OE1 2.68Å; R135-E204 PolarHBondContact NE-OE1 3.26Å; R135-E204 IonicContact NH2-OE1 3.07Å; R135-E204 IonicContact NH2-OE2 3.69Å
136	Q	90.6	Very high	94.4	Very high	188 Å²	188	56.5 Å²	56.5	88%	0.879	30%	0.295	S	S	*	.	S	Bend	trans	-70.5	-34.4	170.5	-69.4	-177.9	-7.8	0	0	111.4
137	S	93.3	Very high	94.5	Very high	44 Å²	44	55.2 Å²	55.2	31%	0.308	29%	0.286	S	S	.	.			trans	-149.8	145.2	174.7	-175	0	0	0	0	109.1	R135 Q170	R135-S137 VanDerWaalsContact C-N 3.33Å; R135-S137 WeakPolarHBondContact CB-O 3.38Å; S137-Q170 WeakPolarHBondContact OG-CG 3.23Å; S137-Q170 PolarHBondContact OG-NE2 3.42Å
138	Y	94.5	Very high	94.6	Very high	13 Å²	13	55.7 Å²	55.7	5%	0.051	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.1	173.8	-57.7	-85.4	0	0	0	108.3	L130 A132 A133 K134 R135 Q170 S171 L174 F203	L130-Y138 HydrophobicContact CD2-CD1 3.63Å; L130-Y138 HydrophobicContact CD2-CG 4.15Å; A132-Y138 HydrophobicContact CB-CD1 4.32Å; A132-Y138 HydrophobicContact CB-CE1 3.99Å; A133-Y138 WeakPolarHBondContact O-CE1 3.29Å; A133-Y138 PolarHBondContact O-OH 2.9Å; A133-Y138 VanDerWaalsContact O-OH 3.04Å; K134-Y138 WeakPolarHBondContact CA-OH 3.4Å; R135-Y138 HydrophobicContact CB-CD1 4.01Å; R135-Y138 HydrophobicContact CB-CE1 3.67Å; R135-Y138 HydrophobicContact CB-CE2 4.31Å; R135-Y138 HydrophobicContact CB-CG 4.49Å; R135-Y138 HydrophobicContact CG-CD1 4.01Å; R135-Y138 HydrophobicContact CG-CE1 3.64Å; R135-Y138 PolarHBondContact N-OH 3.41Å; R135-Y138 VanDerWaalsContact N-OH 3.12Å; Y138-Q170 CarbonylContact O-C 3.41Å; Y138-Q170 VanDerWaalsContact O-CA 3.24Å; Y138-Q170 WeakPolarHBondContact O-CA 3.47Å; Y138-Q170 WeakPolarHBondContact O-CG 3.37Å; Y138-S171 PolarHBondContact N-O 3.15Å; Y138-S171 PolarHBondContact O-N 2.93Å; Y138-L174 HydrophobicContact CD1-CD1 4.02Å; Y138-L174 HydrophobicContact CD2-CB 4.27Å; Y138-L174 HydrophobicContact CE1-CB 4.48Å; Y138-L174 HydrophobicContact CE1-CD1 4Å; Y138-L174 HydrophobicContact CE2-CB 3.8Å; Y138-L174 HydrophobicContact CG-CD1 4.27Å; Y138-F203 HydrophobicContact CD1-CE2 4.3Å; Y138-F203 HydrophobicContact CD1-CZ 4.39Å
139	K	95.6	Very high	94.7	Very high	114 Å²	114	55.4 Å²	55.4	50%	0.496	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	119.3	177	-177.8	-179.1	-178.9	175.8	0	109.1	T168 Q170 F203	K139-T168 HydrophobicContact CD-CG2 4.28Å; K139-T168 HydrophobicContact CG-CG2 3.94Å; K139-Q170 HydrophobicContact CB-CG 4.33Å; K139-F203 VanDerWaalsContact O-CD2 3.32Å; K139-F203 WeakPolarHBondContact O-CD2 3.39Å
140	V	95.9	Very high	94.6	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.7	177	-62.1	0	0	0	0	109.7	L130 T168 V169 L177 L181 F201 T202 F203	L130-V140 HydrophobicContact CB-CG1 4.46Å; L130-V140 HydrophobicContact CD1-CG1 4.15Å; L130-V140 HydrophobicContact CD2-CG1 3.96Å; L130-V140 HydrophobicContact CG-CG1 4.43Å; V140-T168 WeakPolarHBondContact O-CA 3.21Å; V140-V169 HydrophobicContact CG2-CB 3.8Å; V140-V169 HydrophobicContact CG2-CG2 4.49Å; V140-V169 PolarHBondContact N-O 3.11Å; V140-V169 PolarHBondContact O-N 3.07Å; V140-L177 HydrophobicContact CG1-CD2 4.04Å; V140-L177 HydrophobicContact CG2-CD1 4.24Å; V140-L177 HydrophobicContact CG2-CD2 4.38Å; V140-L177 HydrophobicContact CG2-CG 4.46Å; V140-L181 HydrophobicContact CG2-CD1 4.38Å; V140-L181 HydrophobicContact CG2-CD2 3.82Å; V140-L181 HydrophobicContact CG2-CG 4.39Å; V140-F201 HydrophobicContact CB-CE2 3.9Å; V140-F201 HydrophobicContact CG1-CE2 4.34Å; V140-F201 HydrophobicContact CG2-CE2 4.26Å; V140-T202 VanDerWaalsContact CA-O 3.3Å; V140-T202 WeakPolarHBondContact CA-O 3.44Å; V140-F203 HydrophobicContact CG1-CB 4.15Å; V140-F203 HydrophobicContact CG1-CD2 3.83Å; V140-F203 HydrophobicContact CG1-CG 4.38Å
141	T	97.2	Very high	94.3	Very high	25 Å²	25	55.5 Å²	55.5	15%	0.153	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	135	176.8	-43.7	0	0	0	0	108.7	E166 F201 T202	T141-E166 HydrophobicContact CG2-CG 3.56Å; T141-F201 WeakPolarHBondContact O-CA 3.39Å; T141-T202 WeakPolarHBondContact CB-OG1 3.42Å; T141-T202 PolarHBondContact N-O 3.43Å; T141-T202 PolarHBondContact O-N 3.06Å; T141-T202 PolarHBondContact O-OG1 2.84Å
142	L	97.6	Very high	93.7	Very high	3 Å²	3	57.5 Å²	57.5	2%	0.016	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.1	169.8	-174.1	70.2	0	0	0	108.1	I125 L128 L149 E166 I167 L184 A199 H200 F201 F210	I125-L142 HydrophobicContact CD1-CD2 3.58Å; L128-L142 HydrophobicContact CD1-CD2 3.98Å; L142-L149 HydrophobicContact CB-CD1 4.09Å; L142-L149 HydrophobicContact CD2-CD1 4Å; L142-L149 HydrophobicContact CD2-CD2 3.88Å; L142-L149 HydrophobicContact CG-CD1 3.84Å; L142-L149 HydrophobicContact CG-CD2 4.5Å; L142-L149 WeakPolarHBondContact O-CD1 3.13Å; L142-E166 WeakPolarHBondContact O-CA 3.25Å; L142-I167 HydrophobicContact CB-CG2 4.11Å; L142-I167 PolarHBondContact N-O 3.4Å; L142-I167 PolarHBondContact O-N 3.41Å; L142-L184 HydrophobicContact CD2-CD1 4.11Å; L142-A199 HydrophobicContact CD1-CB 4.21Å; L142-H200 CarbonylContact C-O 3.55Å; L142-H200 WeakPolarHBondContact CA-O 3.47Å; L142-F201 HydrophobicContact CD1-CB 3.76Å; L142-F201 HydrophobicContact CD1-CD2 4.19Å; L142-F201 HydrophobicContact CD1-CG 4.23Å; L142-F210 HydrophobicContact CD1-CE1 4.11Å; L142-F210 HydrophobicContact CD1-CZ 4.21Å
143	R	98.1	Very high	92.6	Very high	135 Å²	135	59.7 Å²	59.7	51%	0.509	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.7	179.4	-179.2	-176.2	176.7	-133.7	0.2	110.4	K165 E166 A199 H200	R143-K165 CarbonylContact C-O 3.53Å; R143-K165 WeakPolarHBondContact CA-O 3.41Å; R143-E166 HydrophobicContact CB-CB 4.39Å; R143-E166 HydrophobicContact CB-CG 4.19Å; R143-E166 WeakPolarHBondContact CD-OE2 3.06Å; R143-E166 HydrophobicContact CG-CB 4.32Å; R143-A199 CarbonylContact O-C 3.56Å; R143-A199 VanDerWaalsContact O-CA 3.32Å; R143-A199 WeakPolarHBondContact O-CA 3.41Å; R143-H200 HydrophobicContact CB-CB 4.36Å; R143-H200 PolarHBondContact N-O 3.46Å; R143-H200 PolarHBondContact O-N 2.97Å
144	V	97.7	Very high	90.7	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	156.2	174	-67.5	0	0	0	0	111.3	G147 L149 K165 Y186 L198 A199 I212	V144-G147 VanDerWaalsContact CG2-O 3.27Å; V144-G147 WeakPolarHBondContact CG2-O 3.31Å; V144-L149 HydrophobicContact CG1-CD1 4.2Å; V144-L149 HydrophobicContact CG1-CD2 3.92Å; V144-L149 HydrophobicContact CG1-CG 4.21Å; V144-L149 HydrophobicContact CG2-CD1 4.27Å; V144-L149 HydrophobicContact CG2-CD2 4.48Å; V144-L149 HydrophobicContact CG2-CG 4.02Å; V144-K165 HydrophobicContact CG2-CB 4.41Å; V144-K165 WeakPolarHBondContact CG2-O 3.34Å; V144-K165 PolarHBondContact N-O 2.72Å; V144-Y186 HydrophobicContact CB-CE2 4.15Å; V144-Y186 HydrophobicContact CG1-CD2 3.96Å; V144-Y186 HydrophobicContact CG1-CE2 3.94Å; V144-Y186 HydrophobicContact CG2-CE2 4.18Å; V144-L198 WeakPolarHBondContact CA-O 3.36Å; V144-A199 HydrophobicContact CG1-CB 4.02Å; V144-I212 HydrophobicContact CG1-CD1 4.09Å
145	S	96.2	Very high	88.5	Confident	53 Å²	53	57.2 Å²	57.2	37%	0.371	31%	0.309	S	S	.	.	S	Bend	trans	-80.5	-36.9	-176.7	-53.5	0	0	0	0	112	K165 D197 L198	S145-K165 PolarHBondContact O-NZ 3.45Å; S145-D197 WeakPolarHBondContact CA-OD1 3.31Å; S145-D197 WeakPolarHBondContact CB-OD1 3.39Å; S145-D197 PolarHBondContact N-OD1 2.67Å; S145-L198 PolarHBondContact N-O 3.49Å; S145-L198 PolarHBondContact OG-O 3.44Å
146	S	93.9	Very high	86	Confident	61 Å²	61	62.3 Å²	62.3	43%	0.427	34%	0.337	S	S	.	.	S	Bend	trans	-124.5	-45.4	-170.2	-57.7	0	0	0	0	115.3	T189 D197	S146-T189 PolarHBondContact O-OG1 2.68Å; S146-D197 PolarHBondContact N-OD1 2.83Å; S146-D197 PolarHBondContact N-OD2 2.68Å; S146-D197 VanDerWaalsContact N-OD2 3.08Å
147	G	95.3	Very high	83.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.321	C	S	.	.	S	Bend	trans	-80.2	-165.4	-174.6	0	0	0	0	0	114.1	V144 K165 Y186 T187 D197	V144-G147 VanDerWaalsContact CG2-O 3.27Å; V144-G147 WeakPolarHBondContact CG2-O 3.31Å; G147-K165 WeakPolarHBondContact O-CG 3.18Å; G147-Y186 WeakPolarHBondContact CA-OH 3.43Å; G147-T187 WeakPolarHBondContact CA-O 3.34Å; G147-D197 PolarHBondContact N-OD2 2.94Å
148	V	96.5	Very high	81.5	Confident	37 Å²	37	62.5 Å²	62.5	22%	0.224	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	150.7	176.7	-65.3	0	0	0	0	111.6	G163 E164 T187 T189	V148-G163 WeakPolarHBondContact CB-O 3.36Å; V148-G163 WeakPolarHBondContact CG1-O 3.41Å; V148-E164 CarbonylContact C-O 3.59Å; V148-E164 VanDerWaalsContact CA-O 3.27Å; V148-E164 WeakPolarHBondContact CA-O 3.14Å; V148-T187 PolarHBondContact N-O 2.88Å; V148-T187 PolarHBondContact O-N 3.23Å; V148-T189 HydrophobicContact CG1-CG2 3.66Å; V148-T189 HydrophobicContact CG2-CG2 4.35Å
149	L	96.5	Very high	79.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	144.9	-177.4	-62.1	171	0	0	0	110.4	I125 L142 V144 G163 E164 I167 T185 Y186	I125-L149 HydrophobicContact CD1-CD2 3.88Å; L142-L149 HydrophobicContact CB-CD1 4.09Å; L142-L149 HydrophobicContact CD2-CD1 4Å; L142-L149 HydrophobicContact CD2-CD2 3.88Å; L142-L149 HydrophobicContact CG-CD1 3.84Å; L142-L149 HydrophobicContact CG-CD2 4.5Å; L142-L149 WeakPolarHBondContact O-CD1 3.13Å; V144-L149 HydrophobicContact CG1-CD1 4.2Å; V144-L149 HydrophobicContact CG1-CD2 3.92Å; V144-L149 HydrophobicContact CG1-CG 4.21Å; V144-L149 HydrophobicContact CG2-CD1 4.27Å; V144-L149 HydrophobicContact CG2-CD2 4.48Å; V144-L149 HydrophobicContact CG2-CG 4.02Å; L149-G163 WeakPolarHBondContact O-CA 3.3Å; L149-G163 PolarHBondContact O-N 3.3Å; L149-E164 PolarHBondContact N-O 2.61Å; L149-I167 HydrophobicContact CB-CB 4.17Å; L149-I167 HydrophobicContact CB-CG2 3.89Å; L149-I167 HydrophobicContact CD1-CB 4.44Å; L149-I167 HydrophobicContact CD1-CG2 3.79Å; L149-I167 HydrophobicContact CG-CG2 4.46Å; L149-T185 WeakPolarHBondContact CA-O 3.17Å; L149-Y186 HydrophobicContact CD2-CD2 4.17Å
150	A	92.9	Very high	78.1	Confident	9 Å²	9	66.8 Å²	66.8	7%	0.074	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	148.2	175.5	0	0	0	0	0	110	L184 T185	A150-L184 CarbonylContact O-C 3.56Å; A150-T185 PolarHBondContact N-O 2.95Å; A150-T185 PolarHBondContact O-N 3.28Å; A150-T185 PolarHBondContact O-OG1 3.46Å
151	I	89.4	Confident	76.6	Confident	6 Å²	6	67.2 Å²	67.2	3%	0.031	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.5	170.7	-62	163.3	0	0	0	108.4	A153 Q159 Q162 I167 V169 L180 R183 L184	I151-A153 PolarHBondContact O-N 3.49Å; I151-A153 VanDerWaalsContact O-N 3.1Å; I151-Q159 VanDerWaalsContact CB-OE1 3.28Å; I151-Q159 HydrophobicContact CD1-CG 4.4Å; I151-Q162 VanDerWaalsContact N-NE2 3.1Å; I151-Q162 PolarHBondContact O-NE2 3.41Å; I151-I167 HydrophobicContact CD1-CD1 3.89Å; I151-I167 HydrophobicContact CG1-CD1 3.79Å; I151-V169 HydrophobicContact CD1-CG2 3.93Å; I151-L180 HydrophobicContact CG2-CD2 4.19Å; I151-R183 HydrophobicContact CG2-CB 3.98Å; I151-L184 HydrophobicContact CD1-CD2 4.47Å; I151-L184 HydrophobicContact CG1-CD2 3.64Å; I151-L184 HydrophobicContact CG1-CG 4.06Å
152	K	83.1	Confident	75.9	Confident	131 Å²	131	69.8 Å²	69.8	57%	0.57	39%	0.39	S	S	*	.			trans	-70.4	104	173.8	-170.2	175.2	-179.6	-179.6	0	109.4	R183 T185	K152-R183 HydrophobicContact CB-CB 4.29Å; K152-R183 PolarHBondContact N-O 3.45Å; K152-R183 WeakPolarHBondContact O-CD 3.46Å; K152-T185 HydrophobicContact CB-CG2 4.47Å
153	A	68.1	Low	75.3	Confident	67 Å²	67	71.8 Å²	71.8	55%	0.554	41%	0.411	S	S	*	.			trans	-68.7	148.4	-173.9	0	0	0	0	0	114	I151	I151-A153 PolarHBondContact O-N 3.49Å; I151-A153 VanDerWaalsContact O-N 3.1Å
154	L	50.8	Low	75	Confident	147 Å²	147	71 Å²	71	77%	0.77	41%	0.414	S	S	*	.	S	Bend	trans	-122.3	86.7	151.5	-89.7	165.1	0	0	0	105.1
155	G	46.3	Very low	75	Confident	62 Å²	62	76.2 Å²	76.2	64%	0.639	44%	0.436	S	S	*	.	S	Bend	trans	87.7	148	179.9	0	0	0	0	0	115.1
156	E	37.3	Very low	75	Confident	210 Å²	210	77.9 Å²	77.9	98%	0.981	44%	0.438	S	S	*	.			trans	-63.6	125.8	-177.8	-67.6	174.8	157.1	0	0	111.8
157	G	43.2	Very low	75	Confident	53 Å²	53	75.1 Å²	75.1	55%	0.546	42%	0.418	S	S	.	.			trans	-160.7	137.1	166	0	0	0	0	0	107.7	Q159	G157-Q159 PolarHBondContact O-N 2.86Å
158	D	45.3	Very low	75	Confident	182 Å²	182	76.6 Å²	76.6	97%	0.973	43%	0.427	S	S	*	.			trans	-52.9	118	-176.1	-88.9	-28	0	0	0	111.3
159	Q	58.3	Low	74.8	Confident	61 Å²	61	75.1 Å²	75.1	29%	0.285	42%	0.418	S	S	.	.			trans	-128.6	109.6	175.3	-71.4	174.7	3.5	0	0	108.3	I151 G157 Q162	I151-Q159 VanDerWaalsContact CB-OE1 3.28Å; I151-Q159 HydrophobicContact CD1-CG 4.4Å; G157-Q159 PolarHBondContact O-N 2.86Å; Q159-Q162 HydrophobicContact CB-CG 4.01Å; Q159-Q162 WeakPolarHBondContact O-CG 3.4Å
160	E	60.1	Low	74.7	Confident	157 Å²	157	80.7 Å²	80.7	73%	0.734	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	130.2	-178.5	-158.3	174.4	-161.8	0	0	110.5	I167	E160-I167 WeakPolarHBondContact O-CG1 3.5Å
161	G	64.6	Low	74.7	Confident	11 Å²	11	81.3 Å²	81.3	11%	0.113	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	14.7	178.5	0	0	0	0	0	116.3	G163 E164 E166	G161-G163 PolarHBondContact O-N 2.72Å; G161-E164 PolarHBondContact O-N 3.46Å; G161-E164 VanDerWaalsContact O-N 3.13Å; G161-E166 WeakPolarHBondContact CA-O 3.33Å
162	Q	82	Confident	74.9	Confident	79 Å²	79	86.3 Å²	86.3	37%	0.369	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	121.7	174.4	-79.9	-80.2	-5.3	0	0	111.9	I151 Q159 E164	I151-Q162 VanDerWaalsContact N-NE2 3.1Å; I151-Q162 PolarHBondContact O-NE2 3.41Å; Q159-Q162 HydrophobicContact CB-CG 4.01Å; Q159-Q162 WeakPolarHBondContact O-CG 3.4Å; Q162-E164 VanDerWaalsContact C-N 3.27Å
163	G	84.9	Confident	75.5	Confident	44 Å²	44	81.8 Å²	81.8	45%	0.454	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	10.7	-178.3	0	0	0	0	0	114	V148 L149 G161	V148-G163 WeakPolarHBondContact CB-O 3.36Å; V148-G163 WeakPolarHBondContact CG1-O 3.41Å; L149-G163 WeakPolarHBondContact O-CA 3.3Å; L149-G163 PolarHBondContact O-N 3.3Å; G161-G163 PolarHBondContact O-N 2.72Å
164	E	93	Very high	76.7	Confident	120 Å²	120	80.6 Å²	80.6	56%	0.561	45%	0.448	S	S	*	.	B	Isolated β-bridge	trans	-104.7	176.1	177.7	-59.3	-169.2	174.8	0	0	112	V148 L149 G161 Q162 E166	V148-E164 CarbonylContact C-O 3.59Å; V148-E164 VanDerWaalsContact CA-O 3.27Å; V148-E164 WeakPolarHBondContact CA-O 3.14Å; L149-E164 PolarHBondContact N-O 2.61Å; G161-E164 PolarHBondContact O-N 3.46Å; G161-E164 VanDerWaalsContact O-N 3.13Å; Q162-E164 VanDerWaalsContact C-N 3.27Å; E164-E166 PolarHBondContact O-N 3.44Å
165	K	96.5	Very high	78.8	Confident	110 Å²	110	81.7 Å²	81.7	48%	0.478	44%	0.443	S	S	.	.	S	Bend	trans	-74	-17.3	176.4	-67.7	-170.2	174.7	-167.6	0	113.1	R143 V144 S145 G147	R143-K165 CarbonylContact C-O 3.53Å; R143-K165 WeakPolarHBondContact CA-O 3.41Å; V144-K165 HydrophobicContact CG2-CB 4.41Å; V144-K165 WeakPolarHBondContact CG2-O 3.34Å; V144-K165 PolarHBondContact N-O 2.72Å; S145-K165 PolarHBondContact O-NZ 3.45Å; G147-K165 WeakPolarHBondContact O-CG 3.18Å
166	E	97	Very high	81	Confident	89 Å²	89	82.3 Å²	82.3	42%	0.416	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	139.1	-177.5	-174.2	170.6	113.1	0	0	109.1	T141 L142 R143 G161 E164	T141-E166 HydrophobicContact CG2-CG 3.56Å; L142-E166 WeakPolarHBondContact O-CA 3.25Å; R143-E166 HydrophobicContact CB-CB 4.39Å; R143-E166 HydrophobicContact CB-CG 4.19Å; R143-E166 WeakPolarHBondContact CD-OE2 3.06Å; R143-E166 HydrophobicContact CG-CB 4.32Å; G161-E166 WeakPolarHBondContact CA-O 3.33Å; E164-E166 PolarHBondContact O-N 3.44Å
167	I	95	Very high	83.7	Confident	2 Å²	2	72.3 Å²	72.3	1%	0.01	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.4	174.7	-162.9	165.2	0	0	0	109.2	L142 L149 I151 E160 L184	L142-I167 HydrophobicContact CB-CG2 4.11Å; L142-I167 PolarHBondContact N-O 3.4Å; L142-I167 PolarHBondContact O-N 3.41Å; L149-I167 HydrophobicContact CB-CB 4.17Å; L149-I167 HydrophobicContact CB-CG2 3.89Å; L149-I167 HydrophobicContact CD1-CB 4.44Å; L149-I167 HydrophobicContact CD1-CG2 3.79Å; L149-I167 HydrophobicContact CG-CG2 4.46Å; I151-I167 HydrophobicContact CD1-CD1 3.89Å; I151-I167 HydrophobicContact CG1-CD1 3.79Å; E160-I167 WeakPolarHBondContact O-CG1 3.5Å; I167-L184 HydrophobicContact CD1-CD2 4.05Å; I167-L184 HydrophobicContact CG2-CD2 3.59Å
168	T	95.1	Very high	86.2	Confident	31 Å²	31	71.7 Å²	71.7	19%	0.19	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	128	177.5	-70.5	0	0	0	0	109	K139 V140	K139-T168 HydrophobicContact CD-CG2 4.28Å; K139-T168 HydrophobicContact CG-CG2 3.94Å; V140-T168 WeakPolarHBondContact O-CA 3.21Å
169	V	92.4	Very high	88.4	Confident	6 Å²	6	65.8 Å²	65.8	4%	0.036	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.3	175	-168.8	0	0	0	0	108.6	V140 I151 L177 L180	V140-V169 HydrophobicContact CG2-CB 3.8Å; V140-V169 HydrophobicContact CG2-CG2 4.49Å; V140-V169 PolarHBondContact N-O 3.11Å; V140-V169 PolarHBondContact O-N 3.07Å; I151-V169 HydrophobicContact CD1-CG2 3.93Å; V169-L177 HydrophobicContact CB-CD1 4.33Å; V169-L177 HydrophobicContact CG1-CD1 3.89Å; V169-L180 HydrophobicContact CG1-CB 3.73Å; V169-L180 HydrophobicContact CG1-CD1 3.65Å; V169-L180 HydrophobicContact CG1-CG 4.34Å
170	Q	93.4	Very high	90.1	Very high	118 Å²	118	64.9 Å²	64.9	55%	0.551	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	139.4	179.3	-172.5	174.1	4.8	0	0	110.9	S137 Y138 K139	S137-Q170 WeakPolarHBondContact OG-CG 3.23Å; S137-Q170 PolarHBondContact OG-NE2 3.42Å; Y138-Q170 CarbonylContact O-C 3.41Å; Y138-Q170 VanDerWaalsContact O-CA 3.24Å; Y138-Q170 WeakPolarHBondContact O-CA 3.47Å; Y138-Q170 WeakPolarHBondContact O-CG 3.37Å; K139-Q170 HydrophobicContact CB-CG 4.33Å
171	S	93.6	Very high	91.7	Very high	22 Å²	22	57.5 Å²	57.5	15%	0.154	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	154.6	173.9	-177.7	0	0	0	0	111.2	Y138 S173	Y138-S171 PolarHBondContact N-O 3.15Å; Y138-S171 PolarHBondContact O-N 2.93Å; S171-S173 VanDerWaalsContact C-N 3.31Å; S171-S173 PolarHBondContact OG-N 3.24Å; S171-S173 PolarHBondContact OG-O 2.63Å; S171-S173 VanDerWaalsContact OG-O 3.1Å
172	T	93.8	Very high	93	Very high	111 Å²	111	59.1 Å²	59.1	68%	0.681	32%	0.317	S	S	*	.	S	Bend	trans	-82.5	-13.9	168.6	53.5	0	0	0	0	112.2
173	S	94.4	Very high	93.6	Very high	35 Å²	35	59.6 Å²	59.6	25%	0.245	32%	0.316	C	S	.	.			trans	-113.6	120.4	-179.1	165.3	0	0	0	0	110.1	S171 Y175 D176 L177	S171-S173 VanDerWaalsContact C-N 3.31Å; S171-S173 PolarHBondContact OG-N 3.24Å; S171-S173 PolarHBondContact OG-O 2.63Å; S171-S173 VanDerWaalsContact OG-O 3.1Å; S173-Y175 PolarHBondContact O-N 3.34Å; S173-D176 WeakPolarHBondContact CB-OD2 3.28Å; S173-D176 PolarHBondContact O-N 2.99Å; S173-D176 PolarHBondContact OG-N 2.69Å; S173-D176 PolarHBondContact OG-OD2 3.01Å; S173-L177 PolarHBondContact O-N 3.11Å
174	L	93.7	Very high	94	Very high	43 Å²	43	57.5 Å²	57.5	23%	0.225	29%	0.294	C	S	.	.	H	α-helix	trans	-61.3	-33.6	177	-174.5	61.1	0	0	0	111.7	L130 Y138 L177 N178	L130-L174 HydrophobicContact CB-CD1 4Å; L130-L174 HydrophobicContact CD2-CD1 3.76Å; L130-L174 HydrophobicContact CG-CD1 3.96Å; Y138-L174 HydrophobicContact CD1-CD1 4.02Å; Y138-L174 HydrophobicContact CD2-CB 4.27Å; Y138-L174 HydrophobicContact CE1-CB 4.48Å; Y138-L174 HydrophobicContact CE1-CD1 4Å; Y138-L174 HydrophobicContact CE2-CB 3.8Å; Y138-L174 HydrophobicContact CG-CD1 4.27Å; L174-L177 HydrophobicContact CD1-CD2 4.28Å; L174-N178 WeakPolarHBondContact O-CB 3.15Å; L174-N178 PolarHBondContact O-N 3.13Å; L174-N178 PolarHBondContact O-ND2 3.2Å
175	Y	94.1	Very high	94.1	Very high	169 Å²	169	52 Å²	52	66%	0.663	27%	0.269	S	S	*	.	H	α-helix	trans	-62.8	-49.1	176.6	177.2	-101.6	0	0	0	111.2	S173 L177 N178 N179	S173-Y175 PolarHBondContact O-N 3.34Å; Y175-L177 VanDerWaalsContact C-N 3.35Å; Y175-L177 PolarHBondContact O-N 2.87Å; Y175-N178 PolarHBondContact O-N 3.17Å; Y175-N179 WeakPolarHBondContact CD1-ND2 3.28Å; Y175-N179 WeakPolarHBondContact CE1-ND2 3.5Å; Y175-N179 VanDerWaalsContact CZ-ND2 3.32Å; Y175-N179 VanDerWaalsContact O-CG 3.31Å; Y175-N179 PolarHBondContact O-N 3.42Å; Y175-N179 PolarHBondContact O-ND2 3.4Å
176	D	92.6	Very high	94.2	Very high	75 Å²	75	46.9 Å²	46.9	40%	0.401	25%	0.246	S	C	.	.	H	α-helix	trans	-68.6	-36.4	-179.5	-61.4	-45.6	0	0	0	111.8	S173 N179 L180	S173-D176 WeakPolarHBondContact CB-OD2 3.28Å; S173-D176 PolarHBondContact O-N 2.99Å; S173-D176 PolarHBondContact OG-N 2.69Å; S173-D176 PolarHBondContact OG-OD2 3.01Å; D176-N179 PolarHBondContact O-N 3.24Å; D176-L180 WeakPolarHBondContact O-CG 3.48Å; D176-L180 PolarHBondContact O-N 3.49Å
177	L	94.1	Very high	94.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57.6	-50.3	172.3	-167.6	89.3	0	0	0	111.3	L130 V140 V169 S173 L174 Y175 N179 L180 L181	L130-L177 HydrophobicContact CB-CD2 3.79Å; L130-L177 HydrophobicContact CD2-CD2 3.37Å; L130-L177 HydrophobicContact CG-CD2 4.21Å; V140-L177 HydrophobicContact CG1-CD2 4.04Å; V140-L177 HydrophobicContact CG2-CD1 4.24Å; V140-L177 HydrophobicContact CG2-CD2 4.38Å; V140-L177 HydrophobicContact CG2-CG 4.46Å; V169-L177 HydrophobicContact CB-CD1 4.33Å; V169-L177 HydrophobicContact CG1-CD1 3.89Å; S173-L177 PolarHBondContact O-N 3.11Å; L174-L177 HydrophobicContact CD1-CD2 4.28Å; Y175-L177 VanDerWaalsContact C-N 3.35Å; Y175-L177 PolarHBondContact O-N 2.87Å; L177-N179 VanDerWaalsContact C-N 3.31Å; L177-N179 PolarHBondContact O-N 3.15Å; L177-L180 WeakPolarHBondContact O-CB 3.49Å; L177-L180 PolarHBondContact O-N 3.44Å; L177-L180 VanDerWaalsContact O-N 3.16Å; L177-L181 HydrophobicContact CD2-CD1 4.43Å; L177-L181 WeakPolarHBondContact O-CG 3.29Å; L177-L181 PolarHBondContact O-N 3.2Å
178	N	95.2	Very high	94.1	Very high	40 Å²	40	44 Å²	44	21%	0.214	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-32.5	-179.7	-77.1	-24.3	0	0	0	112.5	A129 L130 L174 Y175 L180 L181 G182	A129-N178 WeakPolarHBondContact CA-OD1 3.42Å; L130-N178 PolarHBondContact N-OD1 3.46Å; L130-N178 PolarHBondContact O-ND2 2.98Å; L130-N178 PolarHBondContact O-OD1 3.34Å; L174-N178 WeakPolarHBondContact O-CB 3.15Å; L174-N178 PolarHBondContact O-N 3.13Å; L174-N178 PolarHBondContact O-ND2 3.2Å; Y175-N178 PolarHBondContact O-N 3.17Å; N178-L180 VanDerWaalsContact C-N 3.34Å; N178-L181 PolarHBondContact O-N 3.31Å; N178-G182 PolarHBondContact O-N 2.96Å
179	N	93.2	Very high	94.1	Very high	58 Å²	58	46.2 Å²	46.2	31%	0.31	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-38.7	171.7	-74.3	-28.2	0	0	0	112.5	Y175 D176 L177 R183	Y175-N179 WeakPolarHBondContact CD1-ND2 3.28Å; Y175-N179 WeakPolarHBondContact CE1-ND2 3.5Å; Y175-N179 VanDerWaalsContact CZ-ND2 3.32Å; Y175-N179 VanDerWaalsContact O-CG 3.31Å; Y175-N179 PolarHBondContact O-N 3.42Å; Y175-N179 PolarHBondContact O-ND2 3.4Å; D176-N179 PolarHBondContact O-N 3.24Å; L177-N179 VanDerWaalsContact C-N 3.31Å; L177-N179 PolarHBondContact O-N 3.15Å; N179-R183 WeakPolarHBondContact O-CG 3.1Å
180	L	92.3	Very high	93.9	Very high	43 Å²	43	49.9 Å²	49.9	23%	0.225	27%	0.271	C	S	.	.	H	α-helix	trans	-70.2	-43.5	174.8	-69.3	169.5	0	0	0	111.4	I151 V169 D176 L177 N178 G182 R183 L184	I151-L180 HydrophobicContact CG2-CD2 4.19Å; V169-L180 HydrophobicContact CG1-CB 3.73Å; V169-L180 HydrophobicContact CG1-CD1 3.65Å; V169-L180 HydrophobicContact CG1-CG 4.34Å; D176-L180 WeakPolarHBondContact O-CG 3.48Å; D176-L180 PolarHBondContact O-N 3.49Å; L177-L180 WeakPolarHBondContact O-CB 3.49Å; L177-L180 PolarHBondContact O-N 3.44Å; L177-L180 VanDerWaalsContact O-N 3.16Å; N178-L180 VanDerWaalsContact C-N 3.34Å; L180-G182 VanDerWaalsContact C-N 3.3Å; L180-G182 PolarHBondContact O-N 2.99Å; L180-R183 PolarHBondContact O-N 3.43Å; L180-L184 PolarHBondContact O-N 3Å
181	L	94.1	Very high	93.8	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-58	-41.5	175.6	-73.8	178.2	0	0	0	112.2	L128 L130 V140 L177 N178 R183 L184 F201	L128-L181 HydrophobicContact CB-CB 4.12Å; L130-L181 HydrophobicContact CB-CD1 4.31Å; V140-L181 HydrophobicContact CG2-CD1 4.38Å; V140-L181 HydrophobicContact CG2-CD2 3.82Å; V140-L181 HydrophobicContact CG2-CG 4.39Å; L177-L181 HydrophobicContact CD2-CD1 4.43Å; L177-L181 WeakPolarHBondContact O-CG 3.29Å; L177-L181 PolarHBondContact O-N 3.2Å; N178-L181 PolarHBondContact O-N 3.31Å; L181-R183 PolarHBondContact O-N 2.74Å; L181-L184 HydrophobicContact CD2-CD1 3.51Å; L181-L184 WeakPolarHBondContact O-CB 3.45Å; L181-L184 PolarHBondContact O-N 3.09Å; L181-L184 VanDerWaalsContact O-N 3.15Å; L181-F201 HydrophobicContact CD1-CZ 3.98Å; L181-F201 HydrophobicContact CD2-CE2 4.09Å; L181-F201 HydrophobicContact CD2-CZ 4.21Å
182	G	93.3	Very high	93.6	Very high	46 Å²	46	57 Å²	57	47%	0.474	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-7.3	175.5	0	0	0	0	0	114.9	N178 L180	N178-G182 PolarHBondContact O-N 2.96Å; L180-G182 VanDerWaalsContact C-N 3.3Å; L180-G182 PolarHBondContact O-N 2.99Å
183	R	93	Very high	93.2	Very high	89 Å²	89	58 Å²	58	34%	0.336	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	0.8	178.4	-65.1	176.8	-170.8	-179.4	4.6	113.2	I151 K152 N179 L180 L181	I151-R183 HydrophobicContact CG2-CB 3.98Å; K152-R183 HydrophobicContact CB-CB 4.29Å; K152-R183 PolarHBondContact N-O 3.45Å; K152-R183 WeakPolarHBondContact O-CD 3.46Å; N179-R183 WeakPolarHBondContact O-CG 3.1Å; L180-R183 PolarHBondContact O-N 3.43Å; L181-R183 PolarHBondContact O-N 2.74Å
184	L	94.4	Very high	92.8	Very high	0 Å²	0	67 Å²	67	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	137.1	173.9	-86.3	165	0	0	0	110.3	L124 I125 L128 L142 A150 I151 I167 L180 L181	L124-L184 WeakPolarHBondContact CA-O 3.42Å; I125-L184 HydrophobicContact CD1-CB 4.41Å; I125-L184 PolarHBondContact N-O 3.32Å; L128-L184 HydrophobicContact CD1-CB 4.06Å; L128-L184 HydrophobicContact CD1-CD1 3.78Å; L142-L184 HydrophobicContact CD2-CD1 4.11Å; A150-L184 CarbonylContact O-C 3.56Å; I151-L184 HydrophobicContact CD1-CD2 4.47Å; I151-L184 HydrophobicContact CG1-CD2 3.64Å; I151-L184 HydrophobicContact CG1-CG 4.06Å; I167-L184 HydrophobicContact CD1-CD2 4.05Å; I167-L184 HydrophobicContact CG2-CD2 3.59Å; L180-L184 PolarHBondContact O-N 3Å; L181-L184 HydrophobicContact CD2-CD1 3.51Å; L181-L184 WeakPolarHBondContact O-CB 3.45Å; L181-L184 PolarHBondContact O-N 3.09Å; L181-L184 VanDerWaalsContact O-N 3.15Å
185	T	95.6	Very high	92.8	Very high	5 Å²	5	67.8 Å²	67.8	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.9	179	58.3	0	0	0	0	109.8	K122 T123 L124 L149 A150 K152	K122-T185 WeakPolarHBondContact CE-OG1 3.31Å; K122-T185 HydrophobicContact CG-CG2 4.09Å; T123-T185 CarbonylContact O-C 3.59Å; T123-T185 WeakPolarHBondContact O-CA 3.23Å; T123-T185 WeakPolarHBondContact O-CB 3.43Å; L124-T185 HydrophobicContact CD2-CG2 3.61Å; L124-T185 HydrophobicContact CG-CG2 4.06Å; L149-T185 WeakPolarHBondContact CA-O 3.17Å; A150-T185 PolarHBondContact N-O 2.95Å; A150-T185 PolarHBondContact O-N 3.28Å; A150-T185 PolarHBondContact O-OG1 3.46Å; K152-T185 HydrophobicContact CB-CG2 4.47Å
186	Y	96.9	Very high	92.8	Very high	1 Å²	1	61.7 Å²	61.7	0%	0.004	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	141.5	170.5	175.4	-93.6	0	0	0	109.5	V117 T123 V144 G147 L149 D197 I212 I214	V117-Y186 HydrophobicContact CB-CD1 4.5Å; V117-Y186 HydrophobicContact CG1-CD1 4.18Å; V117-Y186 HydrophobicContact CG2-CD1 3.91Å; V117-Y186 HydrophobicContact CG2-CE1 3.85Å; T123-Y186 PolarHBondContact N-O 3.41Å; T123-Y186 PolarHBondContact O-N 3.41Å; V144-Y186 HydrophobicContact CB-CE2 4.15Å; V144-Y186 HydrophobicContact CG1-CD2 3.96Å; V144-Y186 HydrophobicContact CG1-CE2 3.94Å; V144-Y186 HydrophobicContact CG2-CE2 4.18Å; G147-Y186 WeakPolarHBondContact CA-OH 3.43Å; L149-Y186 HydrophobicContact CD2-CD2 4.17Å; Y186-D197 HydrophobicContact CE2-CB 4.37Å; Y186-D197 WeakPolarHBondContact CE2-OD2 3.43Å; Y186-D197 WeakPolarHBondContact OH-CB 3.3Å; Y186-D197 PolarHBondContact OH-OD2 3.28Å; Y186-I212 HydrophobicContact CD1-CD1 4.31Å; Y186-I212 HydrophobicContact CD1-CG2 3.91Å; Y186-I212 HydrophobicContact CD2-CD1 3.51Å; Y186-I212 HydrophobicContact CE1-CG2 3.89Å; Y186-I212 HydrophobicContact CE2-CD1 3.71Å; Y186-I212 HydrophobicContact CG-CD1 3.8Å; Y186-I212 HydrophobicContact CG-CG2 4.42Å; Y186-I214 HydrophobicContact CE1-CD1 4.35Å; Y186-I214 HydrophobicContact CE1-CG1 4.24Å; Y186-I214 WeakPolarHBondContact OH-CD1 3.45Å
187	T	96.1	Very high	93	Very high	26 Å²	26	58.4 Å²	58.4	16%	0.16	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	128.3	169.5	-45.6	0	0	0	0	108.9	L120 K122 G147 V148	L120-T187 WeakPolarHBondContact O-CG2 3.46Å; K122-T187 WeakPolarHBondContact CA-OG1 3.28Å; K122-T187 WeakPolarHBondContact CB-OG1 3.48Å; G147-T187 WeakPolarHBondContact CA-O 3.34Å; V148-T187 PolarHBondContact N-O 2.88Å; V148-T187 PolarHBondContact O-N 3.23Å
188	S	95.7	Very high	93.2	Very high	6 Å²	6	62.5 Å²	62.5	4%	0.042	32%	0.317	C	S	.	.			trans	-70.6	147.9	172.1	77.4	0	0	0	0	110.1	P119 L120 V190	P119-S188 WeakPolarHBondContact CA-OG 3.29Å; L120-S188 WeakPolarHBondContact CD2-O 3.49Å; L120-S188 PolarHBondContact N-OG 3.29Å; S188-V190 PolarHBondContact OG-O 2.86Å
189	T	93.8	Very high	93.3	Very high	76 Å²	76	60.6 Å²	60.6	47%	0.466	31%	0.307	S	S	.	.	S	Bend	trans	-94.1	-13.7	-178.2	47.1	0	0	0	0	113.4	S146 V148	S146-T189 PolarHBondContact O-OG1 2.68Å; V148-T189 HydrophobicContact CG1-CG2 3.66Å; V148-T189 HydrophobicContact CG2-CG2 4.35Å
190	V	89.7	Confident	93.5	Very high	83 Å²	83	59.9 Å²	59.9	50%	0.503	30%	0.301	S	S	.	.	S	Bend	trans	-127.9	142.6	-178.7	-166	0	0	0	0	109.6	S188 R192	S188-V190 PolarHBondContact OG-O 2.86Å; V190-R192 HydrophobicContact CG1-CG 4.18Å; V190-R192 PolarHBondContact O-N 3.07Å
191	Y	91.3	Very high	93.8	Very high	131 Å²	131	57.9 Å²	57.9	51%	0.514	29%	0.291	S	S	.	.			trans	-77.7	101.3	169.5	-172.8	-93.6	0	0	0	110.1	P119 L120 M193	P119-Y191 HydrophobicContact CB-CD2 3.83Å; P119-Y191 HydrophobicContact CB-CE2 4.19Å; L120-Y191 HydrophobicContact CD1-CD2 4.38Å; Y191-M193 HydrophobicContact CE1-CG 4.13Å
192	R	87.5	Confident	93.9	Very high	159 Å²	159	59.8 Å²	59.8	60%	0.6	30%	0.302	S	S	*	.			trans	-132.3	129.3	171.1	-70.5	-167.8	176	-139.6	0.4	109.8	P119 V190 R194 T195	P119-R192 VanDerWaalsContact CG-O 3.28Å; P119-R192 WeakPolarHBondContact CG-O 3.33Å; V190-R192 HydrophobicContact CG1-CG 4.18Å; V190-R192 PolarHBondContact O-N 3.07Å; R192-R194 VanDerWaalsContact C-N 3.35Å; R192-R194 PolarHBondContact O-N 3.07Å; R192-T195 HydrophobicContact CB-CG2 3.73Å
193	M	85.4	Confident	94	Very high	132 Å²	132	57.9 Å²	57.9	65%	0.65	28%	0.281	S	S	*	.	S	Bend	trans	-71.6	-25.8	-170.3	-65.3	-176.9	-74.2	0	0	114.4	Y191 Q215 Q216	Y191-M193 HydrophobicContact CE1-CG 4.13Å; M193-Q215 WeakPolarHBondContact O-CA 3.3Å; M193-Q216 PolarHBondContact O-N 3.43Å
194	R	88.1	Confident	94	Very high	224 Å²	224	58.6 Å²	58.6	85%	0.845	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150	101.7	178.6	-171.5	178.4	-175.9	-175.6	-0.2	109.1	R192	R192-R194 VanDerWaalsContact C-N 3.35Å; R192-R194 PolarHBondContact O-N 3.07Å
195	T	93.3	Very high	94	Very high	59 Å²	59	65.9 Å²	65.9	36%	0.362	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	-174.4	176.2	-167.2	0	0	0	0	109.4	R192 I214	R192-T195 HydrophobicContact CB-CG2 3.73Å; T195-I214 HydrophobicContact CG2-CB 3.72Å; T195-I214 HydrophobicContact CG2-CD1 3.78Å; T195-I214 HydrophobicContact CG2-CG1 4.38Å; T195-I214 HydrophobicContact CG2-CG2 3.98Å; T195-I214 PolarHBondContact N-O 3.31Å; T195-I214 PolarHBondContact O-N 3.08Å; T195-I214 VanDerWaalsContact O-O 3.12Å
196	G	94.4	Very high	93.9	Very high	42 Å²	42	68.3 Å²	68.3	43%	0.433	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	164.2	177.4	0	0	0	0	0	111.2	I212	G196-I212 CarbonylContact C-O 3.56Å; G196-I212 WeakPolarHBondContact CA-O 3.38Å
197	D	96.5	Very high	93.8	Very high	6 Å²	6	74.1 Å²	74.1	3%	0.032	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	158.8	171.7	-155.1	-10.5	0	0	0	108.9	S145 S146 G147 Y186 I212 I214	S145-D197 WeakPolarHBondContact CA-OD1 3.31Å; S145-D197 WeakPolarHBondContact CB-OD1 3.39Å; S145-D197 PolarHBondContact N-OD1 2.67Å; S146-D197 PolarHBondContact N-OD1 2.83Å; S146-D197 PolarHBondContact N-OD2 2.68Å; S146-D197 VanDerWaalsContact N-OD2 3.08Å; G147-D197 PolarHBondContact N-OD2 2.94Å; Y186-D197 HydrophobicContact CE2-CB 4.37Å; Y186-D197 WeakPolarHBondContact CE2-OD2 3.43Å; Y186-D197 WeakPolarHBondContact OH-CB 3.3Å; Y186-D197 PolarHBondContact OH-OD2 3.28Å; D197-I212 HydrophobicContact CB-CB 4.21Å; D197-I212 PolarHBondContact N-O 2.75Å; D197-I212 PolarHBondContact O-N 3.28Å; D197-I214 HydrophobicContact CB-CD1 4.28Å
198	L	97.6	Very high	93.8	Very high	85 Å²	85	73 Å²	73	45%	0.445	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	126.9	174.4	-66.2	178	0	0	0	108.7	V144 S145 V209 P211	V144-L198 WeakPolarHBondContact CA-O 3.36Å; S145-L198 PolarHBondContact N-O 3.49Å; S145-L198 PolarHBondContact OG-O 3.44Å; L198-V209 HydrophobicContact CB-CG1 4.32Å; L198-V209 HydrophobicContact CD2-CG1 4.42Å; L198-P211 HydrophobicContact CD2-CB 4.43Å
199	A	97.6	Very high	93.8	Very high	0 Å²	0	76.1 Å²	76.1	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	126.9	174.3	0	0	0	0	0	110	L142 R143 V144 V209 F210 I212	L142-A199 HydrophobicContact CD1-CB 4.21Å; R143-A199 CarbonylContact O-C 3.56Å; R143-A199 VanDerWaalsContact O-CA 3.32Å; R143-A199 WeakPolarHBondContact O-CA 3.41Å; V144-A199 HydrophobicContact CG1-CB 4.02Å; A199-V209 CarbonylContact O-C 3.51Å; A199-V209 VanDerWaalsContact O-CA 3.3Å; A199-V209 WeakPolarHBondContact O-CA 3.43Å; A199-F210 HydrophobicContact CB-CD1 4.08Å; A199-F210 HydrophobicContact CB-CD2 4Å; A199-F210 HydrophobicContact CB-CE1 3.65Å; A199-F210 HydrophobicContact CB-CE2 3.55Å; A199-F210 HydrophobicContact CB-CG 4.25Å; A199-F210 HydrophobicContact CB-CZ 3.36Å; A199-F210 PolarHBondContact N-O 3.28Å; A199-F210 PolarHBondContact O-N 2.91Å; A199-I212 HydrophobicContact CB-CD1 4.03Å; A199-I212 HydrophobicContact CB-CG1 4.34Å
200	H	97.9	Very high	93.9	Very high	43 Å²	43	72.5 Å²	72.5	20%	0.199	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	111.7	175.5	-64.9	-105.5	0	0	0	108.2	L142 R143 E207	L142-H200 CarbonylContact C-O 3.55Å; L142-H200 WeakPolarHBondContact CA-O 3.47Å; R143-H200 HydrophobicContact CB-CB 4.36Å; R143-H200 PolarHBondContact N-O 3.46Å; R143-H200 PolarHBondContact O-N 2.97Å; H200-E207 IonicContact CE1-OE1 3.64Å; H200-E207 IonicContact CG-OE1 3.59Å; H200-E207 IonicContact ND1-OE1 2.88Å; H200-E207 PolarHBondContact ND1-OE1 2.89Å
201	F	97.2	Very high	94.2	Very high	1 Å²	1	71.3 Å²	71.3	0%	0.004	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.6	178.7	-175.1	-150.9	0	0	0	109	L108 L128 V140 T141 L142 L181 E207 A208 F210	L108-F201 HydrophobicContact CB-CD1 3.88Å; L108-F201 HydrophobicContact CB-CE1 3.92Å; L108-F201 HydrophobicContact CD1-CD1 4.14Å; L108-F201 HydrophobicContact CD1-CG 4.33Å; L108-F201 WeakPolarHBondContact CD1-O 3.43Å; L108-F201 HydrophobicContact CD2-CD1 3.87Å; L108-F201 HydrophobicContact CD2-CD2 4.47Å; L108-F201 HydrophobicContact CD2-CE1 3.59Å; L108-F201 HydrophobicContact CD2-CE2 4.21Å; L108-F201 HydrophobicContact CD2-CG 4.31Å; L108-F201 HydrophobicContact CD2-CZ 3.76Å; L108-F201 HydrophobicContact CG-CD1 4.19Å; L108-F201 HydrophobicContact CG-CE1 4.25Å; L128-F201 HydrophobicContact CD2-CD1 4.03Å; L128-F201 HydrophobicContact CD2-CE1 4.07Å; L128-F201 HydrophobicContact CD2-CG 4.49Å; V140-F201 HydrophobicContact CB-CE2 3.9Å; V140-F201 HydrophobicContact CG1-CE2 4.34Å; V140-F201 HydrophobicContact CG2-CE2 4.26Å; T141-F201 WeakPolarHBondContact O-CA 3.39Å; L142-F201 HydrophobicContact CD1-CB 3.76Å; L142-F201 HydrophobicContact CD1-CD2 4.19Å; L142-F201 HydrophobicContact CD1-CG 4.23Å; L181-F201 HydrophobicContact CD1-CZ 3.98Å; L181-F201 HydrophobicContact CD2-CE2 4.09Å; L181-F201 HydrophobicContact CD2-CZ 4.21Å; F201-E207 WeakPolarHBondContact O-CA 3Å; F201-A208 HydrophobicContact CB-CB 4.43Å; F201-A208 PolarHBondContact N-O 2.92Å; F201-A208 PolarHBondContact O-N 3.44Å; F201-F210 HydrophobicContact CB-CE1 4.21Å
202	T	97.3	Very high	94.5	Very high	41 Å²	41	65.1 Å²	65.1	25%	0.252	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	144.4	-172.1	64.9	0	0	0	0	112.8	V140 T141 H206 E207	V140-T202 VanDerWaalsContact CA-O 3.3Å; V140-T202 WeakPolarHBondContact CA-O 3.44Å; T141-T202 WeakPolarHBondContact CB-OG1 3.42Å; T141-T202 PolarHBondContact N-O 3.43Å; T141-T202 PolarHBondContact O-N 3.06Å; T141-T202 PolarHBondContact O-OG1 2.84Å; T202-H206 VanDerWaalsContact CA-O 3.29Å; T202-H206 WeakPolarHBondContact CA-O 3.34Å; T202-E207 HydrophobicContact CG2-CB 4.1Å; T202-E207 HydrophobicContact CG2-CG 3.93Å
203	F	95.9	Very high	94.8	Very high	6 Å²	6	60.2 Å²	60.2	3%	0.026	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	120.1	171.4	173.4	-103.9	0	0	0	109.3	P107 L108 L130 A132 Y138 K139 V140 H205 H206	P107-F203 HydrophobicContact CB-CD1 4.11Å; P107-F203 HydrophobicContact CB-CE1 4.45Å; P107-F203 HydrophobicContact CG-CD1 3.9Å; P107-F203 HydrophobicContact CG-CE1 4.49Å; L108-F203 HydrophobicContact CD2-CB 3.63Å; L108-F203 HydrophobicContact CG-CB 4.45Å; L130-F203 HydrophobicContact CD1-CB 3.88Å; L130-F203 HydrophobicContact CD1-CD1 3.72Å; L130-F203 HydrophobicContact CD1-CD2 3.74Å; L130-F203 HydrophobicContact CD1-CE1 4.18Å; L130-F203 HydrophobicContact CD1-CE2 4.22Å; L130-F203 HydrophobicContact CD1-CG 3.48Å; L130-F203 VanDerWaalsContact CD1-CG 3.48Å; L130-F203 HydrophobicContact CD1-CZ 4.42Å; L130-F203 HydrophobicContact CD2-CD2 3.79Å; L130-F203 HydrophobicContact CD2-CE2 3.69Å; L130-F203 HydrophobicContact CD2-CG 4.38Å; L130-F203 HydrophobicContact CD2-CZ 4.19Å; L130-F203 HydrophobicContact CG-CD2 4.47Å; A132-F203 HydrophobicContact CB-CE1 3.91Å; A132-F203 HydrophobicContact CB-CZ 3.96Å; Y138-F203 HydrophobicContact CD1-CE2 4.3Å; Y138-F203 HydrophobicContact CD1-CZ 4.39Å; K139-F203 VanDerWaalsContact O-CD2 3.32Å; K139-F203 WeakPolarHBondContact O-CD2 3.39Å; V140-F203 HydrophobicContact CG1-CB 4.15Å; V140-F203 HydrophobicContact CG1-CD2 3.83Å; V140-F203 HydrophobicContact CG1-CG 4.38Å; F203-H205 PolarHBondContact O-N 2.84Å; F203-H205 VanDerWaalsContact O-N 3.11Å; F203-H206 PolarHBondContact N-O 3.22Å; F203-H206 WeakPolarHBondContact O-CB 3.42Å; F203-H206 PolarHBondContact O-N 3.05Å
204	E	92.8	Very high	95.2	Very high	105 Å²	105	54.2 Å²	54.2	49%	0.491	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	-116	-174.1	-60.1	174.5	175.6	0	0	110.6	R135	R135-E204 IonicContact CZ-OE1 2.68Å; R135-E204 IonicContact NE-OE1 2.68Å; R135-E204 PolarHBondContact NE-OE1 3.26Å; R135-E204 IonicContact NH2-OE1 3.07Å; R135-E204 IonicContact NH2-OE2 3.69Å
205	H	92.8	Very high	95.4	Very high	153 Å²	153	47.4 Å²	47.4	71%	0.708	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	3.3	178.2	56.1	-80.8	0	0	0	113.4	F203	F203-H205 PolarHBondContact O-N 2.84Å; F203-H205 VanDerWaalsContact O-N 3.11Å
206	H	94.2	Very high	95.4	Very high	55 Å²	55	48.2 Å²	48.2	26%	0.255	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	132.6	178.2	-59.2	85.2	0	0	0	109.9	P107 L108 T202 F203	P107-H206 VanDerWaalsContact CD-CD2 3.4Å; P107-H206 WeakPolarHBondContact CD-CD2 3.34Å; P107-H206 HydrophobicContact CG-CB 4.07Å; L108-H206 HydrophobicContact CD1-CB 4.24Å; T202-H206 VanDerWaalsContact CA-O 3.29Å; T202-H206 WeakPolarHBondContact CA-O 3.34Å; F203-H206 PolarHBondContact N-O 3.22Å; F203-H206 WeakPolarHBondContact O-CB 3.42Å; F203-H206 PolarHBondContact O-N 3.05Å
207	E	95.3	Very high	95	Very high	123 Å²	123	50.8 Å²	50.8	58%	0.575	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	135.4	172	179.1	174.6	-151.9	0	0	109.5	H200 F201 T202 V209	H200-E207 IonicContact CE1-OE1 3.64Å; H200-E207 IonicContact CG-OE1 3.59Å; H200-E207 IonicContact ND1-OE1 2.88Å; H200-E207 PolarHBondContact ND1-OE1 2.89Å; F201-E207 WeakPolarHBondContact O-CA 3Å; T202-E207 HydrophobicContact CG2-CB 4.1Å; T202-E207 HydrophobicContact CG2-CG 3.93Å; E207-V209 HydrophobicContact CG-CG2 4.22Å
208	A	95.3	Very high	94.7	Very high	4 Å²	4	54.9 Å²	54.9	3%	0.033	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133	169.2	0	0	0	0	0	109.2	L108 Y110 F201	L108-A208 HydrophobicContact CB-CB 4.42Å; L108-A208 HydrophobicContact CD1-CB 3.92Å; Y110-A208 HydrophobicContact CD1-CB 3.5Å; Y110-A208 VanDerWaalsContact CD1-CB 3.5Å; Y110-A208 HydrophobicContact CD2-CB 4.31Å; Y110-A208 HydrophobicContact CE1-CB 3.21Å; Y110-A208 HydrophobicContact CE2-CB 4.06Å; Y110-A208 HydrophobicContact CG-CB 4.05Å; F201-A208 HydrophobicContact CB-CB 4.43Å; F201-A208 PolarHBondContact N-O 2.92Å; F201-A208 PolarHBondContact O-N 3.44Å
209	V	96.3	Very high	94.4	Very high	70 Å²	70	56.9 Å²	56.9	42%	0.424	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.6	175.1	-173.2	0	0	0	0	108.9	L198 A199 E207	L198-V209 HydrophobicContact CB-CG1 4.32Å; L198-V209 HydrophobicContact CD2-CG1 4.42Å; A199-V209 CarbonylContact O-C 3.51Å; A199-V209 VanDerWaalsContact O-CA 3.3Å; A199-V209 WeakPolarHBondContact O-CA 3.43Å; E207-V209 HydrophobicContact CG-CG2 4.22Å
210	F	96.1	Very high	94.2	Very high	1 Å²	1	59.4 Å²	59.4	0%	0.004	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	148.7	177.5	64.6	-90.2	0	0	0	113.6	Y110 P111 F115 I125 L128 L142 A199 F201 I212	Y110-F210 HydrophobicContact CD2-CB 3.93Å; Y110-F210 AromaticContact CD2-CD1 3.89Å; Y110-F210 HydrophobicContact CD2-CD1 3.89Å; Y110-F210 HydrophobicContact CD2-CG 4.18Å; Y110-F210 HydrophobicContact CE2-CB 4.4Å; Y110-F210 HydrophobicContact CG-CD1 4.18Å; P111-F210 HydrophobicContact CG-CD2 3.77Å; P111-F210 HydrophobicContact CG-CE2 3.65Å; P111-F210 HydrophobicContact CG-CG 4.44Å; P111-F210 HydrophobicContact CG-CZ 4.24Å; P111-F210 WeakPolarHBondContact O-CB 3.26Å; P111-F210 WeakPolarHBondContact O-CD2 3.44Å; P111-F210 WeakPolarHBondContact O-CG 3.34Å; F115-F210 HydrophobicContact CD1-CE2 4.39Å; I125-F210 HydrophobicContact CG2-CE2 4.15Å; I125-F210 HydrophobicContact CG2-CZ 4.08Å; L128-F210 HydrophobicContact CD2-CE1 4.17Å; L128-F210 HydrophobicContact CD2-CZ 4.13Å; L142-F210 HydrophobicContact CD1-CE1 4.11Å; L142-F210 HydrophobicContact CD1-CZ 4.21Å; A199-F210 HydrophobicContact CB-CD1 4.08Å; A199-F210 HydrophobicContact CB-CD2 4Å; A199-F210 HydrophobicContact CB-CE1 3.65Å; A199-F210 HydrophobicContact CB-CE2 3.55Å; A199-F210 HydrophobicContact CB-CG 4.25Å; A199-F210 HydrophobicContact CB-CZ 3.36Å; A199-F210 PolarHBondContact N-O 3.28Å; A199-F210 PolarHBondContact O-N 2.91Å; F201-F210 HydrophobicContact CB-CE1 4.21Å; F210-I212 HydrophobicContact CE2-CG1 4.23Å
211	P	96.5	Very high	94	Very high	58 Å²	58	61.7 Å²	61.7	38%	0.377	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	141.9	-179.7	32.7	-34.5	0	0	0	112	I112 L198	I112-P211 WeakPolarHBondContact O-CD 3.44Å; L198-P211 HydrophobicContact CD2-CB 4.43Å
212	I	95.8	Very high	93.9	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	115.1	165.6	-53	177.5	0	0	0	106.9	F115 V117 V144 Y186 G196 D197 A199 F210	F115-I212 HydrophobicContact CD1-CB 4.24Å; F115-I212 HydrophobicContact CD1-CG1 3.83Å; F115-I212 HydrophobicContact CD1-CG2 3.93Å; F115-I212 HydrophobicContact CE1-CB 4.35Å; F115-I212 HydrophobicContact CE1-CD1 4.04Å; F115-I212 HydrophobicContact CE1-CG1 3.85Å; F115-I212 HydrophobicContact CE1-CG2 3.77Å; V117-I212 HydrophobicContact CG1-CG2 4.04Å; V117-I212 HydrophobicContact CG2-CG2 3.92Å; V144-I212 HydrophobicContact CG1-CD1 4.09Å; Y186-I212 HydrophobicContact CD1-CD1 4.31Å; Y186-I212 HydrophobicContact CD1-CG2 3.91Å; Y186-I212 HydrophobicContact CD2-CD1 3.51Å; Y186-I212 HydrophobicContact CE1-CG2 3.89Å; Y186-I212 HydrophobicContact CE2-CD1 3.71Å; Y186-I212 HydrophobicContact CG-CD1 3.8Å; Y186-I212 HydrophobicContact CG-CG2 4.42Å; G196-I212 CarbonylContact C-O 3.56Å; G196-I212 WeakPolarHBondContact CA-O 3.38Å; D197-I212 HydrophobicContact CB-CB 4.21Å; D197-I212 PolarHBondContact N-O 2.75Å; D197-I212 PolarHBondContact O-N 3.28Å; A199-I212 HydrophobicContact CB-CD1 4.03Å; A199-I212 HydrophobicContact CB-CG1 4.34Å; F210-I212 HydrophobicContact CE2-CG1 4.23Å
213	V	94.9	Very high	93.8	Very high	56 Å²	56	64.3 Å²	64.3	34%	0.339	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	121.3	177.3	-179	0	0	0	0	108.8	F115 T116 V117 Q215	F115-V213 PolarHBondContact O-N 3.15Å; T116-V213 CarbonylContact C-O 3.49Å; T116-V213 VanDerWaalsContact CA-O 3.25Å; T116-V213 WeakPolarHBondContact CA-O 3.47Å; T116-V213 HydrophobicContact CG2-CB 4.33Å; T116-V213 HydrophobicContact CG2-CG1 4.23Å; V117-V213 PolarHBondContact N-O 2.95Å; V213-Q215 HydrophobicContact CG1-CB 4.29Å
214	I	94.3	Very high	93.6	Very high	6 Å²	6	68 Å²	68	3%	0.031	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	111.5	176.5	-60.9	154.1	0	0	0	107.7	V117 P119 Y186 T195 D197	V117-I214 HydrophobicContact CG2-CB 4.26Å; V117-I214 HydrophobicContact CG2-CG1 3.66Å; V117-I214 WeakPolarHBondContact O-CA 3.41Å; P119-I214 HydrophobicContact CB-CG2 4.23Å; P119-I214 HydrophobicContact CG-CG2 3.84Å; Y186-I214 HydrophobicContact CE1-CD1 4.35Å; Y186-I214 HydrophobicContact CE1-CG1 4.24Å; Y186-I214 WeakPolarHBondContact OH-CD1 3.45Å; T195-I214 HydrophobicContact CG2-CB 3.72Å; T195-I214 HydrophobicContact CG2-CD1 3.78Å; T195-I214 HydrophobicContact CG2-CG1 4.38Å; T195-I214 HydrophobicContact CG2-CG2 3.98Å; T195-I214 PolarHBondContact N-O 3.31Å; T195-I214 PolarHBondContact O-N 3.08Å; T195-I214 VanDerWaalsContact O-O 3.12Å; D197-I214 HydrophobicContact CB-CD1 4.28Å
215	Q	92.4	Very high	93.4	Very high	82 Å²	82	63.7 Å²	63.7	38%	0.383	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	130.8	-173.8	-171.9	172.9	6.8	0	0	112.1	T116 V117 M193 V213 T217	T116-Q215 HydrophobicContact CG2-CB 3.98Å; V117-Q215 PolarHBondContact O-N 3.25Å; M193-Q215 WeakPolarHBondContact O-CA 3.3Å; V213-Q215 HydrophobicContact CG1-CB 4.29Å; Q215-T217 PolarHBondContact O-N 3.37Å
216	Q	91.9	Very high	93.3	Very high	75 Å²	75	56.8 Å²	56.8	35%	0.35	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-71.2	128.3	171.9	-177.9	59.4	43.3	0	0	110.1	M193 S218	M193-Q216 PolarHBondContact O-N 3.43Å; Q216-S218 PolarHBondContact O-N 3.08Å
217	T	87.2	Confident	92.9	Very high	97 Å²	97	60.3 Å²	60.3	60%	0.595	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-64.6	129.8	173	-49.9	0	0	0	0	110.2	Q215	Q215-T217 PolarHBondContact O-N 3.37Å
218	S	88.6	Confident	92.9	Very high	91 Å²	91	58 Å²	58	64%	0.636	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-83.6	143.4	176.7	54.1	0	0	0	0	111.7	Q216	Q216-S218 PolarHBondContact O-N 3.08Å
219	V	91.6	Very high	92.9	Very high	128 Å²	128	59 Å²	59	78%	0.776	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-77.7	127.4	168.7	-178.1	0	0	0	0	108.2
220	P	93.6	Very high	93	Very high	52 Å²	52	57.9 Å²	57.9	34%	0.338	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-68.6	134.8	-179.9	28.4	-35.2	0	0	0	111	Y85 L222	Y85-P220 HydrophobicContact CD2-CB 4.27Å; Y85-P220 HydrophobicContact CD2-CG 4.32Å; Y85-P220 HydrophobicContact CE2-CB 4.08Å; Y85-P220 HydrophobicContact CE2-CG 3.95Å; P220-L222 HydrophobicContact CB-CD2 4.3Å; P220-L222 HydrophobicContact CB-CG 4.47Å
221	V	93.1	Very high	93	Very high	92 Å²	92	61.8 Å²	61.8	56%	0.558	35%	0.35	S	S	*	.			trans	-102.4	112.7	168.9	-178.7	0	0	0	0	107.8
222	L	95.4	Very high	93	Very high	56 Å²	56	62.1 Å²	62.1	29%	0.293	34%	0.344	S	S	.	.			trans	-112.2	148.8	-178.6	-53.5	-178.5	0	0	0	109.6	R81 Y85 H88 P220	R81-L222 HydrophobicContact CG-CD1 4.37Å; Y85-L222 HydrophobicContact CD2-CD1 4.27Å; Y85-L222 HydrophobicContact CD2-CD2 4.42Å; H88-L222 HydrophobicContact CB-CD2 3.67Å; P220-L222 HydrophobicContact CB-CD2 4.3Å; P220-L222 HydrophobicContact CB-CG 4.47Å
223	Y	94.9	Very high	93.1	Very high	40 Å²	40	62.1 Å²	62.1	16%	0.157	34%	0.344	C	S	.	.			trans	-108.5	129.2	174.7	-68.4	-94.8	0	0	0	109	I225 K304 D396	Y223-I225 PolarHBondContact O-N 2.75Å; Y223-K304 VanDerWaalsContact CD1-CA 3.49Å; Y223-K304 HydrophobicContact CD1-CB 4.06Å; Y223-K304 HydrophobicContact CD2-CB 4.15Å; Y223-K304 HydrophobicContact CD2-CG 3.87Å; Y223-K304 HydrophobicContact CG-CB 3.7Å; Y223-K304 HydrophobicContact CG-CG 3.92Å; Y223-D396 HydrophobicContact CE2-CB 4.47Å
224	D	92.6	Very high	93.3	Very high	85 Å²	85	59.5 Å²	59.5	46%	0.455	33%	0.328	S	S	.	.			trans	-78	103.7	166.9	-171.2	-1.9	0	0	0	108.4	R80 G226	R80-D224 IonicContact CZ-OD1 3.84Å; R80-D224 IonicContact CZ-OD2 2.87Å; R80-D224 IonicContact NE-OD1 3.13Å; R80-D224 PolarHBondContact NE-OD1 3.12Å; R80-D224 IonicContact NE-OD2 3.49Å; R80-D224 IonicContact NH2-OD1 3.64Å; R80-D224 PolarHBondContact NH2-OD1 3.26Å; R80-D224 IonicContact NH2-OD2 2.79Å; R80-D224 PolarHBondContact NH2-OD2 3.41Å; D224-G226 VanDerWaalsContact C-N 3.28Å; D224-G226 PolarHBondContact O-N 2.89Å; D224-G226 PolarHBondContact OD1-N 2.85Å
225	I	89.4	Confident	93.6	Very high	13 Å²	13	59.2 Å²	59.2	7%	0.067	33%	0.326	C	S	.	.			trans	-85.3	1.9	-172.8	59.3	166.2	0	0	0	114.1	E84 Y223 R232 K304	E84-I225 WeakPolarHBondContact OE1-CD1 3.43Å; Y223-I225 PolarHBondContact O-N 2.75Å; I225-R232 HydrophobicContact CB-CG 4.1Å; I225-R232 WeakPolarHBondContact O-CG 3.48Å; I225-R232 PolarHBondContact O-NE 2.96Å; I225-R232 VanDerWaalsContact O-NE 3.16Å; I225-K304 HydrophobicContact CG2-CB 3.78Å; I225-K304 HydrophobicContact CG2-CD 3.28Å; I225-K304 HydrophobicContact CG2-CG 4.17Å
226	G	89.6	Confident	93.9	Very high	9 Å²	9	55.3 Å²	55.3	9%	0.093	31%	0.308	C	S	.	.			trans	50	-156.6	-179.9	0	0	0	0	0	113.8	D224 R232	D224-G226 VanDerWaalsContact C-N 3.28Å; D224-G226 PolarHBondContact O-N 2.89Å; D224-G226 PolarHBondContact OD1-N 2.85Å; G226-R232 PolarHBondContact O-NH2 2.94Å
227	N	86.8	Confident	94.2	Very high	128 Å²	128	51.7 Å²	51.7	68%	0.684	29%	0.291	S	S	*	.	S	Bend	trans	-113.7	-16.5	178.6	-67.7	-28.9	0	0	0	112.7
228	D	93.9	Very high	94.6	Very high	75 Å²	75	48 Å²	48	40%	0.401	27%	0.267	S	S	.	.	S	Bend	trans	-101.5	150.5	-175.8	-166.8	-74.5	0	0	0	111	N230 D231 R232	D228-N230 PolarHBondContact O-N 2.82Å; D228-N230 VanDerWaalsContact OD1-CB 3.23Å; D228-N230 WeakPolarHBondContact OD1-CB 3.41Å; D228-N230 PolarHBondContact OD1-N 3.36Å; D228-N230 PolarHBondContact OD1-ND2 3.17Å; D228-D231 PolarHBondContact O-N 2.85Å; D228-D231 VanDerWaalsContact O-N 3.14Å; D228-R232 WeakPolarHBondContact O-CG 3.39Å
229	I	96.8	Very high	95	Very high	24 Å²	24	43.6 Å²	43.6	12%	0.123	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-30	176.9	-167.4	60.4	0	0	0	112.3	D231 R232 V233 Y257 I321 E322 V325	I229-D231 VanDerWaalsContact C-N 3.26Å; I229-D231 PolarHBondContact O-N 3.38Å; I229-R232 HydrophobicContact CD1-CB 4.4Å; I229-R232 WeakPolarHBondContact O-CB 3.5Å; I229-R232 PolarHBondContact O-N 2.92Å; I229-V233 HydrophobicContact CD1-CB 4.46Å; I229-V233 HydrophobicContact CD1-CG2 3.8Å; I229-V233 HydrophobicContact CG1-CG2 4.49Å; I229-V233 PolarHBondContact O-N 3.24Å; I229-Y257 HydrophobicContact CG2-CD1 4.28Å; I229-Y257 HydrophobicContact CG2-CE1 4.42Å; I229-I321 HydrophobicContact CD1-CB 4.5Å; I229-I321 HydrophobicContact CD1-CG2 3.96Å; I229-I321 HydrophobicContact CG1-CG2 4.25Å; I229-E322 HydrophobicContact CD1-CG 4.37Å; I229-V325 HydrophobicContact CD1-CG2 3.87Å
230	N	97	Very high	95.2	Very high	48 Å²	48	37.8 Å²	37.8	26%	0.257	20%	0.201	S	C	.	.	H	α-helix	trans	-64.6	-27.8	178.4	-62.4	-52.9	0	0	0	112.7	D228 R232 I260	D228-N230 PolarHBondContact O-N 2.82Å; D228-N230 VanDerWaalsContact OD1-CB 3.23Å; D228-N230 WeakPolarHBondContact OD1-CB 3.41Å; D228-N230 PolarHBondContact OD1-N 3.36Å; D228-N230 PolarHBondContact OD1-ND2 3.17Å; N230-R232 VanDerWaalsContact C-N 3.32Å; N230-I260 WeakPolarHBondContact OD1-CA 3.47Å; N230-I260 WeakPolarHBondContact OD1-CB 3.48Å; N230-I260 PolarHBondContact OD1-N 3.39Å
231	D	95.8	Very high	95.3	Very high	83 Å²	83	36.7 Å²	36.7	44%	0.444	19%	0.192	S	C	.	.	H	α-helix	trans	-80.7	-17.2	174.8	-61.2	-41.7	0	0	0	112.2	D228 I229 T303	D228-D231 PolarHBondContact O-N 2.85Å; D228-D231 VanDerWaalsContact O-N 3.14Å; I229-D231 VanDerWaalsContact C-N 3.26Å; I229-D231 PolarHBondContact O-N 3.38Å; D231-T303 WeakPolarHBondContact O-CG2 3.45Å
232	R	97.6	Very high	95.4	Very high	65 Å²	65	32.9 Å²	32.9	25%	0.245	17%	0.168	C	C	.	.	H	α-helix	trans	-100.9	-37	-169.6	-63.6	179.6	-178.9	-170.3	1.8	112.9	I225 G226 D228 I229 N230 T303 Y305	I225-R232 HydrophobicContact CB-CG 4.1Å; I225-R232 WeakPolarHBondContact O-CG 3.48Å; I225-R232 PolarHBondContact O-NE 2.96Å; I225-R232 VanDerWaalsContact O-NE 3.16Å; G226-R232 PolarHBondContact O-NH2 2.94Å; D228-R232 WeakPolarHBondContact O-CG 3.39Å; I229-R232 HydrophobicContact CD1-CB 4.4Å; I229-R232 WeakPolarHBondContact O-CB 3.5Å; I229-R232 PolarHBondContact O-N 2.92Å; N230-R232 VanDerWaalsContact C-N 3.32Å; R232-T303 WeakPolarHBondContact O-CB 3.47Å; R232-Y305 PolarHBondContact O-N 3.38Å
233	V	98.7	Very high	95.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	131.9	-169.2	-174.2	0	0	0	0	111	I229 I260 Y305 L307 I321 V325 L392	I229-V233 HydrophobicContact CD1-CB 4.46Å; I229-V233 HydrophobicContact CD1-CG2 3.8Å; I229-V233 HydrophobicContact CG1-CG2 4.49Å; I229-V233 PolarHBondContact O-N 3.24Å; V233-I260 HydrophobicContact CB-CD1 4.36Å; V233-I260 HydrophobicContact CG1-CD1 4.45Å; V233-I260 WeakPolarHBondContact O-CG1 3.4Å; V233-Y305 WeakPolarHBondContact CA-O 3.5Å; V233-L307 HydrophobicContact CG1-CB 4.02Å; V233-I321 HydrophobicContact CB-CG2 4.13Å; V233-I321 HydrophobicContact CG1-CG2 3.92Å; V233-I321 HydrophobicContact CG2-CG2 3.79Å; V233-V325 HydrophobicContact CG2-CG2 3.54Å; V233-L392 HydrophobicContact CG1-CD1 3.76Å; V233-L392 HydrophobicContact CG2-CD1 3.95Å
234	T	98.9	Very high	95.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132.6	163.8	-61.1	0	0	0	0	108.5	V236 K261 I263 V301 T303 Y305 F306 L307	T234-V236 HydrophobicContact CG2-CG1 4.21Å; T234-K261 HydrophobicContact CG2-CB 4.12Å; T234-K261 HydrophobicContact CG2-CD 4.2Å; T234-K261 HydrophobicContact CG2-CG 4.05Å; T234-I263 HydrophobicContact CG2-CB 4.48Å; T234-I263 HydrophobicContact CG2-CD1 3.69Å; T234-I263 HydrophobicContact CG2-CG1 3.74Å; T234-V301 HydrophobicContact CG2-CG2 4.28Å; T234-T303 WeakPolarHBondContact CB-OG1 3.48Å; T234-T303 PolarHBondContact N-OG1 3.47Å; T234-T303 VanDerWaalsContact N-OG1 3.07Å; T234-T303 WeakPolarHBondContact OG1-CG2 3.18Å; T234-T303 PolarHBondContact OG1-OG1 3.49Å; T234-Y305 PolarHBondContact N-O 3.33Å; T234-F306 CarbonylContact O-C 3.58Å; T234-F306 WeakPolarHBondContact O-CA 3.46Å; T234-F306 VanDerWaalsContact O-CB 3.3Å; T234-F306 WeakPolarHBondContact O-CB 3.21Å; T234-L307 PolarHBondContact O-N 3.12Å
235	I	98.9	Very high	95.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	130.7	170.3	-61.8	177	0	0	0	108	I253 I260 K261 I262 I263 L307 V309 F315 I321	I235-I253 HydrophobicContact CD1-CD1 4Å; I235-I253 HydrophobicContact CD1-CG1 4.06Å; I235-I253 HydrophobicContact CD1-CG2 3.64Å; I235-I253 HydrophobicContact CG2-CD1 4.01Å; I235-I260 HydrophobicContact CD1-CD1 4.11Å; I235-I260 HydrophobicContact CD1-CG2 3.69Å; I235-I260 HydrophobicContact CG1-CD1 3.96Å; I235-I260 HydrophobicContact CG1-CG1 4.36Å; I235-I260 HydrophobicContact CG1-CG2 4.32Å; I235-K261 PolarHBondContact N-O 3.07Å; I235-I262 HydrophobicContact CB-CG1 4.45Å; I235-I262 CarbonylContact O-C 3.54Å; I235-I262 WeakPolarHBondContact O-CA 3.16Å; I235-I263 PolarHBondContact O-N 3.44Å; I235-L307 HydrophobicContact CG1-CB 4.45Å; I235-L307 HydrophobicContact CG1-CD2 4.45Å; I235-V309 HydrophobicContact CG2-CG2 3.68Å; I235-F315 HydrophobicContact CD1-CE1 4.24Å; I235-F315 HydrophobicContact CD1-CZ 3.84Å; I235-I321 HydrophobicContact CD1-CD1 4.1Å; I235-I321 HydrophobicContact CG1-CD1 4.33Å
236	V	98.8	Very high	96.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.2	176.9	-58.9	0	0	0	0	109.7	T234 I263 A297 V298 V301 F306 L307 W308 V309	T234-V236 HydrophobicContact CG2-CG1 4.21Å; V236-I263 WeakPolarHBondContact CA-O 3.46Å; V236-I263 HydrophobicContact CG1-CB 4.24Å; V236-A297 HydrophobicContact CB-CB 4.12Å; V236-A297 HydrophobicContact CG1-CB 4.48Å; V236-V298 HydrophobicContact CG2-CG2 4.46Å; V236-V301 HydrophobicContact CG1-CG2 3.48Å; V236-V301 VanDerWaalsContact CG1-CG2 3.48Å; V236-F306 HydrophobicContact CG1-CB 4.1Å; V236-F306 HydrophobicContact CG2-CB 4.28Å; V236-F306 HydrophobicContact CG2-CD2 3.33Å; V236-F306 HydrophobicContact CG2-CE2 3.98Å; V236-F306 HydrophobicContact CG2-CG 4.11Å; V236-L307 PolarHBondContact N-O 3.43Å; V236-W308 HydrophobicContact CB-CE3 4.45Å; V236-W308 HydrophobicContact CG2-CB 4.37Å; V236-W308 HydrophobicContact CG2-CD2 4.35Å; V236-W308 HydrophobicContact CG2-CE3 3.51Å; V236-W308 HydrophobicContact CG2-CZ3 4.02Å; V236-V309 PolarHBondContact O-N 3.34Å; V236-V309 VanDerWaalsContact O-N 3.13Å
237	T	98.4	Very high	96.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	166.6	175.9	-166.5	0	0	0	0	110.6	L246 L249 I263 I264 A265 V309 D311	T237-L246 HydrophobicContact CG2-CD1 3.93Å; T237-L249 HydrophobicContact CG2-CD2 4.3Å; T237-I263 PolarHBondContact N-O 3.14Å; T237-I264 HydrophobicContact CG2-CB 4.37Å; T237-I264 HydrophobicContact CG2-CG1 3.91Å; T237-I264 HydrophobicContact CG2-CG2 4.26Å; T237-I264 WeakPolarHBondContact O-CA 3.15Å; T237-A265 PolarHBondContact O-N 3.35Å; T237-V309 WeakPolarHBondContact CA-O 3.44Å; T237-V309 VanDerWaalsContact CB-O 3.31Å; T237-V309 WeakPolarHBondContact CB-O 3.44Å; T237-V309 PolarHBondContact OG1-O 3Å; T237-D311 PolarHBondContact OG1-N 2.93Å
238	K	96.9	Very high	97	Very high	18 Å²	18	29.7 Å²	29.7	8%	0.078	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	132.2	176.5	-177.9	-82.8	179.3	-169	0	108.9	A265 D267 W308	K238-A265 CarbonylContact C-O 3.51Å; K238-A265 VanDerWaalsContact CA-O 3.23Å; K238-A265 WeakPolarHBondContact CA-O 3.29Å; K238-A265 HydrophobicContact CB-CB 4.39Å; K238-A265 HydrophobicContact CG-CB 4.23Å; K238-D267 VanDerWaalsContact CE-CG 3.48Å; K238-D267 WeakPolarHBondContact CE-OD1 3.45Å; K238-D267 WeakPolarHBondContact CE-OD2 3.45Å; K238-D267 IonicContact NZ-OD1 3.27Å; K238-D267 PolarHBondContact NZ-OD1 3.16Å; K238-D267 IonicContact NZ-OD2 2.97Å; K238-D267 PolarHBondContact NZ-OD2 3.05Å; K238-D267 VanDerWaalsContact NZ-OD2 3.07Å; K238-W308 HydrophobicContact CB-CH2 3.68Å; K238-W308 HydrophobicContact CB-CZ2 4.03Å
239	T	96.7	Very high	97.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	157.5	177.4	-162.6	0	0	0	0	112.8	Y243 L246 I264 A265 D266 D267 D311	T239-Y243 HydrophobicContact CG2-CE1 4.5Å; T239-L246 HydrophobicContact CG2-CD2 3.84Å; T239-I264 HydrophobicContact CG2-CG2 4.09Å; T239-A265 PolarHBondContact N-O 3.24Å; T239-D266 HydrophobicContact CG2-CB 3.89Å; T239-D267 VanDerWaalsContact O-OD1 3.08Å; T239-D311 WeakPolarHBondContact CA-OD2 3.49Å; T239-D311 PolarHBondContact OG1-OD2 3.12Å
240	F	96.2	Very high	97.3	Very high	6 Å²	6	25.5 Å²	25.5	3%	0.026	13%	0.131	C	C	.	.	S	Bend	trans	-155.2	109	169.6	-179.8	-114	0	0	0	109.6	R242 D267 L269 A287 Y444 F447	F240-R242 PolarHBondContact O-N 2.79Å; F240-R242 VanDerWaalsContact O-N 3.13Å; F240-D267 WeakPolarHBondContact CB-OD1 3.48Å; F240-D267 WeakPolarHBondContact CD2-O 3.11Å; F240-D267 WeakPolarHBondContact CD2-OD1 3.31Å; F240-D267 VanDerWaalsContact CE2-O 3.28Å; F240-D267 WeakPolarHBondContact CE2-O 3.49Å; F240-L269 HydrophobicContact CE2-CD2 4.03Å; F240-L269 HydrophobicContact CE2-CG 4.3Å; F240-L269 HydrophobicContact CZ-CD2 4.17Å; F240-L269 HydrophobicContact CZ-CG 4.35Å; F240-A287 HydrophobicContact CE2-CB 3.97Å; F240-A287 HydrophobicContact CZ-CB 4.1Å; F240-Y444 AromaticContact CD1-CD2 3.79Å; F240-Y444 HydrophobicContact CD1-CD2 3.79Å; F240-Y444 HydrophobicContact CD1-CE2 4.19Å; F240-Y444 HydrophobicContact CE1-CD2 4.48Å; F240-Y444 VanDerWaalsContact O-CD2 3.32Å; F240-Y444 WeakPolarHBondContact O-CD2 3.18Å; F240-F447 HydrophobicContact CE1-CB 3.64Å; F240-F447 HydrophobicContact CE1-CD1 4.33Å; F240-F447 AromaticContact CE1-CD2 3.64Å; F240-F447 HydrophobicContact CE1-CD2 3.64Å; F240-F447 HydrophobicContact CE1-CE2 4.4Å; F240-F447 AromaticContact CE1-CG 3.62Å; F240-F447 HydrophobicContact CE1-CG 3.62Å; F240-F447 HydrophobicContact CZ-CB 4.28Å; F240-F447 HydrophobicContact CZ-CD1 4.12Å; F240-F447 AromaticContact CZ-CD2 3.74Å; F240-F447 HydrophobicContact CZ-CD2 3.74Å; F240-F447 HydrophobicContact CZ-CE1 4.38Å; F240-F447 HydrophobicContact CZ-CE2 4.06Å; F240-F447 AromaticContact CZ-CG 3.79Å; F240-F447 HydrophobicContact CZ-CG 3.79Å; F240-F447 HydrophobicContact CZ-CZ 4.36Å
241	L	95.9	Very high	97.4	Very high	29 Å²	29	26.7 Å²	26.7	15%	0.152	14%	0.142	C	C	.	.	S	Bend	trans	57.9	22.1	178	-52.3	178.3	0	0	0	114.7	S268 L269 N441 K443	L241-S268 PolarHBondContact N-OG 3.08Å; L241-L269 HydrophobicContact CD2-CB 4.41Å; L241-L269 HydrophobicContact CD2-CG 4.26Å; L241-N441 PolarHBondContact O-ND2 2.67Å; L241-K443 HydrophobicContact CD1-CB 4.35Å; L241-K443 HydrophobicContact CD1-CD 4.12Å; L241-K443 HydrophobicContact CD1-CG 3.87Å
242	R	95	Very high	97.5	Very high	12 Å²	12	23.2 Å²	23.2	5%	0.045	13%	0.125	C	C	.	.			trans	-127.3	45.9	-174	-72.7	-166.9	-63.9	176.2	-4.5	112.6	F240 T244 E245 L246 D311 D312 Y444	F240-R242 PolarHBondContact O-N 2.79Å; F240-R242 VanDerWaalsContact O-N 3.13Å; R242-T244 VanDerWaalsContact C-N 3.28Å; R242-T244 PolarHBondContact O-N 3.32Å; R242-E245 VanDerWaalsContact CA-OE2 3.31Å; R242-E245 WeakPolarHBondContact CA-OE2 3.32Å; R242-E245 HydrophobicContact CB-CB 4.37Å; R242-E245 WeakPolarHBondContact CB-OE2 3.37Å; R242-E245 PolarHBondContact O-N 3.43Å; R242-L246 WeakPolarHBondContact O-CB 3.46Å; R242-L246 PolarHBondContact O-N 3.13Å; R242-D311 IonicContact CZ-OD1 2.67Å; R242-D311 IonicContact CZ-OD2 2.64Å; R242-D311 VanDerWaalsContact CZ-OD2 3.27Å; R242-D311 IonicContact NE-OD1 3.58Å; R242-D311 PolarHBondContact NE-OD1 3.46Å; R242-D311 VanDerWaalsContact NE-OD1 3.12Å; R242-D311 IonicContact NE-OD2 3.09Å; R242-D311 PolarHBondContact NE-OD2 2.88Å; R242-D311 IonicContact NH1-OD1 3.11Å; R242-D311 PolarHBondContact NH1-OD1 2.87Å; R242-D311 VanDerWaalsContact NH1-OD1 3.11Å; R242-D311 IonicContact NH2-OD1 2.62Å; R242-D311 PolarHBondContact NH2-OD1 3.32Å; R242-D311 IonicContact NH2-OD2 3.12Å; R242-D311 PolarHBondContact NH2-OD2 2.94Å; R242-D311 VanDerWaalsContact NH2-OD2 3.09Å; R242-D312 IonicContact NH1-OD1 3.9Å; R242-D312 IonicContact NH1-OD2 2.95Å; R242-D312 PolarHBondContact NH1-OD2 3.42Å; R242-Y444 HydrophobicContact CG-CD2 4.18Å; R242-Y444 HydrophobicContact CG-CE2 4.29Å; R242-Y444 HydrophobicContact CG-CG 4.43Å; R242-Y444 PolarHBondContact NH1-OH 3.35Å; R242-Y444 PolarHBondContact NH2-OH 3.08Å
243	Y	96.1	Very high	97.6	Very high	18 Å²	18	20.1 Å²	20.1	7%	0.071	11%	0.113	C	C	.	.	H	α-helix	trans	-62.4	-34.1	-179.1	-70.6	-72.5	0	0	0	112.8	T239 L246 Q247 D266 S268 P271 Q272 V274	T239-Y243 HydrophobicContact CG2-CE1 4.5Å; Y243-L246 HydrophobicContact CD1-CD2 4.24Å; Y243-L246 PolarHBondContact O-N 3.39Å; Y243-Q247 WeakPolarHBondContact O-CB 3.13Å; Y243-Q247 VanDerWaalsContact O-CG 3.24Å; Y243-Q247 WeakPolarHBondContact O-CG 3.49Å; Y243-Q247 PolarHBondContact O-N 3.02Å; Y243-D266 WeakPolarHBondContact CE1-OD2 3.44Å; Y243-D266 VanDerWaalsContact OH-CG 3.24Å; Y243-D266 PolarHBondContact OH-OD1 2.88Å; Y243-D266 PolarHBondContact OH-OD2 2.82Å; Y243-S268 WeakPolarHBondContact OH-CB 3.23Å; Y243-S268 PolarHBondContact OH-OG 2.9Å; Y243-P271 WeakPolarHBondContact OH-CA 3.05Å; Y243-Q272 HydrophobicContact CD1-CB 4.05Å; Y243-Q272 HydrophobicContact CD2-CB 4.08Å; Y243-Q272 VanDerWaalsContact CD2-CD 3.42Å; Y243-Q272 HydrophobicContact CD2-CG 3.79Å; Y243-Q272 HydrophobicContact CE1-CB 3.82Å; Y243-Q272 HydrophobicContact CE2-CB 3.81Å; Y243-Q272 HydrophobicContact CE2-CG 3.61Å; Y243-Q272 HydrophobicContact CG-CB 4.2Å; Y243-Q272 HydrophobicContact CG-CG 4.32Å; Y243-Q272 VanDerWaalsContact CZ-N 3.27Å; Y243-Q272 PolarHBondContact OH-N 2.79Å; Y243-V274 HydrophobicContact CD1-CG2 4.12Å; Y243-V274 HydrophobicContact CE1-CG2 4.04Å
244	T	95.5	Very high	97.5	Very high	95 Å²	95	22.1 Å²	22.1	58%	0.583	12%	0.121	S	C	*	.	H	α-helix	trans	-61.1	-50.1	177.2	-56.7	0	0	0	0	111	R242 Q247 V248 I439	R242-T244 VanDerWaalsContact C-N 3.28Å; R242-T244 PolarHBondContact O-N 3.32Å; T244-Q247 PolarHBondContact O-N 3.35Å; T244-V248 WeakPolarHBondContact O-CG2 3.49Å; T244-V248 PolarHBondContact O-N 3.43Å; T244-I439 HydrophobicContact CG2-CD1 4.22Å
245	E	96.9	Very high	97.5	Very high	16 Å²	16	26.8 Å²	26.8	8%	0.075	15%	0.149	C	C	.	.	H	α-helix	trans	-63.9	-43	178.1	-62.3	88.6	155.8	0	0	111.2	R242 Q247 V248 L249 D311 D312 Q436 I439	R242-E245 VanDerWaalsContact CA-OE2 3.31Å; R242-E245 WeakPolarHBondContact CA-OE2 3.32Å; R242-E245 HydrophobicContact CB-CB 4.37Å; R242-E245 WeakPolarHBondContact CB-OE2 3.37Å; R242-E245 PolarHBondContact O-N 3.43Å; E245-Q247 VanDerWaalsContact C-N 3.33Å; E245-Q247 PolarHBondContact O-N 3.18Å; E245-V248 WeakPolarHBondContact O-CB 3.49Å; E245-V248 PolarHBondContact O-N 3.21Å; E245-V248 VanDerWaalsContact O-N 3.16Å; E245-L249 PolarHBondContact O-N 2.66Å; E245-D311 CarbonylContact C-O 3.53Å; E245-D312 HydrophobicContact CB-CB 4.2Å; E245-D312 HydrophobicContact CG-CB 4.34Å; E245-Q436 PolarHBondContact O-NE2 2.84Å; E245-I439 HydrophobicContact CG-CD1 4.39Å
246	L	97.8	Very high	97.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.7	-41.3	177	177.9	62.9	0	0	0	112.2	T237 T239 R242 Y243 V248 L249 I250 I264 V274 D311	T237-L246 HydrophobicContact CG2-CD1 3.93Å; T239-L246 HydrophobicContact CG2-CD2 3.84Å; R242-L246 WeakPolarHBondContact O-CB 3.46Å; R242-L246 PolarHBondContact O-N 3.13Å; Y243-L246 HydrophobicContact CD1-CD2 4.24Å; Y243-L246 PolarHBondContact O-N 3.39Å; L246-V248 VanDerWaalsContact C-N 3.33Å; L246-V248 PolarHBondContact O-N 3.3Å; L246-L249 HydrophobicContact CD1-CD2 4.42Å; L246-L249 WeakPolarHBondContact O-CB 3.29Å; L246-L249 PolarHBondContact O-N 3.3Å; L246-I250 HydrophobicContact CD1-CD1 4.06Å; L246-I250 HydrophobicContact CD1-CG1 4.3Å; L246-I250 HydrophobicContact CG-CD1 3.87Å; L246-I250 VanDerWaalsContact O-CG1 3.28Å; L246-I250 WeakPolarHBondContact O-CG1 3.46Å; L246-I250 PolarHBondContact O-N 3.35Å; L246-I264 HydrophobicContact CD1-CD1 4.26Å; L246-I264 HydrophobicContact CD2-CD1 4.28Å; L246-I264 HydrophobicContact CD2-CG2 4.1Å; L246-V274 HydrophobicContact CD2-CG2 3.98Å; L246-D311 HydrophobicContact CB-CB 4.38Å; L246-D311 HydrophobicContact CD1-CB 4.25Å; L246-D311 PolarHBondContact N-O 3.28Å
247	Q	97.7	Very high	97.5	Very high	76 Å²	76	31.8 Å²	31.8	36%	0.355	17%	0.169	S	C	.	.	H	α-helix	trans	-66.4	-36	177.5	-71.2	-59.3	-22.6	0	0	112	Y243 T244 E245 S251	Y243-Q247 WeakPolarHBondContact O-CB 3.13Å; Y243-Q247 VanDerWaalsContact O-CG 3.24Å; Y243-Q247 WeakPolarHBondContact O-CG 3.49Å; Y243-Q247 PolarHBondContact O-N 3.02Å; T244-Q247 PolarHBondContact O-N 3.35Å; E245-Q247 VanDerWaalsContact C-N 3.33Å; E245-Q247 PolarHBondContact O-N 3.18Å; Q247-S251 VanDerWaalsContact O-CB 3.3Å; Q247-S251 WeakPolarHBondContact O-CB 3.17Å; Q247-S251 PolarHBondContact O-N 3.04Å; Q247-S251 PolarHBondContact O-OG 2.77Å
248	V	98	Very high	97.4	Very high	58 Å²	58	39 Å²	39	35%	0.352	20%	0.2	S	C	.	.	H	α-helix	trans	-66	-43.8	173.1	173.7	0	0	0	0	110.7	T244 E245 L246 S251 S252 L314 Q436	T244-V248 WeakPolarHBondContact O-CG2 3.49Å; T244-V248 PolarHBondContact O-N 3.43Å; E245-V248 WeakPolarHBondContact O-CB 3.49Å; E245-V248 PolarHBondContact O-N 3.21Å; E245-V248 VanDerWaalsContact O-N 3.16Å; L246-V248 VanDerWaalsContact C-N 3.33Å; L246-V248 PolarHBondContact O-N 3.3Å; V248-S251 PolarHBondContact O-N 3.08Å; V248-S252 WeakPolarHBondContact O-CB 3.2Å; V248-S252 PolarHBondContact O-N 2.59Å; V248-S252 PolarHBondContact O-OG 3.48Å; V248-L314 HydrophobicContact CG1-CD1 3.96Å; V248-Q436 VanDerWaalsContact CG1-CD 3.45Å; V248-Q436 HydrophobicContact CG1-CG 4.04Å
249	L	98.5	Very high	97.4	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-56.3	-54.4	174	170.8	65.4	0	0	0	110.5	T237 E245 L246 S251 S252 I253 V309 F313 F315	T237-L249 HydrophobicContact CG2-CD2 4.3Å; E245-L249 PolarHBondContact O-N 2.66Å; L246-L249 HydrophobicContact CD1-CD2 4.42Å; L246-L249 WeakPolarHBondContact O-CB 3.29Å; L246-L249 PolarHBondContact O-N 3.3Å; L249-S251 VanDerWaalsContact C-N 3.33Å; L249-S251 PolarHBondContact O-N 2.95Å; L249-S252 PolarHBondContact O-N 3.15Å; L249-S252 PolarHBondContact O-OG 2.97Å; L249-I253 HydrophobicContact CD1-CD1 3.83Å; L249-I253 HydrophobicContact CD1-CG1 4.13Å; L249-I253 HydrophobicContact CD2-CD1 4.45Å; L249-I253 HydrophobicContact CG-CD1 3.81Å; L249-I253 HydrophobicContact CG-CG1 4.49Å; L249-I253 WeakPolarHBondContact O-CG1 3.28Å; L249-I253 PolarHBondContact O-N 3.16Å; L249-V309 HydrophobicContact CD1-CG2 4.26Å; L249-V309 HydrophobicContact CD2-CG2 3.89Å; L249-F313 HydrophobicContact CD1-CB 4.23Å; L249-F313 WeakPolarHBondContact CD1-O 3.45Å; L249-F315 HydrophobicContact CD1-CD2 3.97Å; L249-F315 HydrophobicContact CD1-CE2 4.01Å
250	I	98.6	Very high	97.5	Very high	11 Å²	11	42.6 Å²	42.6	6%	0.056	22%	0.22	C	C	.	.	H	α-helix	trans	-57.2	-47.1	-179.5	-69.3	163.9	0	0	0	110.8	L246 S252 I253 R254 I262 I264 V274 I279	L246-I250 HydrophobicContact CD1-CD1 4.06Å; L246-I250 HydrophobicContact CD1-CG1 4.3Å; L246-I250 HydrophobicContact CG-CD1 3.87Å; L246-I250 VanDerWaalsContact O-CG1 3.28Å; L246-I250 WeakPolarHBondContact O-CG1 3.46Å; L246-I250 PolarHBondContact O-N 3.35Å; I250-S252 VanDerWaalsContact C-N 3.32Å; I250-S252 PolarHBondContact O-N 2.91Å; I250-I253 WeakPolarHBondContact O-CB 3.46Å; I250-I253 PolarHBondContact O-N 3.07Å; I250-R254 HydrophobicContact CG2-CG 4.38Å; I250-R254 VanDerWaalsContact O-CG 3.29Å; I250-R254 WeakPolarHBondContact O-CG 3.32Å; I250-R254 PolarHBondContact O-N 3.13Å; I250-I262 HydrophobicContact CG1-CD1 4.5Å; I250-I262 HydrophobicContact CG2-CD1 4.44Å; I250-I264 HydrophobicContact CD1-CD1 3.96Å; I250-V274 HydrophobicContact CD1-CG1 3.55Å; I250-I279 HydrophobicContact CD1-CD1 4.18Å; I250-I279 HydrophobicContact CG1-CD1 4.5Å; I250-I279 HydrophobicContact CG2-CD1 3.84Å
251	S	98.3	Very high	97.6	Very high	72 Å²	72	44.4 Å²	44.4	50%	0.503	23%	0.228	S	C	.	.	H	α-helix	trans	-60.3	-44	179.3	-59.8	0	0	0	0	111.3	Q247 V248 L249 R254 T255	Q247-S251 VanDerWaalsContact O-CB 3.3Å; Q247-S251 WeakPolarHBondContact O-CB 3.17Å; Q247-S251 PolarHBondContact O-N 3.04Å; Q247-S251 PolarHBondContact O-OG 2.77Å; V248-S251 PolarHBondContact O-N 3.08Å; L249-S251 VanDerWaalsContact C-N 3.33Å; L249-S251 PolarHBondContact O-N 2.95Å; S251-R254 PolarHBondContact O-N 3.49Å; S251-T255 PolarHBondContact O-N 3.21Å; S251-T255 VanDerWaalsContact O-N 3.13Å; S251-T255 PolarHBondContact O-OG1 2.7Å
252	S	98.6	Very high	97.7	Very high	11 Å²	11	43 Å²	43	8%	0.077	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-38.7	177.6	74.2	0	0	0	0	112.7	V248 L249 I250 R254 T255 Y256 F315	V248-S252 WeakPolarHBondContact O-CB 3.2Å; V248-S252 PolarHBondContact O-N 2.59Å; V248-S252 PolarHBondContact O-OG 3.48Å; L249-S252 PolarHBondContact O-N 3.15Å; L249-S252 PolarHBondContact O-OG 2.97Å; I250-S252 VanDerWaalsContact C-N 3.32Å; I250-S252 PolarHBondContact O-N 2.91Å; S252-R254 VanDerWaalsContact C-N 3.34Å; S252-R254 PolarHBondContact O-N 3.33Å; S252-T255 WeakPolarHBondContact O-CB 3.14Å; S252-T255 PolarHBondContact O-N 2.94Å; S252-Y256 VanDerWaalsContact O-CD2 3.32Å; S252-Y256 WeakPolarHBondContact O-CD2 3.46Å; S252-F315 PolarHBondContact OG-N 3.29Å
253	I	98.6	Very high	97.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.1	-50	172.4	-70.5	164.7	0	0	0	109.2	I235 L249 I250 T255 Y256 Y257 I260 I262 F315	I235-I253 HydrophobicContact CD1-CD1 4Å; I235-I253 HydrophobicContact CD1-CG1 4.06Å; I235-I253 HydrophobicContact CD1-CG2 3.64Å; I235-I253 HydrophobicContact CG2-CD1 4.01Å; L249-I253 HydrophobicContact CD1-CD1 3.83Å; L249-I253 HydrophobicContact CD1-CG1 4.13Å; L249-I253 HydrophobicContact CD2-CD1 4.45Å; L249-I253 HydrophobicContact CG-CD1 3.81Å; L249-I253 HydrophobicContact CG-CG1 4.49Å; L249-I253 WeakPolarHBondContact O-CG1 3.28Å; L249-I253 PolarHBondContact O-N 3.16Å; I250-I253 WeakPolarHBondContact O-CB 3.46Å; I250-I253 PolarHBondContact O-N 3.07Å; I253-T255 PolarHBondContact O-N 3.38Å; I253-Y256 PolarHBondContact O-N 3.32Å; I253-Y257 WeakPolarHBondContact O-CA 3.27Å; I253-Y257 PolarHBondContact O-N 2.92Å; I253-I260 HydrophobicContact CG2-CG2 3.73Å; I253-I262 HydrophobicContact CB-CD1 4.32Å; I253-I262 HydrophobicContact CD1-CD1 3.98Å; I253-I262 HydrophobicContact CG2-CD1 3.87Å; I253-I262 HydrophobicContact CG2-CG1 4.41Å; I253-F315 HydrophobicContact CD1-CD2 4.41Å; I253-F315 HydrophobicContact CD1-CE2 4.02Å; I253-F315 HydrophobicContact CG1-CD1 4.42Å; I253-F315 HydrophobicContact CG1-CD2 3.48Å; I253-F315 VanDerWaalsContact CG1-CD2 3.48Å; I253-F315 HydrophobicContact CG1-CE1 4.4Å; I253-F315 HydrophobicContact CG1-CE2 3.45Å; I253-F315 VanDerWaalsContact CG1-CE2 3.45Å; I253-F315 HydrophobicContact CG1-CG 3.99Å; I253-F315 HydrophobicContact CG1-CZ 3.94Å
254	R	98.2	Very high	98.1	Very high	41 Å²	41	41.6 Å²	41.6	16%	0.155	22%	0.216	C	C	.	.	H	α-helix	trans	-64.5	-23.8	-176	-67.8	-70.5	172.1	-122.5	3.4	113.5	I250 S251 S252 Y256 Y257 K258 I260 S277	I250-R254 HydrophobicContact CG2-CG 4.38Å; I250-R254 VanDerWaalsContact O-CG 3.29Å; I250-R254 WeakPolarHBondContact O-CG 3.32Å; I250-R254 PolarHBondContact O-N 3.13Å; S251-R254 PolarHBondContact O-N 3.49Å; S252-R254 VanDerWaalsContact C-N 3.34Å; S252-R254 PolarHBondContact O-N 3.33Å; R254-Y256 VanDerWaalsContact C-N 3.33Å; R254-Y257 PolarHBondContact NH1-O 3.12Å; R254-K258 WeakPolarHBondContact CD-O 3.39Å; R254-K258 PolarHBondContact NE-O 2.8Å; R254-K258 PolarHBondContact NH1-O 3.41Å; R254-K258 VanDerWaalsContact NH1-O 3.08Å; R254-K258 WeakPolarHBondContact O-CG 3.3Å; R254-I260 PolarHBondContact NH1-O 2.93Å; R254-I260 PolarHBondContact NH2-O 2.84Å; R254-S277 PolarHBondContact NH2-O 3.25Å
255	T	98.2	Very high	98.2	Very high	98 Å²	98	37.1 Å²	37.1	60%	0.601	19%	0.188	S	C	*	.	H	α-helix	trans	-61.7	-39.1	171	-58.8	0	0	0	0	112.5	S251 S252 I253	S251-T255 PolarHBondContact O-N 3.21Å; S251-T255 VanDerWaalsContact O-N 3.13Å; S251-T255 PolarHBondContact O-OG1 2.7Å; S252-T255 WeakPolarHBondContact O-CB 3.14Å; S252-T255 PolarHBondContact O-N 2.94Å; I253-T255 PolarHBondContact O-N 3.38Å
256	Y	98.3	Very high	98.3	Very high	93 Å²	93	36.3 Å²	36.3	37%	0.365	18%	0.184	S	C	.	.	H	α-helix	trans	-105	-29.6	-174.7	-61.9	-80	0	0	0	113.4	S252 I253 R254 F315 D317	S252-Y256 VanDerWaalsContact O-CD2 3.32Å; S252-Y256 WeakPolarHBondContact O-CD2 3.46Å; I253-Y256 PolarHBondContact O-N 3.32Å; R254-Y256 VanDerWaalsContact C-N 3.33Å; Y256-F315 HydrophobicContact CD2-CB 3.96Å; Y256-F315 HydrophobicContact CE2-CB 4.37Å; Y256-F315 WeakPolarHBondContact CE2-O 3.47Å; Y256-D317 HydrophobicContact CE1-CB 4.3Å; Y256-D317 VanDerWaalsContact CZ-N 3.35Å; Y256-D317 PolarHBondContact OH-N 2.91Å; Y256-D317 VanDerWaalsContact OH-N 3.13Å
257	Y	98.2	Very high	98.2	Very high	12 Å²	12	36.3 Å²	36.3	5%	0.047	18%	0.184	C	C	.	.			trans	-135.3	82.8	-174.7	-60.9	-79.1	0	0	0	109.8	I229 I253 R254 D259 I260 F315 T319 I321 E322	I229-Y257 HydrophobicContact CG2-CD1 4.28Å; I229-Y257 HydrophobicContact CG2-CE1 4.42Å; I253-Y257 WeakPolarHBondContact O-CA 3.27Å; I253-Y257 PolarHBondContact O-N 2.92Å; R254-Y257 PolarHBondContact NH1-O 3.12Å; Y257-D259 PolarHBondContact O-N 3.42Å; Y257-I260 VanDerWaalsContact CB-CG2 3.46Å; Y257-I260 HydrophobicContact CG-CG2 4.42Å; Y257-F315 HydrophobicContact CD2-CD1 4.1Å; Y257-F315 HydrophobicContact CD2-CE1 4.08Å; Y257-F315 HydrophobicContact CE2-CD1 4.05Å; Y257-F315 HydrophobicContact CE2-CE1 4.02Å; Y257-T319 PolarHBondContact OH-O 3.43Å; Y257-I321 HydrophobicContact CD1-CD1 4.31Å; Y257-I321 HydrophobicContact CD2-CD1 4Å; Y257-I321 HydrophobicContact CE1-CB 4.33Å; Y257-I321 HydrophobicContact CE1-CD1 4.06Å; Y257-I321 HydrophobicContact CE1-CG1 4.22Å; Y257-I321 HydrophobicContact CE2-CD1 3.74Å; Y257-I321 HydrophobicContact CE2-CG1 3.78Å; Y257-I321 HydrophobicContact CG-CD1 4.29Å; Y257-I321 PolarHBondContact OH-N 2.76Å; Y257-E322 VanDerWaalsContact CE1-OE1 3.3Å; Y257-E322 WeakPolarHBondContact CE1-OE1 3.34Å; Y257-E322 PolarHBondContact OH-OE2 3.08Å
258	K	97.1	Very high	98.2	Very high	151 Å²	151	32.7 Å²	32.7	66%	0.657	17%	0.167	S	C	*	.	S	Bend	trans	-61.2	-41.2	-171.4	-68.6	-177	-179.5	179.7	0	113.4	R254	R254-K258 WeakPolarHBondContact CD-O 3.39Å; R254-K258 PolarHBondContact NE-O 2.8Å; R254-K258 PolarHBondContact NH1-O 3.41Å; R254-K258 VanDerWaalsContact NH1-O 3.08Å; R254-K258 WeakPolarHBondContact O-CG 3.3Å
259	D	97	Very high	98.2	Very high	94 Å²	94	32.6 Å²	32.6	50%	0.503	16%	0.164	S	C	.	.	S	Bend	trans	-109.9	-0.3	-170.4	-59.2	-51.6	0	0	0	114.2	Y257 K261 N278	Y257-D259 PolarHBondContact O-N 3.42Å; D259-K261 PolarHBondContact O-N 3.22Å; D259-N278 PolarHBondContact O-ND2 3.05Å
260	I	98.5	Very high	98.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.196	C	C	.	.			trans	-62.6	138.1	-176.3	-161.5	163.3	0	0	0	111.5	N230 V233 I235 I253 R254 Y257 I262 I321	N230-I260 WeakPolarHBondContact OD1-CA 3.47Å; N230-I260 WeakPolarHBondContact OD1-CB 3.48Å; N230-I260 PolarHBondContact OD1-N 3.39Å; V233-I260 HydrophobicContact CB-CD1 4.36Å; V233-I260 HydrophobicContact CG1-CD1 4.45Å; V233-I260 WeakPolarHBondContact O-CG1 3.4Å; I235-I260 HydrophobicContact CD1-CD1 4.11Å; I235-I260 HydrophobicContact CD1-CG2 3.69Å; I235-I260 HydrophobicContact CG1-CD1 3.96Å; I235-I260 HydrophobicContact CG1-CG1 4.36Å; I235-I260 HydrophobicContact CG1-CG2 4.32Å; I253-I260 HydrophobicContact CG2-CG2 3.73Å; R254-I260 PolarHBondContact NH1-O 2.93Å; R254-I260 PolarHBondContact NH2-O 2.84Å; Y257-I260 VanDerWaalsContact CB-CG2 3.46Å; Y257-I260 HydrophobicContact CG-CG2 4.42Å; I260-I262 PolarHBondContact O-N 2.77Å; I260-I321 HydrophobicContact CD1-CD1 3.82Å
261	K	98.8	Very high	98	Very high	45 Å²	45	41.6 Å²	41.6	20%	0.196	21%	0.211	C	C	.	.			trans	-66.7	132.4	177.6	-171.2	177.2	-176.7	177.1	0	110	T234 I235 D259 I263 N278 E280	T234-K261 HydrophobicContact CG2-CB 4.12Å; T234-K261 HydrophobicContact CG2-CD 4.2Å; T234-K261 HydrophobicContact CG2-CG 4.05Å; I235-K261 PolarHBondContact N-O 3.07Å; D259-K261 PolarHBondContact O-N 3.22Å; K261-I263 HydrophobicContact CD-CD1 4.45Å; K261-I263 HydrophobicContact CD-CG1 4.44Å; K261-I263 HydrophobicContact CG-CG1 4.39Å; K261-N278 WeakPolarHBondContact CA-O 3.08Å; K261-E280 WeakPolarHBondContact CE-OE1 3.39Å; K261-E280 WeakPolarHBondContact CE-OE2 3.43Å; K261-E280 IonicContact NZ-OE1 3.62Å; K261-E280 PolarHBondContact NZ-OE1 2.74Å; K261-E280 IonicContact NZ-OE2 3.45Å; K261-E280 PolarHBondContact NZ-OE2 2.85Å; K261-E280 VanDerWaalsContact NZ-OE2 3.07Å
262	I	98.9	Very high	97.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.1	174.6	-52.7	173	0	0	0	108.2	I235 I250 I253 I260 I264 N278 I279 E280	I235-I262 HydrophobicContact CB-CG1 4.45Å; I235-I262 CarbonylContact O-C 3.54Å; I235-I262 WeakPolarHBondContact O-CA 3.16Å; I250-I262 HydrophobicContact CG1-CD1 4.5Å; I250-I262 HydrophobicContact CG2-CD1 4.44Å; I253-I262 HydrophobicContact CB-CD1 4.32Å; I253-I262 HydrophobicContact CD1-CD1 3.98Å; I253-I262 HydrophobicContact CG2-CD1 3.87Å; I253-I262 HydrophobicContact CG2-CG1 4.41Å; I260-I262 PolarHBondContact O-N 2.77Å; I262-I264 HydrophobicContact CG2-CD1 4.4Å; I262-I264 HydrophobicContact CG2-CG1 3.97Å; I262-N278 PolarHBondContact N-O 3.03Å; I262-I279 HydrophobicContact CB-CG1 4.3Å; I262-I279 HydrophobicContact CD1-CG1 4.41Å; I262-I279 WeakPolarHBondContact O-CA 3.38Å; I262-E280 PolarHBondContact O-N 3.31Å
263	I	98.9	Very high	97.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.5	173.8	-60.4	179.4	0	0	0	108.8	T234 I235 V236 T237 K261 E280 Y282 A297 Q300 V301	T234-I263 HydrophobicContact CG2-CB 4.48Å; T234-I263 HydrophobicContact CG2-CD1 3.69Å; T234-I263 HydrophobicContact CG2-CG1 3.74Å; I235-I263 PolarHBondContact O-N 3.44Å; V236-I263 WeakPolarHBondContact CA-O 3.46Å; V236-I263 HydrophobicContact CG1-CB 4.24Å; T237-I263 PolarHBondContact N-O 3.14Å; K261-I263 HydrophobicContact CD-CD1 4.45Å; K261-I263 HydrophobicContact CD-CG1 4.44Å; K261-I263 HydrophobicContact CG-CG1 4.39Å; I263-E280 CarbonylContact C-O 3.49Å; I263-E280 WeakPolarHBondContact CA-O 3.39Å; I263-E280 HydrophobicContact CG1-CB 4.46Å; I263-Y282 HydrophobicContact CG2-CD2 3.85Å; I263-Y282 HydrophobicContact CG2-CE2 3.86Å; I263-A297 HydrophobicContact CG2-CB 4.11Å; I263-Q300 HydrophobicContact CD1-CB 3.82Å; I263-Q300 HydrophobicContact CG2-CB 4.3Å; I263-V301 HydrophobicContact CD1-CG2 4.23Å
264	I	98.8	Very high	97.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	115.4	-175.7	-52.8	171.3	0	0	0	108.1	T237 T239 L246 I250 I262 V274 I279 E280 Q281 Y282	T237-I264 HydrophobicContact CG2-CB 4.37Å; T237-I264 HydrophobicContact CG2-CG1 3.91Å; T237-I264 HydrophobicContact CG2-CG2 4.26Å; T237-I264 WeakPolarHBondContact O-CA 3.15Å; T239-I264 HydrophobicContact CG2-CG2 4.09Å; L246-I264 HydrophobicContact CD1-CD1 4.26Å; L246-I264 HydrophobicContact CD2-CD1 4.28Å; L246-I264 HydrophobicContact CD2-CG2 4.1Å; I250-I264 HydrophobicContact CD1-CD1 3.96Å; I262-I264 HydrophobicContact CG2-CD1 4.4Å; I262-I264 HydrophobicContact CG2-CG1 3.97Å; I264-V274 HydrophobicContact CD1-CB 4.34Å; I264-V274 HydrophobicContact CD1-CG1 3.86Å; I264-I279 HydrophobicContact CD1-CG2 3.71Å; I264-I279 HydrophobicContact CG1-CG2 4.44Å; I264-E280 PolarHBondContact N-O 2.65Å; I264-Q281 WeakPolarHBondContact O-CA 3.48Å; I264-Y282 PolarHBondContact O-N 2.91Å
265	A	98.6	Very high	97.4	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	127.7	164.5	0	0	0	0	0	109.6	T237 K238 T239 M284 G293 L296 A297	T237-A265 PolarHBondContact O-N 3.35Å; K238-A265 CarbonylContact C-O 3.51Å; K238-A265 VanDerWaalsContact CA-O 3.23Å; K238-A265 WeakPolarHBondContact CA-O 3.29Å; K238-A265 HydrophobicContact CB-CB 4.39Å; K238-A265 HydrophobicContact CG-CB 4.23Å; T239-A265 PolarHBondContact N-O 3.24Å; A265-M284 HydrophobicContact CB-SD 4.18Å; A265-G293 WeakPolarHBondContact CB-O 3.1Å; A265-L296 HydrophobicContact CB-CB 4.46Å; A265-L296 HydrophobicContact CB-CD2 4.45Å; A265-A297 HydrophobicContact CB-CB 4.04Å
266	D	98.3	Very high	97.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	110.2	-172.6	-172.3	-7	0	0	0	110.7	T239 Y243 S268 Q281 Y282 I283 M284	T239-D266 HydrophobicContact CG2-CB 3.89Å; Y243-D266 WeakPolarHBondContact CE1-OD2 3.44Å; Y243-D266 VanDerWaalsContact OH-CG 3.24Å; Y243-D266 PolarHBondContact OH-OD1 2.88Å; Y243-D266 PolarHBondContact OH-OD2 2.82Å; D266-S268 WeakPolarHBondContact OD1-CB 3.41Å; D266-S268 PolarHBondContact OD1-N 2.69Å; D266-S268 PolarHBondContact OD1-OG 3.47Å; D266-Q281 HydrophobicContact CB-CG 4.35Å; D266-Q281 PolarHBondContact OD2-NE2 2.5Å; D266-Y282 PolarHBondContact N-O 2.85Å; D266-I283 HydrophobicContact CB-CD1 3.86Å; D266-I283 WeakPolarHBondContact O-CA 3.5Å; D266-M284 PolarHBondContact O-N 3.36Å
267	D	97.3	Very high	97.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.268	C	S	.	.			trans	-107.7	24.3	176.4	71.1	-15.5	0	0	0	112	K238 T239 F240 M284 P286 A287 Q288 G289	K238-D267 VanDerWaalsContact CE-CG 3.48Å; K238-D267 WeakPolarHBondContact CE-OD1 3.45Å; K238-D267 WeakPolarHBondContact CE-OD2 3.45Å; K238-D267 IonicContact NZ-OD1 3.27Å; K238-D267 PolarHBondContact NZ-OD1 3.16Å; K238-D267 IonicContact NZ-OD2 2.97Å; K238-D267 PolarHBondContact NZ-OD2 3.05Å; K238-D267 VanDerWaalsContact NZ-OD2 3.07Å; T239-D267 VanDerWaalsContact O-OD1 3.08Å; F240-D267 WeakPolarHBondContact CB-OD1 3.48Å; F240-D267 WeakPolarHBondContact CD2-O 3.11Å; F240-D267 WeakPolarHBondContact CD2-OD1 3.31Å; F240-D267 VanDerWaalsContact CE2-O 3.28Å; F240-D267 WeakPolarHBondContact CE2-O 3.49Å; D267-M284 HydrophobicContact CB-CB 3.86Å; D267-M284 HydrophobicContact CB-SD 4.33Å; D267-P286 WeakPolarHBondContact O-CA 3.12Å; D267-A287 PolarHBondContact O-N 3.25Å; D267-Q288 HydrophobicContact CB-CB 4.44Å; D267-Q288 PolarHBondContact OD2-N 3.03Å; D267-G289 PolarHBondContact OD2-N 2.69Å
268	S	97.4	Very high	97.1	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.289	C	S	.	.			trans	-58.6	150	176.9	-61.3	0	0	0	0	111.7	L241 Y243 D266 E270	L241-S268 PolarHBondContact N-OG 3.08Å; Y243-S268 WeakPolarHBondContact OH-CB 3.23Å; Y243-S268 PolarHBondContact OH-OG 2.9Å; D266-S268 WeakPolarHBondContact OD1-CB 3.41Å; D266-S268 PolarHBondContact OD1-N 2.69Å; D266-S268 PolarHBondContact OD1-OG 3.47Å; S268-E270 VanDerWaalsContact C-N 3.29Å; S268-E270 PolarHBondContact O-N 2.92Å
269	L	96.9	Very high	97.1	Very high	55 Å²	55	49.1 Å²	49.1	29%	0.288	26%	0.264	S	S	.	.	S	Bend	trans	-64.5	-38.2	-179.5	-54.1	-172.8	0	0	0	112.2	F240 L241 P286 A287 K443 F447	F240-L269 HydrophobicContact CE2-CD2 4.03Å; F240-L269 HydrophobicContact CE2-CG 4.3Å; F240-L269 HydrophobicContact CZ-CD2 4.17Å; F240-L269 HydrophobicContact CZ-CG 4.35Å; L241-L269 HydrophobicContact CD2-CB 4.41Å; L241-L269 HydrophobicContact CD2-CG 4.26Å; L269-P286 HydrophobicContact CD2-CB 3.72Å; L269-A287 HydrophobicContact CD2-CB 4.35Å; L269-K443 VanDerWaalsContact CD1-CE 3.41Å; L269-F447 HydrophobicContact CD1-CE2 4.27Å; L269-F447 HydrophobicContact CD1-CZ 4.23Å; L269-F447 HydrophobicContact CD2-CZ 4.28Å
270	E	95.9	Very high	97.2	Very high	142 Å²	142	47.7 Å²	47.7	66%	0.664	26%	0.255	S	S	*	.	S	Bend	trans	-129.5	89.2	178.6	-72.3	159	-140.4	0	0	106.8	S268 K443	S268-E270 VanDerWaalsContact C-N 3.29Å; S268-E270 PolarHBondContact O-N 2.92Å; E270-K443 IonicContact OE1-NZ 2.75Å
271	P	96.6	Very high	97.2	Very high	59 Å²	59	49.8 Å²	49.8	38%	0.383	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-66.9	135.9	-174.2	-22.9	33.7	0	0	0	113	Y243 I283	Y243-P271 WeakPolarHBondContact OH-CA 3.05Å; P271-I283 HydrophobicContact CB-CD1 3.62Å; P271-I283 HydrophobicContact CB-CG1 4.28Å; P271-I283 HydrophobicContact CB-CG2 4.11Å; P271-I283 HydrophobicContact CG-CD1 4.31Å; P271-I283 HydrophobicContact CG-CG2 3.61Å
272	Q	96.2	Very high	97.2	Very high	115 Å²	115	50.8 Å²	50.8	54%	0.537	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-100.6	138.9	172.8	-58.2	178.9	23.4	0	0	109.5	Y243 V274 Q281	Y243-Q272 HydrophobicContact CD1-CB 4.05Å; Y243-Q272 HydrophobicContact CD2-CB 4.08Å; Y243-Q272 VanDerWaalsContact CD2-CD 3.42Å; Y243-Q272 HydrophobicContact CD2-CG 3.79Å; Y243-Q272 HydrophobicContact CE1-CB 3.82Å; Y243-Q272 HydrophobicContact CE2-CB 3.81Å; Y243-Q272 HydrophobicContact CE2-CG 3.61Å; Y243-Q272 HydrophobicContact CG-CB 4.2Å; Y243-Q272 HydrophobicContact CG-CG 4.32Å; Y243-Q272 VanDerWaalsContact CZ-N 3.27Å; Y243-Q272 PolarHBondContact OH-N 2.79Å; Q272-V274 PolarHBondContact O-N 2.89Å; Q272-Q281 PolarHBondContact O-NE2 3.31Å; Q272-Q281 PolarHBondContact O-OE1 2.86Å
273	K	95.8	Very high	97.1	Very high	169 Å²	169	55.2 Å²	55.2	74%	0.735	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-66.6	124.1	176.2	-172.1	-178.5	-176	-170.4	0	110	N275	K273-N275 WeakPolarHBondContact CD-OD1 3.42Å; K273-N275 WeakPolarHBondContact CE-OD1 3.15Å
274	V	97	Very high	97	Very high	10 Å²	10	56.2 Å²	56.2	6%	0.061	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-96.8	116.5	173.1	-178.6	0	0	0	0	108.8	Y243 L246 I250 I264 Q272 I279	Y243-V274 HydrophobicContact CD1-CG2 4.12Å; Y243-V274 HydrophobicContact CE1-CG2 4.04Å; L246-V274 HydrophobicContact CD2-CG2 3.98Å; I250-V274 HydrophobicContact CD1-CG1 3.55Å; I264-V274 HydrophobicContact CD1-CB 4.34Å; I264-V274 HydrophobicContact CD1-CG1 3.86Å; Q272-V274 PolarHBondContact O-N 2.89Å; V274-I279 HydrophobicContact CG1-CD1 4.39Å; V274-I279 HydrophobicContact CG1-CG2 4.28Å
275	N	92.8	Very high	96.9	Very high	107 Å²	107	60 Å²	60	57%	0.572	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-101.7	146.7	179.9	-62.2	-54.2	0	0	0	111	K273	K273-N275 WeakPolarHBondContact CD-OD1 3.42Å; K273-N275 WeakPolarHBondContact CE-OD1 3.15Å
276	G	94.1	Very high	96.8	Very high	51 Å²	51	63.8 Å²	63.8	53%	0.526	34%	0.344	S	S	.	.			trans	163.6	164.4	172.3	0	0	0	0	0	111.8
277	S	96.1	Very high	96.6	Very high	67 Å²	67	64.5 Å²	64.5	47%	0.469	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	139.5	173.3	52.8	0	0	0	0	110.4	R254 I279	R254-S277 PolarHBondContact NH2-O 3.25Å; S277-I279 WeakPolarHBondContact O-CG1 3.47Å; S277-I279 PolarHBondContact O-N 2.98Å; S277-I279 VanDerWaalsContact O-N 3.08Å
278	N	97.9	Very high	96.4	Very high	90 Å²	90	67.9 Å²	67.9	48%	0.481	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	36.4	175.8	-59.6	-21.5	0	0	0	114.3	D259 K261 I262	D259-N278 PolarHBondContact O-ND2 3.05Å; K261-N278 WeakPolarHBondContact CA-O 3.08Å; I262-N278 PolarHBondContact N-O 3.03Å
279	I	98.5	Very high	96.1	Very high	27 Å²	27	67.9 Å²	67.9	14%	0.138	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.1	172.5	-62	-175.7	0	0	0	109.1	I250 I262 I264 V274 S277	I250-I279 HydrophobicContact CD1-CD1 4.18Å; I250-I279 HydrophobicContact CG1-CD1 4.5Å; I250-I279 HydrophobicContact CG2-CD1 3.84Å; I262-I279 HydrophobicContact CB-CG1 4.3Å; I262-I279 HydrophobicContact CD1-CG1 4.41Å; I262-I279 WeakPolarHBondContact O-CA 3.38Å; I264-I279 HydrophobicContact CD1-CG2 3.71Å; I264-I279 HydrophobicContact CG1-CG2 4.44Å; V274-I279 HydrophobicContact CG1-CD1 4.39Å; V274-I279 HydrophobicContact CG1-CG2 4.28Å; S277-I279 WeakPolarHBondContact O-CG1 3.47Å; S277-I279 PolarHBondContact O-N 2.98Å; S277-I279 VanDerWaalsContact O-N 3.08Å
280	E	98.6	Very high	95.7	Very high	64 Å²	64	67.5 Å²	67.5	30%	0.299	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.4	167.7	-67.7	176.6	-167.9	0	0	109.5	K261 I262 I263 I264 Y282	K261-E280 WeakPolarHBondContact CE-OE1 3.39Å; K261-E280 WeakPolarHBondContact CE-OE2 3.43Å; K261-E280 IonicContact NZ-OE1 3.62Å; K261-E280 PolarHBondContact NZ-OE1 2.74Å; K261-E280 IonicContact NZ-OE2 3.45Å; K261-E280 PolarHBondContact NZ-OE2 2.85Å; K261-E280 VanDerWaalsContact NZ-OE2 3.07Å; I262-E280 PolarHBondContact O-N 3.31Å; I263-E280 CarbonylContact C-O 3.49Å; I263-E280 WeakPolarHBondContact CA-O 3.39Å; I263-E280 HydrophobicContact CG1-CB 4.46Å; I264-E280 PolarHBondContact N-O 2.65Å; E280-Y282 HydrophobicContact CB-CD2 4.35Å; E280-Y282 HydrophobicContact CB-CE2 3.59Å; E280-Y282 WeakPolarHBondContact OE2-CE2 3.4Å; E280-Y282 PolarHBondContact OE2-OH 2.99Å
281	Q	98.4	Very high	95.7	Very high	45 Å²	45	60.8 Å²	60.8	21%	0.21	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	123.8	176.5	-174.2	-173.4	13.4	0	0	109.3	I264 D266 Q272 I283	I264-Q281 WeakPolarHBondContact O-CA 3.48Å; D266-Q281 HydrophobicContact CB-CG 4.35Å; D266-Q281 PolarHBondContact OD2-NE2 2.5Å; Q272-Q281 PolarHBondContact O-NE2 3.31Å; Q272-Q281 PolarHBondContact O-OE1 2.86Å; Q281-I283 HydrophobicContact CG-CD1 3.83Å
282	Y	98.3	Very high	95.7	Very high	66 Å²	66	58.6 Å²	58.6	26%	0.259	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	112.5	177.2	-65.7	-94.2	0	0	0	109.5	I263 I264 D266 E280 Q300	I263-Y282 HydrophobicContact CG2-CD2 3.85Å; I263-Y282 HydrophobicContact CG2-CE2 3.86Å; I264-Y282 PolarHBondContact O-N 2.91Å; D266-Y282 PolarHBondContact N-O 2.85Å; E280-Y282 HydrophobicContact CB-CD2 4.35Å; E280-Y282 HydrophobicContact CB-CE2 3.59Å; E280-Y282 WeakPolarHBondContact OE2-CE2 3.4Å; E280-Y282 PolarHBondContact OE2-OH 2.99Å; Y282-Q300 HydrophobicContact CD1-CG 4.19Å; Y282-Q300 HydrophobicContact CD2-CG 4.12Å; Y282-Q300 HydrophobicContact CE1-CG 3.77Å; Y282-Q300 HydrophobicContact CE2-CB 3.92Å; Y282-Q300 HydrophobicContact CE2-CG 3.69Å; Y282-Q300 HydrophobicContact CG-CG 4.36Å; Y282-Q300 PolarHBondContact OH-OE1 2.92Å
283	I	98	Very high	95.7	Very high	92 Å²	92	53.1 Å²	53.1	47%	0.472	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	128.9	179.7	-55	-50.6	0	0	0	110.1	D266 P271 Q281	D266-I283 HydrophobicContact CB-CD1 3.86Å; D266-I283 WeakPolarHBondContact O-CA 3.5Å; P271-I283 HydrophobicContact CB-CD1 3.62Å; P271-I283 HydrophobicContact CB-CG1 4.28Å; P271-I283 HydrophobicContact CB-CG2 4.11Å; P271-I283 HydrophobicContact CG-CD1 4.31Å; P271-I283 HydrophobicContact CG-CG2 3.61Å; Q281-I283 HydrophobicContact CG-CD1 3.83Å
284	M	96.6	Very high	95.8	Very high	22 Å²	22	45.1 Å²	45.1	11%	0.108	26%	0.256	C	S	.	.			trans	-105.3	162.1	177.3	-64.9	179.4	71.8	0	0	110.8	A265 D266 D267 Q288 A292 G293 L296	A265-M284 HydrophobicContact CB-SD 4.18Å; D266-M284 PolarHBondContact O-N 3.36Å; D267-M284 HydrophobicContact CB-CB 3.86Å; D267-M284 HydrophobicContact CB-SD 4.33Å; M284-Q288 HydrophobicContact CE-CB 3.76Å; M284-Q288 HydrophobicContact CE-CG 4.28Å; M284-A292 HydrophobicContact CE-CB 3.75Å; M284-G293 WeakPolarHBondContact SD-CA 3.3Å; M284-L296 HydrophobicContact CE-CD2 4.47Å; M284-L296 HydrophobicContact CG-CD2 3.23Å; M284-L296 HydrophobicContact SD-CB 4.3Å; M284-L296 HydrophobicContact SD-CD2 3.69Å
285	P	96.6	Very high	95.8	Very high	80 Å²	80	47.2 Å²	47.2	52%	0.519	27%	0.267	S	S	.	.	S	Bend	trans	-52.4	147.6	163.5	-23.7	32.9	0	0	0	110.9	A287 Q288	P285-A287 PolarHBondContact O-N 2.84Å; P285-Q288 HydrophobicContact CB-CG 3.83Å; P285-Q288 HydrophobicContact CG-CG 4.27Å; P285-Q288 WeakPolarHBondContact O-CG 3.29Å
286	P	95.7	Very high	96.1	Very high	78 Å²	78	44.3 Å²	44.3	51%	0.506	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	136.1	-175.6	-30.6	37.2	0	0	0	114.1	D267 L269 Q288	D267-P286 WeakPolarHBondContact O-CA 3.12Å; L269-P286 HydrophobicContact CD2-CB 3.72Å; P286-Q288 VanDerWaalsContact C-N 3.26Å; P286-Q288 PolarHBondContact O-N 3.38Å
287	A	93.6	Very high	96.3	Very high	15 Å²	15	41.9 Å²	41.9	12%	0.124	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	33.1	171	0	0	0	0	0	115.3	F240 D267 L269 P285 G289 F447	F240-A287 HydrophobicContact CE2-CB 3.97Å; F240-A287 HydrophobicContact CZ-CB 4.1Å; D267-A287 PolarHBondContact O-N 3.25Å; L269-A287 HydrophobicContact CD2-CB 4.35Å; P285-A287 PolarHBondContact O-N 2.84Å; A287-G289 PolarHBondContact O-N 3.03Å; A287-F447 HydrophobicContact CB-CD1 4.16Å; A287-F447 HydrophobicContact CB-CE1 3.97Å
288	Q	94.3	Very high	96.4	Very high	71 Å²	71	38.9 Å²	38.9	33%	0.332	21%	0.205	S	C	.	.			trans	-60.1	-29.8	176.2	-76	-65.7	-38.7	0	0	112.9	D267 M284 P285 P286 A292 K408	D267-Q288 HydrophobicContact CB-CB 4.44Å; D267-Q288 PolarHBondContact OD2-N 3.03Å; M284-Q288 HydrophobicContact CE-CB 3.76Å; M284-Q288 HydrophobicContact CE-CG 4.28Å; P285-Q288 HydrophobicContact CB-CG 3.83Å; P285-Q288 HydrophobicContact CG-CG 4.27Å; P285-Q288 WeakPolarHBondContact O-CG 3.29Å; P286-Q288 VanDerWaalsContact C-N 3.26Å; P286-Q288 PolarHBondContact O-N 3.38Å; Q288-A292 HydrophobicContact CB-CB 4.14Å; Q288-K408 WeakPolarHBondContact O-CG 3.43Å
289	G	91.4	Very high	96.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.01	20%	0.201	C	C	.	.			trans	106.6	178.3	170.7	0	0	0	0	0	114.1	D267 A287 G293 K408	D267-G289 PolarHBondContact OD2-N 2.69Å; A287-G289 PolarHBondContact O-N 3.03Å; G289-G293 PolarHBondContact O-N 3.4Å; G289-K408 VanDerWaalsContact CA-O 3.27Å; G289-K408 WeakPolarHBondContact CA-O 3.33Å
290	W	88.1	Confident	96.4	Very high	47 Å²	47	39.2 Å²	39.2	18%	0.178	21%	0.21	C	C	.	.	H	α-helix	trans	-64.5	-56.2	-164.8	-168.1	-79.5	0	0	0	113.1	G293 R294 D310 N389 K408	W290-G293 PolarHBondContact O-N 2.81Å; W290-R294 VanDerWaalsContact O-CG 3.3Å; W290-R294 WeakPolarHBondContact O-CG 3.28Å; W290-R294 PolarHBondContact O-N 2.9Å; W290-D310 WeakPolarHBondContact CH2-OD1 3.28Å; W290-D310 WeakPolarHBondContact CH2-OD2 3.39Å; W290-D310 WeakPolarHBondContact CZ2-OD1 3.41Å; W290-N389 VanDerWaalsContact CZ2-ND2 3.34Å; W290-N389 WeakPolarHBondContact CZ2-ND2 3.47Å; W290-K408 PolarHBondContact N-O 2.89Å
291	F	94.9	Very high	96.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-70	-32.7	-177.5	-81.8	-0.5	0	0	0	114.1	G293 R294 N295 F403 D404 L407 A411 E414 F415	F291-G293 VanDerWaalsContact C-N 3.34Å; F291-G293 PolarHBondContact O-N 2.78Å; F291-R294 HydrophobicContact CD1-CG 4.32Å; F291-R294 PolarHBondContact O-N 2.51Å; F291-N295 PolarHBondContact O-N 2.93Å; F291-F403 HydrophobicContact CB-CB 3.65Å; F291-F403 HydrophobicContact CD1-CB 3.87Å; F291-F403 AromaticContact CD1-CD1 3.82Å; F291-F403 HydrophobicContact CD1-CD1 3.82Å; F291-F403 HydrophobicContact CD1-CG 4.22Å; F291-F403 HydrophobicContact CD2-CB 4.06Å; F291-F403 AromaticContact CE1-CD1 3.8Å; F291-F403 HydrophobicContact CE1-CD1 3.8Å; F291-F403 HydrophobicContact CG-CB 3.63Å; F291-F403 HydrophobicContact CG-CD1 4.36Å; F291-F403 HydrophobicContact CG-CG 4.45Å; F291-F403 HydrophobicContact CZ-CD1 4.23Å; F291-D404 VanDerWaalsContact CB-O 3.28Å; F291-D404 WeakPolarHBondContact CB-O 3.32Å; F291-D404 HydrophobicContact CD2-CB 4.33Å; F291-D404 VanDerWaalsContact CD2-O 3.28Å; F291-D404 WeakPolarHBondContact CD2-O 3.13Å; F291-L407 HydrophobicContact CD2-CB 4.09Å; F291-L407 HydrophobicContact CD2-CD1 4.29Å; F291-L407 HydrophobicContact CE2-CD1 4.07Å; F291-A411 HydrophobicContact CD1-CB 4.42Å; F291-A411 HydrophobicContact CD2-CB 3.82Å; F291-A411 HydrophobicContact CE1-CB 3.92Å; F291-A411 HydrophobicContact CE2-CB 3.29Å; F291-A411 HydrophobicContact CG-CB 4.36Å; F291-A411 HydrophobicContact CZ-CB 3.32Å; F291-E414 HydrophobicContact CE2-CB 4.2Å; F291-F415 HydrophobicContact CZ-CB 4.1Å
292	A	96.9	Very high	96.3	Very high	14 Å²	14	39 Å²	39	12%	0.116	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-45.1	171.5	0	0	0	0	0	111.4	M284 Q288 N295 L296 P405	M284-A292 HydrophobicContact CE-CB 3.75Å; Q288-A292 HydrophobicContact CB-CB 4.14Å; A292-N295 PolarHBondContact O-N 2.8Å; A292-L296 PolarHBondContact O-N 2.78Å; A292-L296 VanDerWaalsContact O-N 3.08Å; A292-P405 HydrophobicContact CB-CB 3.94Å
293	G	96.7	Very high	96.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.8	-36.4	176.4	0	0	0	0	0	113.5	A265 M284 G289 W290 F291 L296 A297	A265-G293 WeakPolarHBondContact CB-O 3.1Å; M284-G293 WeakPolarHBondContact SD-CA 3.3Å; G289-G293 PolarHBondContact O-N 3.4Å; W290-G293 PolarHBondContact O-N 2.81Å; F291-G293 VanDerWaalsContact C-N 3.34Å; F291-G293 PolarHBondContact O-N 2.78Å; G293-L296 PolarHBondContact O-N 2.87Å; G293-A297 PolarHBondContact O-N 2.97Å
294	R	96.5	Very high	96.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.4	-49.3	172.6	-60.5	-141.8	163.7	158.2	-6	112	W290 F291 L296 A297 V298 W308 N389 F403	W290-R294 VanDerWaalsContact O-CG 3.3Å; W290-R294 WeakPolarHBondContact O-CG 3.28Å; W290-R294 PolarHBondContact O-N 2.9Å; F291-R294 HydrophobicContact CD1-CG 4.32Å; F291-R294 PolarHBondContact O-N 2.51Å; R294-L296 VanDerWaalsContact C-N 3.34Å; R294-L296 PolarHBondContact O-N 3.38Å; R294-A297 PolarHBondContact O-N 2.65Å; R294-V298 WeakPolarHBondContact O-CB 3.23Å; R294-V298 VanDerWaalsContact O-CG2 3.32Å; R294-V298 WeakPolarHBondContact O-CG2 3.44Å; R294-V298 PolarHBondContact O-N 2.95Å; R294-W308 HydrophobicContact CB-CH2 3.99Å; R294-W308 HydrophobicContact CB-CZ3 3.86Å; R294-W308 HydrophobicContact CG-CE3 4.29Å; R294-W308 HydrophobicContact CG-CH2 3.37Å; R294-W308 HydrophobicContact CG-CZ2 3.76Å; R294-W308 HydrophobicContact CG-CZ3 3.66Å; R294-N389 PolarHBondContact NH2-OD1 2.98Å; R294-F403 HydrophobicContact CB-CB 4.12Å; R294-F403 HydrophobicContact CB-CD1 4.21Å; R294-F403 HydrophobicContact CB-CD2 3.45Å; R294-F403 VanDerWaalsContact CB-CD2 3.45Å; R294-F403 HydrophobicContact CB-CE2 3.84Å; R294-F403 HydrophobicContact CB-CG 3.66Å; R294-F403 HydrophobicContact CB-CZ 4.38Å; R294-F403 HydrophobicContact CG-CD1 4.38Å; R294-F403 HydrophobicContact CG-CD2 4.43Å; R294-F403 HydrophobicContact CG-CG 4.29Å
295	N	98.1	Very high	96.5	Very high	55 Å²	55	31.5 Å²	31.5	29%	0.294	18%	0.182	S	C	.	.	H	α-helix	trans	-59	-46.3	178.3	-78.1	-24	0	0	0	111.6	F291 A292 S299 F403	F291-N295 PolarHBondContact O-N 2.93Å; A292-N295 PolarHBondContact O-N 2.8Å; N295-S299 VanDerWaalsContact O-CB 3.23Å; N295-S299 WeakPolarHBondContact O-CB 3.45Å; N295-S299 PolarHBondContact O-N 2.91Å; N295-S299 PolarHBondContact O-OG 3.15Å; N295-F403 PolarHBondContact ND2-O 3.13Å; N295-F403 WeakPolarHBondContact OD1-CB 3.46Å; N295-F403 WeakPolarHBondContact OD1-CD2 3.22Å; N295-F403 PolarHBondContact OD1-N 2.96Å
296	L	98.3	Very high	96.6	Very high	46 Å²	46	27.7 Å²	27.7	24%	0.241	16%	0.157	C	C	.	.	H	α-helix	trans	-59	-54.1	178.3	179.9	60.7	0	0	0	110.5	A265 M284 A292 G293 R294 V298 S299 Q300	A265-L296 HydrophobicContact CB-CB 4.46Å; A265-L296 HydrophobicContact CB-CD2 4.45Å; M284-L296 HydrophobicContact CE-CD2 4.47Å; M284-L296 HydrophobicContact CG-CD2 3.23Å; M284-L296 HydrophobicContact SD-CB 4.3Å; M284-L296 HydrophobicContact SD-CD2 3.69Å; A292-L296 PolarHBondContact O-N 2.78Å; A292-L296 VanDerWaalsContact O-N 3.08Å; G293-L296 PolarHBondContact O-N 2.87Å; R294-L296 VanDerWaalsContact C-N 3.34Å; R294-L296 PolarHBondContact O-N 3.38Å; L296-V298 PolarHBondContact O-N 3.25Å; L296-S299 PolarHBondContact O-N 3.03Å; L296-S299 PolarHBondContact O-OG 3.43Å; L296-Q300 WeakPolarHBondContact O-CG 3.48Å
297	A	98.4	Very high	96.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.7	-48.4	-178.4	0	0	0	0	0	111.8	V236 I263 A265 G293 R294 S299 Q300	V236-A297 HydrophobicContact CB-CB 4.12Å; V236-A297 HydrophobicContact CG1-CB 4.48Å; I263-A297 HydrophobicContact CG2-CB 4.11Å; A265-A297 HydrophobicContact CB-CB 4.04Å; G293-A297 PolarHBondContact O-N 2.97Å; R294-A297 PolarHBondContact O-N 2.65Å; A297-S299 VanDerWaalsContact C-N 3.29Å; A297-S299 PolarHBondContact O-N 3.31Å; A297-Q300 PolarHBondContact O-N 2.82Å; A297-Q300 VanDerWaalsContact O-N 3.15Å
298	V	98.4	Very high	96.9	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.024	13%	0.128	C	C	.	.	H	α-helix	trans	-66.8	-30.3	-179.1	174.5	0	0	0	0	111.6	V236 R294 L296 Q300 V301 F306 V398 R399 F403	V236-V298 HydrophobicContact CG2-CG2 4.46Å; R294-V298 WeakPolarHBondContact O-CB 3.23Å; R294-V298 VanDerWaalsContact O-CG2 3.32Å; R294-V298 WeakPolarHBondContact O-CG2 3.44Å; R294-V298 PolarHBondContact O-N 2.95Å; L296-V298 PolarHBondContact O-N 3.25Å; V298-Q300 PolarHBondContact O-N 2.88Å; V298-V301 PolarHBondContact O-N 3.07Å; V298-F306 HydrophobicContact CG1-CD1 4.28Å; V298-F306 HydrophobicContact CG1-CE1 3.89Å; V298-F306 HydrophobicContact CG1-CZ 4.33Å; V298-F306 HydrophobicContact CG2-CD1 4.42Å; V298-F306 HydrophobicContact CG2-CD2 4.26Å; V298-F306 HydrophobicContact CG2-CE1 4.07Å; V298-F306 HydrophobicContact CG2-CE2 3.87Å; V298-F306 HydrophobicContact CG2-CZ 3.77Å; V298-V398 HydrophobicContact CG1-CG1 4.5Å; V298-R399 HydrophobicContact CG1-CG 3.8Å; V298-R399 VanDerWaalsContact O-CZ 3.27Å; V298-R399 PolarHBondContact O-NE 3.5Å; V298-R399 PolarHBondContact O-NH2 3.16Å; V298-F403 HydrophobicContact CG2-CE2 4.3Å
299	S	98.3	Very high	97.1	Very high	57 Å²	57	20 Å²	20	40%	0.399	11%	0.112	S	C	.	.	H	α-helix	trans	-65.1	-19.8	175.9	72.6	0	0	0	0	113.8	N295 L296 A297 R399	N295-S299 VanDerWaalsContact O-CB 3.23Å; N295-S299 WeakPolarHBondContact O-CB 3.45Å; N295-S299 PolarHBondContact O-N 2.91Å; N295-S299 PolarHBondContact O-OG 3.15Å; L296-S299 PolarHBondContact O-N 3.03Å; L296-S299 PolarHBondContact O-OG 3.43Å; A297-S299 VanDerWaalsContact C-N 3.29Å; A297-S299 PolarHBondContact O-N 3.31Å; S299-R399 PolarHBondContact O-NH2 2.85Å
300	Q	98.4	Very high	97.3	Very high	66 Å²	66	20.7 Å²	20.7	31%	0.308	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-5.6	-179.5	-52.8	-53.1	-56.7	0	0	113.3	I263 Y282 L296 A297 V298	I263-Q300 HydrophobicContact CD1-CB 3.82Å; I263-Q300 HydrophobicContact CG2-CB 4.3Å; Y282-Q300 HydrophobicContact CD1-CG 4.19Å; Y282-Q300 HydrophobicContact CD2-CG 4.12Å; Y282-Q300 HydrophobicContact CE1-CG 3.77Å; Y282-Q300 HydrophobicContact CE2-CB 3.92Å; Y282-Q300 HydrophobicContact CE2-CG 3.69Å; Y282-Q300 HydrophobicContact CG-CG 4.36Å; Y282-Q300 PolarHBondContact OH-OE1 2.92Å; L296-Q300 WeakPolarHBondContact O-CG 3.48Å; A297-Q300 PolarHBondContact O-N 2.82Å; A297-Q300 VanDerWaalsContact O-N 3.15Å; V298-Q300 PolarHBondContact O-N 2.88Å
301	V	98.6	Very high	97.7	Very high	2 Å²	2	18.5 Å²	18.5	1%	0.012	11%	0.107	C	C	.	.			trans	-70	130.6	178.2	175.8	0	0	0	0	111.6	T234 V236 I263 V298 T303 F306 T395 R399	T234-V301 HydrophobicContact CG2-CG2 4.28Å; V236-V301 HydrophobicContact CG1-CG2 3.48Å; V236-V301 VanDerWaalsContact CG1-CG2 3.48Å; I263-V301 HydrophobicContact CD1-CG2 4.23Å; V298-V301 PolarHBondContact O-N 3.07Å; V301-T303 WeakPolarHBondContact CG1-OG1 3.08Å; V301-F306 HydrophobicContact CG1-CB 4.12Å; V301-F306 HydrophobicContact CG2-CB 3.98Å; V301-F306 HydrophobicContact CG2-CG 4.49Å; V301-T395 HydrophobicContact CB-CG2 4.04Å; V301-T395 HydrophobicContact CG1-CG2 3.84Å; V301-T395 WeakPolarHBondContact CG1-OG1 3.4Å; V301-R399 PolarHBondContact O-NH1 2.61Å; V301-R399 PolarHBondContact O-NH2 2.94Å
302	T	97.3	Very high	97.7	Very high	103 Å²	103	19.3 Å²	19.3	63%	0.632	11%	0.111	S	C	*	.			trans	-108.4	-16.9	175.3	53.9	0	0	0	0	113.1
303	T	98.4	Very high	97.7	Very high	13 Å²	13	18.9 Å²	18.9	8%	0.08	11%	0.107	C	C	.	.	S	Bend	trans	-76	157.6	178.9	54	0	0	0	0	112	D231 R232 T234 V301 Y305 T395	D231-T303 WeakPolarHBondContact O-CG2 3.45Å; R232-T303 WeakPolarHBondContact O-CB 3.47Å; T234-T303 WeakPolarHBondContact CB-OG1 3.48Å; T234-T303 PolarHBondContact N-OG1 3.47Å; T234-T303 VanDerWaalsContact N-OG1 3.07Å; T234-T303 WeakPolarHBondContact OG1-CG2 3.18Å; T234-T303 PolarHBondContact OG1-OG1 3.49Å; V301-T303 WeakPolarHBondContact CG1-OG1 3.08Å; T303-Y305 PolarHBondContact O-N 3.3Å; T303-Y305 PolarHBondContact OG1-O 2.95Å; T303-T395 WeakPolarHBondContact O-CB 3.49Å; T303-T395 PolarHBondContact O-OG1 2.94Å
304	K	98.2	Very high	97.7	Very high	7 Å²	7	21.8 Å²	21.8	3%	0.03	12%	0.122	C	C	.	.	S	Bend	trans	-57.8	-37.2	179.5	-173.1	174.7	177.8	-172.7	0	112.6	E84 Y223 I225 E329 T395	E84-K304 IonicContact OE1-NZ 2.77Å; E84-K304 PolarHBondContact OE1-NZ 2.75Å; E84-K304 VanDerWaalsContact OE2-CE 3.3Å; E84-K304 WeakPolarHBondContact OE2-CE 3.23Å; E84-K304 IonicContact OE2-NZ 3.68Å; E84-K304 PolarHBondContact OE2-NZ 3.11Å; Y223-K304 VanDerWaalsContact CD1-CA 3.49Å; Y223-K304 HydrophobicContact CD1-CB 4.06Å; Y223-K304 HydrophobicContact CD2-CB 4.15Å; Y223-K304 HydrophobicContact CD2-CG 3.87Å; Y223-K304 HydrophobicContact CG-CB 3.7Å; Y223-K304 HydrophobicContact CG-CG 3.92Å; I225-K304 HydrophobicContact CG2-CB 3.78Å; I225-K304 HydrophobicContact CG2-CD 3.28Å; I225-K304 HydrophobicContact CG2-CG 4.17Å; K304-E329 WeakPolarHBondContact CE-OE1 3.3Å; K304-E329 IonicContact NZ-OE1 2.61Å; K304-E329 PolarHBondContact NZ-OE1 3.1Å; K304-E329 IonicContact NZ-OE2 3.95Å; K304-E329 PolarHBondContact NZ-OE2 3.44Å; K304-T395 PolarHBondContact O-N 3.02Å; K304-T395 PolarHBondContact O-OG1 3.38Å
305	Y	98.8	Very high	97.8	Very high	2 Å²	2	22 Å²	22	1%	0.008	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	159.1	178.3	-55.4	-66	0	0	0	111.3	R232 V233 T234 T303 M328 E329 L392 G393 R394	R232-Y305 PolarHBondContact O-N 3.38Å; V233-Y305 WeakPolarHBondContact CA-O 3.5Å; T234-Y305 PolarHBondContact N-O 3.33Å; T303-Y305 PolarHBondContact O-N 3.3Å; T303-Y305 PolarHBondContact OG1-O 2.95Å; Y305-M328 HydrophobicContact CD1-CE 3.85Å; Y305-M328 HydrophobicContact CE1-CB 4.05Å; Y305-M328 HydrophobicContact CE1-CE 3.39Å; Y305-M328 HydrophobicContact CE1-CG 4.35Å; Y305-M328 HydrophobicContact CE2-CB 4.38Å; Y305-E329 HydrophobicContact CE2-CG 4.48Å; Y305-E329 WeakPolarHBondContact CE2-OE1 3.34Å; Y305-E329 PolarHBondContact OH-OE1 3.17Å; Y305-L392 HydrophobicContact CG-CD2 4.31Å; Y305-L392 HydrophobicContact CG-CG 4.41Å; Y305-G393 VanDerWaalsContact CA-O 3.28Å; Y305-G393 WeakPolarHBondContact CA-O 3.28Å; Y305-R394 HydrophobicContact CD1-CB 4.13Å; Y305-R394 HydrophobicContact CD1-CG 4.4Å; Y305-R394 HydrophobicContact CE1-CB 3.99Å; Y305-R394 HydrophobicContact CE1-CG 4.02Å; Y305-R394 PolarHBondContact OH-NH1 3.26Å; Y305-R394 PolarHBondContact OH-NH2 3.36Å
306	F	98.9	Very high	97.7	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	150	162.9	67.8	-89.3	0	0	0	110.2	T234 V236 V298 V301 W308 F391 L392 G393 V398	T234-F306 CarbonylContact O-C 3.58Å; T234-F306 WeakPolarHBondContact O-CA 3.46Å; T234-F306 VanDerWaalsContact O-CB 3.3Å; T234-F306 WeakPolarHBondContact O-CB 3.21Å; V236-F306 HydrophobicContact CG1-CB 4.1Å; V236-F306 HydrophobicContact CG2-CB 4.28Å; V236-F306 HydrophobicContact CG2-CD2 3.33Å; V236-F306 HydrophobicContact CG2-CE2 3.98Å; V236-F306 HydrophobicContact CG2-CG 4.11Å; V298-F306 HydrophobicContact CG1-CD1 4.28Å; V298-F306 HydrophobicContact CG1-CE1 3.89Å; V298-F306 HydrophobicContact CG1-CZ 4.33Å; V298-F306 HydrophobicContact CG2-CD1 4.42Å; V298-F306 HydrophobicContact CG2-CD2 4.26Å; V298-F306 HydrophobicContact CG2-CE1 4.07Å; V298-F306 HydrophobicContact CG2-CE2 3.87Å; V298-F306 HydrophobicContact CG2-CZ 3.77Å; V301-F306 HydrophobicContact CG1-CB 4.12Å; V301-F306 HydrophobicContact CG2-CB 3.98Å; V301-F306 HydrophobicContact CG2-CG 4.49Å; F306-W308 HydrophobicContact CD2-CB 4.49Å; F306-W308 HydrophobicContact CE2-CB 4.14Å; F306-F391 AromaticContact CE2-CE2 3.67Å; F306-F391 HydrophobicContact CE2-CE2 3.67Å; F306-F391 HydrophobicContact CE2-CZ 4.16Å; F306-F391 AromaticContact CZ-CE2 3.82Å; F306-F391 HydrophobicContact CZ-CE2 3.82Å; F306-F391 HydrophobicContact CZ-CZ 4.46Å; F306-L392 CarbonylContact O-C 3.52Å; F306-L392 VanDerWaalsContact O-CA 3.32Å; F306-L392 WeakPolarHBondContact O-CA 3.34Å; F306-L392 WeakPolarHBondContact O-CD1 3.15Å; F306-G393 WeakPolarHBondContact CD1-O 3.21Å; F306-G393 PolarHBondContact N-O 3.19Å; F306-G393 PolarHBondContact O-N 3.35Å; F306-V398 HydrophobicContact CE1-CB 3.81Å; F306-V398 HydrophobicContact CE1-CG1 4.06Å; F306-V398 HydrophobicContact CE1-CG2 3.83Å; F306-V398 HydrophobicContact CZ-CB 3.96Å; F306-V398 HydrophobicContact CZ-CG1 3.77Å; F306-V398 HydrophobicContact CZ-CG2 3.82Å
307	L	98.8	Very high	97.6	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.016	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	116.2	171.1	-176.9	75.2	0	0	0	108.9	V233 T234 I235 V236 V309 F315 I321 L324 L390 L392	V233-L307 HydrophobicContact CG1-CB 4.02Å; T234-L307 PolarHBondContact O-N 3.12Å; I235-L307 HydrophobicContact CG1-CB 4.45Å; I235-L307 HydrophobicContact CG1-CD2 4.45Å; V236-L307 PolarHBondContact N-O 3.43Å; L307-V309 HydrophobicContact CD2-CG1 3.99Å; L307-V309 HydrophobicContact CG-CG1 4.07Å; L307-F315 HydrophobicContact CD2-CE1 4.3Å; L307-F315 HydrophobicContact CD2-CZ 3.74Å; L307-I321 HydrophobicContact CD2-CD1 3.98Å; L307-I321 HydrophobicContact CD2-CG1 4.01Å; L307-L324 HydrophobicContact CD1-CD1 3.97Å; L307-L390 HydrophobicContact CD1-CD1 4.24Å; L307-L392 HydrophobicContact CB-CD1 4.12Å; L307-L392 HydrophobicContact CD1-CB 4.26Å; L307-L392 HydrophobicContact CD1-CD1 4.42Å
308	W	98.1	Very high	97.5	Very high	1 Å²	1	29.6 Å²	29.6	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	129.6	170.4	-175.2	-84.5	0	0	0	110.6	V236 K238 R294 F306 D310 F391	V236-W308 HydrophobicContact CB-CE3 4.45Å; V236-W308 HydrophobicContact CG2-CB 4.37Å; V236-W308 HydrophobicContact CG2-CD2 4.35Å; V236-W308 HydrophobicContact CG2-CE3 3.51Å; V236-W308 HydrophobicContact CG2-CZ3 4.02Å; K238-W308 HydrophobicContact CB-CH2 3.68Å; K238-W308 HydrophobicContact CB-CZ2 4.03Å; R294-W308 HydrophobicContact CB-CH2 3.99Å; R294-W308 HydrophobicContact CB-CZ3 3.86Å; R294-W308 HydrophobicContact CG-CE3 4.29Å; R294-W308 HydrophobicContact CG-CH2 3.37Å; R294-W308 HydrophobicContact CG-CZ2 3.76Å; R294-W308 HydrophobicContact CG-CZ3 3.66Å; F306-W308 HydrophobicContact CD2-CB 4.49Å; F306-W308 HydrophobicContact CE2-CB 4.14Å; W308-D310 PolarHBondContact NE1-OD1 2.98Å; W308-F391 HydrophobicContact CB-CD1 3.99Å; W308-F391 HydrophobicContact CB-CD2 4.4Å; W308-F391 HydrophobicContact CB-CE1 3.58Å; W308-F391 HydrophobicContact CB-CE2 4.05Å; W308-F391 HydrophobicContact CB-CG 4.37Å; W308-F391 HydrophobicContact CB-CZ 3.61Å; W308-F391 HydrophobicContact CG-CD1 4.47Å; W308-F391 AromaticContact CG-CE1 3.79Å; W308-F391 HydrophobicContact CG-CE1 3.79Å; W308-F391 HydrophobicContact CG-CZ 4.03Å; W308-F391 PolarHBondContact N-O 2.91Å; W308-F391 PolarHBondContact O-N 3.4Å
309	V	97.6	Very high	97.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.159	C	C	.	.			trans	-136.8	143.6	171.8	-63.3	0	0	0	0	110.8	I235 V236 T237 L249 L307 F313 F315 L390 I433	I235-V309 HydrophobicContact CG2-CG2 3.68Å; V236-V309 PolarHBondContact O-N 3.34Å; V236-V309 VanDerWaalsContact O-N 3.13Å; T237-V309 WeakPolarHBondContact CA-O 3.44Å; T237-V309 VanDerWaalsContact CB-O 3.31Å; T237-V309 WeakPolarHBondContact CB-O 3.44Å; T237-V309 PolarHBondContact OG1-O 3Å; L249-V309 HydrophobicContact CD1-CG2 4.26Å; L249-V309 HydrophobicContact CD2-CG2 3.89Å; L307-V309 HydrophobicContact CD2-CG1 3.99Å; L307-V309 HydrophobicContact CG-CG1 4.07Å; V309-F313 HydrophobicContact CB-CD2 3.86Å; V309-F313 HydrophobicContact CG1-CD2 4.23Å; V309-F315 HydrophobicContact CG1-CE2 4.03Å; V309-F315 HydrophobicContact CG1-CZ 4.26Å; V309-L390 HydrophobicContact CG1-CD1 4.06Å; V309-I433 HydrophobicContact CG1-CD1 3.94Å
310	D	95.4	Very high	97.3	Very high	15 Å²	15	30.7 Å²	30.7	8%	0.08	16%	0.157	C	C	.	.			trans	-76.6	148.4	169.8	-66.9	-11.5	0	0	0	109.7	W290 W308 D312 F313 N389	W290-D310 WeakPolarHBondContact CH2-OD1 3.28Å; W290-D310 WeakPolarHBondContact CH2-OD2 3.39Å; W290-D310 WeakPolarHBondContact CZ2-OD1 3.41Å; W308-D310 PolarHBondContact NE1-OD1 2.98Å; D310-D312 WeakPolarHBondContact CB-OD1 3.28Å; D310-D312 PolarHBondContact O-N 3.21Å; D310-D312 VanDerWaalsContact O-N 3.09Å; D310-F313 HydrophobicContact CB-CD1 3.98Å; D310-F313 HydrophobicContact CB-CD2 4.37Å; D310-F313 HydrophobicContact CB-CE1 3.82Å; D310-F313 HydrophobicContact CB-CE2 4.26Å; D310-F313 HydrophobicContact CB-CG 4.27Å; D310-F313 HydrophobicContact CB-CZ 3.98Å; D310-F313 WeakPolarHBondContact O-CB 3.27Å; D310-F313 PolarHBondContact O-N 3.19Å; D310-N389 WeakPolarHBondContact OD1-CB 3.48Å; D310-N389 VanDerWaalsContact OD2-CB 3.25Å; D310-N389 WeakPolarHBondContact OD2-CB 3.31Å; D310-N389 PolarHBondContact OD2-ND2 3.29Å
311	D	96.1	Very high	97.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.6	-175	62.8	2	0	0	0	114.4	T237 T239 R242 E245 L246	T237-D311 PolarHBondContact OG1-N 2.93Å; T239-D311 WeakPolarHBondContact CA-OD2 3.49Å; T239-D311 PolarHBondContact OG1-OD2 3.12Å; R242-D311 IonicContact CZ-OD1 2.67Å; R242-D311 IonicContact CZ-OD2 2.64Å; R242-D311 VanDerWaalsContact CZ-OD2 3.27Å; R242-D311 IonicContact NE-OD1 3.58Å; R242-D311 PolarHBondContact NE-OD1 3.46Å; R242-D311 VanDerWaalsContact NE-OD1 3.12Å; R242-D311 IonicContact NE-OD2 3.09Å; R242-D311 PolarHBondContact NE-OD2 2.88Å; R242-D311 IonicContact NH1-OD1 3.11Å; R242-D311 PolarHBondContact NH1-OD1 2.87Å; R242-D311 VanDerWaalsContact NH1-OD1 3.11Å; R242-D311 IonicContact NH2-OD1 2.62Å; R242-D311 PolarHBondContact NH2-OD1 3.32Å; R242-D311 IonicContact NH2-OD2 3.12Å; R242-D311 PolarHBondContact NH2-OD2 2.94Å; R242-D311 VanDerWaalsContact NH2-OD2 3.09Å; E245-D311 CarbonylContact C-O 3.53Å; L246-D311 HydrophobicContact CB-CB 4.38Å; L246-D311 HydrophobicContact CD1-CB 4.25Å; L246-D311 PolarHBondContact N-O 3.28Å
312	D	95.3	Very high	97.2	Very high	17 Å²	17	31.4 Å²	31.4	9%	0.091	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	12.3	176.6	59.6	-4	0	0	0	113.4	R242 E245 D310 H435 Q436	R242-D312 IonicContact NH1-OD1 3.9Å; R242-D312 IonicContact NH1-OD2 2.95Å; R242-D312 PolarHBondContact NH1-OD2 3.42Å; E245-D312 HydrophobicContact CB-CB 4.2Å; E245-D312 HydrophobicContact CG-CB 4.34Å; D310-D312 WeakPolarHBondContact CB-OD1 3.28Å; D310-D312 PolarHBondContact O-N 3.21Å; D310-D312 VanDerWaalsContact O-N 3.09Å; D312-H435 IonicContact OD1-NE2 3.85Å; D312-H435 IonicContact OD2-CE1 3.4Å; D312-H435 PolarHBondContact OD2-CE1 3.26Å; D312-H435 IonicContact OD2-NE2 3.64Å; D312-Q436 VanDerWaalsContact O-CB 3.32Å; D312-Q436 WeakPolarHBondContact O-CB 3.3Å; D312-Q436 VanDerWaalsContact O-CG 3.25Å; D312-Q436 WeakPolarHBondContact O-CG 3.09Å; D312-Q436 PolarHBondContact O-N 3.44Å
313	F	97.2	Very high	97.2	Very high	6 Å²	6	29 Å²	29	3%	0.026	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	162	171.4	-72.7	-0.2	0	0	0	112.3	L249 V309 D310 V341 N389 L390 I433 H435 Q436	L249-F313 HydrophobicContact CD1-CB 4.23Å; L249-F313 WeakPolarHBondContact CD1-O 3.45Å; V309-F313 HydrophobicContact CB-CD2 3.86Å; V309-F313 HydrophobicContact CG1-CD2 4.23Å; D310-F313 HydrophobicContact CB-CD1 3.98Å; D310-F313 HydrophobicContact CB-CD2 4.37Å; D310-F313 HydrophobicContact CB-CE1 3.82Å; D310-F313 HydrophobicContact CB-CE2 4.26Å; D310-F313 HydrophobicContact CB-CG 4.27Å; D310-F313 HydrophobicContact CB-CZ 3.98Å; D310-F313 WeakPolarHBondContact O-CB 3.27Å; D310-F313 PolarHBondContact O-N 3.19Å; F313-V341 HydrophobicContact CE1-CG1 3.97Å; F313-V341 HydrophobicContact CE2-CG2 4.25Å; F313-V341 HydrophobicContact CZ-CG1 4.12Å; F313-V341 HydrophobicContact CZ-CG2 3.85Å; F313-N389 WeakPolarHBondContact CE2-O 3.32Å; F313-N389 HydrophobicContact CZ-CB 4.33Å; F313-L390 HydrophobicContact CE2-CB 4.02Å; F313-I433 HydrophobicContact CB-CD1 3.7Å; F313-I433 HydrophobicContact CB-CG1 4.09Å; F313-I433 HydrophobicContact CD2-CD1 3.78Å; F313-I433 HydrophobicContact CD2-CG1 4.43Å; F313-I433 HydrophobicContact CD2-CG2 3.78Å; F313-I433 HydrophobicContact CE2-CG2 3.98Å; F313-I433 HydrophobicContact CG-CD1 4.14Å; F313-I433 HydrophobicContact CG-CG2 4.1Å; F313-H435 AromaticContact CD1-CD2 3.99Å; F313-H435 AromaticContact CE1-CD2 3.81Å; F313-Q436 PolarHBondContact O-NE2 3.48Å
314	L	97.3	Very high	97.2	Very high	61 Å²	61	28.5 Å²	28.5	32%	0.319	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	116.3	-179.1	-177.7	72.2	0	0	0	110	V248 I433 G434 Q436	V248-L314 HydrophobicContact CG1-CD1 3.96Å; L314-I433 VanDerWaalsContact O-CG1 3.25Å; L314-I433 WeakPolarHBondContact O-CG1 3.48Å; L314-G434 PolarHBondContact N-O 3.31Å; L314-G434 WeakPolarHBondContact O-CA 3.18Å; L314-G434 PolarHBondContact O-N 2.87Å; L314-Q436 HydrophobicContact CB-CG 4.37Å
315	F	98	Very high	97.2	Very high	5 Å²	5	28.4 Å²	28.4	2%	0.022	14%	0.14	C	C	.	.			trans	-69.8	137	174.4	-85	-116.6	0	0	0	110.6	I235 L249 S252 I253 Y256 Y257 L307 V309 T319 I321 I433	I235-F315 HydrophobicContact CD1-CE1 4.24Å; I235-F315 HydrophobicContact CD1-CZ 3.84Å; L249-F315 HydrophobicContact CD1-CD2 3.97Å; L249-F315 HydrophobicContact CD1-CE2 4.01Å; S252-F315 PolarHBondContact OG-N 3.29Å; I253-F315 HydrophobicContact CD1-CD2 4.41Å; I253-F315 HydrophobicContact CD1-CE2 4.02Å; I253-F315 HydrophobicContact CG1-CD1 4.42Å; I253-F315 HydrophobicContact CG1-CD2 3.48Å; I253-F315 VanDerWaalsContact CG1-CD2 3.48Å; I253-F315 HydrophobicContact CG1-CE1 4.4Å; I253-F315 HydrophobicContact CG1-CE2 3.45Å; I253-F315 VanDerWaalsContact CG1-CE2 3.45Å; I253-F315 HydrophobicContact CG1-CG 3.99Å; I253-F315 HydrophobicContact CG1-CZ 3.94Å; Y256-F315 HydrophobicContact CD2-CB 3.96Å; Y256-F315 HydrophobicContact CE2-CB 4.37Å; Y256-F315 WeakPolarHBondContact CE2-O 3.47Å; Y257-F315 HydrophobicContact CD2-CD1 4.1Å; Y257-F315 HydrophobicContact CD2-CE1 4.08Å; Y257-F315 HydrophobicContact CE2-CD1 4.05Å; Y257-F315 HydrophobicContact CE2-CE1 4.02Å; L307-F315 HydrophobicContact CD2-CE1 4.3Å; L307-F315 HydrophobicContact CD2-CZ 3.74Å; V309-F315 HydrophobicContact CG1-CE2 4.03Å; V309-F315 HydrophobicContact CG1-CZ 4.26Å; F315-T319 HydrophobicContact CD1-CG2 3.53Å; F315-T319 HydrophobicContact CD2-CG2 4.49Å; F315-T319 HydrophobicContact CE1-CG2 3.56Å; F315-T319 HydrophobicContact CG-CG2 4.02Å; F315-T319 HydrophobicContact CZ-CG2 4.08Å; F315-I321 HydrophobicContact CE1-CD1 4.16Å; F315-I321 HydrophobicContact CE1-CG1 4.36Å; F315-I433 HydrophobicContact CD2-CD1 3.81Å; F315-I433 HydrophobicContact CD2-CG1 4.49Å; F315-I433 HydrophobicContact CE2-CD1 3.67Å; F315-I433 HydrophobicContact CZ-CD1 4.32Å
316	T	96.8	Very high	97.1	Very high	32 Å²	32	33.9 Å²	33.9	20%	0.196	17%	0.165	C	C	.	.			trans	-128.4	177.9	177.3	69.8	0	0	0	0	110.6	K318 T319	T316-K318 PolarHBondContact O-N 3.3Å; T316-K318 VanDerWaalsContact O-N 3.1Å; T316-K318 PolarHBondContact OG1-N 3.34Å; T316-T319 PolarHBondContact N-OG1 2.91Å; T316-T319 VanDerWaalsContact N-OG1 3.08Å; T316-T319 PolarHBondContact O-N 3.01Å
317	D	95.9	Very high	97.1	Very high	100 Å²	100	33.9 Å²	33.9	54%	0.535	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-21.7	171	64.6	-34.9	0	0	0	113	Y256 K320	Y256-D317 HydrophobicContact CE1-CB 4.3Å; Y256-D317 VanDerWaalsContact CZ-N 3.35Å; Y256-D317 PolarHBondContact OH-N 2.91Å; Y256-D317 VanDerWaalsContact OH-N 3.13Å; D317-K320 WeakPolarHBondContact O-CE 3.34Å
318	K	94.9	Very high	97	Very high	128 Å²	128	33.7 Å²	33.7	56%	0.557	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-9.3	177	-59.1	-178.1	-176.4	178.8	0	114.4	T316 K320 S432	T316-K318 PolarHBondContact O-N 3.3Å; T316-K318 VanDerWaalsContact O-N 3.1Å; T316-K318 PolarHBondContact OG1-N 3.34Å; K318-K320 VanDerWaalsContact C-N 3.28Å; K318-K320 PolarHBondContact O-N 3.44Å; K318-K320 VanDerWaalsContact O-N 3.07Å; K318-S432 CarbonylContact C-O 3.6Å; K318-S432 WeakPolarHBondContact CB-OG 3.44Å; K318-S432 PolarHBondContact O-N 3.06Å
319	T	96.1	Very high	96.9	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.018	17%	0.171	C	C	.	.			trans	-87.3	66.4	179.5	-43.5	0	0	0	0	110.6	Y257 F315 T316 I321 S432 I433	Y257-T319 PolarHBondContact OH-O 3.43Å; F315-T319 HydrophobicContact CD1-CG2 3.53Å; F315-T319 HydrophobicContact CD2-CG2 4.49Å; F315-T319 HydrophobicContact CE1-CG2 3.56Å; F315-T319 HydrophobicContact CG-CG2 4.02Å; F315-T319 HydrophobicContact CZ-CG2 4.08Å; T316-T319 PolarHBondContact N-OG1 2.91Å; T316-T319 VanDerWaalsContact N-OG1 3.08Å; T316-T319 PolarHBondContact O-N 3.01Å; T319-I321 PolarHBondContact O-N 2.88Å; T319-S432 VanDerWaalsContact CA-O 3.3Å; T319-S432 WeakPolarHBondContact CA-O 3.35Å; T319-S432 WeakPolarHBondContact CB-O 3.25Å; T319-S432 PolarHBondContact N-O 3.27Å; T319-S432 PolarHBondContact OG1-O 3.15Å; T319-I433 HydrophobicContact CG2-CB 4.26Å; T319-I433 HydrophobicContact CG2-CD1 3.98Å; T319-I433 HydrophobicContact CG2-CG1 4.01Å
320	K	96.9	Very high	96.9	Very high	81 Å²	81	38.1 Å²	38.1	35%	0.352	20%	0.196	S	C	.	.			trans	-88.6	102.8	-179.4	-61.5	-53.6	-167.8	-167	0	111.6	D317 K318 E322 N323	D317-K320 WeakPolarHBondContact O-CE 3.34Å; K318-K320 VanDerWaalsContact C-N 3.28Å; K318-K320 PolarHBondContact O-N 3.44Å; K318-K320 VanDerWaalsContact O-N 3.07Å; K320-E322 VanDerWaalsContact C-N 3.26Å; K320-E322 PolarHBondContact O-N 2.75Å; K320-N323 HydrophobicContact CB-CB 4.32Å; K320-N323 PolarHBondContact O-N 3.41Å
321	I	98.3	Very high	96.9	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-61.7	-37.6	178.6	-56.7	-177.8	0	0	0	110.8	I229 V233 I235 Y257 I260 L307 F315 T319 N323 L324 V325	I229-I321 HydrophobicContact CD1-CB 4.5Å; I229-I321 HydrophobicContact CD1-CG2 3.96Å; I229-I321 HydrophobicContact CG1-CG2 4.25Å; V233-I321 HydrophobicContact CB-CG2 4.13Å; V233-I321 HydrophobicContact CG1-CG2 3.92Å; V233-I321 HydrophobicContact CG2-CG2 3.79Å; I235-I321 HydrophobicContact CD1-CD1 4.1Å; I235-I321 HydrophobicContact CG1-CD1 4.33Å; Y257-I321 HydrophobicContact CD1-CD1 4.31Å; Y257-I321 HydrophobicContact CD2-CD1 4Å; Y257-I321 HydrophobicContact CE1-CB 4.33Å; Y257-I321 HydrophobicContact CE1-CD1 4.06Å; Y257-I321 HydrophobicContact CE1-CG1 4.22Å; Y257-I321 HydrophobicContact CE2-CD1 3.74Å; Y257-I321 HydrophobicContact CE2-CG1 3.78Å; Y257-I321 HydrophobicContact CG-CD1 4.29Å; Y257-I321 PolarHBondContact OH-N 2.76Å; I260-I321 HydrophobicContact CD1-CD1 3.82Å; L307-I321 HydrophobicContact CD2-CD1 3.98Å; L307-I321 HydrophobicContact CD2-CG1 4.01Å; F315-I321 HydrophobicContact CE1-CD1 4.16Å; F315-I321 HydrophobicContact CE1-CG1 4.36Å; T319-I321 PolarHBondContact O-N 2.88Å; I321-N323 PolarHBondContact O-N 3.04Å; I321-L324 PolarHBondContact O-N 3.43Å; I321-V325 HydrophobicContact CG2-CG2 4.29Å; I321-V325 PolarHBondContact O-N 3.04Å
322	E	97.9	Very high	96.9	Very high	81 Å²	81	39 Å²	39	38%	0.379	20%	0.203	S	C	.	.	H	α-helix	trans	-55.5	-40	-179.7	-64.4	81.5	176.8	0	0	111.8	I229 Y257 K320 L324 V325 E326	I229-E322 HydrophobicContact CD1-CG 4.37Å; Y257-E322 VanDerWaalsContact CE1-OE1 3.3Å; Y257-E322 WeakPolarHBondContact CE1-OE1 3.34Å; Y257-E322 PolarHBondContact OH-OE2 3.08Å; K320-E322 VanDerWaalsContact C-N 3.26Å; K320-E322 PolarHBondContact O-N 2.75Å; E322-L324 VanDerWaalsContact C-N 3.33Å; E322-L324 PolarHBondContact O-N 3.38Å; E322-V325 PolarHBondContact O-N 2.67Å; E322-E326 WeakPolarHBondContact O-CB 3.35Å; E322-E326 PolarHBondContact O-N 2.85Å
323	N	97.4	Very high	96.9	Very high	53 Å²	53	43.3 Å²	43.3	28%	0.283	22%	0.222	S	C	.	.	H	α-helix	trans	-66.4	-36.4	179.9	-63.7	3.5	0	0	0	111.5	K320 I321 V327 V431	K320-N323 HydrophobicContact CB-CB 4.32Å; K320-N323 PolarHBondContact O-N 3.41Å; I321-N323 PolarHBondContact O-N 3.04Å; N323-V327 WeakPolarHBondContact O-CG2 3.47Å; N323-V327 PolarHBondContact O-N 2.82Å; N323-V431 HydrophobicContact CB-CG2 3.74Å
324	L	97.6	Very high	96.9	Very high	2 Å²	2	43 Å²	43	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-70	-39.7	173.8	-62.7	-178.7	0	0	0	111.2	L307 I321 E322 E326 V327 M328 V337 L392 C428 V431	L307-L324 HydrophobicContact CD1-CD1 3.97Å; I321-L324 PolarHBondContact O-N 3.43Å; E322-L324 VanDerWaalsContact C-N 3.33Å; E322-L324 PolarHBondContact O-N 3.38Å; L324-E326 VanDerWaalsContact C-N 3.33Å; L324-V327 PolarHBondContact O-N 3.42Å; L324-M328 WeakPolarHBondContact O-CG 3.15Å; L324-M328 PolarHBondContact O-N 3.2Å; L324-M328 VanDerWaalsContact O-N 3.1Å; L324-V337 HydrophobicContact CB-CG1 3.89Å; L324-V337 HydrophobicContact CD2-CG1 4.07Å; L324-V337 HydrophobicContact CD2-CG2 4.07Å; L324-V337 HydrophobicContact CG-CG1 4.44Å; L324-L392 HydrophobicContact CB-CB 4.09Å; L324-L392 HydrophobicContact CB-CD2 3.8Å; L324-L392 HydrophobicContact CD1-CB 4.06Å; L324-C428 HydrophobicContact CD2-CB 4.48Å; L324-V431 HydrophobicContact CD1-CG1 4.22Å; L324-V431 HydrophobicContact CD2-CB 3.99Å; L324-V431 HydrophobicContact CD2-CG1 4.36Å; L324-V431 HydrophobicContact CD2-CG2 3.82Å; L324-V431 HydrophobicContact CG-CB 4.28Å; L324-V431 HydrophobicContact CG-CG1 4.17Å; L324-V431 HydrophobicContact CG-CG2 4.01Å
325	V	98	Very high	96.9	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.03	21%	0.209	C	C	.	.	H	α-helix	trans	-63.1	-41	175.9	172.9	0	0	0	0	110.8	I229 V233 I321 E322 V327 M328 E329 L392	I229-V325 HydrophobicContact CD1-CG2 3.87Å; V233-V325 HydrophobicContact CG2-CG2 3.54Å; I321-V325 HydrophobicContact CG2-CG2 4.29Å; I321-V325 PolarHBondContact O-N 3.04Å; E322-V325 PolarHBondContact O-N 2.67Å; V325-V327 VanDerWaalsContact C-N 3.33Å; V325-V327 PolarHBondContact O-N 3.2Å; V325-M328 PolarHBondContact O-N 3.02Å; V325-E329 HydrophobicContact CG1-CG 3.92Å; V325-E329 WeakPolarHBondContact O-CB 3.17Å; V325-E329 VanDerWaalsContact O-CG 3.29Å; V325-E329 WeakPolarHBondContact O-CG 3.1Å; V325-E329 PolarHBondContact O-N 2.93Å; V325-L392 HydrophobicContact CB-CD2 4.45Å; V325-L392 HydrophobicContact CG2-CD2 3.7Å
326	E	97.3	Very high	97	Very high	117 Å²	117	40.5 Å²	40.5	55%	0.547	21%	0.208	S	C	.	.	H	α-helix	trans	-56.7	-46.9	176.7	-171.9	-177.2	-179.1	0	0	111.5	E322 L324 M328 E329 A330 F378	E322-E326 WeakPolarHBondContact O-CB 3.35Å; E322-E326 PolarHBondContact O-N 2.85Å; L324-E326 VanDerWaalsContact C-N 3.33Å; E326-M328 PolarHBondContact O-N 3.36Å; E326-E329 PolarHBondContact O-N 3.48Å; E326-A330 VanDerWaalsContact O-CB 3.25Å; E326-A330 WeakPolarHBondContact O-CB 2.99Å; E326-A330 PolarHBondContact O-N 2.77Å; E326-F378 HydrophobicContact CG-CE1 4.02Å; E326-F378 HydrophobicContact CG-CZ 4.06Å
327	V	97.9	Very high	97	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60.7	-45.8	176.2	179.2	0	0	0	0	111.3	N323 L324 V325 T331 L334 V337 V375 F378	N323-V327 WeakPolarHBondContact O-CG2 3.47Å; N323-V327 PolarHBondContact O-N 2.82Å; L324-V327 PolarHBondContact O-N 3.42Å; V325-V327 VanDerWaalsContact C-N 3.33Å; V325-V327 PolarHBondContact O-N 3.2Å; V327-T331 WeakPolarHBondContact O-CB 3.29Å; V327-T331 PolarHBondContact O-N 3.13Å; V327-T331 PolarHBondContact O-OG1 3.49Å; V327-L334 HydrophobicContact CG1-CD2 3.79Å; V327-V337 HydrophobicContact CG1-CG2 4.27Å; V327-V375 HydrophobicContact CG1-CG1 4.31Å; V327-F378 HydrophobicContact CG1-CD2 4.45Å; V327-F378 HydrophobicContact CG2-CB 4.5Å; V327-F378 HydrophobicContact CG2-CD1 3.56Å; V327-F378 HydrophobicContact CG2-CD2 4.37Å; V327-F378 HydrophobicContact CG2-CE1 3.76Å; V327-F378 HydrophobicContact CG2-CG 3.88Å; V327-F378 HydrophobicContact CG2-CZ 4.27Å
328	M	97.6	Very high	97	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.6	-35.6	179.5	-69.1	-66.9	-68.7	0	0	113.2	Y305 L324 V325 E326 T331 L334 D335 V337 L392 R394	Y305-M328 HydrophobicContact CD1-CE 3.85Å; Y305-M328 HydrophobicContact CE1-CB 4.05Å; Y305-M328 HydrophobicContact CE1-CE 3.39Å; Y305-M328 HydrophobicContact CE1-CG 4.35Å; Y305-M328 HydrophobicContact CE2-CB 4.38Å; L324-M328 WeakPolarHBondContact O-CG 3.15Å; L324-M328 PolarHBondContact O-N 3.2Å; L324-M328 VanDerWaalsContact O-N 3.1Å; V325-M328 PolarHBondContact O-N 3.02Å; E326-M328 PolarHBondContact O-N 3.36Å; M328-T331 CarbonylContact O-C 3.54Å; M328-T331 VanDerWaalsContact O-O 3.11Å; M328-L334 WeakPolarHBondContact CE-O 3.31Å; M328-L334 HydrophobicContact SD-CB 4.09Å; M328-L334 HydrophobicContact SD-CD2 3.58Å; M328-L334 VanDerWaalsContact SD-CD2 3.58Å; M328-L334 HydrophobicContact SD-CG 3.58Å; M328-L334 VanDerWaalsContact SD-CG 3.58Å; M328-D335 WeakPolarHBondContact CE-O 3.43Å; M328-V337 HydrophobicContact CG-CB 4.48Å; M328-V337 HydrophobicContact CG-CG1 3.63Å; M328-V337 HydrophobicContact SD-CB 4.03Å; M328-V337 HydrophobicContact SD-CG1 3.72Å; M328-L392 HydrophobicContact CG-CD2 3.8Å; M328-R394 HydrophobicContact CE-CB 4.12Å
329	E	96.4	Very high	96.8	Very high	30 Å²	30	28.1 Å²	28.1	14%	0.14	15%	0.146	C	C	.	.	H	α-helix	trans	-80.5	-34.3	-179.2	-69.8	-62.3	110.9	0	0	112.4	K87 K304 Y305 V325 E326 T331	K87-E329 IonicContact NZ-OE2 3.07Å; K87-E329 PolarHBondContact NZ-OE2 3.05Å; K304-E329 WeakPolarHBondContact CE-OE1 3.3Å; K304-E329 IonicContact NZ-OE1 2.61Å; K304-E329 PolarHBondContact NZ-OE1 3.1Å; K304-E329 IonicContact NZ-OE2 3.95Å; K304-E329 PolarHBondContact NZ-OE2 3.44Å; Y305-E329 HydrophobicContact CE2-CG 4.48Å; Y305-E329 WeakPolarHBondContact CE2-OE1 3.34Å; Y305-E329 PolarHBondContact OH-OE1 3.17Å; V325-E329 HydrophobicContact CG1-CG 3.92Å; V325-E329 WeakPolarHBondContact O-CB 3.17Å; V325-E329 VanDerWaalsContact O-CG 3.29Å; V325-E329 WeakPolarHBondContact O-CG 3.1Å; V325-E329 PolarHBondContact O-N 2.93Å; E326-E329 PolarHBondContact O-N 3.48Å; E329-T331 VanDerWaalsContact C-N 3.29Å
330	A	96.6	Very high	96.6	Very high	63 Å²	63	28.3 Å²	28.3	52%	0.521	15%	0.148	S	C	.	.	H	α-helix	trans	-74.1	-20.9	173.8	0	0	0	0	0	112.9	E326 P332 F378	E326-A330 VanDerWaalsContact O-CB 3.25Å; E326-A330 WeakPolarHBondContact O-CB 2.99Å; E326-A330 PolarHBondContact O-N 2.77Å; A330-P332 WeakPolarHBondContact O-CD 3.28Å; A330-F378 HydrophobicContact CB-CE2 3.48Å; A330-F378 VanDerWaalsContact CB-CE2 3.48Å; A330-F378 HydrophobicContact CB-CZ 3.66Å
331	T	96.4	Very high	96.1	Very high	15 Å²	15	25.5 Å²	25.5	9%	0.092	14%	0.137	C	C	.	.			trans	-120.6	80.6	177.8	-45.4	0	0	0	0	110.4	V327 M328 E329 E333 L334 V375 F383	V327-T331 WeakPolarHBondContact O-CB 3.29Å; V327-T331 PolarHBondContact O-N 3.13Å; V327-T331 PolarHBondContact O-OG1 3.49Å; M328-T331 CarbonylContact O-C 3.54Å; M328-T331 VanDerWaalsContact O-O 3.11Å; E329-T331 VanDerWaalsContact C-N 3.29Å; T331-E333 PolarHBondContact O-N 2.94Å; T331-L334 HydrophobicContact CG2-CB 3.89Å; T331-L334 VanDerWaalsContact O-CB 3.23Å; T331-L334 WeakPolarHBondContact O-CB 3.41Å; T331-L334 PolarHBondContact O-N 2.86Å; T331-V375 HydrophobicContact CG2-CG1 4.41Å; T331-V375 WeakPolarHBondContact OG1-CG1 3.25Å; T331-F383 HydrophobicContact CG2-CZ 4.5Å
332	P	94.3	Very high	95.3	Very high	20 Å²	20	27.8 Å²	27.8	13%	0.13	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.2	-172.2	-28.3	36.4	0	0	0	115.9	K87 I90 A330 L334 R394	K87-P332 HydrophobicContact CB-CB 4.1Å; K87-P332 HydrophobicContact CB-CG 4.31Å; K87-P332 HydrophobicContact CG-CB 4.45Å; K87-P332 HydrophobicContact CG-CG 4.13Å; I90-P332 HydrophobicContact CB-CB 4.38Å; I90-P332 HydrophobicContact CD1-CG 4.44Å; I90-P332 HydrophobicContact CG2-CB 4.17Å; I90-P332 HydrophobicContact CG2-CG 4.35Å; A330-P332 WeakPolarHBondContact O-CD 3.28Å; P332-L334 VanDerWaalsContact C-N 3.34Å; P332-R394 PolarHBondContact O-NH2 3.45Å
333	E	95.1	Very high	93.8	Very high	106 Å²	106	26.9 Å²	26.9	50%	0.495	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-16.5	177.3	-62.3	179	96.3	0	0	113.2	I90 T331 L424	I90-E333 HydrophobicContact CG2-CG 4.42Å; T331-E333 PolarHBondContact O-N 2.94Å; E333-L424 HydrophobicContact CB-CD2 3.97Å; E333-L424 WeakPolarHBondContact O-CB 3.33Å
334	L	97.7	Very high	92.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.184	C	C	.	.			trans	-71.9	134	-179.1	-170	65.1	0	0	0	110.6	V327 M328 T331 P332 V337 F383 R394 L424 A426	V327-L334 HydrophobicContact CG1-CD2 3.79Å; M328-L334 WeakPolarHBondContact CE-O 3.31Å; M328-L334 HydrophobicContact SD-CB 4.09Å; M328-L334 HydrophobicContact SD-CD2 3.58Å; M328-L334 VanDerWaalsContact SD-CD2 3.58Å; M328-L334 HydrophobicContact SD-CG 3.58Å; M328-L334 VanDerWaalsContact SD-CG 3.58Å; T331-L334 HydrophobicContact CG2-CB 3.89Å; T331-L334 VanDerWaalsContact O-CB 3.23Å; T331-L334 WeakPolarHBondContact O-CB 3.41Å; T331-L334 PolarHBondContact O-N 2.86Å; P332-L334 VanDerWaalsContact C-N 3.34Å; L334-V337 HydrophobicContact CD2-CB 4.1Å; L334-F383 HydrophobicContact CD1-CD1 4.46Å; L334-F383 HydrophobicContact CD1-CE1 4.13Å; L334-R394 PolarHBondContact O-NE 3.38Å; L334-R394 PolarHBondContact O-NH2 3.41Å; L334-L424 HydrophobicContact CD1-CD2 4.49Å; L334-L424 HydrophobicContact CD1-CG 4.06Å; L334-L424 WeakPolarHBondContact CD1-O 3.36Å; L334-A426 HydrophobicContact CD1-CB 3.69Å; L334-A426 HydrophobicContact CD2-CB 4.09Å
335	D	98.4	Very high	90.3	Very high	13 Å²	13	33 Å²	33	7%	0.07	21%	0.211	C	C	.	.			trans	-110.5	-30.3	-178.8	-64.4	-57.2	0	0	0	112.9	R91 M328 R394 A397 L423 L424	R91-D335 IonicContact NH1-OD1 3.86Å; M328-D335 WeakPolarHBondContact CE-O 3.43Å; D335-R394 WeakPolarHBondContact O-CB 3.32Å; D335-R394 PolarHBondContact O-N 2.94Å; D335-R394 IonicContact OD1-NE 2.86Å; D335-A397 HydrophobicContact CB-CB 3.85Å; D335-A397 VanDerWaalsContact OD1-CB 3.29Å; D335-A397 WeakPolarHBondContact OD1-CB 3.42Å; D335-L423 HydrophobicContact CB-CB 4.5Å; D335-L423 HydrophobicContact CB-CD2 3.89Å; D335-L424 PolarHBondContact N-O 2.83Å; D335-L424 PolarHBondContact OD2-N 2.9Å; D335-L424 VanDerWaalsContact OD2-N 3.15Å
336	V	98.5	Very high	88.6	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	132.1	179	-179.1	0	0	0	0	110.7	V387 F391 L392 V398 F416 L424 V425 A426	V336-V387 HydrophobicContact CG1-CG2 3.96Å; V336-F391 HydrophobicContact CG1-CB 3.83Å; V336-F391 HydrophobicContact CG1-CD2 3.69Å; V336-F391 HydrophobicContact CG1-CG 3.95Å; V336-L392 WeakPolarHBondContact CA-O 3.41Å; V336-V398 HydrophobicContact CG2-CG2 4.21Å; V336-F416 HydrophobicContact CG1-CE1 4.24Å; V336-L424 PolarHBondContact N-O 2.67Å; V336-L424 VanDerWaalsContact N-O 3.13Å; V336-V425 HydrophobicContact CB-CG1 4.16Å; V336-V425 HydrophobicContact CB-CG2 4.23Å; V336-V425 HydrophobicContact CG1-CG1 4.24Å; V336-V425 CarbonylContact O-C 3.6Å; V336-V425 WeakPolarHBondContact O-CA 3.37Å; V336-A426 PolarHBondContact O-N 3.13Å
337	V	97.8	Very high	87.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	124.8	169.6	64.8	0	0	0	0	111.1	L324 V327 M328 L334 F391 L392 A426 C428	L324-V337 HydrophobicContact CB-CG1 3.89Å; L324-V337 HydrophobicContact CD2-CG1 4.07Å; L324-V337 HydrophobicContact CD2-CG2 4.07Å; L324-V337 HydrophobicContact CG-CG1 4.44Å; V327-V337 HydrophobicContact CG1-CG2 4.27Å; M328-V337 HydrophobicContact CG-CB 4.48Å; M328-V337 HydrophobicContact CG-CG1 3.63Å; M328-V337 HydrophobicContact SD-CB 4.03Å; M328-V337 HydrophobicContact SD-CG1 3.72Å; L334-V337 HydrophobicContact CD2-CB 4.1Å; V337-F391 CarbonylContact O-C 3.55Å; V337-F391 VanDerWaalsContact O-CA 3.27Å; V337-F391 WeakPolarHBondContact O-CA 3.49Å; V337-L392 HydrophobicContact CG1-CB 3.85Å; V337-L392 HydrophobicContact CG1-CD2 4.36Å; V337-L392 PolarHBondContact N-O 2.65Å; V337-L392 PolarHBondContact O-N 3.18Å; V337-A426 CarbonylContact C-O 3.58Å; V337-A426 VanDerWaalsContact CA-O 3.31Å; V337-A426 WeakPolarHBondContact CA-O 3.35Å; V337-A426 HydrophobicContact CG2-CB 4.4Å; V337-C428 HydrophobicContact CG2-CB 4.39Å; V337-C428 WeakPolarHBondContact CG2-SG 3.11Å
338	G	95.3	Very high	87	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	150	179.3	0	0	0	0	0	113.6	L390 A426 C428	G338-L390 VanDerWaalsContact CA-O 3.29Å; G338-L390 WeakPolarHBondContact CA-O 3.3Å; G338-A426 PolarHBondContact N-O 3.04Å; G338-C428 PolarHBondContact O-N 2.97Å
339	G	92.4	Very high	86.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	179.2	168.6	0	0	0	0	0	112.3	F347 L390	G339-F347 WeakPolarHBondContact O-CD2 3.31Å; G339-L390 PolarHBondContact N-O 3.17Å
340	S	89.9	Confident	86.6	Confident	7 Å²	7	35 Å²	35	5%	0.049	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	148	175.4	63.8	0	0	0	0	112.5	L390 V431 S432 I433	S340-L390 WeakPolarHBondContact O-CD2 3.3Å; S340-V431 PolarHBondContact N-O 3.2Å; S340-V431 PolarHBondContact OG-O 3.15Å; S340-S432 CarbonylContact O-C 3.59Å; S340-S432 VanDerWaalsContact O-CA 3.22Å; S340-S432 WeakPolarHBondContact O-CA 3.49Å; S340-S432 WeakPolarHBondContact OG-CB 3.47Å; S340-I433 PolarHBondContact O-N 3.28Å
341	V	87.6	Confident	86.5	Confident	22 Å²	22	32.3 Å²	32.3	13%	0.133	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	127.9	176.3	-178.6	0	0	0	0	109.1	F313 G343 H344 V388 L390 I433 H435	F313-V341 HydrophobicContact CE1-CG1 3.97Å; F313-V341 HydrophobicContact CE2-CG2 4.25Å; F313-V341 HydrophobicContact CZ-CG1 4.12Å; F313-V341 HydrophobicContact CZ-CG2 3.85Å; V341-G343 PolarHBondContact O-N 3.09Å; V341-G343 VanDerWaalsContact O-N 3.07Å; V341-H344 PolarHBondContact O-CD2 2.94Å; V341-H344 VanDerWaalsContact O-CD2 3.29Å; V341-H344 PolarHBondContact O-N 3.01Å; V341-H344 VanDerWaalsContact O-N 3.09Å; V341-V388 HydrophobicContact CG2-CG2 3.76Å; V341-L390 HydrophobicContact CG2-CB 3.91Å; V341-I433 HydrophobicContact CB-CG2 4.37Å; V341-I433 HydrophobicContact CG1-CG2 4.24Å; V341-I433 HydrophobicContact CG2-CG2 3.98Å; V341-H435 HydrophobicContact CG1-CB 4.39Å
342	A	81.3	Confident	86.5	Confident	49 Å²	49	33.9 Å²	33.9	41%	0.405	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	29	179.9	0	0	0	0	0	114.8	H344 I433 H435	A342-H344 PolarHBondContact O-N 2.71Å; A342-I433 PolarHBondContact N-O 2.9Å; A342-H435 HydrophobicContact CB-CB 4.23Å
343	G	65.9	Low	86.5	Confident	62 Å²	62	37.4 Å²	37.4	64%	0.639	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.9	11.9	-179.7	0	0	0	0	0	114.7	V341	V341-G343 PolarHBondContact O-N 3.09Å; V341-G343 VanDerWaalsContact O-N 3.07Å
344	H	64.7	Low	86.5	Confident	128 Å²	128	38.8 Å²	38.8	59%	0.593	22%	0.223	S	C	*	.			trans	-70.3	142.5	172.9	-64.1	-65.6	0	0	0	110.6	V341 A342 F347	V341-H344 PolarHBondContact O-CD2 2.94Å; V341-H344 VanDerWaalsContact O-CD2 3.29Å; V341-H344 PolarHBondContact O-N 3.01Å; V341-H344 VanDerWaalsContact O-N 3.09Å; A342-H344 PolarHBondContact O-N 2.71Å; H344-F347 WeakPolarHBondContact O-CD1 3.5Å; H344-F347 WeakPolarHBondContact O-CE1 3.27Å
345	G	57.3	Low	86.3	Confident	56 Å²	56	46.9 Å²	46.9	58%	0.577	26%	0.26	S	S	*	.	S	Bend	trans	-81.2	-16.8	-174.9	0	0	0	0	0	115.9	F347	G345-F347 WeakPolarHBondContact O-CE1 3.31Å
346	Q	61.6	Low	86	Confident	149 Å²	149	48 Å²	48	70%	0.696	28%	0.275	S	S	*	.			trans	-110.4	87.9	-177.3	-68.8	-169.8	-8.8	0	0	111.7	A369	Q346-A369 HydrophobicContact CG-CB 3.93Å
347	F	73.5	Confident	85.6	Confident	12 Å²	12	52.1 Å²	52.1	5%	0.053	30%	0.297	C	S	.	.			trans	-124.9	19	-177.8	48.7	-84	0	0	0	112.8	G339 H344 G345 V387 V388 S427 C428	G339-F347 WeakPolarHBondContact O-CD2 3.31Å; H344-F347 WeakPolarHBondContact O-CD1 3.5Å; H344-F347 WeakPolarHBondContact O-CE1 3.27Å; G345-F347 WeakPolarHBondContact O-CE1 3.31Å; F347-V387 CarbonylContact O-C 3.57Å; F347-V387 WeakPolarHBondContact O-CA 3.14Å; F347-V388 HydrophobicContact CB-CB 4.37Å; F347-V388 HydrophobicContact CB-CG1 4Å; F347-V388 HydrophobicContact CB-CG2 3.56Å; F347-V388 PolarHBondContact O-N 2.89Å; F347-S427 WeakPolarHBondContact CD2-OG 3.41Å; F347-S427 WeakPolarHBondContact CE2-OG 3.34Å; F347-C428 WeakPolarHBondContact CE2-O 3.35Å
348	Y	89.4	Confident	85.1	Confident	30 Å²	30	55.5 Å²	55.5	12%	0.118	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	160.7	-179.3	58.4	-88.8	0	0	0	111.3	A369 V370 K371 G386 S427	Y348-A369 WeakPolarHBondContact CE2-O 3.32Å; Y348-A369 PolarHBondContact O-N 2.71Å; Y348-A369 PolarHBondContact OH-O 2.9Å; Y348-V370 WeakPolarHBondContact CD2-O 3.35Å; Y348-K371 HydrophobicContact CD2-CG 4.14Å; Y348-K371 HydrophobicContact CE2-CD 4.27Å; Y348-K371 HydrophobicContact CE2-CG 3.35Å; Y348-K371 WeakPolarHBondContact OH-CE 3.35Å; Y348-G386 CarbonylContact C-O 3.55Å; Y348-G386 WeakPolarHBondContact CA-O 2.96Å; Y348-G386 WeakPolarHBondContact CB-O 3.43Å; Y348-S427 WeakPolarHBondContact CD1-OG 3.41Å
349	F	92.2	Very high	84.9	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.009	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	155.4	179	59.3	-89.8	0	0	0	111.1	L351 R366 K367 T384 S385 G386 H412 F416	F349-L351 HydrophobicContact CD2-CD2 4.02Å; F349-L351 HydrophobicContact CD2-CG 4.08Å; F349-L351 HydrophobicContact CE2-CD1 4.12Å; F349-L351 HydrophobicContact CE2-CD2 3.9Å; F349-L351 HydrophobicContact CE2-CG 3.87Å; F349-R366 HydrophobicContact CB-CG 4.34Å; F349-R366 HydrophobicContact CD2-CG 3.82Å; F349-R366 HydrophobicContact CE2-CG 4.5Å; F349-R366 HydrophobicContact CG-CG 4.25Å; F349-K367 WeakPolarHBondContact CA-O 3.19Å; F349-K367 WeakPolarHBondContact CB-O 3.48Å; F349-T384 PolarHBondContact O-OG1 3.21Å; F349-S385 PolarHBondContact O-N 3.13Å; F349-S385 VanDerWaalsContact O-N 3.13Å; F349-G386 PolarHBondContact N-O 3.25Å; F349-G386 PolarHBondContact O-N 2.95Å; F349-H412 AromaticContact CE1-CE1 3.93Å; F349-F416 HydrophobicContact CE1-CD2 4.33Å; F349-F416 HydrophobicContact CE2-CB 4.29Å; F349-F416 HydrophobicContact CZ-CB 4.13Å; F349-F416 AromaticContact CZ-CD2 3.67Å; F349-F416 HydrophobicContact CZ-CD2 3.67Å; F349-F416 HydrophobicContact CZ-CE2 4.39Å; F349-F416 HydrophobicContact CZ-CG 4.11Å
350	S	93.3	Very high	84.7	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.007	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147.6	172.7	-69.2	0	0	0	0	111	R366 K367 V370 S385	S350-R366 CarbonylContact O-C 3.08Å; S350-R366 WeakPolarHBondContact O-CA 3.45Å; S350-K367 PolarHBondContact N-O 2.75Å; S350-K367 PolarHBondContact O-N 3.07Å; S350-V370 WeakPolarHBondContact OG-CB 3.39Å; S350-V370 WeakPolarHBondContact OG-CG1 3.39Å; S350-V370 PolarHBondContact OG-O 3.13Å; S350-S385 WeakPolarHBondContact CA-OG 3.43Å
351	L	95	Very high	84.9	Confident	6 Å²	6	67.4 Å²	67.4	3%	0.031	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.1	172.6	-63.7	175.4	0	0	0	107.6	F349 L364 R366 S385 F416 M417 L420	F349-L351 HydrophobicContact CD2-CD2 4.02Å; F349-L351 HydrophobicContact CD2-CG 4.08Å; F349-L351 HydrophobicContact CE2-CD1 4.12Å; F349-L351 HydrophobicContact CE2-CD2 3.9Å; F349-L351 HydrophobicContact CE2-CG 3.87Å; L351-L364 HydrophobicContact CB-CD1 4.47Å; L351-R366 HydrophobicContact CD2-CB 3.82Å; L351-R366 HydrophobicContact CD2-CG 3.96Å; L351-S385 PolarHBondContact N-OG 3.49Å; L351-F416 HydrophobicContact CD1-CB 4.03Å; L351-F416 WeakPolarHBondContact CD1-O 3.35Å; L351-M417 HydrophobicContact CD1-CB 4.46Å; L351-M417 HydrophobicContact CD1-CG 3.91Å; L351-M417 HydrophobicContact CD2-CE 4.36Å; L351-M417 HydrophobicContact CD2-CG 4.29Å; L351-L420 HydrophobicContact CB-CD1 4.11Å; L351-L420 HydrophobicContact CB-CD2 4.21Å
352	V	94.7	Very high	85.3	Confident	48 Å²	48	66.5 Å²	66.5	29%	0.291	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.1	171.3	-177.9	0	0	0	0	106.8	L364 N365 K367	V352-L364 WeakPolarHBondContact O-CA 3.23Å; V352-N365 HydrophobicContact CB-CB 4.49Å; V352-N365 PolarHBondContact N-O 3.31Å; V352-N365 PolarHBondContact O-N 3.11Å; V352-K367 HydrophobicContact CG2-CD 4.46Å
353	Y	95.5	Very high	86.1	Confident	95 Å²	95	65.7 Å²	65.7	37%	0.373	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.1	175.7	176.9	-115.6	0	0	0	109.1	E355 C363 L364 L468	Y353-E355 HydrophobicContact CE1-CB 3.98Å; Y353-E355 HydrophobicContact CE1-CG 4.38Å; Y353-C363 WeakPolarHBondContact CA-O 3.43Å; Y353-L364 HydrophobicContact CD2-CD1 4.22Å; Y353-L364 HydrophobicContact CG-CD1 4.48Å; Y353-L468 HydrophobicContact CD2-CD2 4.1Å; Y353-L468 HydrophobicContact CE2-CD2 3.62Å
354	E	95.5	Very high	87.6	Confident	135 Å²	135	63 Å²	63	63%	0.631	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	113.6	170.9	-69.3	173.3	-166.1	0	0	107.2	G356 G362 C363	E354-G356 PolarHBondContact O-N 3.46Å; E354-G362 CarbonylContact O-C 3.58Å; E354-G362 WeakPolarHBondContact O-CA 3.31Å; E354-C363 PolarHBondContact N-O 2.95Å; E354-C363 PolarHBondContact O-N 3.12Å
355	E	93.7	Very high	89	Confident	170 Å²	170	59 Å²	59	79%	0.794	33%	0.329	S	S	*	.			trans	-65.5	129.3	177.2	-170	170.3	-164.3	0	0	109.4	Y353	Y353-E355 HydrophobicContact CE1-CB 3.98Å; Y353-E355 HydrophobicContact CE1-CG 4.38Å
356	G	91.2	Very high	90.7	Very high	36 Å²	36	58.8 Å²	58.8	37%	0.371	31%	0.311	S	S	.	.			trans	-95	-178.8	178.7	0	0	0	0	0	112.1	E354 G361	E354-G356 PolarHBondContact O-N 3.46Å; G356-G361 WeakPolarHBondContact CA-O 3.32Å
357	N	90.1	Very high	92.1	Very high	87 Å²	87	56 Å²	56	47%	0.465	30%	0.297	S	S	.	.			trans	-72.3	165	167.7	69.8	46.9	0	0	0	110.5	E359 D360 G361	N357-E359 PolarHBondContact O-N 2.88Å; N357-E359 PolarHBondContact OD1-N 2.82Å; N357-D360 WeakPolarHBondContact OD1-CB 3.34Å; N357-D360 PolarHBondContact OD1-N 3.41Å; N357-G361 PolarHBondContact O-N 3.43Å; N357-G361 VanDerWaalsContact O-N 3.07Å
358	G	87.1	Confident	92.6	Very high	71 Å²	71	56.9 Å²	56.9	73%	0.732	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-9.4	-176.5	0	0	0	0	0	115.9	H467	G358-H467 PolarHBondContact O-CE1 3.4Å; G358-H467 PolarHBondContact O-NE2 2.97Å
359	E	90.3	Very high	91.9	Very high	181 Å²	181	57 Å²	57	85%	0.846	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-45.4	177.8	-64	-176.8	169.6	0	0	111.5	N357	N357-E359 PolarHBondContact O-N 2.88Å; N357-E359 PolarHBondContact OD1-N 2.82Å
360	D	88.6	Confident	91.5	Very high	72 Å²	72	59.5 Å²	59.5	39%	0.385	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-30.6	-171.6	-87.9	-18	0	0	0	113.6	N357 K469	N357-D360 WeakPolarHBondContact OD1-CB 3.34Å; N357-D360 PolarHBondContact OD1-N 3.41Å; D360-K469 HydrophobicContact CB-CD 4.1Å; D360-K469 VanDerWaalsContact O-CB 3.31Å; D360-K469 WeakPolarHBondContact O-CB 3.25Å; D360-K469 IonicContact OD1-NZ 3.31Å; D360-K469 IonicContact OD2-NZ 3.5Å; D360-K469 PolarHBondContact OD2-NZ 3.08Å
361	G	94.6	Very high	91.1	Very high	4 Å²	4	63.9 Å²	63.9	4%	0.041	35%	0.351	C	S	.	.			trans	78.2	173.2	-170.7	0	0	0	0	0	114.7	G356 N357 H467	G356-G361 WeakPolarHBondContact CA-O 3.32Å; N357-G361 PolarHBondContact O-N 3.43Å; N357-G361 VanDerWaalsContact O-N 3.07Å; G361-H467 CarbonylContact C-O 3.49Å; G361-H467 VanDerWaalsContact CA-CD2 3.45Å; G361-H467 WeakPolarHBondContact CA-CD2 3.43Å; G361-H467 WeakPolarHBondContact CA-NE2 3.31Å; G361-H467 WeakPolarHBondContact CA-O 3.33Å
362	G	96.9	Very high	91	Very high	2 Å²	2	68.5 Å²	68.5	2%	0.021	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	177	-172.1	0	0	0	0	0	114.9	E354 H467 L468 K469 C470	E354-G362 CarbonylContact O-C 3.58Å; E354-G362 WeakPolarHBondContact O-CA 3.31Å; G362-H467 PolarHBondContact N-O 2.87Å; G362-L468 CarbonylContact O-C 3.56Å; G362-L468 VanDerWaalsContact O-CA 3.31Å; G362-L468 WeakPolarHBondContact O-CA 3.48Å; G362-K469 PolarHBondContact O-N 3.11Å; G362-C470 PolarHBondContact O-N 3.14Å
363	C	96.9	Very high	91	Very high	32 Å²	32	72 Å²	72	22%	0.216	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.6	-179.5	-90.6	0	0	0	0	111.2	Y353 E354 C470	Y353-C363 WeakPolarHBondContact CA-O 3.43Å; E354-C363 PolarHBondContact N-O 2.95Å; E354-C363 PolarHBondContact O-N 3.12Å; C363-C470 WeakPolarHBondContact CA-O 3.41Å; C363-C470 HydrophobicContact CB-CB 4.39Å; C363-C470 WeakPolarHBondContact CB-SG 3.33Å; C363-C470 WeakPolarHBondContact SG-CB 3.44Å; C363-C470 CovalentContact SG-SG 2.03Å; C363-C470 PolarHBondContact SG-SG 2.95Å
364	L	96.7	Very high	91	Very high	7 Å²	7	71.1 Å²	71.1	4%	0.037	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.2	-178	-171.7	79.5	0	0	0	111.6	L351 V352 Y353 M417 L420 L468 C470 I471 R472	L351-L364 HydrophobicContact CB-CD1 4.47Å; V352-L364 WeakPolarHBondContact O-CA 3.23Å; Y353-L364 HydrophobicContact CD2-CD1 4.22Å; Y353-L364 HydrophobicContact CG-CD1 4.48Å; L364-M417 HydrophobicContact CD2-CB 4.24Å; L364-M417 HydrophobicContact CD2-CE 3.6Å; L364-M417 HydrophobicContact CD2-CG 3.52Å; L364-M417 HydrophobicContact CD2-SD 3.44Å; L364-M417 WeakPolarHBondContact CD2-SD 3.42Å; L364-L420 HydrophobicContact CD1-CD2 4.18Å; L364-L468 HydrophobicContact CB-CD1 4.12Å; L364-L468 HydrophobicContact CB-CD2 4.08Å; L364-L468 HydrophobicContact CD2-CD1 4.47Å; L364-C470 PolarHBondContact N-O 3.31Å; L364-I471 HydrophobicContact CB-CG1 4.37Å; L364-I471 HydrophobicContact CD2-CD1 3.95Å; L364-I471 HydrophobicContact CD2-CG1 4.32Å; L364-I471 CarbonylContact O-C 3.6Å; L364-I471 VanDerWaalsContact O-CA 3.29Å; L364-I471 WeakPolarHBondContact O-CA 3.19Å; L364-R472 PolarHBondContact O-N 3.06Å
365	N	95.3	Very high	91.1	Very high	42 Å²	42	64.8 Å²	64.8	23%	0.225	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	116.5	176.7	-169.5	-9.7	0	0	0	110.9	V352	V352-N365 HydrophobicContact CB-CB 4.49Å; V352-N365 PolarHBondContact N-O 3.31Å; V352-N365 PolarHBondContact O-N 3.11Å
366	R	93.2	Very high	91.2	Very high	52 Å²	52	61.3 Å²	61.3	20%	0.196	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	114.1	172.1	-179	-170.8	173.2	-80.4	-2.6	109.4	F349 S350 L351 S413 R472 G474	F349-R366 HydrophobicContact CB-CG 4.34Å; F349-R366 HydrophobicContact CD2-CG 3.82Å; F349-R366 HydrophobicContact CE2-CG 4.5Å; F349-R366 HydrophobicContact CG-CG 4.25Å; S350-R366 CarbonylContact O-C 3.08Å; S350-R366 WeakPolarHBondContact O-CA 3.45Å; L351-R366 HydrophobicContact CD2-CB 3.82Å; L351-R366 HydrophobicContact CD2-CG 3.96Å; R366-S413 WeakPolarHBondContact CD-OG 3.4Å; R366-S413 PolarHBondContact NE-OG 3.02Å; R366-R472 PolarHBondContact N-O 3.35Å; R366-G474 PolarHBondContact NH1-O 2.7Å; R366-G474 WeakPolarHBondContact O-CA 3.05Å; R366-G474 PolarHBondContact O-N 3.48Å
367	K	90.1	Very high	91.4	Very high	91 Å²	91	63.3 Å²	63.3	40%	0.396	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.1	178.4	-60.8	-180	-178.5	177.6	0	110.5	F349 S350 V352 V370	F349-K367 WeakPolarHBondContact CA-O 3.19Å; F349-K367 WeakPolarHBondContact CB-O 3.48Å; S350-K367 PolarHBondContact N-O 2.75Å; S350-K367 PolarHBondContact O-N 3.07Å; V352-K367 HydrophobicContact CG2-CD 4.46Å; K367-V370 HydrophobicContact CB-CG2 3.97Å
368	G	83.9	Confident	91.7	Very high	30 Å²	30	60.6 Å²	60.6	31%	0.309	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	144.5	174.3	0	0	0	0	0	113.1	V370	G368-V370 VanDerWaalsContact C-N 3.26Å; G368-V370 PolarHBondContact O-N 2.84Å; G368-V370 VanDerWaalsContact O-N 3.08Å
369	A	76.2	Confident	91.9	Very high	32 Å²	32	62.5 Å²	62.5	26%	0.264	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	19.8	165.7	0	0	0	0	0	117.6	Q346 Y348	Q346-A369 HydrophobicContact CG-CB 3.93Å; Y348-A369 WeakPolarHBondContact CE2-O 3.32Å; Y348-A369 PolarHBondContact O-N 2.71Å; Y348-A369 PolarHBondContact OH-O 2.9Å
370	V	82.1	Confident	92	Very high	56 Å²	56	56.8 Å²	56.8	34%	0.339	33%	0.332	S	S	.	.			trans	-86	129	173.9	178.6	0	0	0	0	110.6	Y348 S350 K367 G368 T384	Y348-V370 WeakPolarHBondContact CD2-O 3.35Å; S350-V370 WeakPolarHBondContact OG-CB 3.39Å; S350-V370 WeakPolarHBondContact OG-CG1 3.39Å; S350-V370 PolarHBondContact OG-O 3.13Å; K367-V370 HydrophobicContact CB-CG2 3.97Å; G368-V370 VanDerWaalsContact C-N 3.26Å; G368-V370 PolarHBondContact O-N 2.84Å; G368-V370 VanDerWaalsContact O-N 3.08Å; V370-T384 PolarHBondContact O-OG1 3.34Å
371	K	86.2	Confident	92.3	Very high	92 Å²	92	53.3 Å²	53.3	40%	0.4	31%	0.314	S	S	.	.			trans	-109.8	144.4	171.2	-61.9	-176.1	177.3	-169.2	0	109	Y348	Y348-K371 HydrophobicContact CD2-CG 4.14Å; Y348-K371 HydrophobicContact CE2-CD 4.27Å; Y348-K371 HydrophobicContact CE2-CG 3.35Å; Y348-K371 WeakPolarHBondContact OH-CE 3.35Å
372	Y	92.4	Very high	92.4	Very high	104 Å²	104	53.6 Å²	53.6	41%	0.408	32%	0.315	S	S	.	.			trans	-89.2	-148.4	164.6	-54.4	-73.9	0	0	0	109.2	F383 S385	Y372-F383 HydrophobicContact CD2-CB 4.4Å; Y372-F383 WeakPolarHBondContact CD2-O 3.29Å; Y372-F383 PolarHBondContact N-O 2.76Å; Y372-S385 PolarHBondContact OH-OG 3.26Å
373	Q	94.6	Very high	92.3	Very high	121 Å²	121	54.6 Å²	54.6	57%	0.565	32%	0.319	S	S	*	.	S	Bend	trans	-67.4	155.4	177.2	71.8	-77.6	6.4	0	0	112.9	F383	Q373-F383 HydrophobicContact CG-CD2 3.91Å; Q373-F383 HydrophobicContact CG-CE2 4.34Å; Q373-F383 WeakPolarHBondContact O-CD2 3.49Å; Q373-F383 PolarHBondContact O-N 3.02Å
374	P	96.1	Very high	92.3	Very high	76 Å²	76	53.6 Å²	53.6	49%	0.494	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	153.1	171.1	-22.5	33.9	0	0	0	112.6	C381	P374-C381 VanDerWaalsContact CA-O 3.31Å; P374-C381 WeakPolarHBondContact CA-O 3.27Å
375	V	96.9	Very high	92.2	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.012	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	129.9	169.4	-177.9	0	0	0	0	108.2	V327 T331 G377 F378 C381 F383 A426	V327-V375 HydrophobicContact CG1-CG1 4.31Å; T331-V375 HydrophobicContact CG2-CG1 4.41Å; T331-V375 WeakPolarHBondContact OG1-CG1 3.25Å; V375-G377 PolarHBondContact O-N 3.22Å; V375-F378 HydrophobicContact CB-CB 4.27Å; V375-F378 HydrophobicContact CG1-CD2 4.07Å; V375-F378 CarbonylContact O-C 3.55Å; V375-F378 PolarHBondContact O-N 2.82Å; V375-C381 HydrophobicContact CB-CB 4.04Å; V375-C381 HydrophobicContact CG2-CB 3.8Å; V375-C381 PolarHBondContact N-O 2.64Å; V375-F383 HydrophobicContact CB-CZ 4.49Å; V375-F383 HydrophobicContact CG1-CZ 4.36Å; V375-F383 HydrophobicContact CG2-CD1 4.3Å; V375-F383 HydrophobicContact CG2-CE1 4.08Å; V375-F383 HydrophobicContact CG2-CE2 4.31Å; V375-F383 HydrophobicContact CG2-CZ 4.09Å; V375-A426 HydrophobicContact CG2-CB 3.72Å
376	P	95.1	Very high	92.2	Very high	98 Å²	98	51.8 Å²	51.8	64%	0.636	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	127.5	-179.4	-27.9	35.5	0	0	0	112.3	F378	P376-F378 VanDerWaalsContact C-N 3.26Å; P376-F378 VanDerWaalsContact O-CD2 3.28Å; P376-F378 WeakPolarHBondContact O-CD2 3.12Å; P376-F378 PolarHBondContact O-N 2.84Å
377	G	96.1	Very high	92.2	Very high	78 Å²	78	49.3 Å²	49.3	80%	0.804	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-11.1	-176.7	0	0	0	0	0	115.5	V375	V375-G377 PolarHBondContact O-N 3.22Å
378	F	96.3	Very high	92.2	Very high	30 Å²	30	46.8 Å²	46.8	13%	0.132	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	80.9	-177.2	-57.8	-87.4	0	0	0	111.4	E326 V327 A330 V375 P376 T380 C381	E326-F378 HydrophobicContact CG-CE1 4.02Å; E326-F378 HydrophobicContact CG-CZ 4.06Å; V327-F378 HydrophobicContact CG1-CD2 4.45Å; V327-F378 HydrophobicContact CG2-CB 4.5Å; V327-F378 HydrophobicContact CG2-CD1 3.56Å; V327-F378 HydrophobicContact CG2-CD2 4.37Å; V327-F378 HydrophobicContact CG2-CE1 3.76Å; V327-F378 HydrophobicContact CG2-CG 3.88Å; V327-F378 HydrophobicContact CG2-CZ 4.27Å; A330-F378 HydrophobicContact CB-CE2 3.48Å; A330-F378 VanDerWaalsContact CB-CE2 3.48Å; A330-F378 HydrophobicContact CB-CZ 3.66Å; V375-F378 HydrophobicContact CB-CB 4.27Å; V375-F378 HydrophobicContact CG1-CD2 4.07Å; V375-F378 CarbonylContact O-C 3.55Å; V375-F378 PolarHBondContact O-N 2.82Å; P376-F378 VanDerWaalsContact C-N 3.26Å; P376-F378 VanDerWaalsContact O-CD2 3.28Å; P376-F378 WeakPolarHBondContact O-CD2 3.12Å; P376-F378 PolarHBondContact O-N 2.84Å; F378-T380 PolarHBondContact O-N 3.1Å; F378-T380 VanDerWaalsContact O-N 3.16Å; F378-C381 HydrophobicContact CB-CB 3.95Å; F378-C381 WeakPolarHBondContact O-CB 3.46Å; F378-C381 PolarHBondContact O-N 3.26Å; F378-C381 VanDerWaalsContact O-O 3.08Å
379	P	92.3	Very high	92.5	Very high	110 Å²	110	46.7 Å²	46.7	71%	0.714	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.9	-21.1	-173.7	26.4	-35.2	0	0	0	114	C381	P379-C381 PolarHBondContact O-N 2.93Å
380	T	92	Very high	93.3	Very high	61 Å²	61	45.2 Å²	45.2	37%	0.374	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	0	175.1	57.6	0	0	0	0	113	F378 C428 S429 H430	F378-T380 PolarHBondContact O-N 3.1Å; F378-T380 VanDerWaalsContact O-N 3.16Å; T380-C428 WeakPolarHBondContact O-CA 3.45Å; T380-S429 PolarHBondContact O-N 3.13Å; T380-S429 VanDerWaalsContact O-N 3.08Å; T380-S429 PolarHBondContact O-OG 2.03Å; T380-H430 PolarHBondContact OG1-ND1 2.93Å
381	C	94.8	Very high	94	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	143.1	175.8	-58.5	0	0	0	0	110.6	P374 V375 F378 P379 S427 C428 H430	P374-C381 VanDerWaalsContact CA-O 3.31Å; P374-C381 WeakPolarHBondContact CA-O 3.27Å; V375-C381 HydrophobicContact CB-CB 4.04Å; V375-C381 HydrophobicContact CG2-CB 3.8Å; V375-C381 PolarHBondContact N-O 2.64Å; F378-C381 HydrophobicContact CB-CB 3.95Å; F378-C381 WeakPolarHBondContact O-CB 3.46Å; F378-C381 PolarHBondContact O-N 3.26Å; F378-C381 VanDerWaalsContact O-O 3.08Å; P379-C381 PolarHBondContact O-N 2.93Å; C381-S427 CarbonylContact C-O 3.59Å; C381-S427 VanDerWaalsContact CA-O 3.26Å; C381-S427 WeakPolarHBondContact CA-O 3.26Å; C381-C428 HydrophobicContact CB-CB 4.18Å; C381-C428 WeakPolarHBondContact CB-SG 3.42Å; C381-C428 WeakPolarHBondContact SG-CB 3.44Å; C381-C428 CovalentContact SG-SG 2.04Å; C381-C428 PolarHBondContact SG-SG 2.75Å; C381-H430 PolarHBondContact SG-CE1 3.47Å
382	S	95.4	Very high	94.6	Very high	10 Å²	10	38.2 Å²	38.2	7%	0.07	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	146.8	175.9	-47.1	0	0	0	0	110.9	A426 S427	S382-A426 CarbonylContact O-C 3.39Å; S382-A426 WeakPolarHBondContact O-CA 3.43Å; S382-S427 PolarHBondContact N-O 2.93Å; S382-S427 PolarHBondContact O-N 3.16Å
383	F	96.6	Very high	94.9	Very high	23 Å²	23	33.2 Å²	33.2	10%	0.101	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	146.9	173.5	-65.6	-67.2	0	0	0	110.6	T331 L334 Y372 Q373 V375 L424 V425 A426	T331-F383 HydrophobicContact CG2-CZ 4.5Å; L334-F383 HydrophobicContact CD1-CD1 4.46Å; L334-F383 HydrophobicContact CD1-CE1 4.13Å; Y372-F383 HydrophobicContact CD2-CB 4.4Å; Y372-F383 WeakPolarHBondContact CD2-O 3.29Å; Y372-F383 PolarHBondContact N-O 2.76Å; Q373-F383 HydrophobicContact CG-CD2 3.91Å; Q373-F383 HydrophobicContact CG-CE2 4.34Å; Q373-F383 WeakPolarHBondContact O-CD2 3.49Å; Q373-F383 PolarHBondContact O-N 3.02Å; V375-F383 HydrophobicContact CB-CZ 4.49Å; V375-F383 HydrophobicContact CG1-CZ 4.36Å; V375-F383 HydrophobicContact CG2-CD1 4.3Å; V375-F383 HydrophobicContact CG2-CE1 4.08Å; V375-F383 HydrophobicContact CG2-CE2 4.31Å; V375-F383 HydrophobicContact CG2-CZ 4.09Å; F383-L424 HydrophobicContact CD1-CD1 3.81Å; F383-L424 HydrophobicContact CD1-CD2 4.41Å; F383-L424 HydrophobicContact CD1-CG 4.05Å; F383-L424 HydrophobicContact CE1-CD1 3.97Å; F383-L424 HydrophobicContact CE1-CD2 3.74Å; F383-L424 HydrophobicContact CE1-CG 3.84Å; F383-L424 HydrophobicContact CZ-CD2 4.37Å; F383-V425 WeakPolarHBondContact CA-O 3.47Å; F383-A426 HydrophobicContact CD1-CB 4.25Å
384	T	95.4	Very high	95.1	Very high	10 Å²	10	28.1 Å²	28.1	6%	0.061	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	-177.5	-179.3	-165.7	0	0	0	0	109.3	F349 V370 G386 V387 V425	F349-T384 PolarHBondContact O-OG1 3.21Å; V370-T384 PolarHBondContact O-OG1 3.34Å; T384-G386 WeakPolarHBondContact CG2-O 3.48Å; T384-V387 HydrophobicContact CG2-CG1 3.94Å; T384-V425 HydrophobicContact CG2-CB 4.49Å; T384-V425 HydrophobicContact CG2-CG1 3.97Å; T384-V425 PolarHBondContact N-O 2.79Å; T384-V425 VanDerWaalsContact O-O 3.12Å
385	S	95.6	Very high	95.2	Very high	12 Å²	12	24.5 Å²	24.5	8%	0.084	16%	0.163	C	C	.	.	S	Bend	trans	-100.2	-24	176.2	-50	0	0	0	0	113	F349 S350 L351 Y372 F416	F349-S385 PolarHBondContact O-N 3.13Å; F349-S385 VanDerWaalsContact O-N 3.13Å; S350-S385 WeakPolarHBondContact CA-OG 3.43Å; L351-S385 PolarHBondContact N-OG 3.49Å; Y372-S385 PolarHBondContact OH-OG 3.26Å; S385-F416 WeakPolarHBondContact O-CB 3.32Å; S385-F416 VanDerWaalsContact O-CD1 3.31Å; S385-F416 WeakPolarHBondContact O-CD1 3.32Å
386	G	94.9	Very high	95.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	159.8	176.5	0	0	0	0	0	113	Y348 F349 T384	Y348-G386 CarbonylContact C-O 3.55Å; Y348-G386 WeakPolarHBondContact CA-O 2.96Å; Y348-G386 WeakPolarHBondContact CB-O 3.43Å; F349-G386 PolarHBondContact N-O 3.25Å; F349-G386 PolarHBondContact O-N 2.95Å; T384-G386 WeakPolarHBondContact CG2-O 3.48Å
387	V	94.1	Very high	95.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	161.5	-176.4	-67.6	0	0	0	0	110.1	V336 F347 T384 F391 H412 F416 V425 A426	V336-V387 HydrophobicContact CG1-CG2 3.96Å; F347-V387 CarbonylContact O-C 3.57Å; F347-V387 WeakPolarHBondContact O-CA 3.14Å; T384-V387 HydrophobicContact CG2-CG1 3.94Å; V387-F391 HydrophobicContact CG2-CB 3.69Å; V387-F391 HydrophobicContact CG2-CG 4.32Å; V387-H412 PolarHBondContact O-CE1 2.85Å; V387-H412 PolarHBondContact O-NE2 2.86Å; V387-F416 HydrophobicContact CG2-CE1 4.23Å; V387-F416 HydrophobicContact CG2-CZ 3.66Å; V387-F416 VanDerWaalsContact O-CE2 3.25Å; V387-F416 WeakPolarHBondContact O-CE2 3.49Å; V387-V425 HydrophobicContact CG1-CG1 4.01Å; V387-V425 HydrophobicContact CG2-CG1 4.36Å; V387-A426 WeakPolarHBondContact CG1-O 3.34Å
388	V	88.5	Confident	95.4	Very high	37 Å²	37	17.4 Å²	17.4	22%	0.224	10%	0.103	C	C	.	.			trans	-66.8	176.9	175.6	-63.9	0	0	0	0	113.5	V341 F347 L390 H412	V341-V388 HydrophobicContact CG2-CG2 3.76Å; F347-V388 HydrophobicContact CB-CB 4.37Å; F347-V388 HydrophobicContact CB-CG1 4Å; F347-V388 HydrophobicContact CB-CG2 3.56Å; F347-V388 PolarHBondContact O-N 2.89Å; V388-L390 PolarHBondContact O-N 3.42Å; V388-H412 VanDerWaalsContact CA-CE1 3.42Å; V388-H412 WeakPolarHBondContact CA-CE1 3.45Å; V388-H412 VanDerWaalsContact CA-NE2 3.32Å; V388-H412 WeakPolarHBondContact CA-NE2 3.49Å
389	N	90.4	Very high	95.5	Very high	29 Å²	29	20.9 Å²	20.9	16%	0.155	12%	0.115	C	C	.	.	S	Bend	trans	-65.6	25.9	-179.7	-63.2	-25.6	0	0	0	115.4	W290 R294 D310 F313 H412	W290-N389 VanDerWaalsContact CZ2-ND2 3.34Å; W290-N389 WeakPolarHBondContact CZ2-ND2 3.47Å; R294-N389 PolarHBondContact NH2-OD1 2.98Å; D310-N389 WeakPolarHBondContact OD1-CB 3.48Å; D310-N389 VanDerWaalsContact OD2-CB 3.25Å; D310-N389 WeakPolarHBondContact OD2-CB 3.31Å; D310-N389 PolarHBondContact OD2-ND2 3.29Å; F313-N389 WeakPolarHBondContact CE2-O 3.32Å; F313-N389 HydrophobicContact CZ-CB 4.33Å; N389-H412 PolarHBondContact OD1-CD2 3.02Å
390	L	94.1	Very high	95.7	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	11%	0.114	C	C	.	.			trans	-123.9	100.1	163	174.8	69.3	0	0	0	107.7	L307 V309 F313 G338 G339 S340 V341 V388 I433	L307-L390 HydrophobicContact CD1-CD1 4.24Å; V309-L390 HydrophobicContact CG1-CD1 4.06Å; F313-L390 HydrophobicContact CE2-CB 4.02Å; G338-L390 VanDerWaalsContact CA-O 3.29Å; G338-L390 WeakPolarHBondContact CA-O 3.3Å; G339-L390 PolarHBondContact N-O 3.17Å; S340-L390 WeakPolarHBondContact O-CD2 3.3Å; V341-L390 HydrophobicContact CG2-CB 3.91Å; V388-L390 PolarHBondContact O-N 3.42Å; L390-I433 HydrophobicContact CB-CG2 4.35Å; L390-I433 HydrophobicContact CD1-CB 4.18Å; L390-I433 HydrophobicContact CD1-CD1 3.94Å; L390-I433 HydrophobicContact CD1-CG2 4.14Å; L390-I433 HydrophobicContact CD2-CB 3.8Å; L390-I433 HydrophobicContact CD2-CG2 3.64Å; L390-I433 HydrophobicContact CG-CG2 4.25Å
391	F	97.1	Very high	96	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	145.7	177.4	67.9	-92.8	0	0	0	112.7	F306 W308 V336 V337 V387 F403	F306-F391 AromaticContact CE2-CE2 3.67Å; F306-F391 HydrophobicContact CE2-CE2 3.67Å; F306-F391 HydrophobicContact CE2-CZ 4.16Å; F306-F391 AromaticContact CZ-CE2 3.82Å; F306-F391 HydrophobicContact CZ-CE2 3.82Å; F306-F391 HydrophobicContact CZ-CZ 4.46Å; W308-F391 HydrophobicContact CB-CD1 3.99Å; W308-F391 HydrophobicContact CB-CD2 4.4Å; W308-F391 HydrophobicContact CB-CE1 3.58Å; W308-F391 HydrophobicContact CB-CE2 4.05Å; W308-F391 HydrophobicContact CB-CG 4.37Å; W308-F391 HydrophobicContact CB-CZ 3.61Å; W308-F391 HydrophobicContact CG-CD1 4.47Å; W308-F391 AromaticContact CG-CE1 3.79Å; W308-F391 HydrophobicContact CG-CE1 3.79Å; W308-F391 HydrophobicContact CG-CZ 4.03Å; W308-F391 PolarHBondContact N-O 2.91Å; W308-F391 PolarHBondContact O-N 3.4Å; V336-F391 HydrophobicContact CG1-CB 3.83Å; V336-F391 HydrophobicContact CG1-CD2 3.69Å; V336-F391 HydrophobicContact CG1-CG 3.95Å; V337-F391 CarbonylContact O-C 3.55Å; V337-F391 VanDerWaalsContact O-CA 3.27Å; V337-F391 WeakPolarHBondContact O-CA 3.49Å; V387-F391 HydrophobicContact CG2-CB 3.69Å; V387-F391 HydrophobicContact CG2-CG 4.32Å; F391-F403 HydrophobicContact CZ-CZ 4.2Å
392	L	98.6	Very high	96.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	120.5	166	-171.6	78.7	0	0	0	107.7	V233 Y305 F306 L307 L324 V325 M328 V336 V337	V233-L392 HydrophobicContact CG1-CD1 3.76Å; V233-L392 HydrophobicContact CG2-CD1 3.95Å; Y305-L392 HydrophobicContact CG-CD2 4.31Å; Y305-L392 HydrophobicContact CG-CG 4.41Å; F306-L392 CarbonylContact O-C 3.52Å; F306-L392 VanDerWaalsContact O-CA 3.32Å; F306-L392 WeakPolarHBondContact O-CA 3.34Å; F306-L392 WeakPolarHBondContact O-CD1 3.15Å; L307-L392 HydrophobicContact CB-CD1 4.12Å; L307-L392 HydrophobicContact CD1-CB 4.26Å; L307-L392 HydrophobicContact CD1-CD1 4.42Å; L324-L392 HydrophobicContact CB-CB 4.09Å; L324-L392 HydrophobicContact CB-CD2 3.8Å; L324-L392 HydrophobicContact CD1-CB 4.06Å; V325-L392 HydrophobicContact CB-CD2 4.45Å; V325-L392 HydrophobicContact CG2-CD2 3.7Å; M328-L392 HydrophobicContact CG-CD2 3.8Å; V336-L392 WeakPolarHBondContact CA-O 3.41Å; V337-L392 HydrophobicContact CG1-CB 3.85Å; V337-L392 HydrophobicContact CG1-CD2 4.36Å; V337-L392 PolarHBondContact N-O 2.65Å; V337-L392 PolarHBondContact O-N 3.18Å
393	G	98.4	Very high	96.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	140.6	-179.2	0	0	0	0	0	111.8	Y305 F306 T395	Y305-G393 VanDerWaalsContact CA-O 3.28Å; Y305-G393 WeakPolarHBondContact CA-O 3.28Å; F306-G393 WeakPolarHBondContact CD1-O 3.21Å; F306-G393 PolarHBondContact N-O 3.19Å; F306-G393 PolarHBondContact O-N 3.35Å; G393-T395 PolarHBondContact O-N 3.06Å
394	R	98.4	Very high	96.2	Very high	14 Å²	14	22.4 Å²	22.4	5%	0.053	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	121.7	167.9	-168.8	-171.7	-64.8	-67.5	-6.6	109.4	R91 Y305 M328 P332 L334 D335 D396 A397 V398	R91-R394 VanDerWaalsContact NH1-CD 3.29Å; Y305-R394 HydrophobicContact CD1-CB 4.13Å; Y305-R394 HydrophobicContact CD1-CG 4.4Å; Y305-R394 HydrophobicContact CE1-CB 3.99Å; Y305-R394 HydrophobicContact CE1-CG 4.02Å; Y305-R394 PolarHBondContact OH-NH1 3.26Å; Y305-R394 PolarHBondContact OH-NH2 3.36Å; M328-R394 HydrophobicContact CE-CB 4.12Å; P332-R394 PolarHBondContact O-NH2 3.45Å; L334-R394 PolarHBondContact O-NE 3.38Å; L334-R394 PolarHBondContact O-NH2 3.41Å; D335-R394 WeakPolarHBondContact O-CB 3.32Å; D335-R394 PolarHBondContact O-N 2.94Å; D335-R394 IonicContact OD1-NE 2.86Å; R394-D396 WeakPolarHBondContact CD-OD1 3.5Å; R394-D396 WeakPolarHBondContact CG-OD1 3.36Å; R394-D396 PolarHBondContact O-N 3.39Å; R394-A397 HydrophobicContact CB-CB 4.12Å; R394-A397 PolarHBondContact O-N 3.3Å; R394-V398 WeakPolarHBondContact O-CG2 3.47Å; R394-V398 PolarHBondContact O-N 3.49Å
395	T	98.4	Very high	96.2	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59	-45.5	-167.7	-59.1	0	0	0	0	112.7	V301 T303 K304 G393 R399	V301-T395 HydrophobicContact CB-CG2 4.04Å; V301-T395 HydrophobicContact CG1-CG2 3.84Å; V301-T395 WeakPolarHBondContact CG1-OG1 3.4Å; T303-T395 WeakPolarHBondContact O-CB 3.49Å; T303-T395 PolarHBondContact O-OG1 2.94Å; K304-T395 PolarHBondContact O-N 3.02Å; K304-T395 PolarHBondContact O-OG1 3.38Å; G393-T395 PolarHBondContact O-N 3.06Å; T395-R399 VanDerWaalsContact CG2-CZ 3.42Å; T395-R399 WeakPolarHBondContact O-CB 3.48Å; T395-R399 WeakPolarHBondContact O-CD 3.49Å; T395-R399 WeakPolarHBondContact O-CG 3.38Å; T395-R399 PolarHBondContact O-N 3.34Å; T395-R399 VanDerWaalsContact O-N 3.12Å
396	D	96.8	Very high	96	Very high	20 Å²	20	33.1 Å²	33.1	11%	0.107	16%	0.158	C	C	.	.	H	α-helix	trans	-69.6	-39.4	-179.7	70.3	-38.5	0	0	0	112.6	R91 Y223 R394 K400	R91-D396 IonicContact CZ-OD2 3.5Å; R91-D396 IonicContact NH1-OD1 3.15Å; R91-D396 IonicContact NH1-OD2 2.89Å; R91-D396 PolarHBondContact NH1-OD2 3.38Å; R91-D396 VanDerWaalsContact NH1-OD2 3.13Å; R91-D396 IonicContact NH2-OD2 3.28Å; R91-D396 PolarHBondContact NH2-OD2 2.9Å; Y223-D396 HydrophobicContact CE2-CB 4.47Å; R394-D396 WeakPolarHBondContact CD-OD1 3.5Å; R394-D396 WeakPolarHBondContact CG-OD1 3.36Å; R394-D396 PolarHBondContact O-N 3.39Å; D396-K400 VanDerWaalsContact O-CG 3.29Å; D396-K400 WeakPolarHBondContact O-CG 3.24Å; D396-K400 PolarHBondContact O-N 2.92Å; D396-K400 VanDerWaalsContact O-N 3.11Å
397	A	97.8	Very high	95.8	Very high	8 Å²	8	33.7 Å²	33.7	7%	0.066	16%	0.161	C	C	.	.	H	α-helix	trans	-65.9	-48.1	179.7	0	0	0	0	0	111.5	D335 R394 R399 K400 V401 L423	D335-A397 HydrophobicContact CB-CB 3.85Å; D335-A397 VanDerWaalsContact OD1-CB 3.29Å; D335-A397 WeakPolarHBondContact OD1-CB 3.42Å; R394-A397 HydrophobicContact CB-CB 4.12Å; R394-A397 PolarHBondContact O-N 3.3Å; A397-R399 VanDerWaalsContact C-N 3.34Å; A397-R399 PolarHBondContact O-N 3.35Å; A397-K400 PolarHBondContact O-N 3.22Å; A397-V401 PolarHBondContact O-N 3.27Å; A397-L423 HydrophobicContact CB-CD2 3.94Å
398	V	98.1	Very high	95.6	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-39	178.6	176.1	0	0	0	0	111.5	V298 F306 V336 R394 K400 V401 G402 F403 F415	V298-V398 HydrophobicContact CG1-CG1 4.5Å; F306-V398 HydrophobicContact CE1-CB 3.81Å; F306-V398 HydrophobicContact CE1-CG1 4.06Å; F306-V398 HydrophobicContact CE1-CG2 3.83Å; F306-V398 HydrophobicContact CZ-CB 3.96Å; F306-V398 HydrophobicContact CZ-CG1 3.77Å; F306-V398 HydrophobicContact CZ-CG2 3.82Å; V336-V398 HydrophobicContact CG2-CG2 4.21Å; R394-V398 WeakPolarHBondContact O-CG2 3.47Å; R394-V398 PolarHBondContact O-N 3.49Å; V398-K400 VanDerWaalsContact C-N 3.31Å; V398-K400 PolarHBondContact O-N 2.77Å; V398-V401 PolarHBondContact O-N 3.37Å; V398-G402 PolarHBondContact O-N 2.9Å; V398-F403 HydrophobicContact CG1-CE2 3.56Å; V398-F403 HydrophobicContact CG1-CZ 3.74Å; V398-F415 HydrophobicContact CB-CZ 4.3Å; V398-F415 HydrophobicContact CG1-CE2 3.82Å; V398-F415 HydrophobicContact CG1-CZ 3.78Å; V398-F415 HydrophobicContact CG2-CZ 4.07Å
399	R	97.9	Very high	95.4	Very high	102 Å²	102	40.2 Å²	40.2	39%	0.385	19%	0.185	S	C	.	.	H	α-helix	trans	-63	-35.2	176.2	-77.9	173.7	175.2	171.3	-5.6	113.3	V298 S299 V301 T395 A397 V401	V298-R399 HydrophobicContact CG1-CG 3.8Å; V298-R399 VanDerWaalsContact O-CZ 3.27Å; V298-R399 PolarHBondContact O-NE 3.5Å; V298-R399 PolarHBondContact O-NH2 3.16Å; S299-R399 PolarHBondContact O-NH2 2.85Å; V301-R399 PolarHBondContact O-NH1 2.61Å; V301-R399 PolarHBondContact O-NH2 2.94Å; T395-R399 VanDerWaalsContact CG2-CZ 3.42Å; T395-R399 WeakPolarHBondContact O-CB 3.48Å; T395-R399 WeakPolarHBondContact O-CD 3.49Å; T395-R399 WeakPolarHBondContact O-CG 3.38Å; T395-R399 PolarHBondContact O-N 3.34Å; T395-R399 VanDerWaalsContact O-N 3.12Å; A397-R399 VanDerWaalsContact C-N 3.34Å; A397-R399 PolarHBondContact O-N 3.35Å; R399-V401 VanDerWaalsContact C-N 3.35Å
400	K	96.9	Very high	95	Very high	162 Å²	162	41.8 Å²	41.8	70%	0.704	20%	0.195	S	C	*	.	H	α-helix	trans	-66.3	-36.9	177.7	-77.2	171	-176.6	174.6	0	112.4	D396 A397 V398	D396-K400 VanDerWaalsContact O-CG 3.29Å; D396-K400 WeakPolarHBondContact O-CG 3.24Å; D396-K400 PolarHBondContact O-N 2.92Å; D396-K400 VanDerWaalsContact O-N 3.11Å; A397-K400 PolarHBondContact O-N 3.22Å; V398-K400 VanDerWaalsContact C-N 3.31Å; V398-K400 PolarHBondContact O-N 2.77Å
401	V	97.9	Very high	94.4	Very high	36 Å²	36	42.2 Å²	42.2	22%	0.218	20%	0.199	C	C	.	.	H	α-helix	trans	-76.6	-49.1	175.2	178	0	0	0	0	110.5	A397 V398 R399 F415 D418 L423	A397-V401 PolarHBondContact O-N 3.27Å; V398-V401 PolarHBondContact O-N 3.37Å; R399-V401 VanDerWaalsContact C-N 3.35Å; V401-F415 HydrophobicContact CB-CE2 3.9Å; V401-F415 HydrophobicContact CG1-CD2 3.89Å; V401-F415 HydrophobicContact CG1-CE2 3.72Å; V401-D418 HydrophobicContact CG1-CB 3.95Å; V401-L423 HydrophobicContact CG2-CD1 3.94Å; V401-L423 HydrophobicContact CG2-CD2 3.9Å; V401-L423 HydrophobicContact CG2-CG 3.8Å
402	G	96.9	Very high	93.9	Very high	17 Å²	17	44.1 Å²	44.1	18%	0.175	21%	0.207	C	C	.	.			trans	71.3	164.2	-177.4	0	0	0	0	0	113.5	V398 F415	V398-G402 PolarHBondContact O-N 2.9Å; G402-F415 WeakPolarHBondContact O-CD2 3.28Å
403	F	97.1	Very high	93.5	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.013	21%	0.21	C	C	.	.			trans	-106.2	120.1	175.9	-63.2	-83.1	0	0	0	109.5	F291 R294 N295 V298 F391 V398 P405 F415	F291-F403 HydrophobicContact CB-CB 3.65Å; F291-F403 HydrophobicContact CD1-CB 3.87Å; F291-F403 AromaticContact CD1-CD1 3.82Å; F291-F403 HydrophobicContact CD1-CD1 3.82Å; F291-F403 HydrophobicContact CD1-CG 4.22Å; F291-F403 HydrophobicContact CD2-CB 4.06Å; F291-F403 AromaticContact CE1-CD1 3.8Å; F291-F403 HydrophobicContact CE1-CD1 3.8Å; F291-F403 HydrophobicContact CG-CB 3.63Å; F291-F403 HydrophobicContact CG-CD1 4.36Å; F291-F403 HydrophobicContact CG-CG 4.45Å; F291-F403 HydrophobicContact CZ-CD1 4.23Å; R294-F403 HydrophobicContact CB-CB 4.12Å; R294-F403 HydrophobicContact CB-CD1 4.21Å; R294-F403 HydrophobicContact CB-CD2 3.45Å; R294-F403 VanDerWaalsContact CB-CD2 3.45Å; R294-F403 HydrophobicContact CB-CE2 3.84Å; R294-F403 HydrophobicContact CB-CG 3.66Å; R294-F403 HydrophobicContact CB-CZ 4.38Å; R294-F403 HydrophobicContact CG-CD1 4.38Å; R294-F403 HydrophobicContact CG-CD2 4.43Å; R294-F403 HydrophobicContact CG-CG 4.29Å; N295-F403 PolarHBondContact ND2-O 3.13Å; N295-F403 WeakPolarHBondContact OD1-CB 3.46Å; N295-F403 WeakPolarHBondContact OD1-CD2 3.22Å; N295-F403 PolarHBondContact OD1-N 2.96Å; V298-F403 HydrophobicContact CG2-CE2 4.3Å; F391-F403 HydrophobicContact CZ-CZ 4.2Å; V398-F403 HydrophobicContact CG1-CE2 3.56Å; V398-F403 HydrophobicContact CG1-CZ 3.74Å; F403-P405 WeakPolarHBondContact O-CD 3.33Å; F403-P405 VanDerWaalsContact O-N 3.08Å; F403-F415 HydrophobicContact CD1-CB 3.82Å; F403-F415 AromaticContact CD1-CD2 3.63Å; F403-F415 HydrophobicContact CD1-CD2 3.63Å; F403-F415 HydrophobicContact CD1-CE2 4.42Å; F403-F415 AromaticContact CD1-CG 3.79Å; F403-F415 HydrophobicContact CD1-CG 3.79Å; F403-F415 HydrophobicContact CE1-CB 3.83Å; F403-F415 AromaticContact CE1-CD1 3.91Å; F403-F415 HydrophobicContact CE1-CD1 3.91Å; F403-F415 AromaticContact CE1-CD2 3.42Å; F403-F415 HydrophobicContact CE1-CD2 3.42Å; F403-F415 VanDerWaalsContact CE1-CD2 3.42Å; F403-F415 HydrophobicContact CE1-CE1 4.37Å; F403-F415 AromaticContact CE1-CE2 3.93Å; F403-F415 HydrophobicContact CE1-CE2 3.93Å; F403-F415 AromaticContact CE1-CG 3.4Å; F403-F415 HydrophobicContact CE1-CG 3.4Å; F403-F415 VanDerWaalsContact CE1-CG 3.4Å; F403-F415 HydrophobicContact CE1-CZ 4.38Å; F403-F415 HydrophobicContact CE2-CE2 4.5Å; F403-F415 HydrophobicContact CG-CD2 4.3Å; F403-F415 AromaticContact CZ-CD2 3.94Å; F403-F415 HydrophobicContact CZ-CD2 3.94Å; F403-F415 AromaticContact CZ-CE2 3.97Å; F403-F415 HydrophobicContact CZ-CE2 3.97Å; F403-F415 HydrophobicContact CZ-CG 4.22Å; F403-F415 HydrophobicContact CZ-CZ 4.28Å
404	D	96.3	Very high	93.3	Very high	19 Å²	19	44.8 Å²	44.8	10%	0.102	21%	0.211	C	C	.	.			trans	-65.7	108.2	-174.3	-168.5	-26	0	0	0	113.7	F291 R406 L407 H461 K465	F291-D404 VanDerWaalsContact CB-O 3.28Å; F291-D404 WeakPolarHBondContact CB-O 3.32Å; F291-D404 HydrophobicContact CD2-CB 4.33Å; F291-D404 VanDerWaalsContact CD2-O 3.28Å; F291-D404 WeakPolarHBondContact CD2-O 3.13Å; D404-R406 PolarHBondContact O-N 3.37Å; D404-R406 VanDerWaalsContact O-N 3.08Å; D404-R406 VanDerWaalsContact OD1-CB 3.27Å; D404-R406 WeakPolarHBondContact OD1-CB 3.35Å; D404-R406 PolarHBondContact OD1-N 2.91Å; D404-L407 HydrophobicContact CB-CD1 4.35Å; D404-L407 HydrophobicContact CB-CG 4.43Å; D404-L407 PolarHBondContact O-N 2.96Å; D404-H461 IonicContact OD2-CD2 3.51Å; D404-H461 IonicContact OD2-CE1 3.92Å; D404-H461 IonicContact OD2-NE2 3.9Å; D404-H461 PolarHBondContact OD2-NE2 2.93Å; D404-K465 WeakPolarHBondContact OD2-CD 3.29Å; D404-K465 WeakPolarHBondContact OD2-CE 3.4Å; D404-K465 IonicContact OD2-NZ 2.69Å; D404-K465 PolarHBondContact OD2-NZ 3.35Å
405	P	95	Very high	93.2	Very high	65 Å²	65	44.1 Å²	44.1	42%	0.422	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-10.9	-174.9	30.9	-35.8	0	0	0	113.6	A292 F403 L407	A292-P405 HydrophobicContact CB-CB 3.94Å; F403-P405 WeakPolarHBondContact O-CD 3.33Å; F403-P405 VanDerWaalsContact O-N 3.08Å; P405-L407 PolarHBondContact O-N 3.38Å
406	R	92.7	Very high	93.1	Very high	181 Å²	181	44.2 Å²	44.2	68%	0.683	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-26.9	171.5	-67	176.5	62.2	123.3	0.4	111.4	D404 K408 H461	D404-R406 PolarHBondContact O-N 3.37Å; D404-R406 VanDerWaalsContact O-N 3.08Å; D404-R406 VanDerWaalsContact OD1-CB 3.27Å; D404-R406 WeakPolarHBondContact OD1-CB 3.35Å; D404-R406 PolarHBondContact OD1-N 2.91Å; R406-K408 PolarHBondContact O-N 2.95Å; R406-H461 WeakPolarHBondContact CD-CE1 3.07Å; R406-H461 PolarHBondContact NE-CE1 3.39Å; R406-H461 VanDerWaalsContact NE-CE1 3.29Å; R406-H461 PolarHBondContact NE-ND1 3.41Å; R406-H461 VanDerWaalsContact NE-ND1 3.16Å
407	L	91.4	Very high	93.1	Very high	12 Å²	12	44 Å²	44	6%	0.063	21%	0.208	C	C	.	.			trans	-89	81.9	178.8	-55.1	176.6	0	0	0	111.2	F291 D404 P405 A411 E414 K458	F291-L407 HydrophobicContact CD2-CB 4.09Å; F291-L407 HydrophobicContact CD2-CD1 4.29Å; F291-L407 HydrophobicContact CE2-CD1 4.07Å; D404-L407 HydrophobicContact CB-CD1 4.35Å; D404-L407 HydrophobicContact CB-CG 4.43Å; D404-L407 PolarHBondContact O-N 2.96Å; P405-L407 PolarHBondContact O-N 3.38Å; L407-A411 HydrophobicContact CB-CB 3.61Å; L407-A411 HydrophobicContact CD1-CB 3.76Å; L407-A411 HydrophobicContact CG-CB 4.32Å; L407-E414 HydrophobicContact CD1-CB 3.57Å; L407-E414 HydrophobicContact CD1-CG 3.64Å; L407-K458 HydrophobicContact CD2-CB 4.3Å; L407-K458 HydrophobicContact CD2-CD 4.38Å; L407-K458 HydrophobicContact CD2-CG 3.93Å
408	K	89.1	Confident	93	Very high	101 Å²	101	45.6 Å²	45.6	44%	0.439	22%	0.215	S	C	.	.			trans	-75.6	-34.8	-169.8	-61.6	-173.7	178.1	-179.1	0	115.1	Q288 G289 W290 R406	Q288-K408 WeakPolarHBondContact O-CG 3.43Å; G289-K408 VanDerWaalsContact CA-O 3.27Å; G289-K408 WeakPolarHBondContact CA-O 3.33Å; W290-K408 PolarHBondContact N-O 2.89Å; R406-K408 PolarHBondContact O-N 2.95Å
409	R	84.5	Confident	93	Very high	74 Å²	74	45.6 Å²	45.6	28%	0.279	22%	0.216	S	C	.	.	S	Bend	trans	-113.7	-49.9	-165.1	-55.7	-54	-177.5	-171.5	-15	114.2	F447	R409-F447 WeakPolarHBondContact CD-O 3.32Å; R409-F447 PolarHBondContact NE-O 3.37Å
410	V	81	Confident	92.9	Very high	62 Å²	62	43.8 Å²	43.8	38%	0.376	21%	0.214	S	C	.	.	S	Bend	trans	-127.3	93.8	-175.6	-178.8	0	0	0	0	109	Q450 K458	V410-Q450 HydrophobicContact CG2-CB 3.77Å; V410-Q450 HydrophobicContact CG2-CG 4.16Å; V410-K458 PolarHBondContact O-NZ 3.04Å; V410-K458 VanDerWaalsContact O-NZ 3.11Å
411	A	82.8	Confident	92.7	Very high	10 Å²	10	40 Å²	40	8%	0.083	22%	0.22	C	C	.	.			trans	-150.1	141.1	166.8	0	0	0	0	0	111.1	F291 L407 E414	F291-A411 HydrophobicContact CD1-CB 4.42Å; F291-A411 HydrophobicContact CD2-CB 3.82Å; F291-A411 HydrophobicContact CE1-CB 3.92Å; F291-A411 HydrophobicContact CE2-CB 3.29Å; F291-A411 HydrophobicContact CG-CB 4.36Å; F291-A411 HydrophobicContact CZ-CB 3.32Å; L407-A411 HydrophobicContact CB-CB 3.61Å; L407-A411 HydrophobicContact CD1-CB 3.76Å; L407-A411 HydrophobicContact CG-CB 4.32Å; A411-E414 WeakPolarHBondContact CA-OE2 3.44Å; A411-E414 HydrophobicContact CB-CB 4.49Å; A411-E414 VanDerWaalsContact CB-OE2 3.31Å; A411-E414 WeakPolarHBondContact CB-OE2 3.31Å
412	H	85.3	Confident	92.6	Very high	39 Å²	39	42.5 Å²	42.5	18%	0.181	24%	0.239	C	C	.	.	S	Bend	trans	-156.3	-57.9	178.8	178	-132.5	0	0	0	109.3	F349 V387 V388 N389 E414	F349-H412 AromaticContact CE1-CE1 3.93Å; V387-H412 PolarHBondContact O-CE1 2.85Å; V387-H412 PolarHBondContact O-NE2 2.86Å; V388-H412 VanDerWaalsContact CA-CE1 3.42Å; V388-H412 WeakPolarHBondContact CA-CE1 3.45Å; V388-H412 VanDerWaalsContact CA-NE2 3.32Å; V388-H412 WeakPolarHBondContact CA-NE2 3.49Å; N389-H412 PolarHBondContact OD1-CD2 3.02Å; H412-E414 PolarHBondContact N-OE2 3.02Å; H412-E414 PolarHBondContact O-N 3.09Å
413	S	91.6	Very high	92.7	Very high	9 Å²	9	42.8 Å²	42.8	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-66.1	-28.7	179.9	-48.7	0	0	0	0	112.1	R366 F415 F416 M417	R366-S413 WeakPolarHBondContact CD-OG 3.4Å; R366-S413 PolarHBondContact NE-OG 3.02Å; S413-F415 VanDerWaalsContact C-N 3.31Å; S413-F415 PolarHBondContact O-N 3.12Å; S413-F416 CarbonylContact O-C 3.11Å; S413-F416 WeakPolarHBondContact O-CA 3.25Å; S413-F416 WeakPolarHBondContact O-CB 3.42Å; S413-F416 PolarHBondContact O-N 2.62Å; S413-M417 WeakPolarHBondContact O-CG 3.5Å; S413-M417 PolarHBondContact O-N 3.46Å
414	E	94.2	Very high	92.7	Very high	5 Å²	5	45.5 Å²	45.5	2%	0.023	25%	0.251	C	S	.	.	H	α-helix	trans	-65.9	-32.1	-170	-62.6	74.6	-163.9	0	0	112.5	F291 L407 A411 H412 F416 M417 D418 K458 H462	F291-E414 HydrophobicContact CE2-CB 4.2Å; L407-E414 HydrophobicContact CD1-CB 3.57Å; L407-E414 HydrophobicContact CD1-CG 3.64Å; A411-E414 WeakPolarHBondContact CA-OE2 3.44Å; A411-E414 HydrophobicContact CB-CB 4.49Å; A411-E414 VanDerWaalsContact CB-OE2 3.31Å; A411-E414 WeakPolarHBondContact CB-OE2 3.31Å; H412-E414 PolarHBondContact N-OE2 3.02Å; H412-E414 PolarHBondContact O-N 3.09Å; E414-F416 VanDerWaalsContact C-N 3.32Å; E414-F416 PolarHBondContact O-N 3.11Å; E414-M417 HydrophobicContact CB-SD 4.5Å; E414-M417 HydrophobicContact CG-SD 4.13Å; E414-M417 WeakPolarHBondContact O-CB 3.39Å; E414-M417 PolarHBondContact O-N 3.41Å; E414-D418 VanDerWaalsContact O-CG 3.32Å; E414-D418 PolarHBondContact O-N 2.88Å; E414-K458 WeakPolarHBondContact OE1-CE 3.16Å; E414-K458 IonicContact OE1-NZ 3.65Å; E414-K458 PolarHBondContact OE1-NZ 3.49Å; E414-H462 WeakPolarHBondContact CG-CE1 3.5Å
415	F	95.9	Very high	92.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.3	-44.5	169.3	166.9	-108.5	0	0	0	111.7	F291 V398 V401 G402 F403 S413 D418 G419 L423	F291-F415 HydrophobicContact CZ-CB 4.1Å; V398-F415 HydrophobicContact CB-CZ 4.3Å; V398-F415 HydrophobicContact CG1-CE2 3.82Å; V398-F415 HydrophobicContact CG1-CZ 3.78Å; V398-F415 HydrophobicContact CG2-CZ 4.07Å; V401-F415 HydrophobicContact CB-CE2 3.9Å; V401-F415 HydrophobicContact CG1-CD2 3.89Å; V401-F415 HydrophobicContact CG1-CE2 3.72Å; G402-F415 WeakPolarHBondContact O-CD2 3.28Å; F403-F415 HydrophobicContact CD1-CB 3.82Å; F403-F415 AromaticContact CD1-CD2 3.63Å; F403-F415 HydrophobicContact CD1-CD2 3.63Å; F403-F415 HydrophobicContact CD1-CE2 4.42Å; F403-F415 AromaticContact CD1-CG 3.79Å; F403-F415 HydrophobicContact CD1-CG 3.79Å; F403-F415 HydrophobicContact CE1-CB 3.83Å; F403-F415 AromaticContact CE1-CD1 3.91Å; F403-F415 HydrophobicContact CE1-CD1 3.91Å; F403-F415 AromaticContact CE1-CD2 3.42Å; F403-F415 HydrophobicContact CE1-CD2 3.42Å; F403-F415 VanDerWaalsContact CE1-CD2 3.42Å; F403-F415 HydrophobicContact CE1-CE1 4.37Å; F403-F415 AromaticContact CE1-CE2 3.93Å; F403-F415 HydrophobicContact CE1-CE2 3.93Å; F403-F415 AromaticContact CE1-CG 3.4Å; F403-F415 HydrophobicContact CE1-CG 3.4Å; F403-F415 VanDerWaalsContact CE1-CG 3.4Å; F403-F415 HydrophobicContact CE1-CZ 4.38Å; F403-F415 HydrophobicContact CE2-CE2 4.5Å; F403-F415 HydrophobicContact CG-CD2 4.3Å; F403-F415 AromaticContact CZ-CD2 3.94Å; F403-F415 HydrophobicContact CZ-CD2 3.94Å; F403-F415 AromaticContact CZ-CE2 3.97Å; F403-F415 HydrophobicContact CZ-CE2 3.97Å; F403-F415 HydrophobicContact CZ-CG 4.22Å; F403-F415 HydrophobicContact CZ-CZ 4.28Å; S413-F415 VanDerWaalsContact C-N 3.31Å; S413-F415 PolarHBondContact O-N 3.12Å; F415-D418 PolarHBondContact O-N 2.95Å; F415-G419 PolarHBondContact O-N 3.4Å; F415-L423 HydrophobicContact CE1-CD1 3.83Å; F415-L423 HydrophobicContact CE2-CD1 4.24Å; F415-L423 HydrophobicContact CZ-CD1 3.51Å
416	F	96.6	Very high	92.8	Very high	3 Å²	3	41.7 Å²	41.7	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-75.7	-24.9	179	-63.6	-77	0	0	0	112.7	V336 F349 L351 S385 V387 S413 E414 G419 L420 V425	V336-F416 HydrophobicContact CG1-CE1 4.24Å; F349-F416 HydrophobicContact CE1-CD2 4.33Å; F349-F416 HydrophobicContact CE2-CB 4.29Å; F349-F416 HydrophobicContact CZ-CB 4.13Å; F349-F416 AromaticContact CZ-CD2 3.67Å; F349-F416 HydrophobicContact CZ-CD2 3.67Å; F349-F416 HydrophobicContact CZ-CE2 4.39Å; F349-F416 HydrophobicContact CZ-CG 4.11Å; L351-F416 HydrophobicContact CD1-CB 4.03Å; L351-F416 WeakPolarHBondContact CD1-O 3.35Å; S385-F416 WeakPolarHBondContact O-CB 3.32Å; S385-F416 VanDerWaalsContact O-CD1 3.31Å; S385-F416 WeakPolarHBondContact O-CD1 3.32Å; V387-F416 HydrophobicContact CG2-CE1 4.23Å; V387-F416 HydrophobicContact CG2-CZ 3.66Å; V387-F416 VanDerWaalsContact O-CE2 3.25Å; V387-F416 WeakPolarHBondContact O-CE2 3.49Å; S413-F416 CarbonylContact O-C 3.11Å; S413-F416 WeakPolarHBondContact O-CA 3.25Å; S413-F416 WeakPolarHBondContact O-CB 3.42Å; S413-F416 PolarHBondContact O-N 2.62Å; E414-F416 VanDerWaalsContact C-N 3.32Å; E414-F416 PolarHBondContact O-N 3.11Å; F416-G419 CarbonylContact O-C 3.49Å; F416-L420 PolarHBondContact O-N 2.96Å; F416-V425 HydrophobicContact CD1-CG2 4.03Å; F416-V425 HydrophobicContact CE1-CG1 4.07Å; F416-V425 HydrophobicContact CE1-CG2 4.09Å
417	M	96	Very high	92.9	Very high	16 Å²	16	33.3 Å²	33.3	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-66.2	-49.1	170.5	-62.6	174.2	179.3	0	0	110.6	L351 L364 S413 E414 G419 L420 I471 Y473	L351-M417 HydrophobicContact CD1-CB 4.46Å; L351-M417 HydrophobicContact CD1-CG 3.91Å; L351-M417 HydrophobicContact CD2-CE 4.36Å; L351-M417 HydrophobicContact CD2-CG 4.29Å; L364-M417 HydrophobicContact CD2-CB 4.24Å; L364-M417 HydrophobicContact CD2-CE 3.6Å; L364-M417 HydrophobicContact CD2-CG 3.52Å; L364-M417 HydrophobicContact CD2-SD 3.44Å; L364-M417 WeakPolarHBondContact CD2-SD 3.42Å; S413-M417 WeakPolarHBondContact O-CG 3.5Å; S413-M417 PolarHBondContact O-N 3.46Å; E414-M417 HydrophobicContact CB-SD 4.5Å; E414-M417 HydrophobicContact CG-SD 4.13Å; E414-M417 WeakPolarHBondContact O-CB 3.39Å; E414-M417 PolarHBondContact O-N 3.41Å; M417-G419 PolarHBondContact O-N 2.92Å; M417-L420 VanDerWaalsContact O-CB 3.28Å; M417-L420 WeakPolarHBondContact O-CB 3.17Å; M417-L420 PolarHBondContact O-N 3.03Å; M417-I471 HydrophobicContact CE-CD1 3.79Å; M417-I471 HydrophobicContact SD-CD1 4.06Å; M417-Y473 HydrophobicContact CE-CE1 3.83Å
418	D	96.8	Very high	93	Very high	40 Å²	40	32.7 Å²	32.7	21%	0.214	19%	0.193	C	C	.	.	H	α-helix	trans	-66.5	-30.1	176.8	-64.1	-25.8	0	0	0	111.8	V401 E414 F415 K465 N466	V401-D418 HydrophobicContact CG1-CB 3.95Å; E414-D418 VanDerWaalsContact O-CG 3.32Å; E414-D418 PolarHBondContact O-N 2.88Å; F415-D418 PolarHBondContact O-N 2.95Å; D418-K465 WeakPolarHBondContact OD1-CE 3.07Å; D418-K465 IonicContact OD1-NZ 3.86Å; D418-K465 PolarHBondContact OD1-NZ 3.29Å; D418-K465 VanDerWaalsContact OD1-NZ 3.15Å; D418-K465 IonicContact OD2-NZ 2.74Å; D418-K465 PolarHBondContact OD2-NZ 3.06Å; D418-N466 PolarHBondContact OD1-ND2 2.76Å
419	G	97.2	Very high	93	Very high	2 Å²	2	30.8 Å²	30.8	2%	0.021	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.3	175.3	0	0	0	0	0	115.1	F415 F416 M417 G421 S422 L423	F415-G419 PolarHBondContact O-N 3.4Å; F416-G419 CarbonylContact O-C 3.49Å; M417-G419 PolarHBondContact O-N 2.92Å; G419-G421 PolarHBondContact O-N 2.89Å; G419-S422 CarbonylContact O-C 3.51Å; G419-S422 PolarHBondContact O-N 2.77Å; G419-L423 PolarHBondContact O-N 3.29Å
420	L	95.9	Very high	93.3	Very high	64 Å²	64	30.5 Å²	30.5	34%	0.335	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	129.1	-176.5	-171.6	63.6	0	0	0	110.3	L351 L364 F416 M417 S422	L351-L420 HydrophobicContact CB-CD1 4.11Å; L351-L420 HydrophobicContact CB-CD2 4.21Å; L364-L420 HydrophobicContact CD1-CD2 4.18Å; F416-L420 PolarHBondContact O-N 2.96Å; M417-L420 VanDerWaalsContact O-CB 3.28Å; M417-L420 WeakPolarHBondContact O-CB 3.17Å; M417-L420 PolarHBondContact O-N 3.03Å; L420-S422 PolarHBondContact O-N 2.89Å
421	G	93.5	Very high	93.8	Very high	81 Å²	81	27.6 Å²	27.6	84%	0.835	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	77	-4.5	-174.4	0	0	0	0	0	115	G419	G419-G421 PolarHBondContact O-N 2.89Å
422	S	95.3	Very high	94.3	Very high	89 Å²	89	28 Å²	28	62%	0.622	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.7	-26.5	176.8	-62.1	0	0	0	0	113.9	G419 L420	G419-S422 CarbonylContact O-C 3.51Å; G419-S422 PolarHBondContact O-N 2.77Å; L420-S422 PolarHBondContact O-N 2.89Å
423	L	97.7	Very high	94.7	Very high	23 Å²	23	26.3 Å²	26.3	12%	0.12	17%	0.171	C	C	.	.			trans	-108.8	132.8	175.7	-62	177.2	0	0	0	110.4	D335 A397 V401 F415 G419 V425	D335-L423 HydrophobicContact CB-CB 4.5Å; D335-L423 HydrophobicContact CB-CD2 3.89Å; A397-L423 HydrophobicContact CB-CD2 3.94Å; V401-L423 HydrophobicContact CG2-CD1 3.94Å; V401-L423 HydrophobicContact CG2-CD2 3.9Å; V401-L423 HydrophobicContact CG2-CG 3.8Å; F415-L423 HydrophobicContact CE1-CD1 3.83Å; F415-L423 HydrophobicContact CE2-CD1 4.24Å; F415-L423 HydrophobicContact CZ-CD1 3.51Å; G419-L423 PolarHBondContact O-N 3.29Å; L423-V425 HydrophobicContact CB-CG2 4.1Å
424	L	97.4	Very high	94.9	Very high	61 Å²	61	26.6 Å²	26.6	32%	0.319	18%	0.176	S	C	.	.			trans	-91.1	125.7	162.3	-172.7	62.3	0	0	0	109.7	E333 L334 D335 V336 F383	E333-L424 HydrophobicContact CB-CD2 3.97Å; E333-L424 WeakPolarHBondContact O-CB 3.33Å; L334-L424 HydrophobicContact CD1-CD2 4.49Å; L334-L424 HydrophobicContact CD1-CG 4.06Å; L334-L424 WeakPolarHBondContact CD1-O 3.36Å; D335-L424 PolarHBondContact N-O 2.83Å; D335-L424 PolarHBondContact OD2-N 2.9Å; D335-L424 VanDerWaalsContact OD2-N 3.15Å; V336-L424 PolarHBondContact N-O 2.67Å; V336-L424 VanDerWaalsContact N-O 3.13Å; F383-L424 HydrophobicContact CD1-CD1 3.81Å; F383-L424 HydrophobicContact CD1-CD2 4.41Å; F383-L424 HydrophobicContact CD1-CG 4.05Å; F383-L424 HydrophobicContact CE1-CD1 3.97Å; F383-L424 HydrophobicContact CE1-CD2 3.74Å; F383-L424 HydrophobicContact CE1-CG 3.84Å; F383-L424 HydrophobicContact CZ-CD2 4.37Å
425	V	97.9	Very high	94.9	Very high	4 Å²	4	30 Å²	30	2%	0.024	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	137.6	-172.4	-171.9	0	0	0	0	111.2	V336 F383 T384 V387 F416 L423	V336-V425 HydrophobicContact CB-CG1 4.16Å; V336-V425 HydrophobicContact CB-CG2 4.23Å; V336-V425 HydrophobicContact CG1-CG1 4.24Å; V336-V425 CarbonylContact O-C 3.6Å; V336-V425 WeakPolarHBondContact O-CA 3.37Å; F383-V425 WeakPolarHBondContact CA-O 3.47Å; T384-V425 HydrophobicContact CG2-CB 4.49Å; T384-V425 HydrophobicContact CG2-CG1 3.97Å; T384-V425 PolarHBondContact N-O 2.79Å; T384-V425 VanDerWaalsContact O-O 3.12Å; V387-V425 HydrophobicContact CG1-CG1 4.01Å; V387-V425 HydrophobicContact CG2-CG1 4.36Å; F416-V425 HydrophobicContact CD1-CG2 4.03Å; F416-V425 HydrophobicContact CE1-CG1 4.07Å; F416-V425 HydrophobicContact CE1-CG2 4.09Å; L423-V425 HydrophobicContact CB-CG2 4.1Å
426	A	96.9	Very high	94.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	159.1	173.5	0	0	0	0	0	111.7	L334 V336 V337 G338 V375 S382 F383 V387	L334-A426 HydrophobicContact CD1-CB 3.69Å; L334-A426 HydrophobicContact CD2-CB 4.09Å; V336-A426 PolarHBondContact O-N 3.13Å; V337-A426 CarbonylContact C-O 3.58Å; V337-A426 VanDerWaalsContact CA-O 3.31Å; V337-A426 WeakPolarHBondContact CA-O 3.35Å; V337-A426 HydrophobicContact CG2-CB 4.4Å; G338-A426 PolarHBondContact N-O 3.04Å; V375-A426 HydrophobicContact CG2-CB 3.72Å; S382-A426 CarbonylContact O-C 3.39Å; S382-A426 WeakPolarHBondContact O-CA 3.43Å; F383-A426 HydrophobicContact CD1-CB 4.25Å; V387-A426 WeakPolarHBondContact CG1-O 3.34Å
427	S	94.8	Very high	94.5	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.028	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.5	177.3	-175.5	0	0	0	0	110	F347 Y348 C381 S382	F347-S427 WeakPolarHBondContact CD2-OG 3.41Å; F347-S427 WeakPolarHBondContact CE2-OG 3.34Å; Y348-S427 WeakPolarHBondContact CD1-OG 3.41Å; C381-S427 CarbonylContact C-O 3.59Å; C381-S427 VanDerWaalsContact CA-O 3.26Å; C381-S427 WeakPolarHBondContact CA-O 3.26Å; S382-S427 PolarHBondContact N-O 2.93Å; S382-S427 PolarHBondContact O-N 3.16Å
428	C	92.8	Very high	93.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	130.4	-175.9	-65	0	0	0	0	111.1	L324 V337 G338 F347 T380 C381	L324-C428 HydrophobicContact CD2-CB 4.48Å; V337-C428 HydrophobicContact CG2-CB 4.39Å; V337-C428 WeakPolarHBondContact CG2-SG 3.11Å; G338-C428 PolarHBondContact O-N 2.97Å; F347-C428 WeakPolarHBondContact CE2-O 3.35Å; T380-C428 WeakPolarHBondContact O-CA 3.45Å; C381-C428 HydrophobicContact CB-CB 4.18Å; C381-C428 WeakPolarHBondContact CB-SG 3.42Å; C381-C428 WeakPolarHBondContact SG-CB 3.44Å; C381-C428 CovalentContact SG-SG 2.04Å; C381-C428 PolarHBondContact SG-SG 2.75Å
429	S	89.3	Confident	93.3	Very high	61 Å²	61	46.9 Å²	46.9	43%	0.427	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-16.6	-180	57.9	0	0	0	0	114.5	T380 V431	T380-S429 PolarHBondContact O-N 3.13Å; T380-S429 VanDerWaalsContact O-N 3.08Å; T380-S429 PolarHBondContact O-OG 2.03Å; S429-V431 VanDerWaalsContact C-N 3.35Å
430	H	89.7	Confident	92.7	Very high	67 Å²	67	51.8 Å²	51.8	31%	0.31	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-8.9	-172.7	66.5	-90.3	0	0	0	113.9	T380 C381	T380-H430 PolarHBondContact OG1-ND1 2.93Å; C381-H430 PolarHBondContact SG-CE1 3.47Å
431	V	91.9	Very high	92.3	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.7	169.9	-178.5	0	0	0	0	108.4	N323 L324 S340 S429	N323-V431 HydrophobicContact CB-CG2 3.74Å; L324-V431 HydrophobicContact CD1-CG1 4.22Å; L324-V431 HydrophobicContact CD2-CB 3.99Å; L324-V431 HydrophobicContact CD2-CG1 4.36Å; L324-V431 HydrophobicContact CD2-CG2 3.82Å; L324-V431 HydrophobicContact CG-CB 4.28Å; L324-V431 HydrophobicContact CG-CG1 4.17Å; L324-V431 HydrophobicContact CG-CG2 4.01Å; S340-V431 PolarHBondContact N-O 3.2Å; S340-V431 PolarHBondContact OG-O 3.15Å; S429-V431 VanDerWaalsContact C-N 3.35Å
432	S	93.2	Very high	92.1	Very high	20 Å²	20	50.9 Å²	50.9	14%	0.14	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	150.5	178.5	70.6	0	0	0	0	112.3	K318 T319 S340	K318-S432 CarbonylContact C-O 3.6Å; K318-S432 WeakPolarHBondContact CB-OG 3.44Å; K318-S432 PolarHBondContact O-N 3.06Å; T319-S432 VanDerWaalsContact CA-O 3.3Å; T319-S432 WeakPolarHBondContact CA-O 3.35Å; T319-S432 WeakPolarHBondContact CB-O 3.25Å; T319-S432 PolarHBondContact N-O 3.27Å; T319-S432 PolarHBondContact OG1-O 3.15Å; S340-S432 CarbonylContact O-C 3.59Å; S340-S432 VanDerWaalsContact O-CA 3.22Å; S340-S432 WeakPolarHBondContact O-CA 3.49Å; S340-S432 WeakPolarHBondContact OG-CB 3.47Å
433	I	95.1	Very high	91.8	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	145.6	172.1	-156.8	160.4	0	0	0	110.1	V309 F313 L314 F315 T319 S340 V341 A342 L390	V309-I433 HydrophobicContact CG1-CD1 3.94Å; F313-I433 HydrophobicContact CB-CD1 3.7Å; F313-I433 HydrophobicContact CB-CG1 4.09Å; F313-I433 HydrophobicContact CD2-CD1 3.78Å; F313-I433 HydrophobicContact CD2-CG1 4.43Å; F313-I433 HydrophobicContact CD2-CG2 3.78Å; F313-I433 HydrophobicContact CE2-CG2 3.98Å; F313-I433 HydrophobicContact CG-CD1 4.14Å; F313-I433 HydrophobicContact CG-CG2 4.1Å; L314-I433 VanDerWaalsContact O-CG1 3.25Å; L314-I433 WeakPolarHBondContact O-CG1 3.48Å; F315-I433 HydrophobicContact CD2-CD1 3.81Å; F315-I433 HydrophobicContact CD2-CG1 4.49Å; F315-I433 HydrophobicContact CE2-CD1 3.67Å; F315-I433 HydrophobicContact CZ-CD1 4.32Å; T319-I433 HydrophobicContact CG2-CB 4.26Å; T319-I433 HydrophobicContact CG2-CD1 3.98Å; T319-I433 HydrophobicContact CG2-CG1 4.01Å; S340-I433 PolarHBondContact O-N 3.28Å; V341-I433 HydrophobicContact CB-CG2 4.37Å; V341-I433 HydrophobicContact CG1-CG2 4.24Å; V341-I433 HydrophobicContact CG2-CG2 3.98Å; A342-I433 PolarHBondContact N-O 2.9Å; L390-I433 HydrophobicContact CB-CG2 4.35Å; L390-I433 HydrophobicContact CD1-CB 4.18Å; L390-I433 HydrophobicContact CD1-CD1 3.94Å; L390-I433 HydrophobicContact CD1-CG2 4.14Å; L390-I433 HydrophobicContact CD2-CB 3.8Å; L390-I433 HydrophobicContact CD2-CG2 3.64Å; L390-I433 HydrophobicContact CG-CG2 4.25Å
434	G	95.4	Very high	91.5	Very high	16 Å²	16	51.5 Å²	51.5	17%	0.165	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	166	170.6	0	0	0	0	0	111.8	L314	L314-G434 PolarHBondContact N-O 3.31Å; L314-G434 WeakPolarHBondContact O-CA 3.18Å; L314-G434 PolarHBondContact O-N 2.87Å
435	H	94.1	Very high	91	Very high	76 Å²	76	50.8 Å²	50.8	35%	0.352	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	132.7	173.9	-167.1	-61.6	0	0	0	108.6	D312 F313 V341 A342	D312-H435 IonicContact OD1-NE2 3.85Å; D312-H435 IonicContact OD2-CE1 3.4Å; D312-H435 PolarHBondContact OD2-CE1 3.26Å; D312-H435 IonicContact OD2-NE2 3.64Å; F313-H435 AromaticContact CD1-CD2 3.99Å; F313-H435 AromaticContact CE1-CD2 3.81Å; V341-H435 HydrophobicContact CG1-CB 4.39Å; A342-H435 HydrophobicContact CB-CB 4.23Å
436	Q	94.6	Very high	90.5	Very high	18 Å²	18	53.8 Å²	53.8	8%	0.084	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-69.9	149.2	178.8	-63.5	176.1	51.6	0	0	110.7	E245 V248 D312 F313 L314	E245-Q436 PolarHBondContact O-NE2 2.84Å; V248-Q436 VanDerWaalsContact CG1-CD 3.45Å; V248-Q436 HydrophobicContact CG1-CG 4.04Å; D312-Q436 VanDerWaalsContact O-CB 3.32Å; D312-Q436 WeakPolarHBondContact O-CB 3.3Å; D312-Q436 VanDerWaalsContact O-CG 3.25Å; D312-Q436 WeakPolarHBondContact O-CG 3.09Å; D312-Q436 PolarHBondContact O-N 3.44Å; F313-Q436 PolarHBondContact O-NE2 3.48Å; L314-Q436 HydrophobicContact CB-CG 4.37Å
437	P	88.9	Confident	90.1	Very high	115 Å²	115	56.4 Å²	56.4	75%	0.747	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-57	144.1	171	-22.6	33.5	0	0	0	111.3	I439	P437-I439 PolarHBondContact O-N 2.71Å
438	K	83.8	Confident	89.6	Confident	184 Å²	184	63 Å²	63	80%	0.8	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-68.5	121.7	179.5	-68.1	-179.6	-179.2	173.6	0	110.5
439	I	84.9	Confident	89	Confident	96 Å²	96	71.5 Å²	71.5	49%	0.492	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-92.1	133.7	171.4	-57	175.1	0	0	0	108.9	T244 E245 P437 N441	T244-I439 HydrophobicContact CG2-CD1 4.22Å; E245-I439 HydrophobicContact CG-CD1 4.39Å; P437-I439 PolarHBondContact O-N 2.71Å; I439-N441 PolarHBondContact O-N 3.35Å
440	A	84.6	Confident	88.6	Confident	105 Å²	105	72 Å²	72	87%	0.868	38%	0.381	S	S	*	.			trans	-69.4	114.7	178.3	0	0	0	0	0	110.5
441	N	87.4	Confident	88.4	Confident	41 Å²	41	75.8 Å²	75.8	22%	0.219	40%	0.397	C	S	.	.			trans	-132.6	100.6	174.8	-177.8	-25.1	0	0	0	109.2	L241 I439 K443 Y444 S445	L241-N441 PolarHBondContact O-ND2 2.67Å; I439-N441 PolarHBondContact O-N 3.35Å; N441-K443 PolarHBondContact O-N 2.94Å; N441-K443 PolarHBondContact OD1-N 2.92Å; N441-Y444 PolarHBondContact O-N 3.1Å; N441-Y444 WeakPolarHBondContact OD1-CB 3.47Å; N441-Y444 PolarHBondContact OD1-N 2.84Å; N441-S445 VanDerWaalsContact O-CB 3.26Å; N441-S445 WeakPolarHBondContact O-CB 3.25Å; N441-S445 PolarHBondContact O-N 3.01Å; N441-S445 PolarHBondContact O-OG 3.33Å
442	A	87.9	Confident	88.2	Confident	86 Å²	86	80.8 Å²	80.8	71%	0.711	43%	0.432	S	S	*	.	H	α-helix	trans	-63.9	-40.8	-175	0	0	0	0	0	112.6	S445 S446	A442-S445 PolarHBondContact O-N 3.07Å; A442-S446 PolarHBondContact O-N 3.08Å
443	K	90.3	Very high	88	Confident	96 Å²	96	86.6 Å²	86.6	42%	0.417	46%	0.455	S	S	.	.	H	α-helix	trans	-63	-49	177.8	-165	177.6	-176.1	-178.9	0	110.1	L241 L269 E270 N441 S445 S446 F447	L241-K443 HydrophobicContact CD1-CB 4.35Å; L241-K443 HydrophobicContact CD1-CD 4.12Å; L241-K443 HydrophobicContact CD1-CG 3.87Å; L269-K443 VanDerWaalsContact CD1-CE 3.41Å; E270-K443 IonicContact OE1-NZ 2.75Å; N441-K443 PolarHBondContact O-N 2.94Å; N441-K443 PolarHBondContact OD1-N 2.92Å; K443-S445 VanDerWaalsContact C-N 3.34Å; K443-S445 PolarHBondContact O-N 2.83Å; K443-S446 PolarHBondContact O-N 2.86Å; K443-S446 PolarHBondContact O-OG 2.82Å; K443-F447 VanDerWaalsContact O-CD2 3.23Å; K443-F447 WeakPolarHBondContact O-CD2 3.22Å
444	Y	89.6	Confident	87.6	Confident	28 Å²	28	89.3 Å²	89.3	11%	0.11	47%	0.469	C	S	.	.	H	α-helix	trans	-59.2	-44.3	173.5	173	-107	0	0	0	112.4	F240 R242 N441 S446 F447 R448	F240-Y444 AromaticContact CD1-CD2 3.79Å; F240-Y444 HydrophobicContact CD1-CD2 3.79Å; F240-Y444 HydrophobicContact CD1-CE2 4.19Å; F240-Y444 HydrophobicContact CE1-CD2 4.48Å; F240-Y444 VanDerWaalsContact O-CD2 3.32Å; F240-Y444 WeakPolarHBondContact O-CD2 3.18Å; R242-Y444 HydrophobicContact CG-CD2 4.18Å; R242-Y444 HydrophobicContact CG-CE2 4.29Å; R242-Y444 HydrophobicContact CG-CG 4.43Å; R242-Y444 PolarHBondContact NH1-OH 3.35Å; R242-Y444 PolarHBondContact NH2-OH 3.08Å; N441-Y444 PolarHBondContact O-N 3.1Å; N441-Y444 WeakPolarHBondContact OD1-CB 3.47Å; N441-Y444 PolarHBondContact OD1-N 2.84Å; Y444-S446 VanDerWaalsContact C-N 3.27Å; Y444-S446 PolarHBondContact O-N 2.73Å; Y444-F447 PolarHBondContact O-N 3.32Å; Y444-R448 PolarHBondContact O-N 3.34Å; Y444-R448 VanDerWaalsContact O-N 3.12Å
445	S	87.8	Confident	87.3	Confident	47 Å²	47	92.5 Å²	92.5	33%	0.329	48%	0.482	S	S	.	.	H	α-helix	trans	-66.4	-25	-176.1	-60.9	0	0	0	0	113.7	N441 A442 K443 F447 R449	N441-S445 VanDerWaalsContact O-CB 3.26Å; N441-S445 WeakPolarHBondContact O-CB 3.25Å; N441-S445 PolarHBondContact O-N 3.01Å; N441-S445 PolarHBondContact O-OG 3.33Å; A442-S445 PolarHBondContact O-N 3.07Å; K443-S445 VanDerWaalsContact C-N 3.34Å; K443-S445 PolarHBondContact O-N 2.83Å; S445-F447 VanDerWaalsContact C-N 3.33Å; S445-R449 PolarHBondContact O-NE 3.06Å
446	S	88.6	Confident	87.2	Confident	66 Å²	66	95.5 Å²	95.5	46%	0.462	50%	0.496	S	S	.	.	H	α-helix	trans	-71.5	-28.2	173.5	68.3	0	0	0	0	112.6	A442 K443 Y444	A442-S446 PolarHBondContact O-N 3.08Å; K443-S446 PolarHBondContact O-N 2.86Å; K443-S446 PolarHBondContact O-OG 2.82Å; Y444-S446 VanDerWaalsContact C-N 3.27Å; Y444-S446 PolarHBondContact O-N 2.73Å
447	F	88.3	Confident	87.1	Confident	56 Å²	56	98.7 Å²	98.7	25%	0.246	51%	0.514	C	S	.	.	H	α-helix	trans	-87.1	-24.7	176.6	-73.7	-84.8	0	0	0	113.4	F240 L269 A287 R409 K443 Y444 S445	F240-F447 HydrophobicContact CE1-CB 3.64Å; F240-F447 HydrophobicContact CE1-CD1 4.33Å; F240-F447 AromaticContact CE1-CD2 3.64Å; F240-F447 HydrophobicContact CE1-CD2 3.64Å; F240-F447 HydrophobicContact CE1-CE2 4.4Å; F240-F447 AromaticContact CE1-CG 3.62Å; F240-F447 HydrophobicContact CE1-CG 3.62Å; F240-F447 HydrophobicContact CZ-CB 4.28Å; F240-F447 HydrophobicContact CZ-CD1 4.12Å; F240-F447 AromaticContact CZ-CD2 3.74Å; F240-F447 HydrophobicContact CZ-CD2 3.74Å; F240-F447 HydrophobicContact CZ-CE1 4.38Å; F240-F447 HydrophobicContact CZ-CE2 4.06Å; F240-F447 AromaticContact CZ-CG 3.79Å; F240-F447 HydrophobicContact CZ-CG 3.79Å; F240-F447 HydrophobicContact CZ-CZ 4.36Å; L269-F447 HydrophobicContact CD1-CE2 4.27Å; L269-F447 HydrophobicContact CD1-CZ 4.23Å; L269-F447 HydrophobicContact CD2-CZ 4.28Å; A287-F447 HydrophobicContact CB-CD1 4.16Å; A287-F447 HydrophobicContact CB-CE1 3.97Å; R409-F447 WeakPolarHBondContact CD-O 3.32Å; R409-F447 PolarHBondContact NE-O 3.37Å; K443-F447 VanDerWaalsContact O-CD2 3.23Å; K443-F447 WeakPolarHBondContact O-CD2 3.22Å; Y444-F447 PolarHBondContact O-N 3.32Å; S445-F447 VanDerWaalsContact C-N 3.33Å
448	R	83.6	Confident	87.2	Confident	141 Å²	141	94.1 Å²	94.1	53%	0.532	48%	0.483	S	S	.	.	H	α-helix	trans	-74.3	-30.6	-178.4	-173.9	172.9	-178.2	157.9	6.1	113.4	Y444 Q450	Y444-R448 PolarHBondContact O-N 3.34Å; Y444-R448 VanDerWaalsContact O-N 3.12Å; R448-Q450 PolarHBondContact O-N 3.41Å
449	R	80.3	Confident	87.7	Confident	180 Å²	180	89 Å²	89	68%	0.679	46%	0.463	S	S	*	.	S	Bend	trans	-71.8	119.7	-175.4	-77.4	-175.7	-91.9	174.9	-7.8	110.8	S445	S445-R449 PolarHBondContact O-NE 3.06Å
450	Q	80.9	Confident	88.2	Confident	71 Å²	71	87.2 Å²	87.2	33%	0.332	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-66.6	128.9	170.2	-167.5	177.1	13.1	0	0	109.4	V410 R448 D454	V410-Q450 HydrophobicContact CG2-CB 3.77Å; V410-Q450 HydrophobicContact CG2-CG 4.16Å; R448-Q450 PolarHBondContact O-N 3.41Å; Q450-D454 HydrophobicContact CG-CB 3.65Å
451	K	86.2	Confident	88.7	Confident	146 Å²	146	83.2 Å²	83.2	64%	0.635	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-87	158.8	172.5	-59.8	-179.7	-178.3	180	0	109.7	K453 D454 L455	K451-K453 PolarHBondContact O-N 2.83Å; K451-D454 WeakPolarHBondContact CB-OD2 3.19Å; K451-D454 PolarHBondContact N-OD2 2.85Å; K451-D454 WeakPolarHBondContact O-CB 3.43Å; K451-D454 PolarHBondContact O-N 2.94Å; K451-L455 PolarHBondContact O-N 2.04Å
452	S	87.1	Confident	89	Confident	107 Å²	107	81.4 Å²	81.4	75%	0.748	42%	0.417	S	S	*	.	H	α-helix	trans	-55.5	-39.6	177.5	-49.3	0	0	0	0	112.4	D454 L455 E456	S452-D454 VanDerWaalsContact C-N 3.33Å; S452-D454 PolarHBondContact O-N 3.05Å; S452-L455 WeakPolarHBondContact O-CB 3.48Å; S452-L455 PolarHBondContact O-N 2.94Å; S452-L455 VanDerWaalsContact O-N 3.1Å; S452-E456 PolarHBondContact O-N 2.96Å
453	K	88.2	Confident	89.4	Confident	142 Å²	142	83.5 Å²	83.5	62%	0.617	41%	0.41	S	S	*	.	H	α-helix	trans	-61.1	-38.1	174.3	-173.3	172.3	-177.8	172.6	0	113	K451 L455 E456 D457	K451-K453 PolarHBondContact O-N 2.83Å; K453-L455 PolarHBondContact O-N 3.16Å; K453-E456 PolarHBondContact O-N 2.92Å; K453-D457 WeakPolarHBondContact O-CB 3.01Å; K453-D457 VanDerWaalsContact O-CG 3.27Å; K453-D457 PolarHBondContact O-N 3.19Å
454	D	87.1	Confident	89.6	Confident	58 Å²	58	87.3 Å²	87.3	31%	0.31	43%	0.427	S	S	.	.	H	α-helix	trans	-65.8	-29.3	176.8	-58.3	-40.8	0	0	0	111.6	Q450 K451 S452 K458	Q450-D454 HydrophobicContact CG-CB 3.65Å; K451-D454 WeakPolarHBondContact CB-OD2 3.19Å; K451-D454 PolarHBondContact N-OD2 2.85Å; K451-D454 WeakPolarHBondContact O-CB 3.43Å; K451-D454 PolarHBondContact O-N 2.94Å; S452-D454 VanDerWaalsContact C-N 3.33Å; S452-D454 PolarHBondContact O-N 3.05Å; D454-K458 WeakPolarHBondContact O-CB 3.44Å; D454-K458 PolarHBondContact O-N 3.08Å
455	L	89.2	Confident	89.9	Confident	83 Å²	83	89.6 Å²	89.6	44%	0.435	44%	0.437	S	S	.	.	H	α-helix	trans	-74.7	-45.3	174.3	179.5	63.5	0	0	0	111.1	K451 S452 K453 K458 L459	K451-L455 PolarHBondContact O-N 2.04Å; S452-L455 WeakPolarHBondContact O-CB 3.48Å; S452-L455 PolarHBondContact O-N 2.94Å; S452-L455 VanDerWaalsContact O-N 3.1Å; K453-L455 PolarHBondContact O-N 3.16Å; L455-K458 WeakPolarHBondContact O-CB 3.36Å; L455-K458 PolarHBondContact O-N 2.98Å; L455-L459 HydrophobicContact CD1-CD1 4.36Å; L455-L459 HydrophobicContact CD1-CG 4.3Å; L455-L459 HydrophobicContact CG-CD1 4.21Å; L455-L459 WeakPolarHBondContact O-CG 3.26Å; L455-L459 PolarHBondContact O-N 2.79Å
456	E	91.8	Very high	90.2	Very high	139 Å²	139	89 Å²	89	65%	0.65	43%	0.43	S	S	*	.	H	α-helix	trans	-58.2	-51	175.8	-173.6	-178.9	175.3	0	0	111.3	S452 K453 K458 L459 A460	S452-E456 PolarHBondContact O-N 2.96Å; K453-E456 PolarHBondContact O-N 2.92Å; E456-K458 VanDerWaalsContact C-N 3.27Å; E456-K458 PolarHBondContact O-N 3.38Å; E456-L459 PolarHBondContact O-N 3.28Å; E456-L459 VanDerWaalsContact O-N 3.15Å; E456-A460 WeakPolarHBondContact O-CB 3.31Å; E456-A460 PolarHBondContact O-N 3.21Å
457	D	92	Very high	90.5	Very high	86 Å²	86	89.9 Å²	89.9	46%	0.46	43%	0.427	S	S	.	.	H	α-helix	trans	-59.2	-38.9	177.1	-71.9	-19.9	0	0	0	111.2	K453 H461	K453-D457 WeakPolarHBondContact O-CB 3.01Å; K453-D457 VanDerWaalsContact O-CG 3.27Å; K453-D457 PolarHBondContact O-N 3.19Å; D457-H461 WeakPolarHBondContact O-CB 3.07Å; D457-H461 PolarHBondContact O-N 3.43Å
458	K	92.2	Very high	90.9	Very high	19 Å²	19	87.7 Å²	87.7	8%	0.083	42%	0.418	C	S	.	.	H	α-helix	trans	-65.2	-44.8	176	174.3	177.3	179.3	175.3	0	112.1	L407 V410 E414 D454 L455 E456 H461 H462	L407-K458 HydrophobicContact CD2-CB 4.3Å; L407-K458 HydrophobicContact CD2-CD 4.38Å; L407-K458 HydrophobicContact CD2-CG 3.93Å; V410-K458 PolarHBondContact O-NZ 3.04Å; V410-K458 VanDerWaalsContact O-NZ 3.11Å; E414-K458 WeakPolarHBondContact OE1-CE 3.16Å; E414-K458 IonicContact OE1-NZ 3.65Å; E414-K458 PolarHBondContact OE1-NZ 3.49Å; D454-K458 WeakPolarHBondContact O-CB 3.44Å; D454-K458 PolarHBondContact O-N 3.08Å; L455-K458 WeakPolarHBondContact O-CB 3.36Å; L455-K458 PolarHBondContact O-N 2.98Å; E456-K458 VanDerWaalsContact C-N 3.27Å; E456-K458 PolarHBondContact O-N 3.38Å; K458-H461 WeakPolarHBondContact O-CB 3.43Å; K458-H461 PolarHBondContact O-N 3.27Å; K458-H462 VanDerWaalsContact CE-NE2 3.32Å; K458-H462 WeakPolarHBondContact CE-NE2 3.42Å; K458-H462 PolarHBondContact O-CD2 3.22Å; K458-H462 PolarHBondContact O-N 3.14Å
459	L	93.6	Very high	91.6	Very high	76 Å²	76	86.7 Å²	86.7	40%	0.398	42%	0.417	S	S	.	.	H	α-helix	trans	-67.6	-43.6	179.7	-68.5	174.8	0	0	0	111.4	L455 E456 H461 H462 F463 I471	L455-L459 HydrophobicContact CD1-CD1 4.36Å; L455-L459 HydrophobicContact CD1-CG 4.3Å; L455-L459 HydrophobicContact CG-CD1 4.21Å; L455-L459 WeakPolarHBondContact O-CG 3.26Å; L455-L459 PolarHBondContact O-N 2.79Å; E456-L459 PolarHBondContact O-N 3.28Å; E456-L459 VanDerWaalsContact O-N 3.15Å; L459-H461 PolarHBondContact O-N 2.69Å; L459-H462 PolarHBondContact O-N 3.13Å; L459-F463 PolarHBondContact O-N 3.07Å; L459-I471 HydrophobicContact CD2-CG2 4.06Å
460	A	94.8	Very high	92.3	Very high	59 Å²	59	80.9 Å²	80.9	49%	0.488	40%	0.404	S	S	.	.	H	α-helix	trans	-60.2	-38.3	173.1	0	0	0	0	0	111.6	E456 F463 F464	E456-A460 WeakPolarHBondContact O-CB 3.31Å; E456-A460 PolarHBondContact O-N 3.21Å; A460-F463 PolarHBondContact O-N 3.08Å; A460-F464 PolarHBondContact O-N 3.49Å; A460-F464 VanDerWaalsContact O-N 3.12Å
461	H	95.3	Very high	92.9	Very high	20 Å²	20	79.5 Å²	79.5	9%	0.093	40%	0.398	C	S	.	.	H	α-helix	trans	-65.1	-42.7	175.3	-171.4	63.1	0	0	0	112.3	D404 R406 D457 K458 L459 F464 K465	D404-H461 IonicContact OD2-CD2 3.51Å; D404-H461 IonicContact OD2-CE1 3.92Å; D404-H461 IonicContact OD2-NE2 3.9Å; D404-H461 PolarHBondContact OD2-NE2 2.93Å; R406-H461 WeakPolarHBondContact CD-CE1 3.07Å; R406-H461 PolarHBondContact NE-CE1 3.39Å; R406-H461 VanDerWaalsContact NE-CE1 3.29Å; R406-H461 PolarHBondContact NE-ND1 3.41Å; R406-H461 VanDerWaalsContact NE-ND1 3.16Å; D457-H461 WeakPolarHBondContact O-CB 3.07Å; D457-H461 PolarHBondContact O-N 3.43Å; K458-H461 WeakPolarHBondContact O-CB 3.43Å; K458-H461 PolarHBondContact O-N 3.27Å; L459-H461 PolarHBondContact O-N 2.69Å; H461-F464 PolarHBondContact O-N 3.09Å; H461-K465 VanDerWaalsContact NE2-CD 3.3Å; H461-K465 WeakPolarHBondContact NE2-CD 3.05Å; H461-K465 WeakPolarHBondContact O-CB 3.37Å; H461-K465 PolarHBondContact O-N 2.89Å
462	H	94.6	Very high	93.3	Very high	4 Å²	4	80.5 Å²	80.5	2%	0.019	40%	0.398	C	S	.	.	H	α-helix	trans	-63.3	-42.2	173.9	-75	-49.2	0	0	0	112.9	E414 K458 L459 F464 N466 L468	E414-H462 WeakPolarHBondContact CG-CE1 3.5Å; K458-H462 VanDerWaalsContact CE-NE2 3.32Å; K458-H462 WeakPolarHBondContact CE-NE2 3.42Å; K458-H462 PolarHBondContact O-CD2 3.22Å; K458-H462 PolarHBondContact O-N 3.14Å; L459-H462 PolarHBondContact O-N 3.13Å; H462-F464 VanDerWaalsContact C-N 3.31Å; H462-F464 PolarHBondContact O-N 2.88Å; H462-N466 PolarHBondContact ND1-OD1 3Å; H462-N466 WeakPolarHBondContact O-CB 3.41Å; H462-N466 PolarHBondContact O-N 2.96Å; H462-N466 VanDerWaalsContact O-N 3.13Å; H462-L468 HydrophobicContact CB-CD1 4.36Å
463	F	95.3	Very high	93.3	Very high	129 Å²	129	79.8 Å²	79.8	57%	0.566	38%	0.38	S	S	*	.	H	α-helix	trans	-54.6	-49.7	176.1	177.3	-93.7	0	0	0	110.9	L459 A460 H467 L468	L459-F463 PolarHBondContact O-N 3.07Å; A460-F463 PolarHBondContact O-N 3.08Å; F463-H467 VanDerWaalsContact O-CA 3.29Å; F463-H467 WeakPolarHBondContact O-CA 3.45Å; F463-H467 PolarHBondContact O-N 3.29Å; F463-L468 WeakPolarHBondContact CA-O 3.42Å; F463-L468 WeakPolarHBondContact CD2-O 3.42Å; F463-L468 PolarHBondContact O-N 3.21Å
464	F	95.1	Very high	92.7	Very high	176 Å²	176	76.8 Å²	76.8	77%	0.772	39%	0.389	S	S	*	.	H	α-helix	trans	-77.6	-57.7	-178	-171.5	-92.1	0	0	0	113.1	A460 H461 H462 N466 H467	A460-F464 PolarHBondContact O-N 3.49Å; A460-F464 VanDerWaalsContact O-N 3.12Å; H461-F464 PolarHBondContact O-N 3.09Å; H462-F464 VanDerWaalsContact C-N 3.31Å; H462-F464 PolarHBondContact O-N 2.88Å; F464-N466 PolarHBondContact O-N 3.48Å; F464-H467 PolarHBondContact O-N 3.44Å
465	K	95.3	Very high	93	Very high	77 Å²	77	77.7 Å²	77.7	34%	0.335	39%	0.392	S	S	.	.	H	α-helix	trans	-65	-44.8	-170.8	176.4	-172.9	164.8	-165.3	0	112.4	D404 D418 H461	D404-K465 WeakPolarHBondContact OD2-CD 3.29Å; D404-K465 WeakPolarHBondContact OD2-CE 3.4Å; D404-K465 IonicContact OD2-NZ 2.69Å; D404-K465 PolarHBondContact OD2-NZ 3.35Å; D418-K465 WeakPolarHBondContact OD1-CE 3.07Å; D418-K465 IonicContact OD1-NZ 3.86Å; D418-K465 PolarHBondContact OD1-NZ 3.29Å; D418-K465 VanDerWaalsContact OD1-NZ 3.15Å; D418-K465 IonicContact OD2-NZ 2.74Å; D418-K465 PolarHBondContact OD2-NZ 3.06Å; H461-K465 VanDerWaalsContact NE2-CD 3.3Å; H461-K465 WeakPolarHBondContact NE2-CD 3.05Å; H461-K465 WeakPolarHBondContact O-CB 3.37Å; H461-K465 PolarHBondContact O-N 2.89Å
466	N	94.9	Very high	93.2	Very high	33 Å²	33	77.4 Å²	77.4	18%	0.176	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	3.9	-175.2	-59.5	111.3	0	0	0	111.8	D418 H462 F464 L468	D418-N466 PolarHBondContact OD1-ND2 2.76Å; H462-N466 PolarHBondContact ND1-OD1 3Å; H462-N466 WeakPolarHBondContact O-CB 3.41Å; H462-N466 PolarHBondContact O-N 2.96Å; H462-N466 VanDerWaalsContact O-N 3.13Å; F464-N466 PolarHBondContact O-N 3.48Å; N466-L468 VanDerWaalsContact C-N 3.27Å; N466-L468 HydrophobicContact CB-CD1 3.78Å; N466-L468 HydrophobicContact CB-CG 3.64Å; N466-L468 PolarHBondContact O-N 3.41Å
467	H	95.7	Very high	93.3	Very high	86 Å²	86	74 Å²	74	40%	0.398	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	52.2	-174.5	-166.6	54.7	0	0	0	111.2	G358 G361 G362 F463 F464	G358-H467 PolarHBondContact O-CE1 3.4Å; G358-H467 PolarHBondContact O-NE2 2.97Å; G361-H467 CarbonylContact C-O 3.49Å; G361-H467 VanDerWaalsContact CA-CD2 3.45Å; G361-H467 WeakPolarHBondContact CA-CD2 3.43Å; G361-H467 WeakPolarHBondContact CA-NE2 3.31Å; G361-H467 WeakPolarHBondContact CA-O 3.33Å; G362-H467 PolarHBondContact N-O 2.87Å; F463-H467 VanDerWaalsContact O-CA 3.29Å; F463-H467 WeakPolarHBondContact O-CA 3.45Å; F463-H467 PolarHBondContact O-N 3.29Å; F464-H467 PolarHBondContact O-N 3.44Å
468	L	96.6	Very high	93.3	Very high	9 Å²	9	73.3 Å²	73.3	5%	0.047	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	126.8	-175.8	-68.1	179.8	0	0	0	111.6	Y353 G362 L364 H462 F463 N466 I471	Y353-L468 HydrophobicContact CD2-CD2 4.1Å; Y353-L468 HydrophobicContact CE2-CD2 3.62Å; G362-L468 CarbonylContact O-C 3.56Å; G362-L468 VanDerWaalsContact O-CA 3.31Å; G362-L468 WeakPolarHBondContact O-CA 3.48Å; L364-L468 HydrophobicContact CB-CD1 4.12Å; L364-L468 HydrophobicContact CB-CD2 4.08Å; L364-L468 HydrophobicContact CD2-CD1 4.47Å; H462-L468 HydrophobicContact CB-CD1 4.36Å; F463-L468 WeakPolarHBondContact CA-O 3.42Å; F463-L468 WeakPolarHBondContact CD2-O 3.42Å; F463-L468 PolarHBondContact O-N 3.21Å; N466-L468 VanDerWaalsContact C-N 3.27Å; N466-L468 HydrophobicContact CB-CD1 3.78Å; N466-L468 HydrophobicContact CB-CG 3.64Å; N466-L468 PolarHBondContact O-N 3.41Å; L468-I471 HydrophobicContact CD1-CD1 4.41Å
469	K	96.4	Very high	93.4	Very high	120 Å²	120	76.7 Å²	76.7	52%	0.522	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-40.3	164.4	-169.4	-179.8	-168.8	157.9	0	111.8	D360 G362	D360-K469 HydrophobicContact CB-CD 4.1Å; D360-K469 VanDerWaalsContact O-CB 3.31Å; D360-K469 WeakPolarHBondContact O-CB 3.25Å; D360-K469 IonicContact OD1-NZ 3.31Å; D360-K469 IonicContact OD2-NZ 3.5Å; D360-K469 PolarHBondContact OD2-NZ 3.08Å; G362-K469 PolarHBondContact O-N 3.11Å
470	C	95.4	Very high	93.4	Very high	59 Å²	59	76.7 Å²	76.7	40%	0.399	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	148.6	-173.8	86.4	0	0	0	0	113.3	G362 C363 L364	G362-C470 PolarHBondContact O-N 3.14Å; C363-C470 WeakPolarHBondContact CA-O 3.41Å; C363-C470 HydrophobicContact CB-CB 4.39Å; C363-C470 WeakPolarHBondContact CB-SG 3.33Å; C363-C470 WeakPolarHBondContact SG-CB 3.44Å; C363-C470 CovalentContact SG-SG 2.03Å; C363-C470 PolarHBondContact SG-SG 2.95Å; L364-C470 PolarHBondContact N-O 3.31Å
471	I	95	Very high	93.3	Very high	42 Å²	42	78 Å²	78	22%	0.215	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	129.6	174	-171	163.4	0	0	0	110.1	L364 M417 L459 L468 Y473	L364-I471 HydrophobicContact CB-CG1 4.37Å; L364-I471 HydrophobicContact CD2-CD1 3.95Å; L364-I471 HydrophobicContact CD2-CG1 4.32Å; L364-I471 CarbonylContact O-C 3.6Å; L364-I471 VanDerWaalsContact O-CA 3.29Å; L364-I471 WeakPolarHBondContact O-CA 3.19Å; M417-I471 HydrophobicContact CE-CD1 3.79Å; M417-I471 HydrophobicContact SD-CD1 4.06Å; L459-I471 HydrophobicContact CD2-CG2 4.06Å; L468-I471 HydrophobicContact CD1-CD1 4.41Å; I471-Y473 HydrophobicContact CD1-CE1 4.29Å; I471-Y473 HydrophobicContact CD1-CE2 3.79Å; I471-Y473 VanDerWaalsContact CD1-OH 3.27Å; I471-Y473 WeakPolarHBondContact CD1-OH 3.41Å; I471-Y473 HydrophobicContact CG1-CD2 4.34Å; I471-Y473 HydrophobicContact CG1-CE2 3.78Å; I471-Y473 HydrophobicContact CG2-CE2 4.05Å
472	R	93.8	Very high	93.1	Very high	166 Å²	166	82.5 Å²	82.5	63%	0.626	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.7	174.7	-176.8	176.9	175.7	176.7	-1	109.8	L364 R366	L364-R472 PolarHBondContact O-N 3.06Å; R366-R472 PolarHBondContact N-O 3.35Å
473	Y	87.9	Confident	93	Very high	93 Å²	93	89 Å²	89	37%	0.365	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112.3	169.1	-62.4	-89	0	0	0	108.3	M417 I471	M417-Y473 HydrophobicContact CE-CE1 3.83Å; I471-Y473 HydrophobicContact CD1-CE1 4.29Å; I471-Y473 HydrophobicContact CD1-CE2 3.79Å; I471-Y473 VanDerWaalsContact CD1-OH 3.27Å; I471-Y473 WeakPolarHBondContact CD1-OH 3.41Å; I471-Y473 HydrophobicContact CG1-CD2 4.34Å; I471-Y473 HydrophobicContact CG1-CE2 3.78Å; I471-Y473 HydrophobicContact CG2-CE2 4.05Å
474	G	74.8	Confident	92.8	Very high	78 Å²	78	85.4 Å²	85.4	80%	0.804	42%	0.424	S	S	*	.			trans	-109.5	0	173.9	0	0	0	0	0	113.8	R366	R366-G474 PolarHBondContact NH1-O 2.7Å; R366-G474 WeakPolarHBondContact O-CA 3.05Å; R366-G474 PolarHBondContact O-N 3.48Å

Retrieved 474 of 474 residues in 344.2 ms (Link to these results)

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