A0A096MV26_PAPAN Loading...

Calmodulin-lysine N-methyltransferase

Catalyzes the trimethylation of 'Lys-116' in calmodulin.

AlphaFold DB , UniProt , Accession A0A096MV26, Species PAPAN (Papio anubis, Olive baboon), Gene CAMKMT, Length 323 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	34.7	Very low	30.4	Very low	236 Å²	236	138.9 Å²	138.9	100%	1.163	87%	0.866	S	S	*	*				0	111.9	0	-108.8	165.2	170	0	0	107.1
2	E	30.5	Very low	30.3	Very low	178 Å²	178	143.2 Å²	143.2	83%	0.832	87%	0.867	S	S	*	*			trans	46.3	103.2	153.3	-59	-178.9	158.8	0	0	118.3
3	S	29.1	Very low	30.4	Very low	105 Å²	105	143.2 Å²	143.2	73%	0.734	87%	0.868	S	S	*	*				69.4	125.7	73.7	83	0	0	0	0	115.7
4	R	33.3	Very low	30.5	Very low	239 Å²	239	140 Å²	140	90%	0.902	87%	0.865	S	S	*	*			trans	172.1	112.6	147.4	-94.2	164.7	-170.1	-150.7	3.7	107.9
5	V	31.7	Very low	30.4	Very low	142 Å²	142	147.4 Å²	147.4	86%	0.861	87%	0.87	S	S	*	*				102.3	139.1	58.9	164.4	0	0	0	0	111.7
6	A	30.9	Very low	30.5	Very low	92 Å²	92	144.8 Å²	144.8	76%	0.76	87%	0.87	S	S	*	*			trans	112.7	106.2	163.4	0	0	0	0	0	112.9
7	D	28	Very low	30.5	Very low	167 Å²	167	142.8 Å²	142.8	89%	0.893	87%	0.873	S	S	*	*			cis	91.2	142.8	38	-155.2	21.5	0	0	0	114.7
8	A	30.8	Very low	30.4	Very low	98 Å²	98	139.3 Å²	139.3	81%	0.81	87%	0.87	S	S	*	*			trans	78.9	135.1	-177.4	0	0	0	0	0	116.9
9	G	28.4	Very low	30.3	Very low	78 Å²	78	136.4 Å²	136.4	80%	0.804	87%	0.87	S	S	*	*			cis	-167.6	166.8	14.2	0	0	0	0	0	112
10	A	28	Very low	30.2	Very low	111 Å²	111	133.4 Å²	133.4	92%	0.917	87%	0.866	S	S	*	*			trans	-78.6	162.1	-161.3	0	0	0	0	0	115.9
11	G	29.1	Very low	30.5	Very low	82 Å²	82	133.2 Å²	133.2	85%	0.845	87%	0.865	S	S	*	*			trans	-169.1	79.8	166	0	0	0	0	0	111.1
12	E	29	Very low	30.3	Very low	190 Å²	190	126.6 Å²	126.6	89%	0.888	85%	0.847	S	S	*	*			trans	-75	135.3	165.1	-77.8	-176.9	136.5	0	0	110.4
13	T	32.2	Very low	30.5	Very low	143 Å²	143	125.1 Å²	125.1	88%	0.877	85%	0.85	S	S	*	*			trans	-156.7	119.5	135.4	34.9	0	0	0	0	112
14	A	31.7	Very low	30.5	Very low	99 Å²	99	123.1 Å²	123.1	82%	0.818	85%	0.846	S	S	*	*			trans	60.8	106.5	137.4	0	0	0	0	0	122.4
15	R	29.4	Very low	30.3	Very low	251 Å²	251	117.1 Å²	117.1	95%	0.947	84%	0.84	S	S	*	*			trans	-17.1	137.6	145.5	-64.2	174.1	173.2	-179.4	-2.2	118.3
16	A	31.3	Very low	30.2	Very low	105 Å²	105	116.4 Å²	116.4	87%	0.868	84%	0.836	S	S	*	*			trans	-148.8	135.4	131.3	0	0	0	0	0	110.1
17	A	31.2	Very low	30.3	Very low	111 Å²	111	118 Å²	118	92%	0.917	84%	0.836	S	S	*	*			trans	-83.6	149.6	-174	0	0	0	0	0	112.9
18	G	28.8	Very low	30.6	Very low	80 Å²	80	121.6 Å²	121.6	83%	0.825	84%	0.837	S	S	*	*			trans	-179.6	101.8	165.9	0	0	0	0	0	110.9
19	G	27.8	Very low	30.7	Very low	85 Å²	85	119.3 Å²	119.3	88%	0.876	82%	0.824	S	S	*	*			trans	-84.9	132.1	-172.8	0	0	0	0	0	115.2
20	G	28.3	Very low	30.9	Very low	75 Å²	75	121.6 Å²	121.6	77%	0.773	82%	0.824	S	S	*	*			trans	59.4	164.2	141.8	0	0	0	0	0	122.1
21	P	37.1	Very low	31.5	Very low	130 Å²	130	122.7 Å²	122.7	84%	0.844	82%	0.819	S	S	*	*			cis	-117.9	160.2	-13.2	35.2	-19.3	0	0	0	114
22	A	30.3	Very low	32.1	Very low	97 Å²	97	125.2 Å²	125.2	80%	0.802	82%	0.818	S	S	*	*			trans	-61.4	140.4	179.2	0	0	0	0	0	113.5	G24	A22-G24 PolarHBondContact O-N 2.88Å
23	V	34.3	Very low	33.4	Very low	148 Å²	148	121 Å²	121	90%	0.897	81%	0.809	S	S	*	*			trans	-64.5	97.6	166.8	176.1	0	0	0	0	108.2	C25	V23-C25 PolarHBondContact O-N 3.26Å; V23-C25 VanDerWaalsContact O-N 3.11Å
24	G	28.3	Very low	34.7	Very low	63 Å²	63	117.1 Å²	117.1	65%	0.649	79%	0.792	S	S	*	*			trans	-69.5	100.8	170.1	0	0	0	0	0	109.8	A22 T26	A22-G24 PolarHBondContact O-N 2.88Å; G24-T26 VanDerWaalsContact C-N 3.31Å; G24-T26 PolarHBondContact O-N 3.26Å
25	C	30.2	Very low	36.9	Very low	113 Å²	113	117 Å²	117	76%	0.764	78%	0.783	S	S	*	*			trans	-63	94.5	162.8	-172.1	0	0	0	0	107.8	V23 T27	V23-C25 PolarHBondContact O-N 3.26Å; V23-C25 VanDerWaalsContact O-N 3.11Å; C25-T27 PolarHBondContact O-N 3.06Å
26	T	29.4	Very low	39	Very low	126 Å²	126	109.8 Å²	109.8	77%	0.773	76%	0.762	S	S	*	*			trans	-80	95.1	168.2	41.9	0	0	0	0	107.4	G24 R28	G24-T26 VanDerWaalsContact C-N 3.31Å; G24-T26 PolarHBondContact O-N 3.26Å; T26-R28 PolarHBondContact O-N 3Å
27	T	31.9	Very low	41.1	Very low	126 Å²	126	106.6 Å²	106.6	77%	0.773	74%	0.74	S	S	*	*			trans	-53.6	104.9	159.4	43.3	0	0	0	0	107.5	C25 G29	C25-T27 PolarHBondContact O-N 3.06Å; T27-G29 PolarHBondContact O-N 2.91Å
28	R	35.7	Very low	43.3	Very low	242 Å²	242	103.9 Å²	103.9	91%	0.913	72%	0.718	S	S	*	*			trans	-58.5	104.4	170.1	-79.5	-178.5	174.7	-177.2	-1.5	107.3	T26	T26-R28 PolarHBondContact O-N 3Å
29	G	33	Very low	45.7	Very low	51 Å²	51	100.6 Å²	100.6	53%	0.526	68%	0.683	S	S	.	*			trans	-57.3	159.6	164.3	0	0	0	0	0	110.2	T27 V31	T27-G29 PolarHBondContact O-N 2.91Å; G29-V31 PolarHBondContact O-N 2.6Å
30	P	32.8	Very low	48.2	Very low	125 Å²	125	102 Å²	102	81%	0.812	66%	0.662	S	S	*	*			trans	-58.3	125.9	-178.5	25.7	-32.5	0	0	0	108.9	V32	P30-V32 PolarHBondContact O-N 3.02Å
31	V	39.1	Very low	50.6	Low	134 Å²	134	107.4 Å²	107.4	81%	0.812	66%	0.659	S	S	*	*			trans	-59.4	106.9	174.1	177.3	0	0	0	0	106.7	G29 S33	G29-V31 PolarHBondContact O-N 2.6Å; V31-S33 PolarHBondContact O-N 3.38Å
32	V	43.2	Very low	52.6	Low	136 Å²	136	106.3 Å²	106.3	82%	0.824	64%	0.641	S	S	*	*			trans	-61.8	105.9	172.1	178.5	0	0	0	0	106.2	P30 A34	P30-V32 PolarHBondContact O-N 3.02Å; V32-A34 PolarHBondContact O-N 3.19Å
33	S	55.1	Low	54.8	Low	100 Å²	100	102.7 Å²	102.7	70%	0.699	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-57.3	124.9	175.3	62.1	0	0	0	0	107.9	V31	V31-S33 PolarHBondContact O-N 3.38Å
34	A	60.4	Low	56.8	Low	62 Å²	62	99.6 Å²	99.6	51%	0.512	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-52.3	140.8	173.3	0	0	0	0	0	109.3	V32 L36	V32-A34 PolarHBondContact O-N 3.19Å; A34-L36 PolarHBondContact O-N 3.48Å
35	P	76.9	Confident	59.1	Low	98 Å²	98	104.4 Å²	104.4	64%	0.636	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-49.9	133	176.5	-25.2	32.1	0	0	0	110	G37 A38 A39	P35-G37 CarbonylContact O-C 3.54Å; P35-G37 PolarHBondContact O-N 2.96Å; P35-A38 WeakPolarHBondContact O-CA 3.48Å; P35-A38 WeakPolarHBondContact O-CB 3.12Å; P35-A38 PolarHBondContact O-N 3.37Å; P35-A39 PolarHBondContact O-N 3.11Å; P35-A39 VanDerWaalsContact O-N 3.15Å
36	L	74.8	Confident	61.2	Low	98 Å²	98	100.2 Å²	100.2	51%	0.513	55%	0.553	S	S	.	*	H	α-helix	trans	-48.8	-38.2	-173	-176.7	68.6	0	0	0	112.8	A34 A39 R40 V60	A34-L36 PolarHBondContact O-N 3.48Å; L36-A39 PolarHBondContact O-N 2.83Å; L36-R40 WeakPolarHBondContact O-CG 3.44Å; L36-R40 PolarHBondContact O-N 3.15Å; L36-V60 HydrophobicContact CD1-CB 4.05Å; L36-V60 HydrophobicContact CD1-CG1 3.76Å
37	G	74.4	Confident	63.3	Low	39 Å²	39	96.5 Å²	96.5	40%	0.402	53%	0.531	S	S	.	.	H	α-helix	trans	-59.6	-48.1	174.2	0	0	0	0	0	113	P35 A39 R40 W41	P35-G37 CarbonylContact O-C 3.54Å; P35-G37 PolarHBondContact O-N 2.96Å; G37-A39 VanDerWaalsContact C-N 3.31Å; G37-A39 PolarHBondContact O-N 3.21Å; G37-R40 PolarHBondContact O-N 3.29Å; G37-W41 PolarHBondContact O-N 3.32Å
38	A	78.3	Confident	65.1	Low	54 Å²	54	94.3 Å²	94.3	45%	0.446	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-37.6	178.2	0	0	0	0	0	112.1	P35 W41 K42	P35-A38 WeakPolarHBondContact O-CA 3.48Å; P35-A38 WeakPolarHBondContact O-CB 3.12Å; P35-A38 PolarHBondContact O-N 3.37Å; A38-W41 PolarHBondContact O-N 2.82Å; A38-K42 WeakPolarHBondContact O-CB 3.49Å; A38-K42 PolarHBondContact O-N 3.18Å
39	A	78.3	Confident	66.6	Low	11 Å²	11	89.9 Å²	89.9	9%	0.091	50%	0.501	C	S	.	.	H	α-helix	trans	-64.7	-42.4	174.9	0	0	0	0	0	112.1	P35 L36 G37 K42 L43 L57 V60	P35-A39 PolarHBondContact O-N 3.11Å; P35-A39 VanDerWaalsContact O-N 3.15Å; L36-A39 PolarHBondContact O-N 2.83Å; G37-A39 VanDerWaalsContact C-N 3.31Å; G37-A39 PolarHBondContact O-N 3.21Å; A39-K42 WeakPolarHBondContact O-CB 3.46Å; A39-K42 PolarHBondContact O-N 2.92Å; A39-L43 PolarHBondContact O-N 2.86Å; A39-L57 HydrophobicContact CB-CD2 4.45Å; A39-V60 HydrophobicContact CB-CG1 4.02Å; A39-V60 HydrophobicContact CB-CG2 4.25Å
40	R	79.8	Confident	67.8	Low	115 Å²	115	93.8 Å²	93.8	43%	0.434	51%	0.506	S	S	.	.	H	α-helix	trans	-65.4	-39.5	175	-73.6	178.7	171.8	176.2	0.2	112.7	L36 G37 K42 L43 L44 V60	L36-R40 WeakPolarHBondContact O-CG 3.44Å; L36-R40 PolarHBondContact O-N 3.15Å; G37-R40 PolarHBondContact O-N 3.29Å; R40-K42 VanDerWaalsContact C-N 3.33Å; R40-K42 PolarHBondContact O-N 2.73Å; R40-L43 WeakPolarHBondContact O-CB 3.42Å; R40-L43 PolarHBondContact O-N 2.89Å; R40-L44 PolarHBondContact O-N 2.94Å; R40-V60 HydrophobicContact CG-CB 4.41Å; R40-V60 HydrophobicContact CG-CG2 4.47Å; R40-V60 PolarHBondContact NE-O 2.94Å
41	W	78.4	Confident	69.1	Low	188 Å²	188	96.8 Å²	96.8	71%	0.712	51%	0.506	S	S	*	.	H	α-helix	trans	-64.1	-38	173.3	-81.4	108.7	0	0	0	112.4	G37 A38 L44 R45	G37-W41 PolarHBondContact O-N 3.32Å; A38-W41 PolarHBondContact O-N 2.82Å; W41-L44 HydrophobicContact CE3-CD2 4.26Å; W41-L44 HydrophobicContact CZ3-CD2 4.18Å; W41-R45 WeakPolarHBondContact O-CB 3.24Å; W41-R45 PolarHBondContact O-N 2.83Å
42	K	80.4	Confident	69.7	Low	106 Å²	106	97.3 Å²	97.3	46%	0.461	50%	0.499	S	S	.	.	H	α-helix	trans	-64.3	-44.1	173.9	-172.1	-177.9	175.1	-168.3	0	111.5	A38 A39 R40 R45 Q46 L57	A38-K42 WeakPolarHBondContact O-CB 3.49Å; A38-K42 PolarHBondContact O-N 3.18Å; A39-K42 WeakPolarHBondContact O-CB 3.46Å; A39-K42 PolarHBondContact O-N 2.92Å; R40-K42 VanDerWaalsContact C-N 3.33Å; R40-K42 PolarHBondContact O-N 2.73Å; K42-R45 PolarHBondContact O-N 2.81Å; K42-Q46 WeakPolarHBondContact O-CG 3.48Å; K42-Q46 PolarHBondContact O-N 2.92Å; K42-L57 HydrophobicContact CB-CD1 4.38Å; K42-L57 HydrophobicContact CD-CD1 4Å; K42-L57 HydrophobicContact CG-CD1 3.99Å
43	L	77	Confident	70.4	Confident	22 Å²	22	94.1 Å²	94.1	12%	0.115	48%	0.477	C	S	.	.	H	α-helix	trans	-57.7	-51.8	175.3	178.7	68.8	0	0	0	111.2	A39 R40 R45 Q46 V47 L53 L57 V60	A39-L43 PolarHBondContact O-N 2.86Å; R40-L43 WeakPolarHBondContact O-CB 3.42Å; R40-L43 PolarHBondContact O-N 2.89Å; L43-R45 VanDerWaalsContact C-N 3.34Å; L43-R45 PolarHBondContact O-N 3.09Å; L43-Q46 PolarHBondContact O-N 2.88Å; L43-Q46 VanDerWaalsContact O-N 3.14Å; L43-V47 WeakPolarHBondContact O-CG2 3.31Å; L43-V47 PolarHBondContact O-N 2.74Å; L43-L53 HydrophobicContact CD1-CD2 3.18Å; L43-L53 HydrophobicContact CG-CD2 4.36Å; L43-L57 HydrophobicContact CB-CB 4.49Å; L43-L57 HydrophobicContact CB-CD1 4.46Å; L43-L57 HydrophobicContact CD1-CB 3.87Å; L43-V60 HydrophobicContact CD2-CG2 4.27Å
44	L	75.1	Confident	70.6	Confident	83 Å²	83	92.3 Å²	92.3	44%	0.435	46%	0.46	S	S	.	.	H	α-helix	trans	-58.2	-45.3	177.9	179.5	62	0	0	0	111.7	R40 W41 Q46 V47 L48	R40-L44 PolarHBondContact O-N 2.94Å; W41-L44 HydrophobicContact CE3-CD2 4.26Å; W41-L44 HydrophobicContact CZ3-CD2 4.18Å; L44-Q46 VanDerWaalsContact C-N 3.3Å; L44-Q46 PolarHBondContact O-N 2.94Å; L44-V47 PolarHBondContact O-N 3.36Å; L44-L48 HydrophobicContact CD1-CD1 3.98Å; L44-L48 HydrophobicContact CD1-CG 4.13Å; L44-L48 HydrophobicContact CG-CD1 3.99Å; L44-L48 HydrophobicContact CG-CG 4.48Å; L44-L48 WeakPolarHBondContact O-CG 3.49Å; L44-L48 PolarHBondContact O-N 2.76Å
45	R	76.6	Confident	70.5	Confident	163 Å²	163	94.2 Å²	94.2	62%	0.615	46%	0.461	S	S	*	.	H	α-helix	trans	-59.6	-39.5	177.2	-175.6	-176.2	-178.1	-141.8	2	112.1	W41 K42 L43 K49	W41-R45 WeakPolarHBondContact O-CB 3.24Å; W41-R45 PolarHBondContact O-N 2.83Å; K42-R45 PolarHBondContact O-N 2.81Å; L43-R45 VanDerWaalsContact C-N 3.34Å; L43-R45 PolarHBondContact O-N 3.09Å; R45-K49 HydrophobicContact CG-CD 4.1Å; R45-K49 HydrophobicContact CG-CG 4.47Å; R45-K49 VanDerWaalsContact O-CB 3.27Å; R45-K49 WeakPolarHBondContact O-CB 3.37Å; R45-K49 WeakPolarHBondContact O-CG 3.42Å; R45-K49 PolarHBondContact O-N 2.92Å
46	Q	75.4	Confident	69.6	Low	25 Å²	25	93.8 Å²	93.8	12%	0.117	46%	0.459	C	S	.	.	H	α-helix	trans	-68	-45.2	177.5	-76.5	-178.5	-16.1	0	0	111.7	K42 L43 L44 L48 K49 Q50	K42-Q46 WeakPolarHBondContact O-CG 3.48Å; K42-Q46 PolarHBondContact O-N 2.92Å; L43-Q46 PolarHBondContact O-N 2.88Å; L43-Q46 VanDerWaalsContact O-N 3.14Å; L44-Q46 VanDerWaalsContact C-N 3.3Å; L44-Q46 PolarHBondContact O-N 2.94Å; Q46-L48 VanDerWaalsContact C-N 3.3Å; Q46-L48 PolarHBondContact O-N 3.18Å; Q46-K49 PolarHBondContact O-N 2.92Å; Q46-Q50 WeakPolarHBondContact O-CA 3.43Å; Q46-Q50 PolarHBondContact O-N 3.45Å
47	V	72.9	Confident	69	Low	49 Å²	49	89.8 Å²	89.8	30%	0.297	44%	0.439	S	S	.	.	H	α-helix	trans	-58.4	-44	176.8	173	0	0	0	0	110.9	L43 L44 L53 L110	L43-V47 WeakPolarHBondContact O-CG2 3.31Å; L43-V47 PolarHBondContact O-N 2.74Å; L44-V47 PolarHBondContact O-N 3.36Å; V47-L53 HydrophobicContact CG2-CD2 3.66Å; V47-L53 HydrophobicContact CG2-CG 4.22Å; V47-L110 HydrophobicContact CG1-CD1 3.6Å
48	L	69.4	Low	68.6	Low	79 Å²	79	94.1 Å²	94.1	41%	0.414	44%	0.443	S	S	.	.	H	α-helix	trans	-73.4	-31.3	-179.5	-66.9	177.3	0	0	0	114	L44 Q46 V112	L44-L48 HydrophobicContact CD1-CD1 3.98Å; L44-L48 HydrophobicContact CD1-CG 4.13Å; L44-L48 HydrophobicContact CG-CD1 3.99Å; L44-L48 HydrophobicContact CG-CG 4.48Å; L44-L48 WeakPolarHBondContact O-CG 3.49Å; L44-L48 PolarHBondContact O-N 2.76Å; Q46-L48 VanDerWaalsContact C-N 3.3Å; Q46-L48 PolarHBondContact O-N 3.18Å; L48-V112 HydrophobicContact CD2-CG2 4.23Å
49	K	68.1	Low	68.1	Low	149 Å²	149	97.1 Å²	97.1	65%	0.648	45%	0.447	S	S	*	.	H	α-helix	trans	-104.3	-33.3	-172.7	-67	-165	177.3	-151.2	0	115.5	R45 Q46	R45-K49 HydrophobicContact CG-CD 4.1Å; R45-K49 HydrophobicContact CG-CG 4.47Å; R45-K49 VanDerWaalsContact O-CB 3.27Å; R45-K49 WeakPolarHBondContact O-CB 3.37Å; R45-K49 WeakPolarHBondContact O-CG 3.42Å; R45-K49 PolarHBondContact O-N 2.92Å; Q46-K49 PolarHBondContact O-N 2.92Å
50	Q	58.3	Low	67.8	Low	133 Å²	133	96.9 Å²	96.9	62%	0.621	45%	0.445	S	S	*	.	H	α-helix	trans	-119.8	-6.7	-161.9	-69.1	-179.6	-17.9	0	0	113.9	Q46 H52	Q46-Q50 WeakPolarHBondContact O-CA 3.43Å; Q46-Q50 PolarHBondContact O-N 3.45Å; Q50-H52 PolarHBondContact O-N 2.57Å
51	K	58.3	Low	67.6	Low	188 Å²	188	93 Å²	93	82%	0.817	44%	0.435	S	S	*	.	S	Bend	trans	52.7	-0.4	-178.3	-63.1	-173.7	178.9	-176.7	0	115.9
52	H	52.8	Low	67.3	Low	145 Å²	145	86.3 Å²	86.3	67%	0.671	42%	0.415	S	S	*	.			trans	-123.6	132.2	178.6	-167.6	-78.6	0	0	0	109.3	Q50	Q50-H52 PolarHBondContact O-N 2.57Å
53	L	56.7	Low	67.2	Low	69 Å²	69	85.9 Å²	85.9	36%	0.361	41%	0.411	S	S	.	.			trans	-89.9	134.3	179.3	-80.8	155.4	0	0	0	109.8	L43 V47 D55	L43-L53 HydrophobicContact CD1-CD2 3.18Å; L43-L53 HydrophobicContact CG-CD2 4.36Å; V47-L53 HydrophobicContact CG2-CD2 3.66Å; V47-L53 HydrophobicContact CG2-CG 4.22Å; L53-D55 PolarHBondContact O-N 3.32Å
54	D	59.9	Low	67.5	Low	62 Å²	62	87.4 Å²	87.4	33%	0.332	42%	0.415	S	S	.	.			trans	-72.9	120.7	164.8	-172.8	-10.7	0	0	0	108.2	C56 L57	D54-C56 PolarHBondContact O-N 2.97Å; D54-C56 VanDerWaalsContact O-N 3.09Å; D54-C56 WeakPolarHBondContact OD1-CB 3.38Å; D54-C56 PolarHBondContact OD1-N 3.3Å; D54-C56 VanDerWaalsContact OD1-N 3.17Å; D54-C56 PolarHBondContact OD1-SG 3.44Å; D54-L57 HydrophobicContact CB-CD1 4.39Å; D54-L57 HydrophobicContact CB-CG 4.47Å; D54-L57 PolarHBondContact O-N 3.3Å
55	D	59.3	Low	68.1	Low	103 Å²	103	84.1 Å²	84.1	55%	0.551	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-56.7	-27.7	-180	-79.3	-19.1	0	0	0	111.7	L53 L57 R58	L53-D55 PolarHBondContact O-N 3.32Å; D55-L57 PolarHBondContact O-N 3.18Å; D55-L57 VanDerWaalsContact O-N 3.14Å; D55-R58 PolarHBondContact O-N 3.04Å; D55-R58 IonicContact OD1-CZ 3.66Å; D55-R58 IonicContact OD1-NE 3.68Å; D55-R58 PolarHBondContact OD1-NE 3.32Å; D55-R58 IonicContact OD1-NH2 3.52Å; D55-R58 PolarHBondContact OD1-NH2 2.98Å
56	C	57.7	Low	68.6	Low	88 Å²	88	81.3 Å²	81.3	60%	0.595	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-65.4	-14.4	175.8	-58.5	0	0	0	0	113.3	D54 H59	D54-C56 PolarHBondContact O-N 2.97Å; D54-C56 VanDerWaalsContact O-N 3.09Å; D54-C56 WeakPolarHBondContact OD1-CB 3.38Å; D54-C56 PolarHBondContact OD1-N 3.3Å; D54-C56 VanDerWaalsContact OD1-N 3.17Å; D54-C56 PolarHBondContact OD1-SG 3.44Å; C56-H59 PolarHBondContact O-CE1 3.03Å; C56-H59 PolarHBondContact O-ND1 2.96Å
57	L	62.8	Low	69.4	Low	15 Å²	15	81.7 Å²	81.7	8%	0.079	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-106.4	-0.9	178.1	-63.9	175.2	0	0	0	113.2	A39 K42 L43 D54 D55 H59 V60	A39-L57 HydrophobicContact CB-CD2 4.45Å; K42-L57 HydrophobicContact CB-CD1 4.38Å; K42-L57 HydrophobicContact CD-CD1 4Å; K42-L57 HydrophobicContact CG-CD1 3.99Å; L43-L57 HydrophobicContact CB-CB 4.49Å; L43-L57 HydrophobicContact CB-CD1 4.46Å; L43-L57 HydrophobicContact CD1-CB 3.87Å; D54-L57 HydrophobicContact CB-CD1 4.39Å; D54-L57 HydrophobicContact CB-CG 4.47Å; D54-L57 PolarHBondContact O-N 3.3Å; D55-L57 PolarHBondContact O-N 3.18Å; D55-L57 VanDerWaalsContact O-N 3.14Å; L57-H59 VanDerWaalsContact C-N 3.27Å; L57-H59 PolarHBondContact O-N 3.31Å; L57-V60 HydrophobicContact CB-CG2 4.41Å; L57-V60 WeakPolarHBondContact O-CG2 3.27Å; L57-V60 PolarHBondContact O-N 2.8Å
58	R	64.7	Low	70.4	Confident	129 Å²	129	79.6 Å²	79.6	49%	0.487	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-61.8	-35.9	176.1	-71.1	-170	-166.2	-152.2	9.3	112.2	D55 V60 S61 R64	D55-R58 PolarHBondContact O-N 3.04Å; D55-R58 IonicContact OD1-CZ 3.66Å; D55-R58 IonicContact OD1-NE 3.68Å; D55-R58 PolarHBondContact OD1-NE 3.32Å; D55-R58 IonicContact OD1-NH2 3.52Å; D55-R58 PolarHBondContact OD1-NH2 2.98Å; R58-V60 PolarHBondContact O-N 2.89Å; R58-S61 WeakPolarHBondContact O-CB 3.42Å; R58-S61 PolarHBondContact O-N 2.94Å; R58-R64 WeakPolarHBondContact O-CB 3.39Å
59	H	67.3	Low	71.7	Confident	117 Å²	117	81.6 Å²	81.6	54%	0.542	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-62.6	-25.1	-178.4	72.9	-83.3	0	0	0	114.2	C56 L57 R64	C56-H59 PolarHBondContact O-CE1 3.03Å; C56-H59 PolarHBondContact O-ND1 2.96Å; L57-H59 VanDerWaalsContact C-N 3.27Å; L57-H59 PolarHBondContact O-N 3.31Å; H59-R64 WeakPolarHBondContact O-CD 3.39Å; H59-R64 PolarHBondContact O-NH1 2.92Å
60	V	73	Confident	73.1	Confident	7 Å²	7	74.5 Å²	74.5	4%	0.042	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-87.1	-8.9	176.5	-59.8	0	0	0	0	113.6	L36 A39 R40 L43 L57 R58	L36-V60 HydrophobicContact CD1-CB 4.05Å; L36-V60 HydrophobicContact CD1-CG1 3.76Å; A39-V60 HydrophobicContact CB-CG1 4.02Å; A39-V60 HydrophobicContact CB-CG2 4.25Å; R40-V60 HydrophobicContact CG-CB 4.41Å; R40-V60 HydrophobicContact CG-CG2 4.47Å; R40-V60 PolarHBondContact NE-O 2.94Å; L43-V60 HydrophobicContact CD2-CG2 4.27Å; L57-V60 HydrophobicContact CB-CG2 4.41Å; L57-V60 WeakPolarHBondContact O-CG2 3.27Å; L57-V60 PolarHBondContact O-N 2.8Å; R58-V60 PolarHBondContact O-N 2.89Å
61	S	74.5	Confident	75	Confident	32 Å²	32	68.8 Å²	68.8	22%	0.224	34%	0.336	C	S	.	.	S	Bend	trans	-75.4	141.3	175.7	-173.2	0	0	0	0	110.9	R58 R63 R64	R58-S61 WeakPolarHBondContact O-CB 3.42Å; R58-S61 PolarHBondContact O-N 2.94Å; S61-R63 PolarHBondContact O-N 3.44Å; S61-R63 PolarHBondContact OG-N 3.15Å; S61-R64 WeakPolarHBondContact O-CB 3.15Å; S61-R64 VanDerWaalsContact O-CG 3.3Å; S61-R64 WeakPolarHBondContact O-CG 3.38Å; S61-R64 PolarHBondContact O-N 3.46Å
62	V	73.4	Confident	76.7	Confident	48 Å²	48	62 Å²	62	29%	0.291	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-68.2	-22	167.4	-179.6	0	0	0	0	110.6	R64 L311 H312	V62-R64 VanDerWaalsContact C-N 3.26Å; V62-R64 PolarHBondContact O-N 3.31Å; V62-L311 HydrophobicContact CG1-CD1 4.47Å; V62-H312 PolarHBondContact O-NE2 2.92Å
63	R	78.9	Confident	78.7	Confident	98 Å²	98	58.7 Å²	58.7	37%	0.37	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-87.9	21.7	177.7	-157.8	-178.9	178.2	-123.4	-5	113.3	S61 F65 C126	S61-R63 PolarHBondContact O-N 3.44Å; S61-R63 PolarHBondContact OG-N 3.15Å; R63-F65 VanDerWaalsContact C-N 3.26Å; R63-F65 PolarHBondContact O-N 2.86Å; R63-C126 PolarHBondContact NE-SG 3.11Å; R63-C126 VanDerWaalsContact NH2-CB 3.25Å; R63-C126 PolarHBondContact NH2-SG 3.23Å; R63-C126 VanDerWaalsContact NH2-SG 3.43Å
64	R	82.4	Confident	80.3	Confident	54 Å²	54	59.5 Å²	59.5	20%	0.204	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-71	-23.1	-180	64.1	-178.5	-178.4	-127.7	-7.3	113.1	R58 H59 S61 V62 I306 E308	R58-R64 WeakPolarHBondContact O-CB 3.39Å; H59-R64 WeakPolarHBondContact O-CD 3.39Å; H59-R64 PolarHBondContact O-NH1 2.92Å; S61-R64 WeakPolarHBondContact O-CB 3.15Å; S61-R64 VanDerWaalsContact O-CG 3.3Å; S61-R64 WeakPolarHBondContact O-CG 3.38Å; S61-R64 PolarHBondContact O-N 3.46Å; V62-R64 VanDerWaalsContact C-N 3.26Å; V62-R64 PolarHBondContact O-N 3.31Å; R64-I306 VanDerWaalsContact CG-O 3.29Å; R64-I306 WeakPolarHBondContact CG-O 3.48Å; R64-I306 PolarHBondContact NE-O 3.35Å; R64-E308 IonicContact CZ-OE2 2.65Å; R64-E308 VanDerWaalsContact NH2-CB 3.28Å; R64-E308 IonicContact NH2-OE2 2.77Å; R64-E308 PolarHBondContact NH2-OE2 3.47Å
65	F	87.3	Confident	81.5	Confident	13 Å²	13	64.3 Å²	64.3	6%	0.057	33%	0.331	C	S	.	.	S	Bend	trans	-109.8	127.1	164.1	173	-99.8	0	0	0	107.7	R63 S67 F68 P129 L299 Y307 H312	R63-F65 VanDerWaalsContact C-N 3.26Å; R63-F65 PolarHBondContact O-N 2.86Å; F65-S67 WeakPolarHBondContact CE2-O 3.47Å; F65-S67 VanDerWaalsContact CZ-C 3.44Å; F65-S67 WeakPolarHBondContact CZ-O 3.32Å; F65-F68 AromaticContact CE1-CD2 3.97Å; F65-F68 HydrophobicContact CE1-CD2 3.97Å; F65-F68 AromaticContact CE1-CE2 3.77Å; F65-F68 HydrophobicContact CE1-CE2 3.77Å; F65-F68 HydrophobicContact CE1-CG 4.5Å; F65-F68 HydrophobicContact CE1-CZ 4.12Å; F65-F68 HydrophobicContact CZ-CD1 4.15Å; F65-F68 AromaticContact CZ-CD2 3.96Å; F65-F68 HydrophobicContact CZ-CD2 3.96Å; F65-F68 HydrophobicContact CZ-CE1 4.21Å; F65-F68 HydrophobicContact CZ-CE2 4.03Å; F65-F68 HydrophobicContact CZ-CG 4.03Å; F65-F68 HydrophobicContact CZ-CZ 4.15Å; F65-P129 HydrophobicContact CD1-CB 4.47Å; F65-P129 HydrophobicContact CD1-CG 3.87Å; F65-P129 HydrophobicContact CE1-CB 4Å; F65-P129 HydrophobicContact CE1-CG 3.84Å; F65-L299 HydrophobicContact CD2-CD2 4.4Å; F65-L299 HydrophobicContact CE2-CD1 3.6Å; F65-L299 HydrophobicContact CE2-CD2 3.84Å; F65-L299 HydrophobicContact CE2-CG 4.38Å; F65-L299 HydrophobicContact CZ-CD1 3.75Å; F65-Y307 HydrophobicContact CD1-CD2 4.07Å; F65-Y307 HydrophobicContact CD1-CE2 4.32Å; F65-Y307 AromaticContact CD2-CD2 3.88Å; F65-Y307 HydrophobicContact CD2-CD2 3.88Å; F65-Y307 HydrophobicContact CE1-CD2 4.14Å; F65-Y307 HydrophobicContact CE1-CE2 4.05Å; F65-Y307 AromaticContact CE2-CD2 3.97Å; F65-Y307 HydrophobicContact CE2-CD2 3.97Å; F65-Y307 HydrophobicContact CE2-CE2 4.41Å; F65-Y307 AromaticContact CG-CD2 3.92Å; F65-Y307 HydrophobicContact CG-CD2 3.92Å; F65-Y307 HydrophobicContact CZ-CD2 4.09Å; F65-Y307 HydrophobicContact CZ-CE2 4.09Å; F65-H312 WeakPolarHBondContact CB-ND1 3.34Å; F65-H312 HydrophobicContact CD1-CB 3.68Å; F65-H312 AromaticContact CD1-CG 3.77Å; F65-H312 HydrophobicContact CE1-CB 4.17Å; F65-H312 HydrophobicContact CG-CB 4.41Å; F65-H312 AromaticContact CG-ND1 3.97Å
66	E	86.6	Confident	82.6	Confident	105 Å²	105	61.5 Å²	61.5	49%	0.491	32%	0.318	S	S	.	.			trans	-103.8	-37	-169.5	-62.2	-173.9	170.9	0	0	112.7
67	S	92.3	Very high	83.1	Confident	33 Å²	33	67 Å²	67	23%	0.231	33%	0.331	C	S	.	.			trans	-164.9	153.1	-167.8	171.4	0	0	0	0	113	F65 N69 E132	F65-S67 WeakPolarHBondContact CE2-O 3.47Å; F65-S67 VanDerWaalsContact CZ-C 3.44Å; F65-S67 WeakPolarHBondContact CZ-O 3.32Å; S67-N69 VanDerWaalsContact C-N 3.26Å; S67-N69 PolarHBondContact OG-N 3.13Å; S67-E132 WeakPolarHBondContact CA-OE2 3.12Å; S67-E132 WeakPolarHBondContact CB-OE2 3.36Å; S67-E132 PolarHBondContact OG-OE1 2.85Å; S67-E132 PolarHBondContact OG-OE2 3.18Å
68	F	95.4	Very high	83.1	Confident	5 Å²	5	69.4 Å²	69.4	2%	0.022	34%	0.342	C	S	.	.			trans	-82.2	-0.8	167.8	-73.6	-89.3	0	0	0	113.2	F65 L70 P129 E132 V133 F295 L299 Y307 Y313	F65-F68 AromaticContact CE1-CD2 3.97Å; F65-F68 HydrophobicContact CE1-CD2 3.97Å; F65-F68 AromaticContact CE1-CE2 3.77Å; F65-F68 HydrophobicContact CE1-CE2 3.77Å; F65-F68 HydrophobicContact CE1-CG 4.5Å; F65-F68 HydrophobicContact CE1-CZ 4.12Å; F65-F68 HydrophobicContact CZ-CD1 4.15Å; F65-F68 AromaticContact CZ-CD2 3.96Å; F65-F68 HydrophobicContact CZ-CD2 3.96Å; F65-F68 HydrophobicContact CZ-CE1 4.21Å; F65-F68 HydrophobicContact CZ-CE2 4.03Å; F65-F68 HydrophobicContact CZ-CG 4.03Å; F65-F68 HydrophobicContact CZ-CZ 4.15Å; F68-L70 VanDerWaalsContact C-N 3.33Å; F68-L70 HydrophobicContact CB-CD1 4.04Å; F68-L70 HydrophobicContact CB-CD2 4.1Å; F68-L70 HydrophobicContact CB-CG 3.77Å; F68-L70 PolarHBondContact O-N 3.36Å; F68-P129 HydrophobicContact CD2-CB 4.02Å; F68-P129 HydrophobicContact CE2-CB 3.82Å; F68-E132 PolarHBondContact N-OE2 3.17Å; F68-V133 HydrophobicContact CD2-CG2 3.62Å; F68-V133 HydrophobicContact CE2-CG2 3.9Å; F68-V133 HydrophobicContact CG-CG2 4.25Å; F68-F295 HydrophobicContact CD1-CB 3.93Å; F68-F295 HydrophobicContact CD1-CD2 4.49Å; F68-F295 HydrophobicContact CE1-CB 4.41Å; F68-L299 HydrophobicContact CD1-CD1 4.01Å; F68-L299 HydrophobicContact CE1-CD1 3.83Å; F68-Y307 HydrophobicContact CE1-CE2 4.33Å; F68-Y307 HydrophobicContact CZ-CE2 4.05Å; F68-Y313 HydrophobicContact CZ-CD2 4.25Å
69	N	95.3	Very high	82.6	Confident	121 Å²	121	73.9 Å²	73.9	65%	0.647	36%	0.359	S	S	*	.			trans	57.1	42.7	-178.3	-52.3	-71.2	0	0	0	112.8	S67 F71 E132	S67-N69 VanDerWaalsContact C-N 3.26Å; S67-N69 PolarHBondContact OG-N 3.13Å; N69-F71 VanDerWaalsContact C-N 3.29Å; N69-E132 PolarHBondContact N-OE1 2.91Å; N69-E132 VanDerWaalsContact N-OE1 3.12Å
70	L	97.8	Very high	81.7	Confident	0 Å²	0	78 Å²	78	0%	0	38%	0.379	C	S	.	.			trans	-79.8	-17.7	177.4	-53.4	175.2	0	0	0	111.9	F68 I94 F95 E132 V133 Y136 I292 F295	F68-L70 VanDerWaalsContact C-N 3.33Å; F68-L70 HydrophobicContact CB-CD1 4.04Å; F68-L70 HydrophobicContact CB-CD2 4.1Å; F68-L70 HydrophobicContact CB-CG 3.77Å; F68-L70 PolarHBondContact O-N 3.36Å; L70-I94 WeakPolarHBondContact O-CG1 3.11Å; L70-I94 PolarHBondContact O-N 2.86Å; L70-F95 HydrophobicContact CD2-CE2 3.85Å; L70-E132 HydrophobicContact CB-CG 4.19Å; L70-E132 WeakPolarHBondContact CB-OE1 3.28Å; L70-E132 HydrophobicContact CD1-CG 4.14Å; L70-E132 HydrophobicContact CG-CG 4.37Å; L70-E132 PolarHBondContact N-OE1 2.95Å; L70-V133 HydrophobicContact CD1-CG2 3.91Å; L70-Y136 HydrophobicContact CB-CD2 4.32Å; L70-Y136 HydrophobicContact CB-CG 4.33Å; L70-Y136 HydrophobicContact CD1-CD1 4.06Å; L70-Y136 HydrophobicContact CD1-CG 3.8Å; L70-Y136 HydrophobicContact CD2-CG 4.46Å; L70-Y136 HydrophobicContact CG-CG 4.41Å; L70-I292 HydrophobicContact CD1-CD1 3.58Å; L70-I292 HydrophobicContact CD2-CD1 3.62Å; L70-I292 HydrophobicContact CG-CD1 4.22Å; L70-F295 HydrophobicContact CD2-CD2 4.17Å; L70-F295 HydrophobicContact CD2-CE2 3.73Å
71	F	97.6	Very high	80.4	Confident	12 Å²	12	83.7 Å²	83.7	5%	0.053	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	137.5	176.7	-62.4	-94.3	0	0	0	110.7	N69 Y91 T92 E132 A135 L139 M164	N69-F71 VanDerWaalsContact C-N 3.29Å; F71-Y91 HydrophobicContact CB-CD1 3.72Å; F71-Y91 HydrophobicContact CB-CE1 4.48Å; F71-Y91 HydrophobicContact CG-CD1 4.16Å; F71-T92 CarbonylContact C-O 3.51Å; F71-T92 VanDerWaalsContact CA-O 3.24Å; F71-T92 WeakPolarHBondContact CA-O 3.49Å; F71-E132 HydrophobicContact CD2-CG 3.83Å; F71-E132 HydrophobicContact CE2-CG 4.12Å; F71-A135 HydrophobicContact CE2-CB 4.19Å; F71-A135 HydrophobicContact CZ-CB 4.05Å; F71-L139 HydrophobicContact CE1-CD1 3.86Å; F71-L139 HydrophobicContact CZ-CD1 4.02Å; F71-M164 HydrophobicContact CE1-CE 4.44Å; F71-M164 HydrophobicContact CE1-CG 4.36Å; F71-M164 HydrophobicContact CE1-SD 3.71Å; F71-M164 HydrophobicContact CZ-CG 4.18Å; F71-M164 HydrophobicContact CZ-SD 4.12Å
72	S	96.1	Very high	79.3	Confident	47 Å²	47	87.1 Å²	87.1	33%	0.329	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	143.7	162.3	61.8	0	0	0	0	109.7	Y91 T92	S72-Y91 WeakPolarHBondContact O-CA 3.49Å; S72-T92 PolarHBondContact N-O 3.21Å; S72-T92 PolarHBondContact O-N 2.98Å; S72-T92 PolarHBondContact OG-O 2.88Å
73	V	93.3	Very high	77.9	Confident	75 Å²	75	95 Å²	95	46%	0.455	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.5	-179.4	-174.3	0	0	0	0	108.7	V89 Q90 Y91	V73-V89 HydrophobicContact CG1-CB 3.84Å; V73-V89 HydrophobicContact CG1-CG1 4.22Å; V73-V89 HydrophobicContact CG1-CG2 4.26Å; V73-Q90 WeakPolarHBondContact CA-O 3.22Å; V73-Y91 HydrophobicContact CG1-CD2 4.48Å; V73-Y91 HydrophobicContact CG1-CE2 4.08Å; V73-Y91 HydrophobicContact CG2-CD1 3.91Å; V73-Y91 HydrophobicContact CG2-CD2 4.4Å; V73-Y91 HydrophobicContact CG2-CE1 3.52Å; V73-Y91 HydrophobicContact CG2-CE2 4.09Å; V73-Y91 HydrophobicContact CG2-CG 4.32Å
74	T	91.5	Very high	76.8	Confident	85 Å²	85	94.4 Å²	94.4	52%	0.521	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	126.9	176.2	-52.3	0	0	0	0	110.1	V76 V89 Q90	T74-V76 PolarHBondContact O-N 3.34Å; T74-V89 CarbonylContact O-C 3.59Å; T74-V89 WeakPolarHBondContact O-CA 3.46Å; T74-Q90 PolarHBondContact N-O 3.31Å; T74-Q90 PolarHBondContact O-N 2.72Å
75	E	85.4	Confident	75.6	Confident	163 Å²	163	97.4 Å²	97.4	76%	0.762	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.8	131.7	174.2	-69.3	-177.5	-177.9	0	0	111.2	K77 V89	E75-K77 PolarHBondContact O-N 3.05Å; E75-V89 HydrophobicContact CG-CG1 4.22Å
76	V	81.8	Confident	74.5	Confident	45 Å²	45	97.6 Å²	97.6	27%	0.273	49%	0.487	S	S	.	.			trans	-87.1	111.5	175.6	-176.2	0	0	0	0	107.8	T74 E78 W88 Q90	T74-V76 PolarHBondContact O-N 3.34Å; V76-E78 PolarHBondContact O-N 3.3Å; V76-E78 VanDerWaalsContact O-N 3.1Å; V76-W88 HydrophobicContact CB-CB 4.2Å; V76-W88 PolarHBondContact N-O 3.49Å; V76-Q90 HydrophobicContact CG2-CB 4.29Å
77	K	68.4	Low	74.3	Confident	203 Å²	203	94.5 Å²	94.5	88%	0.883	48%	0.48	S	S	*	.			trans	-69.9	105.2	173	-67.6	-174.8	-179.4	-178.6	0	109.2	E75	E75-K77 PolarHBondContact O-N 3.05Å
78	E	63.3	Low	74.2	Confident	66 Å²	66	93.3 Å²	93.3	31%	0.308	47%	0.47	S	S	.	.			trans	-71.5	145.8	173.4	-65	-168.2	148.9	0	0	111.3	V76 W88	V76-E78 PolarHBondContact O-N 3.3Å; V76-E78 VanDerWaalsContact O-N 3.1Å; E78-W88 PolarHBondContact OE1-NE1 3.43Å
79	R	53.4	Low	74	Confident	222 Å²	222	93.5 Å²	93.5	84%	0.838	47%	0.472	S	S	*	.			trans	-76.9	140.6	166.1	-65.6	-175.3	-176.2	-162.6	1.2	107.4	T81	R79-T81 PolarHBondContact O-N 3.08Å
80	E	47.5	Very low	74	Confident	205 Å²	205	90 Å²	90	96%	0.958	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	5.4	-167.8	-61.9	179.5	153.6	0	0	117.8
81	T	46.8	Very low	74	Confident	126 Å²	126	91.2 Å²	91.2	77%	0.773	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-9.4	-172.5	43.6	0	0	0	0	115.5	R79	R79-T81 PolarHBondContact O-N 3.08Å
82	E	50.6	Low	74	Confident	103 Å²	103	91.9 Å²	91.9	48%	0.481	46%	0.461	S	S	.	.			trans	-105	106.5	-179.9	-71.3	178.5	170	0	0	110	E84	E82-E84 HydrophobicContact CB-CG 4.47Å; E82-E84 PolarHBondContact O-N 2.9Å
83	K	45.4	Very low	74.1	Confident	213 Å²	213	89.7 Å²	89.7	93%	0.926	45%	0.446	S	S	*	.			trans	-72.8	46	171.2	-70.9	-178.5	176.3	177.8	0	110.9
84	E	54.4	Low	74.3	Confident	86 Å²	86	90.1 Å²	90.1	40%	0.402	45%	0.445	S	S	.	.			trans	-84.2	127.7	177.8	-73.7	-163.6	175.8	0	0	110.4	E82 G86 W88	E82-E84 HydrophobicContact CB-CG 4.47Å; E82-E84 PolarHBondContact O-N 2.9Å; E84-G86 PolarHBondContact O-N 3.27Å; E84-W88 PolarHBondContact OE2-NE1 2.97Å
85	V	56.9	Low	74.6	Confident	118 Å²	118	89.5 Å²	89.5	72%	0.715	44%	0.435	S	S	*	.	S	Bend	trans	-82.1	94.9	174.9	-179.7	0	0	0	0	107.7
86	G	64.4	Low	75	Confident	16 Å²	16	83.3 Å²	83.3	17%	0.165	41%	0.409	C	S	.	.	S	Bend	trans	156.8	148.8	175.4	0	0	0	0	0	111.9	E84 H105	E84-G86 PolarHBondContact O-N 3.27Å; G86-H105 WeakPolarHBondContact CA-O 3.47Å
87	A	82.4	Confident	75.7	Confident	41 Å²	41	85.1 Å²	85.1	34%	0.339	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119.4	174.7	0	0	0	0	0	109.5	H105 S107	A87-H105 PolarHBondContact N-O 3.39Å; A87-H105 PolarHBondContact O-N 3Å; A87-S107 VanDerWaalsContact CB-OG 3.23Å; A87-S107 WeakPolarHBondContact CB-OG 3.43Å; A87-S107 PolarHBondContact N-OG 2.92Å
88	W	89.8	Confident	77	Confident	8 Å²	8	81.7 Å²	81.7	3%	0.03	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	131.4	171.9	-72.3	91.8	0	0	0	110.8	V76 E78 E84 I103 R104 I190 R193	V76-W88 HydrophobicContact CB-CB 4.2Å; V76-W88 PolarHBondContact N-O 3.49Å; E78-W88 PolarHBondContact OE1-NE1 3.43Å; E84-W88 PolarHBondContact OE2-NE1 2.97Å; W88-I103 WeakPolarHBondContact CA-O 3.09Å; W88-R104 HydrophobicContact CD2-CB 3.86Å; W88-R104 HydrophobicContact CD2-CG 4.02Å; W88-R104 HydrophobicContact CE3-CB 3.8Å; W88-R104 HydrophobicContact CE3-CG 4.47Å; W88-R104 HydrophobicContact CG-CG 4.34Å; W88-R104 HydrophobicContact CH2-CB 3.98Å; W88-R104 HydrophobicContact CZ2-CB 4.04Å; W88-R104 HydrophobicContact CZ2-CG 4.25Å; W88-R104 HydrophobicContact CZ3-CB 3.84Å; W88-I190 HydrophobicContact CH2-CG1 4.37Å; W88-I190 HydrophobicContact CZ3-CG1 4.15Å; W88-R193 VanDerWaalsContact CE3-CD 3.49Å; W88-R193 HydrophobicContact CH2-CB 3.56Å; W88-R193 VanDerWaalsContact CH2-CD 3.41Å; W88-R193 HydrophobicContact CH2-CG 4.1Å; W88-R193 HydrophobicContact CZ2-CB 4.21Å; W88-R193 HydrophobicContact CZ3-CB 3.98Å; W88-R193 HydrophobicContact CZ3-CG 4.21Å
89	V	92.4	Very high	78.7	Confident	8 Å²	8	80.5 Å²	80.5	5%	0.048	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.1	179.7	-66.9	0	0	0	0	109.3	V73 T74 E75 Y91 I103	V73-V89 HydrophobicContact CG1-CB 3.84Å; V73-V89 HydrophobicContact CG1-CG1 4.22Å; V73-V89 HydrophobicContact CG1-CG2 4.26Å; T74-V89 CarbonylContact O-C 3.59Å; T74-V89 WeakPolarHBondContact O-CA 3.46Å; E75-V89 HydrophobicContact CG-CG1 4.22Å; V89-Y91 HydrophobicContact CG2-CD2 3.99Å; V89-Y91 HydrophobicContact CG2-CE2 3.56Å; V89-I103 HydrophobicContact CG2-CB 4.24Å; V89-I103 PolarHBondContact N-O 2.91Å; V89-I103 PolarHBondContact O-N 2.92Å
90	Q	95.6	Very high	80.8	Confident	48 Å²	48	71.3 Å²	71.3	22%	0.224	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	119.7	175.4	-165.4	75.3	10.8	0	0	109	V73 T74 V76 S100 S102	V73-Q90 WeakPolarHBondContact CA-O 3.22Å; T74-Q90 PolarHBondContact N-O 3.31Å; T74-Q90 PolarHBondContact O-N 2.72Å; V76-Q90 HydrophobicContact CG2-CB 4.29Å; Q90-S100 WeakPolarHBondContact CG-OG 3.28Å; Q90-S100 PolarHBondContact NE2-OG 2.91Å; Q90-S102 PolarHBondContact OE1-OG 2.82Å
91	Y	97.3	Very high	83.2	Confident	26 Å²	26	61.5 Å²	61.5	10%	0.102	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	122	169.6	-84.2	-107.3	0	0	0	109	F71 S72 V73 V89 S100 I101 I103 H105 I127	F71-Y91 HydrophobicContact CB-CD1 3.72Å; F71-Y91 HydrophobicContact CB-CE1 4.48Å; F71-Y91 HydrophobicContact CG-CD1 4.16Å; S72-Y91 WeakPolarHBondContact O-CA 3.49Å; V73-Y91 HydrophobicContact CG1-CD2 4.48Å; V73-Y91 HydrophobicContact CG1-CE2 4.08Å; V73-Y91 HydrophobicContact CG2-CD1 3.91Å; V73-Y91 HydrophobicContact CG2-CD2 4.4Å; V73-Y91 HydrophobicContact CG2-CE1 3.52Å; V73-Y91 HydrophobicContact CG2-CE2 4.09Å; V73-Y91 HydrophobicContact CG2-CG 4.32Å; V89-Y91 HydrophobicContact CG2-CD2 3.99Å; V89-Y91 HydrophobicContact CG2-CE2 3.56Å; Y91-S100 CarbonylContact O-C 3.57Å; Y91-S100 VanDerWaalsContact O-CA 3.25Å; Y91-S100 WeakPolarHBondContact O-CA 3.25Å; Y91-S100 PolarHBondContact O-OG 3.21Å; Y91-I101 PolarHBondContact N-O 2.9Å; Y91-I101 PolarHBondContact O-N 3.14Å; Y91-I103 HydrophobicContact CD2-CB 4.02Å; Y91-I103 HydrophobicContact CD2-CG1 3.75Å; Y91-I103 HydrophobicContact CE2-CB 4.25Å; Y91-I103 HydrophobicContact CE2-CG1 4.31Å; Y91-I103 HydrophobicContact CG-CG1 4.36Å; Y91-H105 AromaticContact CE2-CE1 3.93Å; Y91-H105 AromaticContact CE2-NE2 3.54Å; Y91-H105 AromaticContact CZ-NE2 3.8Å; Y91-H105 PolarHBondContact OH-CE1 2.84Å; Y91-H105 VanDerWaalsContact OH-CE1 3.22Å; Y91-H105 PolarHBondContact OH-NE2 3.33Å; Y91-H105 VanDerWaalsContact OH-NE2 3.15Å; Y91-I127 HydrophobicContact CD1-CD1 4.3Å; Y91-I127 HydrophobicContact CE1-CD1 3.63Å; Y91-I127 HydrophobicContact CE2-CD1 3.89Å; Y91-I127 WeakPolarHBondContact OH-CD1 3.48Å
92	T	98.3	Very high	85.6	Confident	25 Å²	25	56.1 Å²	56.1	15%	0.153	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.3	178.3	-53	0	0	0	0	109.4	F71 S72 I94 P97 S100	F71-T92 CarbonylContact C-O 3.51Å; F71-T92 VanDerWaalsContact CA-O 3.24Å; F71-T92 WeakPolarHBondContact CA-O 3.49Å; S72-T92 PolarHBondContact N-O 3.21Å; S72-T92 PolarHBondContact O-N 2.98Å; S72-T92 PolarHBondContact OG-O 2.88Å; T92-I94 PolarHBondContact O-N 3.31Å; T92-P97 HydrophobicContact CG2-CB 4.31Å; T92-P97 WeakPolarHBondContact CG2-O 3.48Å; T92-S100 PolarHBondContact OG1-OG 2.83Å
93	S	98.1	Very high	87.7	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.007	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	132	178.7	172.8	0	0	0	0	110.5	F95 C96 P97 Y99	S93-F95 VanDerWaalsContact C-N 3.28Å; S93-F95 PolarHBondContact O-N 3.29Å; S93-F95 PolarHBondContact OG-N 3.33Å; S93-C96 WeakPolarHBondContact CB-O 3.43Å; S93-C96 CarbonylContact O-C 3.57Å; S93-C96 PolarHBondContact OG-N 3.28Å; S93-C96 VanDerWaalsContact OG-N 3.13Å; S93-P97 VanDerWaalsContact O-CA 3.31Å; S93-P97 WeakPolarHBondContact O-CA 3.46Å; S93-Y99 PolarHBondContact N-O 3.06Å; S93-Y99 VanDerWaalsContact N-O 3.07Å
94	I	97.8	Very high	89.9	Confident	85 Å²	85	42.4 Å²	42.4	44%	0.436	23%	0.231	S	C	.	.	S	Bend	trans	-66.8	-34.5	176.4	-65.4	-62.6	0	0	0	111	L70 T92	L70-I94 WeakPolarHBondContact O-CG1 3.11Å; L70-I94 PolarHBondContact O-N 2.86Å; T92-I94 PolarHBondContact O-N 3.31Å
95	F	95.9	Very high	91.3	Very high	71 Å²	71	40.7 Å²	40.7	31%	0.311	22%	0.223	S	C	.	.	S	Bend	trans	-92.8	-21.6	-173.4	-61.9	-83.9	0	0	0	113.5	L70 S93 Y136 H291 F295	L70-F95 HydrophobicContact CD2-CE2 3.85Å; S93-F95 VanDerWaalsContact C-N 3.28Å; S93-F95 PolarHBondContact O-N 3.29Å; S93-F95 PolarHBondContact OG-N 3.33Å; F95-Y136 HydrophobicContact CB-CE2 4Å; F95-Y136 HydrophobicContact CD2-CD2 4.01Å; F95-Y136 AromaticContact CD2-CE2 3.31Å; F95-Y136 HydrophobicContact CD2-CE2 3.31Å; F95-Y136 AromaticContact CE2-CE2 3.95Å; F95-Y136 HydrophobicContact CE2-CE2 3.95Å; F95-Y136 AromaticContact CG-CE2 3.81Å; F95-Y136 HydrophobicContact CG-CE2 3.81Å; F95-H291 AromaticContact CD1-CE1 3.62Å; F95-H291 AromaticContact CD1-ND1 3.73Å; F95-H291 HydrophobicContact CE1-CB 4.46Å; F95-H291 AromaticContact CE1-CE1 3.45Å; F95-H291 VanDerWaalsContact CE1-CE1 3.45Å; F95-H291 WeakPolarHBondContact CE1-CE1 3.45Å; F95-H291 AromaticContact CE1-CG 3.79Å; F95-H291 AromaticContact CE1-ND1 3.37Å; F95-H291 WeakPolarHBondContact CE1-ND1 3.07Å; F95-H291 AromaticContact CE1-NE2 3.91Å; F95-H291 HydrophobicContact CZ-CB 4.16Å; F95-H291 AromaticContact CZ-CG 3.98Å; F95-H291 AromaticContact CZ-ND1 3.81Å; F95-F295 HydrophobicContact CE2-CE2 4.49Å; F95-F295 HydrophobicContact CZ-CE2 4.15Å; F95-F295 HydrophobicContact CZ-CZ 4.15Å
96	C	94.9	Very high	91.9	Very high	33 Å²	33	38 Å²	38	22%	0.223	21%	0.205	C	C	.	.			trans	-137.3	73.9	176.4	-57.1	0	0	0	0	109.5	S93 E98 Y99	S93-C96 WeakPolarHBondContact CB-O 3.43Å; S93-C96 CarbonylContact O-C 3.57Å; S93-C96 PolarHBondContact OG-N 3.28Å; S93-C96 VanDerWaalsContact OG-N 3.13Å; C96-E98 VanDerWaalsContact CA-OE2 3.29Å; C96-E98 WeakPolarHBondContact CA-OE2 3.25Å; C96-E98 PolarHBondContact O-N 3.17Å; C96-Y99 HydrophobicContact CB-CD2 3.55Å; C96-Y99 HydrophobicContact CB-CE2 4.01Å; C96-Y99 PolarHBondContact O-N 2.77Å
97	P	96.2	Very high	91.5	Very high	83 Å²	83	41 Å²	41	54%	0.539	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.2	-171	-23.3	35.2	0	0	0	115.2	T92 S93 Y99	T92-P97 HydrophobicContact CG2-CB 4.31Å; T92-P97 WeakPolarHBondContact CG2-O 3.48Å; S93-P97 VanDerWaalsContact O-CA 3.31Å; S93-P97 WeakPolarHBondContact O-CA 3.46Å; P97-Y99 PolarHBondContact O-N 3.08Å
98	E	96.7	Very high	90.3	Very high	131 Å²	131	41 Å²	41	61%	0.612	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.4	170.1	67.7	-87.6	-152.9	0	0	113	C96	C96-E98 VanDerWaalsContact CA-OE2 3.29Å; C96-E98 WeakPolarHBondContact CA-OE2 3.25Å; C96-E98 PolarHBondContact O-N 3.17Å
99	Y	98.3	Very high	88.5	Confident	42 Å²	42	45 Å²	45	17%	0.165	26%	0.257	C	S	.	.			trans	-96.9	112.3	176.9	-59	-51.7	0	0	0	110.6	S93 C96 P97 L139 I167	S93-Y99 PolarHBondContact N-O 3.06Å; S93-Y99 VanDerWaalsContact N-O 3.07Å; C96-Y99 HydrophobicContact CB-CD2 3.55Å; C96-Y99 HydrophobicContact CB-CE2 4.01Å; C96-Y99 PolarHBondContact O-N 2.77Å; P97-Y99 PolarHBondContact O-N 3.08Å; Y99-L139 HydrophobicContact CD2-CD1 4.44Å; Y99-L139 HydrophobicContact CD2-CD2 3.78Å; Y99-L139 HydrophobicContact CG-CD2 3.83Å; Y99-I167 HydrophobicContact CD1-CD1 4.49Å; Y99-I167 HydrophobicContact CD1-CG1 4.29Å
100	S	98.1	Very high	86.9	Confident	28 Å²	28	49.5 Å²	49.5	20%	0.196	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	137.4	-177.1	-165.5	0	0	0	0	110.1	Q90 Y91 T92	Q90-S100 WeakPolarHBondContact CG-OG 3.28Å; Q90-S100 PolarHBondContact NE2-OG 2.91Å; Y91-S100 CarbonylContact O-C 3.57Å; Y91-S100 VanDerWaalsContact O-CA 3.25Å; Y91-S100 WeakPolarHBondContact O-CA 3.25Å; Y91-S100 PolarHBondContact O-OG 3.21Å; T92-S100 PolarHBondContact OG1-OG 2.83Å
101	I	98	Very high	85.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	140.3	-178.6	-161.6	79.9	0	0	0	110.3	Y91 I103 L160 L163 M164 I167 N194 V199 F200	Y91-I101 PolarHBondContact N-O 2.9Å; Y91-I101 PolarHBondContact O-N 3.14Å; I101-I103 HydrophobicContact CG1-CD1 4.29Å; I101-I103 HydrophobicContact CG2-CD1 3.67Å; I101-I103 HydrophobicContact CG2-CG1 3.85Å; I101-L160 HydrophobicContact CG2-CD1 4.11Å; I101-L163 HydrophobicContact CG1-CB 4.4Å; I101-L163 HydrophobicContact CG1-CD1 4.43Å; I101-M164 HydrophobicContact CB-CE 3.78Å; I101-M164 HydrophobicContact CG2-CE 3.23Å; I101-I167 HydrophobicContact CB-CD1 4.43Å; I101-I167 HydrophobicContact CD1-CG2 3.69Å; I101-N194 HydrophobicContact CD1-CB 3.76Å; I101-N194 VanDerWaalsContact CD1-OD1 3.22Å; I101-N194 WeakPolarHBondContact CD1-OD1 3.35Å; I101-N194 WeakPolarHBondContact CG1-OD1 3.42Å; I101-V199 HydrophobicContact CD1-CG2 3.98Å; I101-F200 HydrophobicContact CD1-CE1 3.9Å; I101-F200 HydrophobicContact CD1-CZ 4.26Å
102	S	97.2	Very high	83.7	Confident	12 Å²	12	53 Å²	53	8%	0.084	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	122	169.3	-65.4	0	0	0	0	109.9	Q90 N194	Q90-S102 PolarHBondContact OE1-OG 2.82Å; S102-N194 PolarHBondContact N-OD1 2.69Å; S102-N194 PolarHBondContact O-ND2 3.01Å
103	I	95	Very high	82	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	142.6	175.5	-58.6	-58.2	0	0	0	109.1	W88 V89 Y91 I101 T158 L160 L163 I190	W88-I103 WeakPolarHBondContact CA-O 3.09Å; V89-I103 HydrophobicContact CG2-CB 4.24Å; V89-I103 PolarHBondContact N-O 2.91Å; V89-I103 PolarHBondContact O-N 2.92Å; Y91-I103 HydrophobicContact CD2-CB 4.02Å; Y91-I103 HydrophobicContact CD2-CG1 3.75Å; Y91-I103 HydrophobicContact CE2-CB 4.25Å; Y91-I103 HydrophobicContact CE2-CG1 4.31Å; Y91-I103 HydrophobicContact CG-CG1 4.36Å; I101-I103 HydrophobicContact CG1-CD1 4.29Å; I101-I103 HydrophobicContact CG2-CD1 3.67Å; I101-I103 HydrophobicContact CG2-CG1 3.85Å; I103-T158 HydrophobicContact CG2-CG2 3.58Å; I103-L160 HydrophobicContact CD1-CD1 4.02Å; I103-L160 HydrophobicContact CG1-CD1 4.22Å; I103-L163 HydrophobicContact CD1-CD1 3.58Å; I103-I190 HydrophobicContact CD1-CD1 4.47Å; I103-I190 HydrophobicContact CD1-CG2 4.05Å; I103-I190 HydrophobicContact CG2-CD1 4.11Å
104	R	91.5	Very high	80.3	Confident	28 Å²	28	60 Å²	60	11%	0.106	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115.5	170.5	-162.7	174.7	66.3	-170.2	-0.9	109.9	W88 N186 D189 I190	W88-R104 HydrophobicContact CD2-CB 3.86Å; W88-R104 HydrophobicContact CD2-CG 4.02Å; W88-R104 HydrophobicContact CE3-CB 3.8Å; W88-R104 HydrophobicContact CE3-CG 4.47Å; W88-R104 HydrophobicContact CG-CG 4.34Å; W88-R104 HydrophobicContact CH2-CB 3.98Å; W88-R104 HydrophobicContact CZ2-CB 4.04Å; W88-R104 HydrophobicContact CZ2-CG 4.25Å; W88-R104 HydrophobicContact CZ3-CB 3.84Å; R104-N186 VanDerWaalsContact CZ-OD1 3.26Å; R104-N186 PolarHBondContact NE-OD1 2.86Å; R104-N186 PolarHBondContact NH2-OD1 3.36Å; R104-N186 PolarHBondContact O-ND2 3.17Å; R104-D189 IonicContact CZ-OD2 3.15Å; R104-D189 IonicContact NH1-OD2 2.76Å; R104-D189 PolarHBondContact NH1-OD2 3.16Å; R104-D189 IonicContact NH2-OD2 2.84Å; R104-D189 PolarHBondContact NH2-OD2 2.98Å; R104-I190 HydrophobicContact CB-CG1 4.13Å
105	H	82.9	Confident	78.7	Confident	51 Å²	51	59 Å²	59	24%	0.236	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	138.3	168.4	-69.7	175.6	0	0	0	109.6	G86 A87 Y91 S107	G86-H105 WeakPolarHBondContact CA-O 3.47Å; A87-H105 PolarHBondContact N-O 3.39Å; A87-H105 PolarHBondContact O-N 3Å; Y91-H105 AromaticContact CE2-CE1 3.93Å; Y91-H105 AromaticContact CE2-NE2 3.54Å; Y91-H105 AromaticContact CZ-NE2 3.8Å; Y91-H105 PolarHBondContact OH-CE1 2.84Å; Y91-H105 VanDerWaalsContact OH-CE1 3.22Å; Y91-H105 PolarHBondContact OH-NE2 3.33Å; Y91-H105 VanDerWaalsContact OH-NE2 3.15Å; H105-S107 PolarHBondContact O-N 2.64Å; H105-S107 VanDerWaalsContact O-N 3.12Å
106	N	69.6	Low	76.9	Confident	60 Å²	60	62.2 Å²	62.2	32%	0.321	35%	0.354	S	S	.	.			trans	-83.2	93	177.8	-157	-6.8	0	0	0	108.2	G108 M157	N106-G108 PolarHBondContact O-N 2.83Å; N106-M157 HydrophobicContact CB-CE 3.35Å
107	S	56.4	Low	74.9	Confident	81 Å²	81	65.5 Å²	65.5	57%	0.566	37%	0.373	S	S	*	.			trans	-78.9	8.9	-179.3	-43.5	0	0	0	0	113.3	A87 H105	A87-S107 VanDerWaalsContact CB-OG 3.23Å; A87-S107 WeakPolarHBondContact CB-OG 3.43Å; A87-S107 PolarHBondContact N-OG 2.92Å; H105-S107 PolarHBondContact O-N 2.64Å; H105-S107 VanDerWaalsContact O-N 3.12Å
108	G	55.9	Low	73	Confident	40 Å²	40	63.4 Å²	63.4	41%	0.412	36%	0.361	S	S	.	.	S	Bend	trans	-66.7	151.6	180	0	0	0	0	0	112.7	N106 L110	N106-G108 PolarHBondContact O-N 2.83Å; G108-L110 PolarHBondContact O-N 3.26Å
109	S	53.3	Low	71	Confident	93 Å²	93	59.6 Å²	59.6	65%	0.65	34%	0.342	S	S	*	.			trans	-60.1	135.7	169.5	52.8	0	0	0	0	110.2	N111	S109-N111 PolarHBondContact O-N 2.93Å
110	L	59.2	Low	69.3	Low	101 Å²	101	59.7 Å²	59.7	53%	0.529	35%	0.345	S	S	.	.			trans	-52.2	107.4	170.4	-71.1	167	0	0	0	109.1	V47 G108 V112 V115	V47-L110 HydrophobicContact CG1-CD1 3.6Å; G108-L110 PolarHBondContact O-N 3.26Å; L110-V112 PolarHBondContact O-N 3.49Å; L110-V115 HydrophobicContact CB-CG2 4.47Å; L110-V115 HydrophobicContact CD2-CG2 4.29Å
111	N	61.4	Low	67.4	Low	70 Å²	70	60 Å²	60	37%	0.374	35%	0.345	S	S	.	.			trans	-76.8	120.2	171.5	-179.4	-5.5	0	0	0	107.7	S109 E113 D114 V115	S109-N111 PolarHBondContact O-N 2.93Å; N111-E113 PolarHBondContact O-N 3.26Å; N111-E113 WeakPolarHBondContact OD1-CB 3.4Å; N111-E113 PolarHBondContact OD1-N 3.35Å; N111-D114 HydrophobicContact CB-CB 4.02Å; N111-D114 PolarHBondContact ND2-OD1 2.96Å; N111-D114 WeakPolarHBondContact O-CB 3.33Å; N111-D114 PolarHBondContact O-N 3.47Å; N111-D114 VanDerWaalsContact O-N 3.13Å; N111-V115 WeakPolarHBondContact O-CG2 3.42Å; N111-V115 PolarHBondContact O-N 2.85Å
112	V	64.2	Low	65.6	Low	77 Å²	77	62 Å²	62	47%	0.467	36%	0.358	S	S	.	.	H	α-helix	trans	-57.1	-36.2	179.7	176.9	0	0	0	0	111.1	L48 L110 V115 L116	L48-V112 HydrophobicContact CD2-CG2 4.23Å; L110-V112 PolarHBondContact O-N 3.49Å; V112-V115 PolarHBondContact O-N 3.38Å; V112-L116 HydrophobicContact CG1-CD1 3.67Å; V112-L116 HydrophobicContact CG1-CG 4.21Å; V112-L116 WeakPolarHBondContact O-CB 3.41Å; V112-L116 WeakPolarHBondContact O-CG 3.41Å; V112-L116 PolarHBondContact O-N 2.84Å
113	E	62.5	Low	63.7	Low	131 Å²	131	62.5 Å²	62.5	61%	0.612	36%	0.364	S	S	*	.	H	α-helix	trans	-64.7	-47.4	176.6	-169.1	168.1	-164.8	0	0	111.2	N111 V115 L116 T117	N111-E113 PolarHBondContact O-N 3.26Å; N111-E113 WeakPolarHBondContact OD1-CB 3.4Å; N111-E113 PolarHBondContact OD1-N 3.35Å; E113-V115 VanDerWaalsContact C-N 3.29Å; E113-V115 PolarHBondContact O-N 2.96Å; E113-L116 PolarHBondContact O-N 3.42Å; E113-L116 VanDerWaalsContact O-N 3.17Å; E113-T117 HydrophobicContact CG-CG2 4.18Å; E113-T117 WeakPolarHBondContact O-CB 3.48Å; E113-T117 WeakPolarHBondContact O-CG2 3.22Å; E113-T117 PolarHBondContact O-N 2.87Å; E113-T117 PolarHBondContact O-OG1 3.21Å
114	D	62.3	Low	62.1	Low	43 Å²	43	64 Å²	64	23%	0.23	37%	0.372	C	S	.	.	H	α-helix	trans	-58.8	-40.3	173.7	-64	9.4	0	0	0	111.4	N111 L116 S118 N121 K182	N111-D114 HydrophobicContact CB-CB 4.02Å; N111-D114 PolarHBondContact ND2-OD1 2.96Å; N111-D114 WeakPolarHBondContact O-CB 3.33Å; N111-D114 PolarHBondContact O-N 3.47Å; N111-D114 VanDerWaalsContact O-N 3.13Å; D114-L116 VanDerWaalsContact C-N 3.33Å; D114-L116 PolarHBondContact O-N 3.37Å; D114-S118 VanDerWaalsContact O-CB 3.22Å; D114-S118 WeakPolarHBondContact O-CB 3.48Å; D114-S118 PolarHBondContact O-N 2.85Å; D114-S118 VanDerWaalsContact O-N 3.15Å; D114-S118 PolarHBondContact O-OG 3.21Å; D114-N121 PolarHBondContact O-ND2 3.47Å; D114-K182 IonicContact OD2-NZ 3.67Å; D114-K182 PolarHBondContact OD2-NZ 3.17Å
115	V	62.6	Low	60.8	Low	65 Å²	65	66.5 Å²	66.5	39%	0.394	39%	0.39	S	S	.	.	H	α-helix	trans	-63.3	-39.3	178.2	176.3	0	0	0	0	111.7	L110 N111 V112 E113 N121	L110-V115 HydrophobicContact CB-CG2 4.47Å; L110-V115 HydrophobicContact CD2-CG2 4.29Å; N111-V115 WeakPolarHBondContact O-CG2 3.42Å; N111-V115 PolarHBondContact O-N 2.85Å; V112-V115 PolarHBondContact O-N 3.38Å; E113-V115 VanDerWaalsContact C-N 3.29Å; E113-V115 PolarHBondContact O-N 2.96Å; V115-N121 VanDerWaalsContact CA-ND2 3.32Å; V115-N121 WeakPolarHBondContact CA-ND2 3.42Å; V115-N121 PolarHBondContact O-ND2 2.85Å
116	L	57.9	Low	60.5	Low	138 Å²	138	64.9 Å²	64.9	72%	0.723	38%	0.384	S	S	*	.	H	α-helix	trans	-89	-21.7	-174.2	-66.4	175.9	0	0	0	114	V112 E113 D114	V112-L116 HydrophobicContact CG1-CD1 3.67Å; V112-L116 HydrophobicContact CG1-CG 4.21Å; V112-L116 WeakPolarHBondContact O-CB 3.41Å; V112-L116 WeakPolarHBondContact O-CG 3.41Å; V112-L116 PolarHBondContact O-N 2.84Å; E113-L116 PolarHBondContact O-N 3.42Å; E113-L116 VanDerWaalsContact O-N 3.17Å; D114-L116 VanDerWaalsContact C-N 3.33Å; D114-L116 PolarHBondContact O-N 3.37Å
117	T	52.9	Low	61.4	Low	102 Å²	102	62.9 Å²	62.9	63%	0.626	37%	0.373	S	S	*	.	H	α-helix	trans	-110.1	-17.1	-172.8	61.4	0	0	0	0	114.4	E113	E113-T117 HydrophobicContact CG-CG2 4.18Å; E113-T117 WeakPolarHBondContact O-CB 3.48Å; E113-T117 WeakPolarHBondContact O-CG2 3.22Å; E113-T117 PolarHBondContact O-N 2.87Å; E113-T117 PolarHBondContact O-OG1 3.21Å
118	S	57.9	Low	63.1	Low	39 Å²	39	61.2 Å²	61.2	27%	0.273	36%	0.355	S	S	.	.	S	Bend	trans	-76	149.1	-179.7	-55.3	0	0	0	0	112.3	D114 D120 N121	D114-S118 VanDerWaalsContact O-CB 3.22Å; D114-S118 WeakPolarHBondContact O-CB 3.48Å; D114-S118 PolarHBondContact O-N 2.85Å; D114-S118 VanDerWaalsContact O-N 3.15Å; D114-S118 PolarHBondContact O-OG 3.21Å; S118-D120 PolarHBondContact O-N 3.06Å; S118-N121 WeakPolarHBondContact CB-ND2 3.42Å; S118-N121 WeakPolarHBondContact CB-OD1 3.5Å; S118-N121 PolarHBondContact OG-OD1 3.28Å
119	F	54.5	Low	65	Low	50 Å²	50	59.6 Å²	59.6	22%	0.219	34%	0.337	C	S	.	.	S	Bend	trans	-55.4	-47.6	179.3	-178.7	-95.2	0	0	0	113.2	Y239	F119-Y239 HydrophobicContact CD1-CE2 4.29Å; F119-Y239 HydrophobicContact CD2-CE2 4.18Å; F119-Y239 AromaticContact CD2-CZ 3.83Å; F119-Y239 WeakPolarHBondContact CD2-OH 3.48Å; F119-Y239 AromaticContact CE1-CD2 3.88Å; F119-Y239 HydrophobicContact CE1-CD2 3.88Å; F119-Y239 AromaticContact CE1-CE2 3.65Å; F119-Y239 HydrophobicContact CE1-CE2 3.65Å; F119-Y239 HydrophobicContact CE1-CG 4.48Å; F119-Y239 HydrophobicContact CE2-CD1 4.19Å; F119-Y239 HydrophobicContact CE2-CD2 4.28Å; F119-Y239 AromaticContact CE2-CE1 3.44Å; F119-Y239 HydrophobicContact CE2-CE1 3.44Å; F119-Y239 VanDerWaalsContact CE2-CE1 3.44Å; F119-Y239 AromaticContact CE2-CE2 3.53Å; F119-Y239 HydrophobicContact CE2-CE2 3.53Å; F119-Y239 AromaticContact CE2-CZ 3.06Å; F119-Y239 WeakPolarHBondContact CE2-OH 3.4Å; F119-Y239 AromaticContact CZ-CD1 3.79Å; F119-Y239 HydrophobicContact CZ-CD1 3.79Å; F119-Y239 AromaticContact CZ-CD2 3.56Å; F119-Y239 HydrophobicContact CZ-CD2 3.56Å; F119-Y239 AromaticContact CZ-CE1 3.51Å; F119-Y239 HydrophobicContact CZ-CE1 3.51Å; F119-Y239 AromaticContact CZ-CE2 3.23Å; F119-Y239 HydrophobicContact CZ-CE2 3.23Å; F119-Y239 AromaticContact CZ-CG 3.84Å; F119-Y239 HydrophobicContact CZ-CG 3.84Å; F119-Y239 AromaticContact CZ-CZ 3.23Å
120	D	61.3	Low	67.1	Low	44 Å²	44	55.3 Å²	55.3	24%	0.235	31%	0.307	C	S	.	.			trans	-153.3	149	166.6	-177.5	14.3	0	0	0	107.8	S118 T122 N180	S118-D120 PolarHBondContact O-N 3.06Å; D120-T122 WeakPolarHBondContact OD1-CB 3.38Å; D120-T122 PolarHBondContact OD1-N 3.26Å; D120-T122 PolarHBondContact OD1-OG1 2.88Å; D120-N180 PolarHBondContact O-ND2 3.37Å
121	N	59.5	Low	69	Low	34 Å²	34	51 Å²	51	18%	0.182	28%	0.284	C	S	.	.			trans	-121.2	-2.9	178	-75	-54	0	0	0	113.2	D114 V115 S118 G123 N124	D114-N121 PolarHBondContact O-ND2 3.47Å; V115-N121 VanDerWaalsContact CA-ND2 3.32Å; V115-N121 WeakPolarHBondContact CA-ND2 3.42Å; V115-N121 PolarHBondContact O-ND2 2.85Å; S118-N121 WeakPolarHBondContact CB-ND2 3.42Å; S118-N121 WeakPolarHBondContact CB-OD1 3.5Å; S118-N121 PolarHBondContact OG-OD1 3.28Å; N121-G123 VanDerWaalsContact C-N 3.26Å; N121-G123 PolarHBondContact O-N 3.38Å; N121-N124 WeakPolarHBondContact O-CB 3.43Å; N121-N124 PolarHBondContact O-N 3.18Å; N121-N124 PolarHBondContact OD1-ND2 3.01Å
122	T	59	Low	70.7	Confident	44 Å²	44	48 Å²	48	27%	0.27	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-57.1	-42.3	-176.4	-52.7	0	0	0	0	111.2	D120 N124 W128 F235	D120-T122 WeakPolarHBondContact OD1-CB 3.38Å; D120-T122 PolarHBondContact OD1-N 3.26Å; D120-T122 PolarHBondContact OD1-OG1 2.88Å; T122-N124 VanDerWaalsContact C-N 3.3Å; T122-N124 PolarHBondContact O-N 3.48Å; T122-W128 HydrophobicContact CG2-CH2 4.47Å; T122-W128 HydrophobicContact CG2-CZ2 3.59Å; T122-W128 PolarHBondContact O-NE1 3.14Å; T122-F235 HydrophobicContact CG2-CZ 4.03Å
123	G	58.3	Low	72.3	Confident	21 Å²	21	44.3 Å²	44.3	22%	0.216	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-76.5	-3.6	175.6	0	0	0	0	0	115.9	N121 M157	N121-G123 VanDerWaalsContact C-N 3.26Å; N121-G123 PolarHBondContact O-N 3.38Å; G123-M157 VanDerWaalsContact O-CG 3.23Å; G123-M157 WeakPolarHBondContact O-CG 3.45Å; G123-M157 PolarHBondContact O-N 3.05Å
124	N	61	Low	74.1	Confident	31 Å²	31	38.1 Å²	38.1	17%	0.166	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-96.1	3.3	179.7	-65.8	-30.1	0	0	0	113.5	N121 T122 M157 N180 A183	N121-N124 WeakPolarHBondContact O-CB 3.43Å; N121-N124 PolarHBondContact O-N 3.18Å; N121-N124 PolarHBondContact OD1-ND2 3.01Å; T122-N124 VanDerWaalsContact C-N 3.3Å; T122-N124 PolarHBondContact O-N 3.48Å; N124-M157 VanDerWaalsContact O-SD 3.36Å; N124-N180 PolarHBondContact ND2-ND2 3.07Å; N124-A183 WeakPolarHBondContact OD1-CB 3.46Å
125	V	65.4	Low	75.8	Confident	81 Å²	81	36 Å²	36	49%	0.491	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-49	-173.1	-179.1	0	0	0	0	111.6
126	C	76.1	Confident	77.5	Confident	17 Å²	17	33.3 Å²	33.3	12%	0.115	19%	0.188	C	C	.	.			trans	-167.9	172.5	-179.2	62.8	0	0	0	0	111.2	R63 W128	R63-C126 PolarHBondContact NE-SG 3.11Å; R63-C126 VanDerWaalsContact NH2-CB 3.25Å; R63-C126 PolarHBondContact NH2-SG 3.23Å; R63-C126 VanDerWaalsContact NH2-SG 3.43Å; C126-W128 VanDerWaalsContact O-CD1 3.31Å
127	I	87.9	Confident	79.5	Confident	18 Å²	18	28.1 Å²	28.1	9%	0.092	16%	0.159	C	C	.	.			trans	-69.4	129.1	162.8	-69.8	154.6	0	0	0	108.5	Y91 E131 E132 T158 L160	Y91-I127 HydrophobicContact CD1-CD1 4.3Å; Y91-I127 HydrophobicContact CE1-CD1 3.63Å; Y91-I127 HydrophobicContact CE2-CD1 3.89Å; Y91-I127 WeakPolarHBondContact OH-CD1 3.48Å; I127-E131 HydrophobicContact CG2-CB 4.22Å; I127-E131 HydrophobicContact CG2-CG 4.12Å; I127-E132 HydrophobicContact CG2-CB 4.13Å; I127-T158 HydrophobicContact CD1-CG2 4.14Å; I127-T158 HydrophobicContact CG1-CG2 3.94Å; I127-L160 HydrophobicContact CD1-CD1 4.46Å; I127-L160 HydrophobicContact CD1-CD2 3.86Å; I127-L160 HydrophobicContact CG1-CD2 4.29Å; I127-L160 HydrophobicContact CG2-CD2 3.96Å
128	W	92	Very high	81.7	Confident	46 Å²	46	23.3 Å²	23.3	17%	0.174	13%	0.13	C	C	.	.			trans	-93.9	157.6	179.2	-71	88.3	0	0	0	111.2	T122 C126 S130 E131 E132	T122-W128 HydrophobicContact CG2-CH2 4.47Å; T122-W128 HydrophobicContact CG2-CZ2 3.59Å; T122-W128 PolarHBondContact O-NE1 3.14Å; C126-W128 VanDerWaalsContact O-CD1 3.31Å; W128-S130 PolarHBondContact O-N 3.33Å; W128-S130 VanDerWaalsContact O-N 3.13Å; W128-E131 WeakPolarHBondContact O-CB 3.43Å; W128-E131 PolarHBondContact O-N 3.12Å; W128-E132 PolarHBondContact O-N 2.63Å
129	P	95.1	Very high	83.6	Confident	7 Å²	7	21.7 Å²	21.7	5%	0.045	12%	0.118	C	C	.	.	H	α-helix	trans	-54.4	-35.9	-179.3	-28.6	34.9	0	0	0	114.6	F65 F68 V133	F65-P129 HydrophobicContact CD1-CB 4.47Å; F65-P129 HydrophobicContact CD1-CG 3.87Å; F65-P129 HydrophobicContact CE1-CB 4Å; F65-P129 HydrophobicContact CE1-CG 3.84Å; F68-P129 HydrophobicContact CD2-CB 4.02Å; F68-P129 HydrophobicContact CE2-CB 3.82Å; P129-V133 WeakPolarHBondContact O-CB 3.42Å; P129-V133 WeakPolarHBondContact O-CG2 3.09Å; P129-V133 PolarHBondContact O-N 3.3Å
130	S	97.9	Very high	85.6	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.014	13%	0.126	C	C	.	.	H	α-helix	trans	-66	-39.5	176.4	-48	0	0	0	0	112.6	W128 L134 P262	W128-S130 PolarHBondContact O-N 3.33Å; W128-S130 VanDerWaalsContact O-N 3.13Å; S130-L134 WeakPolarHBondContact O-CB 3.23Å; S130-L134 PolarHBondContact O-N 3.13Å; S130-P262 WeakPolarHBondContact OG-CD 3.29Å
131	E	98.3	Very high	87.4	Confident	11 Å²	11	23.9 Å²	23.9	5%	0.051	13%	0.126	C	C	.	.	H	α-helix	trans	-69	-43.4	178.5	179.7	61.9	-162.1	0	0	110.2	I127 W128 V133 L134 A135 L160 A161 A231	I127-E131 HydrophobicContact CG2-CB 4.22Å; I127-E131 HydrophobicContact CG2-CG 4.12Å; W128-E131 WeakPolarHBondContact O-CB 3.43Å; W128-E131 PolarHBondContact O-N 3.12Å; E131-V133 PolarHBondContact O-N 3.07Å; E131-L134 PolarHBondContact O-N 3.48Å; E131-A135 VanDerWaalsContact O-CB 3.22Å; E131-A135 WeakPolarHBondContact O-CB 3.49Å; E131-A135 PolarHBondContact O-N 2.93Å; E131-L160 HydrophobicContact CG-CB 4.1Å; E131-L160 WeakPolarHBondContact OE1-CA 3.29Å; E131-L160 WeakPolarHBondContact OE1-CB 3.5Å; E131-L160 PolarHBondContact OE1-N 2.86Å; E131-A161 PolarHBondContact OE1-N 2.85Å; E131-A231 HydrophobicContact CB-CB 4.08Å; E131-A231 WeakPolarHBondContact OE2-CB 3.36Å
132	E	98.2	Very high	89.2	Confident	7 Å²	7	23.6 Å²	23.6	3%	0.033	13%	0.126	C	C	.	.	H	α-helix	trans	-58.5	-47	173.6	-169.4	-165.4	179.8	0	0	112	S67 F68 N69 L70 F71 I127 W128 A135 Y136	S67-E132 WeakPolarHBondContact CA-OE2 3.12Å; S67-E132 WeakPolarHBondContact CB-OE2 3.36Å; S67-E132 PolarHBondContact OG-OE1 2.85Å; S67-E132 PolarHBondContact OG-OE2 3.18Å; F68-E132 PolarHBondContact N-OE2 3.17Å; N69-E132 PolarHBondContact N-OE1 2.91Å; N69-E132 VanDerWaalsContact N-OE1 3.12Å; L70-E132 HydrophobicContact CB-CG 4.19Å; L70-E132 WeakPolarHBondContact CB-OE1 3.28Å; L70-E132 HydrophobicContact CD1-CG 4.14Å; L70-E132 HydrophobicContact CG-CG 4.37Å; L70-E132 PolarHBondContact N-OE1 2.95Å; F71-E132 HydrophobicContact CD2-CG 3.83Å; F71-E132 HydrophobicContact CE2-CG 4.12Å; I127-E132 HydrophobicContact CG2-CB 4.13Å; W128-E132 PolarHBondContact O-N 2.63Å; E132-A135 PolarHBondContact O-N 3.32Å; E132-Y136 WeakPolarHBondContact O-CB 3.45Å; E132-Y136 PolarHBondContact O-N 3.39Å
133	V	98.8	Very high	91.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-68.8	-41.3	-179.9	172.4	0	0	0	0	111.5	F68 L70 P129 E131 Y136 Y137 F260 Y288 I292 P314	F68-V133 HydrophobicContact CD2-CG2 3.62Å; F68-V133 HydrophobicContact CE2-CG2 3.9Å; F68-V133 HydrophobicContact CG-CG2 4.25Å; L70-V133 HydrophobicContact CD1-CG2 3.91Å; P129-V133 WeakPolarHBondContact O-CB 3.42Å; P129-V133 WeakPolarHBondContact O-CG2 3.09Å; P129-V133 PolarHBondContact O-N 3.3Å; E131-V133 PolarHBondContact O-N 3.07Å; V133-Y136 PolarHBondContact O-N 2.91Å; V133-Y137 VanDerWaalsContact O-CB 3.29Å; V133-Y137 WeakPolarHBondContact O-CB 3.31Å; V133-Y137 PolarHBondContact O-N 3.43Å; V133-F260 HydrophobicContact CG1-CD1 3.82Å; V133-F260 HydrophobicContact CG1-CE1 3.77Å; V133-Y288 HydrophobicContact CG1-CE2 3.76Å; V133-I292 HydrophobicContact CG1-CG1 4.44Å; V133-I292 HydrophobicContact CG2-CD1 4.2Å; V133-P314 HydrophobicContact CB-CG 3.79Å; V133-P314 HydrophobicContact CG1-CG 3.93Å; V133-P314 HydrophobicContact CG2-CG 3.78Å
134	L	98.8	Very high	93	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.7	-46.2	174.4	171.9	60.5	0	0	0	110.5	S130 E131 Y136 Y137 C138 A161 M229 A231 M258 F260	S130-L134 WeakPolarHBondContact O-CB 3.23Å; S130-L134 PolarHBondContact O-N 3.13Å; E131-L134 PolarHBondContact O-N 3.48Å; L134-Y136 PolarHBondContact O-N 3.37Å; L134-Y137 PolarHBondContact O-N 3.09Å; L134-C138 PolarHBondContact O-N 3.23Å; L134-C138 PolarHBondContact O-SG 3.04Å; L134-A161 HydrophobicContact CB-CB 4.31Å; L134-A161 HydrophobicContact CD2-CB 3.51Å; L134-A161 HydrophobicContact CG-CB 3.5Å; L134-M229 HydrophobicContact CD1-CB 4.42Å; L134-M229 HydrophobicContact CD1-SD 4.32Å; L134-M229 HydrophobicContact CD2-CB 4.25Å; L134-M229 HydrophobicContact CD2-CG 4.33Å; L134-M229 HydrophobicContact CD2-SD 4.37Å; L134-A231 HydrophobicContact CB-CB 4.4Å; L134-A231 HydrophobicContact CD2-CB 4Å; L134-M258 HydrophobicContact CD1-CE 4.49Å; L134-F260 HydrophobicContact CB-CB 4.15Å; L134-F260 HydrophobicContact CB-CD2 3.81Å; L134-F260 HydrophobicContact CB-CE2 4.38Å; L134-F260 HydrophobicContact CB-CG 4.04Å; L134-F260 HydrophobicContact CD1-CD2 3.46Å; L134-F260 VanDerWaalsContact CD1-CD2 3.46Å; L134-F260 HydrophobicContact CD1-CE2 3.61Å; L134-F260 HydrophobicContact CG-CD2 4.11Å
135	A	98.8	Very high	94.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.5	-45.8	177.1	0	0	0	0	0	112.5	F71 E131 E132 C138 L139 L160 A161 M164	F71-A135 HydrophobicContact CE2-CB 4.19Å; F71-A135 HydrophobicContact CZ-CB 4.05Å; E131-A135 VanDerWaalsContact O-CB 3.22Å; E131-A135 WeakPolarHBondContact O-CB 3.49Å; E131-A135 PolarHBondContact O-N 2.93Å; E132-A135 PolarHBondContact O-N 3.32Å; A135-C138 PolarHBondContact O-N 3.42Å; A135-L139 PolarHBondContact O-N 2.98Å; A135-L160 HydrophobicContact CB-CB 4.36Å; A135-L160 HydrophobicContact CB-CD2 3.79Å; A135-L160 HydrophobicContact CB-CG 3.74Å; A135-A161 HydrophobicContact CB-CB 4.43Å; A135-M164 HydrophobicContact CB-CB 4.42Å; A135-M164 HydrophobicContact CB-CG 3.72Å
136	Y	98.7	Very high	96.3	Very high	7 Å²	7	32.4 Å²	32.4	3%	0.027	15%	0.15	C	C	.	.	H	α-helix	trans	-59.7	-46.1	173.2	169.3	-105.4	0	0	0	112.3	L70 F95 E132 V133 L134 C138 L139 K140 H291 I292	L70-Y136 HydrophobicContact CB-CD2 4.32Å; L70-Y136 HydrophobicContact CB-CG 4.33Å; L70-Y136 HydrophobicContact CD1-CD1 4.06Å; L70-Y136 HydrophobicContact CD1-CG 3.8Å; L70-Y136 HydrophobicContact CD2-CG 4.46Å; L70-Y136 HydrophobicContact CG-CG 4.41Å; F95-Y136 HydrophobicContact CB-CE2 4Å; F95-Y136 HydrophobicContact CD2-CD2 4.01Å; F95-Y136 AromaticContact CD2-CE2 3.31Å; F95-Y136 HydrophobicContact CD2-CE2 3.31Å; F95-Y136 AromaticContact CE2-CE2 3.95Å; F95-Y136 HydrophobicContact CE2-CE2 3.95Å; F95-Y136 AromaticContact CG-CE2 3.81Å; F95-Y136 HydrophobicContact CG-CE2 3.81Å; E132-Y136 WeakPolarHBondContact O-CB 3.45Å; E132-Y136 PolarHBondContact O-N 3.39Å; V133-Y136 PolarHBondContact O-N 2.91Å; L134-Y136 PolarHBondContact O-N 3.37Å; Y136-C138 VanDerWaalsContact C-N 3.31Å; Y136-C138 PolarHBondContact O-N 3.41Å; Y136-L139 WeakPolarHBondContact O-CB 3.49Å; Y136-L139 PolarHBondContact O-N 3.35Å; Y136-K140 HydrophobicContact CE1-CD 4.43Å; Y136-K140 PolarHBondContact O-N 3.27Å; Y136-H291 PolarHBondContact OH-ND1 3.21Å; Y136-I292 HydrophobicContact CD1-CD1 4.1Å; Y136-I292 HydrophobicContact CD1-CG1 4.23Å; Y136-I292 HydrophobicContact CE1-CD1 4.22Å; Y136-I292 HydrophobicContact CE1-CG1 4.12Å
137	Y	98.7	Very high	97.4	Very high	30 Å²	30	34.8 Å²	34.8	12%	0.118	17%	0.171	C	C	.	.	H	α-helix	trans	-61.6	-41	179.1	-170.8	-87.2	0	0	0	111.2	V133 L134 L139 K140 H141 M258 F260 Y288 L316	V133-Y137 VanDerWaalsContact O-CB 3.29Å; V133-Y137 WeakPolarHBondContact O-CB 3.31Å; V133-Y137 PolarHBondContact O-N 3.43Å; L134-Y137 PolarHBondContact O-N 3.09Å; Y137-L139 VanDerWaalsContact C-N 3.35Å; Y137-L139 PolarHBondContact O-N 3.25Å; Y137-K140 PolarHBondContact O-N 2.97Å; Y137-H141 AromaticContact CD1-CD2 3.8Å; Y137-H141 AromaticContact CD2-CD2 3.67Å; Y137-H141 AromaticContact CD2-NE2 3.96Å; Y137-H141 HydrophobicContact CE1-CB 4.3Å; Y137-H141 AromaticContact CE1-CD2 3.58Å; Y137-H141 AromaticContact CE2-CD2 3.46Å; Y137-H141 VanDerWaalsContact CE2-CD2 3.46Å; Y137-H141 WeakPolarHBondContact CE2-CD2 3.46Å; Y137-H141 AromaticContact CE2-NE2 3.49Å; Y137-H141 WeakPolarHBondContact CE2-NE2 3.44Å; Y137-H141 AromaticContact CG-CD2 3.85Å; Y137-H141 AromaticContact CZ-CD2 3.41Å; Y137-H141 VanDerWaalsContact CZ-CD2 3.41Å; Y137-H141 AromaticContact CZ-NE2 3.72Å; Y137-H141 WeakPolarHBondContact O-CB 3.44Å; Y137-H141 PolarHBondContact O-CD2 2.82Å; Y137-H141 PolarHBondContact O-N 2.95Å; Y137-M258 HydrophobicContact CD1-CE 3.51Å; Y137-M258 HydrophobicContact CE1-CE 3.44Å; Y137-M258 VanDerWaalsContact CE1-CE 3.44Å; Y137-F260 HydrophobicContact CD1-CE2 4.17Å; Y137-F260 AromaticContact CD1-CZ 3.99Å; Y137-F260 HydrophobicContact CD1-CZ 3.99Å; Y137-F260 AromaticContact CD2-CZ 3.82Å; Y137-F260 HydrophobicContact CD2-CZ 3.82Å; Y137-F260 HydrophobicContact CE2-CZ 4.38Å; Y137-F260 HydrophobicContact CG-CE2 4.16Å; Y137-F260 AromaticContact CG-CZ 3.59Å; Y137-F260 HydrophobicContact CG-CZ 3.59Å; Y137-Y288 HydrophobicContact CD2-CD2 4.14Å; Y137-Y288 HydrophobicContact CE2-CD2 4.32Å; Y137-L316 HydrophobicContact CE2-CD2 4.18Å
138	C	98.7	Very high	97.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60	-41.6	175.6	-73.1	0	0	0	0	112.5	L134 A135 Y136 H141 S142 F145 M164 V165	L134-C138 PolarHBondContact O-N 3.23Å; L134-C138 PolarHBondContact O-SG 3.04Å; A135-C138 PolarHBondContact O-N 3.42Å; Y136-C138 VanDerWaalsContact C-N 3.31Å; Y136-C138 PolarHBondContact O-N 3.41Å; C138-H141 CarbonylContact O-C 3.51Å; C138-S142 VanDerWaalsContact O-CA 3.28Å; C138-S142 WeakPolarHBondContact O-CA 3.34Å; C138-S142 PolarHBondContact O-N 3.49Å; C138-F145 HydrophobicContact CB-CE2 4.03Å; C138-F145 HydrophobicContact CB-CZ 4.28Å; C138-M164 HydrophobicContact CB-CB 4.48Å; C138-V165 HydrophobicContact CB-CG2 3.76Å
139	L	97.9	Very high	98.3	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.026	17%	0.168	C	C	.	.	H	α-helix	trans	-62.5	-49.8	174.8	-68.1	-179.1	0	0	0	111.6	F71 Y99 A135 Y136 Y137 H141 S142 M164 S168	F71-L139 HydrophobicContact CE1-CD1 3.86Å; F71-L139 HydrophobicContact CZ-CD1 4.02Å; Y99-L139 HydrophobicContact CD2-CD1 4.44Å; Y99-L139 HydrophobicContact CD2-CD2 3.78Å; Y99-L139 HydrophobicContact CG-CD2 3.83Å; A135-L139 PolarHBondContact O-N 2.98Å; Y136-L139 WeakPolarHBondContact O-CB 3.49Å; Y136-L139 PolarHBondContact O-N 3.35Å; Y137-L139 VanDerWaalsContact C-N 3.35Å; Y137-L139 PolarHBondContact O-N 3.25Å; L139-H141 PolarHBondContact O-N 3.25Å; L139-S142 WeakPolarHBondContact O-CB 3.46Å; L139-S142 PolarHBondContact O-N 3.31Å; L139-M164 HydrophobicContact CD1-CG 4.3Å; L139-M164 HydrophobicContact CD1-SD 3.72Å; L139-M164 HydrophobicContact CD2-CB 3.78Å; L139-M164 HydrophobicContact CD2-CG 4.12Å; L139-M164 HydrophobicContact CD2-SD 3.73Å; L139-M164 HydrophobicContact CG-CB 3.94Å; L139-M164 HydrophobicContact CG-CG 4Å; L139-M164 HydrophobicContact CG-SD 3.89Å; L139-S168 VanDerWaalsContact CD2-CB 3.49Å
140	K	97.7	Very high	98.4	Very high	90 Å²	90	33.3 Å²	33.3	39%	0.391	17%	0.166	S	C	.	.	H	α-helix	trans	-63.2	-32.1	-176.6	-168.7	177.5	-177.2	171.4	0	112.5	Y136 Y137 D289	Y136-K140 HydrophobicContact CE1-CD 4.43Å; Y136-K140 PolarHBondContact O-N 3.27Å; Y137-K140 PolarHBondContact O-N 2.97Å; K140-D289 VanDerWaalsContact CD-OD2 3.25Å; K140-D289 WeakPolarHBondContact CD-OD2 3.24Å; K140-D289 WeakPolarHBondContact CE-OD2 3.43Å; K140-D289 IonicContact NZ-OD2 2.7Å; K140-D289 PolarHBondContact NZ-OD2 2.84Å
141	H	98.1	Very high	98.5	Very high	51 Å²	51	33.2 Å²	33.2	24%	0.236	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	29.4	-178.3	-62	-76.4	0	0	0	112.6	Y137 C138 L139 N143 I144	Y137-H141 AromaticContact CD1-CD2 3.8Å; Y137-H141 AromaticContact CD2-CD2 3.67Å; Y137-H141 AromaticContact CD2-NE2 3.96Å; Y137-H141 HydrophobicContact CE1-CB 4.3Å; Y137-H141 AromaticContact CE1-CD2 3.58Å; Y137-H141 AromaticContact CE2-CD2 3.46Å; Y137-H141 VanDerWaalsContact CE2-CD2 3.46Å; Y137-H141 WeakPolarHBondContact CE2-CD2 3.46Å; Y137-H141 AromaticContact CE2-NE2 3.49Å; Y137-H141 WeakPolarHBondContact CE2-NE2 3.44Å; Y137-H141 AromaticContact CG-CD2 3.85Å; Y137-H141 AromaticContact CZ-CD2 3.41Å; Y137-H141 VanDerWaalsContact CZ-CD2 3.41Å; Y137-H141 AromaticContact CZ-NE2 3.72Å; Y137-H141 WeakPolarHBondContact O-CB 3.44Å; Y137-H141 PolarHBondContact O-CD2 2.82Å; Y137-H141 PolarHBondContact O-N 2.95Å; C138-H141 CarbonylContact O-C 3.51Å; L139-H141 PolarHBondContact O-N 3.25Å; H141-N143 PolarHBondContact O-N 3.45Å; H141-N143 PolarHBondContact O-OD1 2.93Å; H141-I144 HydrophobicContact CB-CD1 4.09Å; H141-I144 HydrophobicContact CB-CG2 4.26Å; H141-I144 VanDerWaalsContact O-CG1 3.22Å; H141-I144 WeakPolarHBondContact O-CG1 3.44Å; H141-I144 WeakPolarHBondContact O-CG2 3.13Å; H141-I144 PolarHBondContact O-N 3.46Å
142	S	98	Very high	98.5	Very high	27 Å²	27	32.7 Å²	32.7	19%	0.189	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-53.6	-29.2	-173.7	59.4	0	0	0	0	114.2	C138 L139 I144 F145 A169	C138-S142 VanDerWaalsContact O-CA 3.28Å; C138-S142 WeakPolarHBondContact O-CA 3.34Å; C138-S142 PolarHBondContact O-N 3.49Å; L139-S142 WeakPolarHBondContact O-CB 3.46Å; L139-S142 PolarHBondContact O-N 3.31Å; S142-I144 PolarHBondContact O-N 2.89Å; S142-F145 PolarHBondContact O-N 3.03Å; S142-A169 VanDerWaalsContact O-CB 3.25Å; S142-A169 WeakPolarHBondContact O-CB 3.18Å
143	N	98.1	Very high	98.5	Very high	118 Å²	118	32.4 Å²	32.4	63%	0.631	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-60.5	-24.4	177.4	66.1	-60.5	0	0	0	114.1	H141 F145 R146	H141-N143 PolarHBondContact O-N 3.45Å; H141-N143 PolarHBondContact O-OD1 2.93Å; N143-F145 PolarHBondContact O-N 3.5Å; N143-R146 PolarHBondContact O-N 3.23Å
144	I	98.1	Very high	98.5	Very high	63 Å²	63	33.1 Å²	33.1	32%	0.323	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-70.8	-20.3	179.7	77.9	-171.6	0	0	0	112.6	H141 S142 L148 M258	H141-I144 HydrophobicContact CB-CD1 4.09Å; H141-I144 HydrophobicContact CB-CG2 4.26Å; H141-I144 VanDerWaalsContact O-CG1 3.22Å; H141-I144 WeakPolarHBondContact O-CG1 3.44Å; H141-I144 WeakPolarHBondContact O-CG2 3.13Å; H141-I144 PolarHBondContact O-N 3.46Å; S142-I144 PolarHBondContact O-N 2.89Å; I144-L148 WeakPolarHBondContact O-CD1 3.36Å; I144-M258 HydrophobicContact CD1-CE 4.23Å; I144-M258 HydrophobicContact CD1-SD 3.89Å
145	F	98.8	Very high	98.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-93.9	2.9	-177.4	-54	-73	0	0	0	113.4	C138 S142 N143 A147 L148 V150 V165 A169 V171 I227 M229 M258	C138-F145 HydrophobicContact CB-CE2 4.03Å; C138-F145 HydrophobicContact CB-CZ 4.28Å; S142-F145 PolarHBondContact O-N 3.03Å; N143-F145 PolarHBondContact O-N 3.5Å; F145-A147 PolarHBondContact O-N 2.78Å; F145-L148 WeakPolarHBondContact O-CB 3.31Å; F145-L148 PolarHBondContact O-N 2.58Å; F145-L148 VanDerWaalsContact O-N 3.11Å; F145-V150 HydrophobicContact CB-CG2 4.43Å; F145-V150 HydrophobicContact CD1-CG1 4.5Å; F145-V150 HydrophobicContact CD1-CG2 3.76Å; F145-V150 HydrophobicContact CG-CG2 4.49Å; F145-V165 HydrophobicContact CB-CG1 3.92Å; F145-V165 HydrophobicContact CD1-CG1 4.19Å; F145-V165 HydrophobicContact CD1-CG2 4.31Å; F145-V165 HydrophobicContact CD2-CG1 4.12Å; F145-V165 HydrophobicContact CD2-CG2 4.02Å; F145-V165 HydrophobicContact CE1-CG2 4.15Å; F145-V165 HydrophobicContact CE2-CG2 3.85Å; F145-V165 HydrophobicContact CG-CG1 3.81Å; F145-V165 HydrophobicContact CG-CG2 4.24Å; F145-V165 HydrophobicContact CZ-CG2 3.91Å; F145-A169 HydrophobicContact CB-CB 3.75Å; F145-A169 HydrophobicContact CD2-CB 4.35Å; F145-V171 HydrophobicContact CB-CB 4.48Å; F145-V171 HydrophobicContact CB-CG2 4.36Å; F145-V171 WeakPolarHBondContact O-CA 3.33Å; F145-I227 HydrophobicContact CD1-CD1 3.79Å; F145-I227 HydrophobicContact CE1-CD1 3.82Å; F145-I227 HydrophobicContact CE1-CG2 4.25Å; F145-M229 HydrophobicContact CD1-CE 4.29Å; F145-M229 HydrophobicContact CE1-CE 3.33Å; F145-M229 HydrophobicContact CZ-CE 3.7Å; F145-M258 HydrophobicContact CE1-SD 4.25Å; F145-M258 HydrophobicContact CZ-CE 4.47Å; F145-M258 HydrophobicContact CZ-SD 4.18Å
146	R	98.6	Very high	98.1	Very high	182 Å²	182	33.5 Å²	33.5	69%	0.687	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	124.6	-176.7	-178.7	176.5	179.9	179	1.7	111.2	N143 L148 D170	N143-R146 PolarHBondContact O-N 3.23Å; R146-L148 WeakPolarHBondContact O-CG 3.48Å; R146-L148 PolarHBondContact O-N 2.77Å; R146-D170 WeakPolarHBondContact CA-O 3.34Å; R146-D170 HydrophobicContact CG-CB 4.42Å
147	A	98.6	Very high	97.8	Very high	66 Å²	66	33.5 Å²	33.5	55%	0.545	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	18.8	-179.8	0	0	0	0	0	115.2	F145 D170 K172	F145-A147 PolarHBondContact O-N 2.78Å; A147-D170 PolarHBondContact N-O 3.41Å; A147-K172 WeakPolarHBondContact O-CB 3.46Å
148	L	98.8	Very high	97.6	Very high	41 Å²	41	32.2 Å²	32.2	22%	0.215	17%	0.169	C	C	.	.			trans	-97.5	152.7	-179.4	-59.6	-166	0	0	0	112.6	I144 F145 R146 V150 V171 K172 E173 D226 I227	I144-L148 WeakPolarHBondContact O-CD1 3.36Å; F145-L148 WeakPolarHBondContact O-CB 3.31Å; F145-L148 PolarHBondContact O-N 2.58Å; F145-L148 VanDerWaalsContact O-N 3.11Å; R146-L148 WeakPolarHBondContact O-CG 3.48Å; R146-L148 PolarHBondContact O-N 2.77Å; L148-V150 HydrophobicContact CB-CG2 4.34Å; L148-V171 WeakPolarHBondContact O-CG2 3.2Å; L148-K172 WeakPolarHBondContact O-CB 3.27Å; L148-K172 PolarHBondContact O-N 2.93Å; L148-E173 PolarHBondContact O-N 2.89Å; L148-D226 WeakPolarHBondContact CA-OD2 3.49Å; L148-D226 HydrophobicContact CB-CB 3.9Å; L148-D226 HydrophobicContact CD1-CB 4.08Å; L148-D226 HydrophobicContact CD2-CB 3.96Å; L148-D226 HydrophobicContact CG-CB 4.19Å; L148-I227 HydrophobicContact CD1-CD1 3.66Å; L148-I227 HydrophobicContact CD1-CG1 4.03Å
149	A	98.9	Very high	97.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.4	163.2	0	0	0	0	0	109.9	E173 F225 D226 I227	A149-E173 HydrophobicContact CB-CG 3.41Å; A149-E173 VanDerWaalsContact CB-CG 3.41Å; A149-F225 HydrophobicContact CB-CD1 4.12Å; A149-D226 PolarHBondContact N-OD2 2.94Å; A149-D226 PolarHBondContact O-N 2.78Å; A149-I227 PolarHBondContact O-N 2.96Å
150	V	98.9	Very high	97.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.3	-173.9	-175.4	0	0	0	0	110.2	F145 L148 V165 V171 E173 V174 L175 I227 M229	F145-V150 HydrophobicContact CB-CG2 4.43Å; F145-V150 HydrophobicContact CD1-CG1 4.5Å; F145-V150 HydrophobicContact CD1-CG2 3.76Å; F145-V150 HydrophobicContact CG-CG2 4.49Å; L148-V150 HydrophobicContact CB-CG2 4.34Å; V150-V165 HydrophobicContact CG2-CG1 4.34Å; V150-V171 HydrophobicContact CG2-CG2 3.76Å; V150-E173 PolarHBondContact N-O 3.49Å; V150-V174 CarbonylContact O-C 3.48Å; V150-V174 WeakPolarHBondContact O-CA 3.32Å; V150-L175 PolarHBondContact O-N 2.9Å; V150-I227 CarbonylContact C-O 3.5Å; V150-I227 WeakPolarHBondContact CA-O 3.4Å; V150-I227 HydrophobicContact CG2-CB 4.47Å; V150-M229 HydrophobicContact CG1-CE 3.48Å; V150-M229 VanDerWaalsContact CG1-CE 3.48Å; V150-M229 HydrophobicContact CG1-SD 4.35Å
151	C	98.9	Very high	97.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	133	171.9	-178.6	0	0	0	0	110.2	L175 F225 I227 V228 M229	C151-L175 WeakPolarHBondContact CA-O 3.39Å; C151-F225 HydrophobicContact CB-CB 4.36Å; C151-F225 HydrophobicContact CB-CD1 3.55Å; C151-F225 HydrophobicContact CB-CD2 3.65Å; C151-F225 HydrophobicContact CB-CE1 3.61Å; C151-F225 HydrophobicContact CB-CE2 3.71Å; C151-F225 HydrophobicContact CB-CG 3.56Å; C151-F225 HydrophobicContact CB-CZ 3.7Å; C151-I227 PolarHBondContact N-O 2.89Å; C151-V228 HydrophobicContact CB-CG2 4.22Å; C151-V228 CarbonylContact O-C 3.5Å; C151-V228 WeakPolarHBondContact O-CA 3.21Å; C151-M229 PolarHBondContact O-N 3.36Å
152	E	98.9	Very high	97.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	123	166.5	-173.3	179.9	175.3	0	0	109.7	G155 C159 G162 L175 L176 T177 M229	E152-G155 WeakPolarHBondContact OE1-CA 3.24Å; E152-C159 WeakPolarHBondContact OE1-CA 3.31Å; E152-C159 WeakPolarHBondContact OE2-CA 3.43Å; E152-C159 VanDerWaalsContact OE2-CB 3.3Å; E152-C159 WeakPolarHBondContact OE2-CB 3.38Å; E152-G162 VanDerWaalsContact OE2-CA 3.3Å; E152-G162 WeakPolarHBondContact OE2-CA 3.29Å; E152-G162 PolarHBondContact OE2-N 3.27Å; E152-L175 PolarHBondContact N-O 3.49Å; E152-L176 HydrophobicContact CB-CD2 4.3Å; E152-T177 WeakPolarHBondContact O-CA 3.48Å; E152-T177 WeakPolarHBondContact O-CB 3.16Å; E152-T177 PolarHBondContact O-N 3.09Å; E152-T177 PolarHBondContact O-OG1 2.95Å; E152-M229 CarbonylContact C-O 3.49Å; E152-M229 WeakPolarHBondContact CA-O 3.3Å; E152-M229 HydrophobicContact CB-CG 4.17Å; E152-M229 HydrophobicContact CG-CG 4.26Å
153	L	98.8	Very high	97.7	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	-99.8	131.7	176.2	-69.5	-179.3	0	0	0	110.7	G155 T177 L210 V228 M229 C230 L243 I247 L250	L153-G155 VanDerWaalsContact C-N 3.3Å; L153-G155 PolarHBondContact O-N 3.42Å; L153-T177 WeakPolarHBondContact CA-OG1 3.49Å; L153-T177 WeakPolarHBondContact CD2-OG1 3.48Å; L153-L210 HydrophobicContact CD2-CD1 3.92Å; L153-L210 HydrophobicContact CD2-CD2 3.85Å; L153-L210 HydrophobicContact CD2-CG 4.44Å; L153-V228 HydrophobicContact CD1-CG1 3.58Å; L153-V228 HydrophobicContact CG-CG1 3.82Å; L153-M229 PolarHBondContact N-O 2.95Å; L153-C230 HydrophobicContact CB-CB 4.13Å; L153-C230 WeakPolarHBondContact O-CB 3.39Å; L153-L243 HydrophobicContact CD1-CD1 4.04Å; L153-I247 HydrophobicContact CD1-CG1 3.76Å; L153-L250 HydrophobicContact CD1-CD1 4.05Å; L153-L250 HydrophobicContact CD2-CD1 3.7Å; L153-L250 HydrophobicContact CG-CD1 4.28Å
154	G	97.3	Very high	97.8	Very high	15 Å²	15	18.4 Å²	18.4	16%	0.155	10%	0.099	C	C	.	.	S	Bend	trans	64.8	34.1	173	0	0	0	0	0	113.2	G156 T177 D178	G154-G156 PolarHBondContact O-N 3.31Å; G154-G156 VanDerWaalsContact O-N 3.1Å; G154-T177 PolarHBondContact N-O 3.25Å; G154-D178 VanDerWaalsContact C-OD2 3.26Å; G154-D178 VanDerWaalsContact CA-OD2 3.32Å; G154-D178 WeakPolarHBondContact CA-OD2 3.46Å
155	G	96.8	Very high	97.8	Very high	6 Å²	6	15.4 Å²	15.4	6%	0.062	8%	0.083	C	C	.	.			trans	-72.5	3.9	-178.1	0	0	0	0	0	113.8	E152 L153 C159 T177	E152-G155 WeakPolarHBondContact OE1-CA 3.24Å; L153-G155 VanDerWaalsContact C-N 3.3Å; L153-G155 PolarHBondContact O-N 3.42Å; G155-C159 VanDerWaalsContact CA-SG 3.59Å; G155-C159 WeakPolarHBondContact O-CA 3.23Å; G155-C159 PolarHBondContact O-N 2.7Å; G155-T177 PolarHBondContact N-O 3.13Å; G155-T177 VanDerWaalsContact N-O 3.14Å
156	G	93.6	Very high	97.8	Very high	3 Å²	3	15.4 Å²	15.4	3%	0.031	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	-151	-178.3	0	0	0	0	0	112.2	G154 T158 D178	G154-G156 PolarHBondContact O-N 3.31Å; G154-G156 VanDerWaalsContact O-N 3.1Å; G156-T158 PolarHBondContact O-N 3.5Å; G156-D178 WeakPolarHBondContact CA-OD2 3.08Å; G156-D178 PolarHBondContact N-OD2 3.16Å
157	M	91.3	Very high	97.8	Very high	6 Å²	6	7 Å²	7	3%	0.03	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-7.5	-176.2	71	-168.8	-67.2	0	0	114.5	N106 G123 N124 A183 N186 V187	N106-M157 HydrophobicContact CB-CE 3.35Å; G123-M157 VanDerWaalsContact O-CG 3.23Å; G123-M157 WeakPolarHBondContact O-CG 3.45Å; G123-M157 PolarHBondContact O-N 3.05Å; N124-M157 VanDerWaalsContact O-SD 3.36Å; M157-A183 HydrophobicContact CB-CB 4.38Å; M157-N186 PolarHBondContact O-ND2 2.78Å; M157-V187 WeakPolarHBondContact O-CG2 3.21Å
158	T	95.4	Very high	97.8	Very high	4 Å²	4	4 Å²	4	3%	0.025	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-42.1	-174.7	61.6	0	0	0	0	113.1	I103 I127 G156 L160 L163	I103-T158 HydrophobicContact CG2-CG2 3.58Å; I127-T158 HydrophobicContact CD1-CG2 4.14Å; I127-T158 HydrophobicContact CG1-CG2 3.94Å; G156-T158 PolarHBondContact O-N 3.5Å; T158-L160 VanDerWaalsContact C-N 3.27Å; T158-L160 PolarHBondContact O-N 2.66Å; T158-L163 WeakPolarHBondContact O-CD1 3.45Å
159	C	98	Very high	97.8	Very high	0 Å²	0	2.1 Å²	2.1	0%	0	2%	0.018	C	C	.	.			trans	49.2	52.6	-168	-61.9	0	0	0	0	110.7	E152 G155 A161 L163 L176 V187	E152-C159 WeakPolarHBondContact OE1-CA 3.31Å; E152-C159 WeakPolarHBondContact OE2-CA 3.43Å; E152-C159 VanDerWaalsContact OE2-CB 3.3Å; E152-C159 WeakPolarHBondContact OE2-CB 3.38Å; G155-C159 VanDerWaalsContact CA-SG 3.59Å; G155-C159 WeakPolarHBondContact O-CA 3.23Å; G155-C159 PolarHBondContact O-N 2.7Å; C159-A161 VanDerWaalsContact C-N 3.28Å; C159-A161 PolarHBondContact O-N 3.3Å; C159-L163 VanDerWaalsContact O-CG 3.29Å; C159-L163 WeakPolarHBondContact O-CG 3.37Å; C159-L163 PolarHBondContact O-N 2.99Å; C159-L163 VanDerWaalsContact O-N 3.13Å; C159-L176 HydrophobicContact CB-CB 3.72Å; C159-L176 HydrophobicContact CB-CD1 3.87Å; C159-L176 HydrophobicContact CB-CD2 4.01Å; C159-L176 HydrophobicContact CB-CG 4.07Å; C159-V187 HydrophobicContact CB-CG1 4.24Å; C159-V187 HydrophobicContact CB-CG2 4.31Å
160	L	98.4	Very high	97.8	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-65.5	-37.9	-168.5	-178.9	69.4	0	0	0	110	I101 I103 I127 E131 A135 T158 L163 M164	I101-L160 HydrophobicContact CG2-CD1 4.11Å; I103-L160 HydrophobicContact CD1-CD1 4.02Å; I103-L160 HydrophobicContact CG1-CD1 4.22Å; I127-L160 HydrophobicContact CD1-CD1 4.46Å; I127-L160 HydrophobicContact CD1-CD2 3.86Å; I127-L160 HydrophobicContact CG1-CD2 4.29Å; I127-L160 HydrophobicContact CG2-CD2 3.96Å; E131-L160 HydrophobicContact CG-CB 4.1Å; E131-L160 WeakPolarHBondContact OE1-CA 3.29Å; E131-L160 WeakPolarHBondContact OE1-CB 3.5Å; E131-L160 PolarHBondContact OE1-N 2.86Å; A135-L160 HydrophobicContact CB-CB 4.36Å; A135-L160 HydrophobicContact CB-CD2 3.79Å; A135-L160 HydrophobicContact CB-CG 3.74Å; T158-L160 VanDerWaalsContact C-N 3.27Å; T158-L160 PolarHBondContact O-N 2.66Å; L160-L163 PolarHBondContact O-N 2.79Å; L160-M164 HydrophobicContact CD1-CE 3.77Å; L160-M164 WeakPolarHBondContact O-CG 3.42Å; L160-M164 PolarHBondContact O-N 3.05Å
161	A	98.8	Very high	97.8	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-60.1	-49.6	-180	0	0	0	0	0	113	E131 L134 A135 C159 M164 V165 M229	E131-A161 PolarHBondContact OE1-N 2.85Å; L134-A161 HydrophobicContact CB-CB 4.31Å; L134-A161 HydrophobicContact CD2-CB 3.51Å; L134-A161 HydrophobicContact CG-CB 3.5Å; A135-A161 HydrophobicContact CB-CB 4.43Å; C159-A161 VanDerWaalsContact C-N 3.28Å; C159-A161 PolarHBondContact O-N 3.3Å; A161-M164 WeakPolarHBondContact O-CB 3.29Å; A161-M164 PolarHBondContact O-N 2.89Å; A161-V165 WeakPolarHBondContact O-CG2 3.43Å; A161-V165 PolarHBondContact O-N 3.46Å; A161-M229 HydrophobicContact CB-SD 4.11Å
162	G	98.8	Very high	97.8	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-68.5	-34.3	178.5	0	0	0	0	0	112.2	E152 M164 V165 A166	E152-G162 VanDerWaalsContact OE2-CA 3.3Å; E152-G162 WeakPolarHBondContact OE2-CA 3.29Å; E152-G162 PolarHBondContact OE2-N 3.27Å; G162-M164 VanDerWaalsContact C-N 3.33Å; G162-M164 PolarHBondContact O-N 3.44Å; G162-V165 WeakPolarHBondContact O-CB 3.38Å; G162-V165 PolarHBondContact O-N 2.91Å; G162-A166 WeakPolarHBondContact O-CB 3.35Å; G162-A166 PolarHBondContact O-N 3.35Å
163	L	98.9	Very high	97.8	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-60.8	-42.6	169.8	-70.5	169.2	0	0	0	111.7	I101 I103 T158 C159 L160 V165 A166 I167 L176 I190 I191 F200 I205	I101-L163 HydrophobicContact CG1-CB 4.4Å; I101-L163 HydrophobicContact CG1-CD1 4.43Å; I103-L163 HydrophobicContact CD1-CD1 3.58Å; T158-L163 WeakPolarHBondContact O-CD1 3.45Å; C159-L163 VanDerWaalsContact O-CG 3.29Å; C159-L163 WeakPolarHBondContact O-CG 3.37Å; C159-L163 PolarHBondContact O-N 2.99Å; C159-L163 VanDerWaalsContact O-N 3.13Å; L160-L163 PolarHBondContact O-N 2.79Å; L163-V165 VanDerWaalsContact C-N 3.34Å; L163-V165 PolarHBondContact O-N 3.43Å; L163-A166 PolarHBondContact O-N 2.71Å; L163-I167 PolarHBondContact O-N 2.9Å; L163-I167 VanDerWaalsContact O-N 3.12Å; L163-L176 HydrophobicContact CD2-CD1 3.82Å; L163-L176 HydrophobicContact CG-CD1 3.87Å; L163-I190 HydrophobicContact CD1-CG2 3.59Å; L163-I190 HydrophobicContact CD2-CG2 4.19Å; L163-I191 HydrophobicContact CD2-CG1 4.48Å; L163-F200 HydrophobicContact CD2-CE1 3.83Å; L163-F200 HydrophobicContact CD2-CZ 3.79Å; L163-I205 HydrophobicContact CD2-CD1 4.1Å
164	M	98.8	Very high	97.8	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.4	-39.9	175.3	-73.2	-50.8	111.3	0	0	112.1	F71 I101 A135 C138 L139 L160 A161 G162 A166 I167 S168	F71-M164 HydrophobicContact CE1-CE 4.44Å; F71-M164 HydrophobicContact CE1-CG 4.36Å; F71-M164 HydrophobicContact CE1-SD 3.71Å; F71-M164 HydrophobicContact CZ-CG 4.18Å; F71-M164 HydrophobicContact CZ-SD 4.12Å; I101-M164 HydrophobicContact CB-CE 3.78Å; I101-M164 HydrophobicContact CG2-CE 3.23Å; A135-M164 HydrophobicContact CB-CB 4.42Å; A135-M164 HydrophobicContact CB-CG 3.72Å; C138-M164 HydrophobicContact CB-CB 4.48Å; L139-M164 HydrophobicContact CD1-CG 4.3Å; L139-M164 HydrophobicContact CD1-SD 3.72Å; L139-M164 HydrophobicContact CD2-CB 3.78Å; L139-M164 HydrophobicContact CD2-CG 4.12Å; L139-M164 HydrophobicContact CD2-SD 3.73Å; L139-M164 HydrophobicContact CG-CB 3.94Å; L139-M164 HydrophobicContact CG-CG 4Å; L139-M164 HydrophobicContact CG-SD 3.89Å; L160-M164 HydrophobicContact CD1-CE 3.77Å; L160-M164 WeakPolarHBondContact O-CG 3.42Å; L160-M164 PolarHBondContact O-N 3.05Å; A161-M164 WeakPolarHBondContact O-CB 3.29Å; A161-M164 PolarHBondContact O-N 2.89Å; G162-M164 VanDerWaalsContact C-N 3.33Å; G162-M164 PolarHBondContact O-N 3.44Å; M164-A166 VanDerWaalsContact C-N 3.34Å; M164-I167 HydrophobicContact CE-CD1 3.9Å; M164-I167 WeakPolarHBondContact O-CG1 3.23Å; M164-I167 HydrophobicContact SD-CD1 3.86Å; M164-S168 VanDerWaalsContact O-CB 3.29Å; M164-S168 WeakPolarHBondContact O-CB 3.5Å; M164-S168 PolarHBondContact O-N 3.41Å; M164-S168 VanDerWaalsContact O-N 3.14Å; M164-S168 PolarHBondContact O-OG 2.82Å
165	V	98.9	Very high	97.9	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-58.7	-48.1	172	174.2	0	0	0	0	110.4	C138 F145 V150 A161 G162 L163 I167 S168 A169 V171 V174 M229	C138-V165 HydrophobicContact CB-CG2 3.76Å; F145-V165 HydrophobicContact CB-CG1 3.92Å; F145-V165 HydrophobicContact CD1-CG1 4.19Å; F145-V165 HydrophobicContact CD1-CG2 4.31Å; F145-V165 HydrophobicContact CD2-CG1 4.12Å; F145-V165 HydrophobicContact CD2-CG2 4.02Å; F145-V165 HydrophobicContact CE1-CG2 4.15Å; F145-V165 HydrophobicContact CE2-CG2 3.85Å; F145-V165 HydrophobicContact CG-CG1 3.81Å; F145-V165 HydrophobicContact CG-CG2 4.24Å; F145-V165 HydrophobicContact CZ-CG2 3.91Å; V150-V165 HydrophobicContact CG2-CG1 4.34Å; A161-V165 WeakPolarHBondContact O-CG2 3.43Å; A161-V165 PolarHBondContact O-N 3.46Å; G162-V165 WeakPolarHBondContact O-CB 3.38Å; G162-V165 PolarHBondContact O-N 2.91Å; L163-V165 VanDerWaalsContact C-N 3.34Å; L163-V165 PolarHBondContact O-N 3.43Å; V165-I167 VanDerWaalsContact C-N 3.33Å; V165-I167 PolarHBondContact O-N 2.94Å; V165-S168 PolarHBondContact O-N 3.28Å; V165-A169 HydrophobicContact CG1-CB 4.33Å; V165-A169 WeakPolarHBondContact O-CB 3.19Å; V165-A169 PolarHBondContact O-N 3.48Å; V165-V171 HydrophobicContact CG1-CB 4.16Å; V165-V171 HydrophobicContact CG1-CG1 4.29Å; V165-V171 HydrophobicContact CG1-CG2 4.01Å; V165-V174 HydrophobicContact CG1-CG2 4.03Å; V165-M229 HydrophobicContact CG2-CE 4.05Å; V165-M229 HydrophobicContact CG2-SD 4.33Å
166	A	98.8	Very high	98	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-66.5	-27.7	-174.3	0	0	0	0	0	114.7	G162 L163 M164 V174 F200 K201 I205	G162-A166 WeakPolarHBondContact O-CB 3.35Å; G162-A166 PolarHBondContact O-N 3.35Å; L163-A166 PolarHBondContact O-N 2.71Å; M164-A166 VanDerWaalsContact C-N 3.34Å; A166-V174 HydrophobicContact CB-CG2 4.13Å; A166-F200 HydrophobicContact CB-CD1 3.62Å; A166-F200 HydrophobicContact CB-CE1 4.01Å; A166-K201 PolarHBondContact O-N 2.91Å; A166-I205 HydrophobicContact CB-CD1 3.58Å
167	I	98.8	Very high	98.2	Very high	7 Å²	7	13.2 Å²	13.2	4%	0.036	7%	0.066	C	C	.	.	H	α-helix	trans	-90.7	-23.2	176.1	67.7	176.2	0	0	0	113.4	Y99 I101 L163 M164 V165 V199 F200 K201	Y99-I167 HydrophobicContact CD1-CD1 4.49Å; Y99-I167 HydrophobicContact CD1-CG1 4.29Å; I101-I167 HydrophobicContact CB-CD1 4.43Å; I101-I167 HydrophobicContact CD1-CG2 3.69Å; L163-I167 PolarHBondContact O-N 2.9Å; L163-I167 VanDerWaalsContact O-N 3.12Å; M164-I167 HydrophobicContact CE-CD1 3.9Å; M164-I167 WeakPolarHBondContact O-CG1 3.23Å; M164-I167 HydrophobicContact SD-CD1 3.86Å; V165-I167 VanDerWaalsContact C-N 3.33Å; V165-I167 PolarHBondContact O-N 2.94Å; I167-V199 HydrophobicContact CG2-CB 4.33Å; I167-V199 HydrophobicContact CG2-CG2 3.95Å; I167-F200 HydrophobicContact CG2-CD1 3.64Å; I167-F200 HydrophobicContact CG2-CE1 3.9Å; I167-K201 WeakPolarHBondContact O-CE 3.45Å
168	S	98.6	Very high	98.5	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.014	7%	0.07	C	C	.	.	H	α-helix	trans	-103.6	-34.6	-172.2	66.1	0	0	0	0	114.4	L139 M164 V165 K201	L139-S168 VanDerWaalsContact CD2-CB 3.49Å; M164-S168 VanDerWaalsContact O-CB 3.29Å; M164-S168 WeakPolarHBondContact O-CB 3.5Å; M164-S168 PolarHBondContact O-N 3.41Å; M164-S168 VanDerWaalsContact O-N 3.14Å; M164-S168 PolarHBondContact O-OG 2.82Å; V165-S168 PolarHBondContact O-N 3.28Å; S168-K201 WeakPolarHBondContact O-CE 3.3Å; S168-K201 PolarHBondContact O-NZ 2.96Å
169	A	98.6	Very high	98.5	Very high	2 Å²	2	14.3 Å²	14.3	2%	0.017	7%	0.074	C	C	.	.	S	Bend	trans	-101	151	-173.5	0	0	0	0	0	113.4	S142 F145 V165 V171 K201	S142-A169 VanDerWaalsContact O-CB 3.25Å; S142-A169 WeakPolarHBondContact O-CB 3.18Å; F145-A169 HydrophobicContact CB-CB 3.75Å; F145-A169 HydrophobicContact CD2-CB 4.35Å; V165-A169 HydrophobicContact CG1-CB 4.33Å; V165-A169 WeakPolarHBondContact O-CB 3.19Å; V165-A169 PolarHBondContact O-N 3.48Å; A169-V171 HydrophobicContact CB-CB 4.2Å; A169-V171 PolarHBondContact O-N 3.4Å; A169-K201 WeakPolarHBondContact O-CB 3.37Å; A169-K201 WeakPolarHBondContact O-CD 3.47Å
170	D	98.5	Very high	98.2	Very high	102 Å²	102	14.9 Å²	14.9	55%	0.545	8%	0.077	S	C	.	.			trans	-77.6	57.1	166.4	-58.4	-33.7	0	0	0	110.1	R146 A147 K201	R146-D170 WeakPolarHBondContact CA-O 3.34Å; R146-D170 HydrophobicContact CG-CB 4.42Å; A147-D170 PolarHBondContact N-O 3.41Å; D170-K201 IonicContact OD1-NZ 2.77Å
171	V	98.8	Very high	97.8	Very high	8 Å²	8	20.4 Å²	20.4	5%	0.048	10%	0.103	C	C	.	.			trans	-78.6	146.3	-173.6	66.3	0	0	0	0	111.5	F145 L148 V150 V165 A169 V174 T202	F145-V171 HydrophobicContact CB-CB 4.48Å; F145-V171 HydrophobicContact CB-CG2 4.36Å; F145-V171 WeakPolarHBondContact O-CA 3.33Å; L148-V171 WeakPolarHBondContact O-CG2 3.2Å; V150-V171 HydrophobicContact CG2-CG2 3.76Å; V165-V171 HydrophobicContact CG1-CB 4.16Å; V165-V171 HydrophobicContact CG1-CG1 4.29Å; V165-V171 HydrophobicContact CG1-CG2 4.01Å; A169-V171 HydrophobicContact CB-CB 4.2Å; A169-V171 PolarHBondContact O-N 3.4Å; V171-V174 HydrophobicContact CB-CG2 4.38Å; V171-V174 HydrophobicContact CG1-CG2 3.65Å; V171-V174 HydrophobicContact CG2-CG2 3.83Å; V171-T202 HydrophobicContact CG1-CG2 3.7Å; V171-T202 WeakPolarHBondContact O-CB 3.44Å
172	K	98.8	Very high	97.3	Very high	97 Å²	97	24.2 Å²	24.2	42%	0.422	12%	0.12	S	C	.	.	S	Bend	trans	-73	-50.3	179.3	172.9	-167.8	173.5	-133.3	0	110.6	A147 L148 T202	A147-K172 WeakPolarHBondContact O-CB 3.46Å; L148-K172 WeakPolarHBondContact O-CB 3.27Å; L148-K172 PolarHBondContact O-N 2.93Å; K172-T202 PolarHBondContact O-OG1 3.44Å
173	E	98.8	Very high	96.9	Very high	31 Å²	31	24.3 Å²	24.3	15%	0.145	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	150.1	180	61.9	-168.8	117.5	0	0	111.3	L148 A149 V150 K204 H224	L148-E173 PolarHBondContact O-N 2.89Å; A149-E173 HydrophobicContact CB-CG 3.41Å; A149-E173 VanDerWaalsContact CB-CG 3.41Å; V150-E173 PolarHBondContact N-O 3.49Å; E173-K204 CarbonylContact C-O 3.55Å; E173-K204 VanDerWaalsContact CA-O 3.23Å; E173-K204 WeakPolarHBondContact CA-O 3.22Å; E173-K204 HydrophobicContact CB-CB 3.67Å; E173-K204 HydrophobicContact CB-CD 4.24Å; E173-H224 VanDerWaalsContact CD-NE2 3.29Å; E173-H224 IonicContact OE1-CE1 3.41Å; E173-H224 IonicContact OE1-NE2 2.78Å; E173-H224 PolarHBondContact OE1-NE2 3.19Å; E173-H224 IonicContact OE2-CD2 3.45Å; E173-H224 IonicContact OE2-CE1 2.57Å; E173-H224 IonicContact OE2-NE2 3.82Å; E173-H224 PolarHBondContact OE2-NE2 2.77Å
174	V	98.9	Very high	96.8	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.012	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123	176.7	-178.3	0	0	0	0	109.1	V150 V165 A166 V171 L176 K204 I205 S206	V150-V174 CarbonylContact O-C 3.48Å; V150-V174 WeakPolarHBondContact O-CA 3.32Å; V165-V174 HydrophobicContact CG1-CG2 4.03Å; A166-V174 HydrophobicContact CB-CG2 4.13Å; V171-V174 HydrophobicContact CB-CG2 4.38Å; V171-V174 HydrophobicContact CG1-CG2 3.65Å; V171-V174 HydrophobicContact CG2-CG2 3.83Å; V174-L176 HydrophobicContact CG1-CD2 3.52Å; V174-L176 HydrophobicContact CG1-CG 4.32Å; V174-K204 PolarHBondContact N-O 2.95Å; V174-I205 WeakPolarHBondContact O-CA 3.33Å; V174-S206 PolarHBondContact O-N 3.41Å; V174-S206 VanDerWaalsContact O-N 3.16Å
175	L	98.9	Very high	96.6	Very high	17 Å²	17	31.4 Å²	31.4	9%	0.089	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.2	171.5	-174.3	69	0	0	0	109.9	V150 C151 E152 T177 S206 C208 L221 F225	V150-L175 PolarHBondContact O-N 2.9Å; C151-L175 WeakPolarHBondContact CA-O 3.39Å; E152-L175 PolarHBondContact N-O 3.49Å; L175-T177 HydrophobicContact CD2-CG2 3.68Å; L175-T177 HydrophobicContact CG-CG2 3.61Å; L175-S206 WeakPolarHBondContact CD1-OG 3.44Å; L175-C208 HydrophobicContact CD1-CB 4.46Å; L175-L221 HydrophobicContact CD2-CD1 3.6Å; L175-L221 HydrophobicContact CD2-CD2 4.15Å; L175-F225 HydrophobicContact CB-CE1 3.82Å; L175-F225 HydrophobicContact CB-CZ 3.78Å; L175-F225 HydrophobicContact CD2-CE1 4.43Å; L175-F225 HydrophobicContact CD2-CE2 4.28Å; L175-F225 HydrophobicContact CD2-CZ 3.54Å; L175-F225 HydrophobicContact CG-CZ 4.3Å
176	L	98.9	Very high	96.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	122	178.8	-52.7	-174	0	0	0	109.6	E152 C159 L163 V174 V187 I191 I205 S206 S207 C208	E152-L176 HydrophobicContact CB-CD2 4.3Å; C159-L176 HydrophobicContact CB-CB 3.72Å; C159-L176 HydrophobicContact CB-CD1 3.87Å; C159-L176 HydrophobicContact CB-CD2 4.01Å; C159-L176 HydrophobicContact CB-CG 4.07Å; L163-L176 HydrophobicContact CD2-CD1 3.82Å; L163-L176 HydrophobicContact CG-CD1 3.87Å; V174-L176 HydrophobicContact CG1-CD2 3.52Å; V174-L176 HydrophobicContact CG1-CG 4.32Å; L176-V187 HydrophobicContact CB-CG1 3.83Å; L176-V187 HydrophobicContact CD1-CG1 3.64Å; L176-V187 HydrophobicContact CG-CG1 4.37Å; L176-I191 HydrophobicContact CD1-CD1 4.05Å; L176-I191 HydrophobicContact CD1-CG1 4.18Å; L176-I205 HydrophobicContact CD1-CD1 4.29Å; L176-S206 PolarHBondContact N-O 2.91Å; L176-S207 WeakPolarHBondContact O-CA 3.41Å; L176-S207 WeakPolarHBondContact O-CB 3.26Å; L176-C208 PolarHBondContact O-N 3.36Å; L176-C208 VanDerWaalsContact O-N 3.1Å
177	T	98.8	Very high	96.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151.4	-171.8	78.2	0	0	0	0	114.1	E152 L153 G154 G155 L175 C208 L210	E152-T177 WeakPolarHBondContact O-CA 3.48Å; E152-T177 WeakPolarHBondContact O-CB 3.16Å; E152-T177 PolarHBondContact O-N 3.09Å; E152-T177 PolarHBondContact O-OG1 2.95Å; L153-T177 WeakPolarHBondContact CA-OG1 3.49Å; L153-T177 WeakPolarHBondContact CD2-OG1 3.48Å; G154-T177 PolarHBondContact N-O 3.25Å; G155-T177 PolarHBondContact N-O 3.13Å; G155-T177 VanDerWaalsContact N-O 3.14Å; L175-T177 HydrophobicContact CD2-CG2 3.68Å; L175-T177 HydrophobicContact CG-CG2 3.61Å; T177-C208 WeakPolarHBondContact CA-O 3.2Å; T177-L210 HydrophobicContact CG2-CB 4.03Å; T177-L210 HydrophobicContact CG2-CD1 4Å
178	D	97.8	Very high	96.2	Very high	20 Å²	20	34.9 Å²	34.9	11%	0.107	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	154.1	176.2	-163.8	-85.2	0	0	0	108.3	G154 G156 N180 A183 I184 V209 L210	G154-D178 VanDerWaalsContact C-OD2 3.26Å; G154-D178 VanDerWaalsContact CA-OD2 3.32Å; G154-D178 WeakPolarHBondContact CA-OD2 3.46Å; G156-D178 WeakPolarHBondContact CA-OD2 3.08Å; G156-D178 PolarHBondContact N-OD2 3.16Å; D178-N180 VanDerWaalsContact C-N 3.26Å; D178-N180 PolarHBondContact O-N 2.94Å; D178-N180 VanDerWaalsContact OD1-CB 3.24Å; D178-N180 WeakPolarHBondContact OD1-CB 3.28Å; D178-N180 PolarHBondContact OD1-N 3.49Å; D178-A183 HydrophobicContact CB-CB 4.4Å; D178-I184 HydrophobicContact CB-CD1 3.7Å; D178-I184 HydrophobicContact CB-CG1 3.88Å; D178-V209 WeakPolarHBondContact O-CA 3.41Å; D178-L210 PolarHBondContact O-N 3.13Å
179	G	95.1	Very high	96.1	Very high	12 Å²	12	38 Å²	38	12%	0.124	18%	0.18	C	C	.	.	S	Bend	trans	-76.4	-13.9	176.8	0	0	0	0	0	113.4
180	N	90.6	Very high	96	Very high	12 Å²	12	37.9 Å²	37.9	6%	0.064	18%	0.18	C	C	.	.			trans	-94.4	114.2	-179.7	-169.7	-50.3	0	0	0	111.5	D120 N124 D178 K182 A183 I184	D120-N180 PolarHBondContact O-ND2 3.37Å; N124-N180 PolarHBondContact ND2-ND2 3.07Å; D178-N180 VanDerWaalsContact C-N 3.26Å; D178-N180 PolarHBondContact O-N 2.94Å; D178-N180 VanDerWaalsContact OD1-CB 3.24Å; D178-N180 WeakPolarHBondContact OD1-CB 3.28Å; D178-N180 PolarHBondContact OD1-N 3.49Å; N180-K182 VanDerWaalsContact C-N 3.27Å; N180-K182 PolarHBondContact O-N 2.75Å; N180-K182 WeakPolarHBondContact OD1-CA 3.36Å; N180-K182 VanDerWaalsContact OD1-CB 3.29Å; N180-K182 WeakPolarHBondContact OD1-CB 3.36Å; N180-K182 PolarHBondContact OD1-N 3.42Å; N180-A183 HydrophobicContact CB-CB 3.86Å; N180-A183 VanDerWaalsContact O-CB 3.28Å; N180-A183 WeakPolarHBondContact O-CB 3.35Å; N180-A183 PolarHBondContact O-N 3.49Å; N180-A183 VanDerWaalsContact O-N 3.11Å; N180-A183 PolarHBondContact OD1-N 2.83Å; N180-I184 PolarHBondContact O-N 3.14Å; N180-I184 VanDerWaalsContact O-N 3.08Å
181	E	90.7	Very high	96	Very high	117 Å²	117	33 Å²	33	55%	0.547	15%	0.154	S	C	.	.	H	α-helix	trans	-60.8	-33.5	-179	-50.1	-177	171.2	0	0	113.8	A183 I184 R185 V209	E181-A183 VanDerWaalsContact C-N 3.35Å; E181-I184 PolarHBondContact O-N 3.36Å; E181-R185 VanDerWaalsContact CB-NH1 3.34Å; E181-R185 WeakPolarHBondContact O-CG 3.5Å; E181-R185 PolarHBondContact O-N 2.91Å; E181-R185 IonicContact OE2-NH1 2.69Å; E181-R185 PolarHBondContact OE2-NH1 3.45Å; E181-V209 HydrophobicContact CB-CG2 4.17Å; E181-V209 HydrophobicContact CG-CG1 4.45Å; E181-V209 HydrophobicContact CG-CG2 4.02Å
182	K	89.3	Confident	96	Very high	80 Å²	80	35.2 Å²	35.2	35%	0.348	17%	0.167	S	C	.	.	H	α-helix	trans	-69.5	-37.8	178.7	-170.9	-178	-177.9	-177	0	110.6	D114 N180 N186	D114-K182 IonicContact OD2-NZ 3.67Å; D114-K182 PolarHBondContact OD2-NZ 3.17Å; N180-K182 VanDerWaalsContact C-N 3.27Å; N180-K182 PolarHBondContact O-N 2.75Å; N180-K182 WeakPolarHBondContact OD1-CA 3.36Å; N180-K182 VanDerWaalsContact OD1-CB 3.29Å; N180-K182 WeakPolarHBondContact OD1-CB 3.36Å; N180-K182 PolarHBondContact OD1-N 3.42Å; K182-N186 PolarHBondContact O-N 3.45Å
183	A	90.8	Very high	95.9	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-60.3	-51.1	173.2	0	0	0	0	0	110.3	N124 M157 D178 N180 E181 R185 N186 V187	N124-A183 WeakPolarHBondContact OD1-CB 3.46Å; M157-A183 HydrophobicContact CB-CB 4.38Å; D178-A183 HydrophobicContact CB-CB 4.4Å; N180-A183 HydrophobicContact CB-CB 3.86Å; N180-A183 VanDerWaalsContact O-CB 3.28Å; N180-A183 WeakPolarHBondContact O-CB 3.35Å; N180-A183 PolarHBondContact O-N 3.49Å; N180-A183 VanDerWaalsContact O-N 3.11Å; N180-A183 PolarHBondContact OD1-N 2.83Å; E181-A183 VanDerWaalsContact C-N 3.35Å; A183-R185 PolarHBondContact O-N 3.06Å; A183-N186 WeakPolarHBondContact O-CA 3.28Å; A183-N186 VanDerWaalsContact O-CB 3.24Å; A183-N186 WeakPolarHBondContact O-CB 3.31Å; A183-N186 PolarHBondContact O-N 2.73Å; A183-V187 WeakPolarHBondContact O-CG2 3.35Å; A183-V187 PolarHBondContact O-N 3.16Å
184	I	95.4	Very high	95.8	Very high	11 Å²	11	33.1 Å²	33.1	6%	0.056	16%	0.155	C	C	.	.	H	α-helix	trans	-65.9	-36	-179	-69.4	-50.1	0	0	0	113.6	D178 N180 E181 N186 V187 Q188 V209	D178-I184 HydrophobicContact CB-CD1 3.7Å; D178-I184 HydrophobicContact CB-CG1 3.88Å; N180-I184 PolarHBondContact O-N 3.14Å; N180-I184 VanDerWaalsContact O-N 3.08Å; E181-I184 PolarHBondContact O-N 3.36Å; I184-N186 PolarHBondContact O-N 2.77Å; I184-V187 HydrophobicContact CD1-CB 4.43Å; I184-V187 HydrophobicContact CD1-CG2 4.28Å; I184-V187 PolarHBondContact O-N 3.35Å; I184-Q188 PolarHBondContact O-N 3.01Å; I184-V209 HydrophobicContact CB-CG2 4.14Å; I184-V209 HydrophobicContact CG1-CG2 4.35Å; I184-V209 HydrophobicContact CG2-CG2 4.19Å
185	R	93.9	Very high	95.8	Very high	139 Å²	139	37.4 Å²	37.4	53%	0.525	18%	0.175	S	C	.	.	H	α-helix	trans	-58	-39.3	169.7	-74.8	-173.8	-64.6	-95.1	4.6	111.8	E181 A183 Q188 D189	E181-R185 VanDerWaalsContact CB-NH1 3.34Å; E181-R185 WeakPolarHBondContact O-CG 3.5Å; E181-R185 PolarHBondContact O-N 2.91Å; E181-R185 IonicContact OE2-NH1 2.69Å; E181-R185 PolarHBondContact OE2-NH1 3.45Å; A183-R185 PolarHBondContact O-N 3.06Å; R185-Q188 PolarHBondContact O-N 2.83Å; R185-D189 PolarHBondContact O-N 2.79Å
186	N	94	Very high	95.7	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.032	21%	0.208	C	C	.	.	H	α-helix	trans	-66.6	-42.7	175.2	-167.9	68.4	0	0	0	112.5	R104 M157 K182 A183 I184 Q188 D189 I190	R104-N186 VanDerWaalsContact CZ-OD1 3.26Å; R104-N186 PolarHBondContact NE-OD1 2.86Å; R104-N186 PolarHBondContact NH2-OD1 3.36Å; R104-N186 PolarHBondContact O-ND2 3.17Å; M157-N186 PolarHBondContact O-ND2 2.78Å; K182-N186 PolarHBondContact O-N 3.45Å; A183-N186 WeakPolarHBondContact O-CA 3.28Å; A183-N186 VanDerWaalsContact O-CB 3.24Å; A183-N186 WeakPolarHBondContact O-CB 3.31Å; A183-N186 PolarHBondContact O-N 2.73Å; I184-N186 PolarHBondContact O-N 2.77Å; N186-Q188 VanDerWaalsContact C-N 3.29Å; N186-Q188 PolarHBondContact O-N 3.13Å; N186-D189 PolarHBondContact O-N 3.3Å; N186-I190 WeakPolarHBondContact O-CG1 3.21Å; N186-I190 PolarHBondContact O-N 3.08Å
187	V	96.9	Very high	95.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-39.7	175.9	178.6	0	0	0	0	110.8	M157 C159 L176 A183 I184 D189 I190 I191	M157-V187 WeakPolarHBondContact O-CG2 3.21Å; C159-V187 HydrophobicContact CB-CG1 4.24Å; C159-V187 HydrophobicContact CB-CG2 4.31Å; L176-V187 HydrophobicContact CB-CG1 3.83Å; L176-V187 HydrophobicContact CD1-CG1 3.64Å; L176-V187 HydrophobicContact CG-CG1 4.37Å; A183-V187 WeakPolarHBondContact O-CG2 3.35Å; A183-V187 PolarHBondContact O-N 3.16Å; I184-V187 HydrophobicContact CD1-CB 4.43Å; I184-V187 HydrophobicContact CD1-CG2 4.28Å; I184-V187 PolarHBondContact O-N 3.35Å; V187-D189 VanDerWaalsContact C-N 3.32Å; V187-D189 PolarHBondContact O-N 3.44Å; V187-I190 WeakPolarHBondContact O-CB 3.21Å; V187-I190 PolarHBondContact O-N 3.03Å; V187-I190 VanDerWaalsContact O-N 3.17Å; V187-I191 HydrophobicContact CG1-CD1 4.14Å; V187-I191 HydrophobicContact CG1-CG1 4.42Å; V187-I191 WeakPolarHBondContact O-CG1 3.42Å; V187-I191 PolarHBondContact O-N 3.04Å
188	Q	97.7	Very high	95.6	Very high	74 Å²	74	51.4 Å²	51.4	35%	0.346	27%	0.266	S	S	.	.	H	α-helix	trans	-62.4	-38.3	176.9	-170.9	55.4	46.6	0	0	112.6	I184 R185 N186 I191 T192 S207	I184-Q188 PolarHBondContact O-N 3.01Å; R185-Q188 PolarHBondContact O-N 2.83Å; N186-Q188 VanDerWaalsContact C-N 3.29Å; N186-Q188 PolarHBondContact O-N 3.13Å; Q188-I191 PolarHBondContact O-N 3.24Å; Q188-T192 WeakPolarHBondContact O-CB 3.39Å; Q188-T192 PolarHBondContact O-N 3.38Å; Q188-T192 PolarHBondContact O-OG1 3.43Å; Q188-S207 WeakPolarHBondContact CB-OG 3.46Å; Q188-S207 PolarHBondContact OE1-OG 2.93Å
189	D	96.1	Very high	95.6	Very high	66 Å²	66	52.9 Å²	52.9	35%	0.353	28%	0.276	S	S	.	.	H	α-helix	trans	-68.2	-39.6	174.7	-68.5	-24	0	0	0	111.3	R104 R185 N186 V187 T192 R193	R104-D189 IonicContact CZ-OD2 3.15Å; R104-D189 IonicContact NH1-OD2 2.76Å; R104-D189 PolarHBondContact NH1-OD2 3.16Å; R104-D189 IonicContact NH2-OD2 2.84Å; R104-D189 PolarHBondContact NH2-OD2 2.98Å; R185-D189 PolarHBondContact O-N 2.79Å; N186-D189 PolarHBondContact O-N 3.3Å; V187-D189 VanDerWaalsContact C-N 3.32Å; V187-D189 PolarHBondContact O-N 3.44Å; D189-T192 PolarHBondContact O-N 2.92Å; D189-R193 PolarHBondContact O-N 2.99Å
190	I	97.4	Very high	95.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-49.5	173.1	-69.2	166	0	0	0	110.7	W88 I103 R104 L163 N186 V187 T192 R193 N194	W88-I190 HydrophobicContact CH2-CG1 4.37Å; W88-I190 HydrophobicContact CZ3-CG1 4.15Å; I103-I190 HydrophobicContact CD1-CD1 4.47Å; I103-I190 HydrophobicContact CD1-CG2 4.05Å; I103-I190 HydrophobicContact CG2-CD1 4.11Å; R104-I190 HydrophobicContact CB-CG1 4.13Å; L163-I190 HydrophobicContact CD1-CG2 3.59Å; L163-I190 HydrophobicContact CD2-CG2 4.19Å; N186-I190 WeakPolarHBondContact O-CG1 3.21Å; N186-I190 PolarHBondContact O-N 3.08Å; V187-I190 WeakPolarHBondContact O-CB 3.21Å; V187-I190 PolarHBondContact O-N 3.03Å; V187-I190 VanDerWaalsContact O-N 3.17Å; I190-T192 VanDerWaalsContact C-N 3.33Å; I190-T192 PolarHBondContact O-N 3.05Å; I190-R193 PolarHBondContact O-N 3.45Å; I190-N194 PolarHBondContact O-N 3.04Å; I190-N194 VanDerWaalsContact O-N 3.1Å; I190-N194 PolarHBondContact O-ND2 3.37Å
191	I	98.6	Very high	96.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-56.8	-50.1	176	-67.1	167.8	0	0	0	109.5	L163 L176 V187 Q188 R193 N194 Q195 F200 I205	L163-I191 HydrophobicContact CD2-CG1 4.48Å; L176-I191 HydrophobicContact CD1-CD1 4.05Å; L176-I191 HydrophobicContact CD1-CG1 4.18Å; V187-I191 HydrophobicContact CG1-CD1 4.14Å; V187-I191 HydrophobicContact CG1-CG1 4.42Å; V187-I191 WeakPolarHBondContact O-CG1 3.42Å; V187-I191 PolarHBondContact O-N 3.04Å; Q188-I191 PolarHBondContact O-N 3.24Å; I191-R193 VanDerWaalsContact C-N 3.34Å; I191-R193 PolarHBondContact O-N 3.16Å; I191-N194 PolarHBondContact O-N 2.84Å; I191-Q195 WeakPolarHBondContact O-CB 3.35Å; I191-Q195 PolarHBondContact O-N 3.26Å; I191-F200 HydrophobicContact CG2-CE2 4.21Å; I191-I205 HydrophobicContact CD1-CG1 4.11Å; I191-I205 HydrophobicContact CG1-CD1 4.25Å; I191-I205 HydrophobicContact CG1-CG1 4.15Å; I191-I205 HydrophobicContact CG2-CG1 4.3Å; I191-I205 HydrophobicContact CG2-CG2 4.17Å
192	T	98.2	Very high	96.5	Very high	54 Å²	54	52.5 Å²	52.5	33%	0.331	27%	0.27	S	S	.	.	H	α-helix	trans	-58.2	-44.4	-176.6	-59.1	0	0	0	0	112.1	Q188 D189 I190 K196	Q188-T192 WeakPolarHBondContact O-CB 3.39Å; Q188-T192 PolarHBondContact O-N 3.38Å; Q188-T192 PolarHBondContact O-OG1 3.43Å; D189-T192 PolarHBondContact O-N 2.92Å; I190-T192 VanDerWaalsContact C-N 3.33Å; I190-T192 PolarHBondContact O-N 3.05Å; T192-K196 WeakPolarHBondContact O-CG 3.3Å; T192-K196 PolarHBondContact O-N 2.91Å; T192-K196 VanDerWaalsContact O-N 3.16Å
193	R	96.8	Very high	96.9	Very high	82 Å²	82	56 Å²	56	31%	0.309	29%	0.287	S	S	.	.	H	α-helix	trans	-65.8	-47	178.9	-176.4	173.2	177	87.2	-1.1	112.1	W88 D189 I190 I191 Q195 K196 A197	W88-R193 VanDerWaalsContact CE3-CD 3.49Å; W88-R193 HydrophobicContact CH2-CB 3.56Å; W88-R193 VanDerWaalsContact CH2-CD 3.41Å; W88-R193 HydrophobicContact CH2-CG 4.1Å; W88-R193 HydrophobicContact CZ2-CB 4.21Å; W88-R193 HydrophobicContact CZ3-CB 3.98Å; W88-R193 HydrophobicContact CZ3-CG 4.21Å; D189-R193 PolarHBondContact O-N 2.99Å; I190-R193 PolarHBondContact O-N 3.45Å; I191-R193 VanDerWaalsContact C-N 3.34Å; I191-R193 PolarHBondContact O-N 3.16Å; R193-Q195 VanDerWaalsContact C-N 3.34Å; R193-Q195 PolarHBondContact O-N 3.28Å; R193-K196 WeakPolarHBondContact O-CB 3.33Å; R193-K196 PolarHBondContact O-N 3.03Å; R193-A197 PolarHBondContact O-N 2.87Å
194	N	98.1	Very high	97.2	Very high	2 Å²	2	62 Å²	62	1%	0.011	31%	0.313	C	S	.	.	H	α-helix	trans	-71.7	-30.4	-177.8	-71.5	-76.2	0	0	0	112.2	I101 S102 I190 I191 A197 G198 V199 F200	I101-N194 HydrophobicContact CD1-CB 3.76Å; I101-N194 VanDerWaalsContact CD1-OD1 3.22Å; I101-N194 WeakPolarHBondContact CD1-OD1 3.35Å; I101-N194 WeakPolarHBondContact CG1-OD1 3.42Å; S102-N194 PolarHBondContact N-OD1 2.69Å; S102-N194 PolarHBondContact O-ND2 3.01Å; I190-N194 PolarHBondContact O-N 3.04Å; I190-N194 VanDerWaalsContact O-N 3.1Å; I190-N194 PolarHBondContact O-ND2 3.37Å; I191-N194 PolarHBondContact O-N 2.84Å; N194-A197 CarbonylContact O-C 3.6Å; N194-A197 WeakPolarHBondContact O-CB 3.3Å; N194-A197 PolarHBondContact O-N 3.13Å; N194-G198 PolarHBondContact O-N 2.89Å; N194-G198 VanDerWaalsContact O-N 3.14Å; N194-V199 HydrophobicContact CB-CG2 3.76Å; N194-V199 PolarHBondContact O-N 2.67Å; N194-F200 HydrophobicContact CB-CE1 4.29Å; N194-F200 HydrophobicContact CB-CE2 3.68Å; N194-F200 HydrophobicContact CB-CZ 3.52Å
195	Q	98.1	Very high	97.4	Very high	92 Å²	92	62.1 Å²	62.1	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-65.7	-40.7	172.7	-173.2	169.8	-16.3	0	0	111.6	I191 R193 A197 G198 F200	I191-Q195 WeakPolarHBondContact O-CB 3.35Å; I191-Q195 PolarHBondContact O-N 3.26Å; R193-Q195 VanDerWaalsContact C-N 3.34Å; R193-Q195 PolarHBondContact O-N 3.28Å; Q195-A197 PolarHBondContact O-N 3.1Å; Q195-G198 PolarHBondContact O-N 3.43Å; Q195-F200 HydrophobicContact CB-CD2 4.06Å; Q195-F200 HydrophobicContact CB-CE2 4.09Å
196	K	97.5	Very high	97.6	Very high	179 Å²	179	58.2 Å²	58.2	78%	0.778	31%	0.307	S	S	*	.	H	α-helix	trans	-61.3	-32.8	171.7	-71.8	171.6	-178.7	175.8	0	112.5	T192 R193 G198	T192-K196 WeakPolarHBondContact O-CG 3.3Å; T192-K196 PolarHBondContact O-N 2.91Å; T192-K196 VanDerWaalsContact O-N 3.16Å; R193-K196 WeakPolarHBondContact O-CB 3.33Å; R193-K196 PolarHBondContact O-N 3.03Å; K196-G198 VanDerWaalsContact C-N 3.27Å
197	A	96.9	Very high	97.9	Very high	70 Å²	70	58.7 Å²	58.7	58%	0.579	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-9.6	175.9	0	0	0	0	0	113.7	R193 N194 Q195 V199	R193-A197 PolarHBondContact O-N 2.87Å; N194-A197 CarbonylContact O-C 3.6Å; N194-A197 WeakPolarHBondContact O-CB 3.3Å; N194-A197 PolarHBondContact O-N 3.13Å; Q195-A197 PolarHBondContact O-N 3.1Å; A197-V199 VanDerWaalsContact C-N 3.34Å; A197-V199 HydrophobicContact CB-CG1 4.12Å; A197-V199 PolarHBondContact O-N 3.41Å
198	G	97.9	Very high	97.9	Very high	62 Å²	62	60.4 Å²	60.4	64%	0.639	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	23.3	176.4	0	0	0	0	0	114.8	N194 Q195 K196	N194-G198 PolarHBondContact O-N 2.89Å; N194-G198 VanDerWaalsContact O-N 3.14Å; Q195-G198 PolarHBondContact O-N 3.43Å; K196-G198 VanDerWaalsContact C-N 3.27Å
199	V	98.3	Very high	97.9	Very high	52 Å²	52	59.2 Å²	59.2	32%	0.315	32%	0.32	S	S	.	.			trans	-84.9	-17.1	-174.6	-58.5	0	0	0	0	114.3	I101 I167 N194 A197	I101-V199 HydrophobicContact CD1-CG2 3.98Å; I167-V199 HydrophobicContact CG2-CB 4.33Å; I167-V199 HydrophobicContact CG2-CG2 3.95Å; N194-V199 HydrophobicContact CB-CG2 3.76Å; N194-V199 PolarHBondContact O-N 2.67Å; A197-V199 VanDerWaalsContact C-N 3.34Å; A197-V199 HydrophobicContact CB-CG1 4.12Å; A197-V199 PolarHBondContact O-N 3.41Å
200	F	98.7	Very high	98.1	Very high	19 Å²	19	56 Å²	56	8%	0.083	30%	0.304	C	S	.	.			trans	-78.3	136.9	180	-62.2	-53.2	0	0	0	112.1	I101 L163 A166 I167 I191 N194 Q195 I205	I101-F200 HydrophobicContact CD1-CE1 3.9Å; I101-F200 HydrophobicContact CD1-CZ 4.26Å; L163-F200 HydrophobicContact CD2-CE1 3.83Å; L163-F200 HydrophobicContact CD2-CZ 3.79Å; A166-F200 HydrophobicContact CB-CD1 3.62Å; A166-F200 HydrophobicContact CB-CE1 4.01Å; I167-F200 HydrophobicContact CG2-CD1 3.64Å; I167-F200 HydrophobicContact CG2-CE1 3.9Å; I191-F200 HydrophobicContact CG2-CE2 4.21Å; N194-F200 HydrophobicContact CB-CE1 4.29Å; N194-F200 HydrophobicContact CB-CE2 3.68Å; N194-F200 HydrophobicContact CB-CZ 3.52Å; Q195-F200 HydrophobicContact CB-CD2 4.06Å; Q195-F200 HydrophobicContact CB-CE2 4.09Å; F200-I205 HydrophobicContact CD1-CD1 4.04Å; F200-I205 HydrophobicContact CD2-CG2 3.78Å; F200-I205 HydrophobicContact CE1-CD1 3.64Å; F200-I205 HydrophobicContact CE2-CD1 4.2Å; F200-I205 HydrophobicContact CE2-CG2 4.07Å; F200-I205 HydrophobicContact CG-CG2 4.13Å; F200-I205 HydrophobicContact CZ-CD1 3.72Å
201	K	98.5	Very high	98.1	Very high	101 Å²	101	60.1 Å²	60.1	44%	0.439	32%	0.319	S	S	.	.	S	Bend	trans	-81.7	-15.3	174.9	-71	-172.8	171.9	-167.8	0	113.7	A166 I167 S168 A169 D170	A166-K201 PolarHBondContact O-N 2.91Å; I167-K201 WeakPolarHBondContact O-CE 3.45Å; S168-K201 WeakPolarHBondContact O-CE 3.3Å; S168-K201 PolarHBondContact O-NZ 2.96Å; A169-K201 WeakPolarHBondContact O-CB 3.37Å; A169-K201 WeakPolarHBondContact O-CD 3.47Å; D170-K201 IonicContact OD1-NZ 2.77Å
202	T	98.1	Very high	98.1	Very high	13 Å²	13	61 Å²	61	8%	0.08	32%	0.323	C	S	.	.			trans	-117.6	147.6	173.2	-174.3	0	0	0	0	111.2	V171 K172 K204 I205	V171-T202 HydrophobicContact CG1-CG2 3.7Å; V171-T202 WeakPolarHBondContact O-CB 3.44Å; K172-T202 PolarHBondContact O-OG1 3.44Å; T202-K204 VanDerWaalsContact C-N 3.34Å; T202-K204 PolarHBondContact OG1-N 3.07Å; T202-K204 VanDerWaalsContact OG1-N 3.07Å; T202-I205 HydrophobicContact CG2-CB 4.48Å
203	Q	96.4	Very high	98	Very high	153 Å²	153	61.4 Å²	61.4	72%	0.715	32%	0.322	S	S	*	.	S	Bend	trans	-84.6	-13.5	169.7	-58	-58.2	-45.2	0	0	112.1	I205	Q203-I205 PolarHBondContact O-N 3.38Å
204	K	98.6	Very high	98.1	Very high	128 Å²	128	60.1 Å²	60.1	56%	0.557	32%	0.322	S	S	*	.			trans	-99	64.6	-178.1	-65.3	-173.8	174.6	-171	0	110.6	E173 V174 T202	E173-K204 CarbonylContact C-O 3.55Å; E173-K204 VanDerWaalsContact CA-O 3.23Å; E173-K204 WeakPolarHBondContact CA-O 3.22Å; E173-K204 HydrophobicContact CB-CB 3.67Å; E173-K204 HydrophobicContact CB-CD 4.24Å; V174-K204 PolarHBondContact N-O 2.95Å; T202-K204 VanDerWaalsContact C-N 3.34Å; T202-K204 PolarHBondContact OG1-N 3.07Å; T202-K204 VanDerWaalsContact OG1-N 3.07Å
205	I	98.8	Very high	98.1	Very high	13 Å²	13	65.1 Å²	65.1	7%	0.067	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.4	168.7	177.3	161.7	0	0	0	109.1	L163 A166 V174 L176 I191 F200 T202 Q203	L163-I205 HydrophobicContact CD2-CD1 4.1Å; A166-I205 HydrophobicContact CB-CD1 3.58Å; V174-I205 WeakPolarHBondContact O-CA 3.33Å; L176-I205 HydrophobicContact CD1-CD1 4.29Å; I191-I205 HydrophobicContact CD1-CG1 4.11Å; I191-I205 HydrophobicContact CG1-CD1 4.25Å; I191-I205 HydrophobicContact CG1-CG1 4.15Å; I191-I205 HydrophobicContact CG2-CG1 4.3Å; I191-I205 HydrophobicContact CG2-CG2 4.17Å; F200-I205 HydrophobicContact CD1-CD1 4.04Å; F200-I205 HydrophobicContact CD2-CG2 3.78Å; F200-I205 HydrophobicContact CE1-CD1 3.64Å; F200-I205 HydrophobicContact CE2-CD1 4.2Å; F200-I205 HydrophobicContact CE2-CG2 4.07Å; F200-I205 HydrophobicContact CG-CG2 4.13Å; F200-I205 HydrophobicContact CZ-CD1 3.72Å; T202-I205 HydrophobicContact CG2-CB 4.48Å; Q203-I205 PolarHBondContact O-N 3.38Å
206	S	98.8	Very high	98.1	Very high	56 Å²	56	65.4 Å²	65.4	39%	0.392	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	167.5	178.1	57.9	0	0	0	0	111.1	V174 L175 L176	V174-S206 PolarHBondContact O-N 3.41Å; V174-S206 VanDerWaalsContact O-N 3.16Å; L175-S206 WeakPolarHBondContact CD1-OG 3.44Å; L176-S206 PolarHBondContact N-O 2.91Å
207	S	98.8	Very high	98.1	Very high	17 Å²	17	58.1 Å²	58.1	12%	0.119	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	147	171.5	67.2	0	0	0	0	111	L176 Q188	L176-S207 WeakPolarHBondContact O-CA 3.41Å; L176-S207 WeakPolarHBondContact O-CB 3.26Å; Q188-S207 WeakPolarHBondContact CB-OG 3.46Å; Q188-S207 PolarHBondContact OE1-OG 2.93Å
208	C	98.2	Very high	98.2	Very high	36 Å²	36	54.9 Å²	54.9	24%	0.243	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	158	172.2	78.7	0	0	0	0	111.5	L175 L176 T177	L175-C208 HydrophobicContact CD1-CB 4.46Å; L176-C208 PolarHBondContact O-N 3.36Å; L176-C208 VanDerWaalsContact O-N 3.1Å; T177-C208 WeakPolarHBondContact CA-O 3.2Å
209	V	98.1	Very high	98.2	Very high	48 Å²	48	54.4 Å²	54.4	29%	0.291	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	131.5	171	-179.4	0	0	0	0	107.8	D178 E181 I184	D178-V209 WeakPolarHBondContact O-CA 3.41Å; E181-V209 HydrophobicContact CB-CG2 4.17Å; E181-V209 HydrophobicContact CG-CG1 4.45Å; E181-V209 HydrophobicContact CG-CG2 4.02Å; I184-V209 HydrophobicContact CB-CG2 4.14Å; I184-V209 HydrophobicContact CG1-CG2 4.35Å; I184-V209 HydrophobicContact CG2-CG2 4.19Å
210	L	98.4	Very high	98.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.295	C	S	.	.			trans	-143.5	104.5	175.5	-166.6	166.6	0	0	0	108.7	L153 T177 D178 D217 V218 L221 L250	L153-L210 HydrophobicContact CD2-CD1 3.92Å; L153-L210 HydrophobicContact CD2-CD2 3.85Å; L153-L210 HydrophobicContact CD2-CG 4.44Å; T177-L210 HydrophobicContact CG2-CB 4.03Å; T177-L210 HydrophobicContact CG2-CD1 4Å; D178-L210 PolarHBondContact O-N 3.13Å; L210-D217 HydrophobicContact CG-CB 4.33Å; L210-V218 HydrophobicContact CD2-CG2 4.38Å; L210-L221 HydrophobicContact CD1-CD1 3.63Å; L210-L250 HydrophobicContact CD1-CD1 4.01Å; L210-L250 HydrophobicContact CD1-CD2 4.26Å
211	R	97.8	Very high	98.2	Very high	86 Å²	86	58.3 Å²	58.3	33%	0.325	30%	0.298	S	S	.	.			trans	-88.7	124.1	170.1	-79.1	-175.9	59	174.1	-1.3	110.2	D213 N214 D217	R211-D213 WeakPolarHBondContact CB-OD1 3.22Å; R211-D213 IonicContact CZ-OD1 2.76Å; R211-D213 IonicContact CZ-OD2 3.85Å; R211-D213 IonicContact NE-OD1 3.1Å; R211-D213 PolarHBondContact NE-OD1 2.94Å; R211-D213 VanDerWaalsContact NE-OD1 3.08Å; R211-D213 IonicContact NE-OD2 3.48Å; R211-D213 IonicContact NH2-OD1 3.25Å; R211-D213 PolarHBondContact NH2-OD1 2.87Å; R211-D213 IonicContact NH2-OD2 2.69Å; R211-D213 PolarHBondContact NH2-OD2 3.14Å; R211-D213 PolarHBondContact O-N 2.96Å; R211-D213 VanDerWaalsContact O-N 3.16Å; R211-N214 HydrophobicContact CB-CB 3.67Å; R211-N214 WeakPolarHBondContact O-CB 3.42Å; R211-N214 PolarHBondContact O-N 3.1Å; R211-D217 WeakPolarHBondContact CB-OD2 3.31Å; R211-D217 PolarHBondContact N-OD2 2.96Å
212	W	98.2	Very high	98.2	Very high	19 Å²	19	58.7 Å²	58.7	7%	0.072	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.9	-177.6	-43.6	-35.2	0	0	0	112.9	C233 L236 L243 A246	W212-C233 HydrophobicContact CH2-CB 3.63Å; W212-C233 HydrophobicContact CZ2-CB 4.04Å; W212-L236 HydrophobicContact CH2-CD1 4.47Å; W212-L236 HydrophobicContact CZ3-CD1 4.35Å; W212-L243 HydrophobicContact CD2-CB 4.05Å; W212-L243 HydrophobicContact CD2-CD1 3.75Å; W212-L243 HydrophobicContact CD2-CG 4.44Å; W212-L243 HydrophobicContact CE3-CB 3.63Å; W212-L243 HydrophobicContact CE3-CD1 4.04Å; W212-L243 HydrophobicContact CE3-CG 4.28Å; W212-L243 HydrophobicContact CG-CD1 4.23Å; W212-L243 HydrophobicContact CH2-CD1 4.26Å; W212-L243 HydrophobicContact CH2-CD2 4.39Å; W212-L243 HydrophobicContact CZ2-CD1 3.97Å; W212-L243 HydrophobicContact CZ3-CB 4.05Å; W212-L243 HydrophobicContact CZ3-CD1 4.28Å; W212-L243 HydrophobicContact CZ3-CD2 4.25Å; W212-L243 HydrophobicContact CZ3-CG 4.42Å; W212-A246 HydrophobicContact CB-CB 3.93Å; W212-A246 HydrophobicContact CG-CB 4.42Å
213	D	97	Very high	98.2	Very high	61 Å²	61	59.7 Å²	59.7	33%	0.326	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	2.5	178.7	67.6	-37.5	0	0	0	113.6	R211 Y239	R211-D213 WeakPolarHBondContact CB-OD1 3.22Å; R211-D213 IonicContact CZ-OD1 2.76Å; R211-D213 IonicContact CZ-OD2 3.85Å; R211-D213 IonicContact NE-OD1 3.1Å; R211-D213 PolarHBondContact NE-OD1 2.94Å; R211-D213 VanDerWaalsContact NE-OD1 3.08Å; R211-D213 IonicContact NE-OD2 3.48Å; R211-D213 IonicContact NH2-OD1 3.25Å; R211-D213 PolarHBondContact NH2-OD1 2.87Å; R211-D213 IonicContact NH2-OD2 2.69Å; R211-D213 PolarHBondContact NH2-OD2 3.14Å; R211-D213 PolarHBondContact O-N 2.96Å; R211-D213 VanDerWaalsContact O-N 3.16Å; D213-Y239 HydrophobicContact CB-CD1 4.29Å
214	N	98.1	Very high	98.3	Very high	55 Å²	55	56.2 Å²	56.2	29%	0.294	30%	0.299	S	S	.	.			trans	-100.4	119.1	177.9	-174.2	-60.6	0	0	0	110.9	R211 T216 D217 V218	R211-N214 HydrophobicContact CB-CB 3.67Å; R211-N214 WeakPolarHBondContact O-CB 3.42Å; R211-N214 PolarHBondContact O-N 3.1Å; N214-T216 PolarHBondContact O-N 2.86Å; N214-T216 WeakPolarHBondContact OD1-CB 3.38Å; N214-T216 PolarHBondContact OD1-N 3.17Å; N214-D217 HydrophobicContact CB-CB 3.98Å; N214-D217 WeakPolarHBondContact CB-OD2 3.36Å; N214-D217 PolarHBondContact O-N 2.81Å; N214-D217 PolarHBondContact OD1-N 2.72Å; N214-V218 WeakPolarHBondContact O-CG2 3.5Å; N214-V218 PolarHBondContact O-N 2.82Å
215	E	98.1	Very high	98.3	Very high	108 Å²	108	50.2 Å²	50.2	51%	0.505	27%	0.272	S	S	.	.	H	α-helix	trans	-62.8	-42.2	-176.6	-179.2	50.6	-140.1	0	0	113.1	V218 S219 R249	E215-V218 PolarHBondContact O-N 2.77Å; E215-S219 WeakPolarHBondContact O-CB 3.47Å; E215-S219 PolarHBondContact O-N 3.46Å; E215-S219 PolarHBondContact O-OG 3.43Å; E215-S219 PolarHBondContact OE1-OG 3.3Å; E215-R249 IonicContact OE1-CZ 3.64Å; E215-R249 IonicContact OE1-NH1 2.72Å; E215-R249 PolarHBondContact OE1-NH1 3.11Å; E215-R249 IonicContact OE1-NH2 3.84Å; E215-R249 PolarHBondContact OE1-NH2 2.8Å; E215-R249 IonicContact OE2-CZ 2.97Å; E215-R249 IonicContact OE2-NH1 3.39Å; E215-R249 PolarHBondContact OE2-NH1 3.23Å; E215-R249 IonicContact OE2-NH2 3.86Å
216	T	98	Very high	98.3	Very high	97 Å²	97	51.2 Å²	51.2	60%	0.595	28%	0.278	S	S	*	.	H	α-helix	trans	-64.6	-43.4	179.8	-55.4	0	0	0	0	111	N214 V218 Q220	N214-T216 PolarHBondContact O-N 2.86Å; N214-T216 WeakPolarHBondContact OD1-CB 3.38Å; N214-T216 PolarHBondContact OD1-N 3.17Å; T216-V218 VanDerWaalsContact C-N 3.32Å; T216-V218 PolarHBondContact O-N 3.12Å; T216-Q220 PolarHBondContact O-N 3.39Å
217	D	98.1	Very high	98.3	Very high	27 Å²	27	49.2 Å²	49.2	14%	0.144	26%	0.263	C	S	.	.	H	α-helix	trans	-62	-41.1	-178.1	-68.1	-4.8	0	0	0	111.7	L210 R211 N214 Q220	L210-D217 HydrophobicContact CG-CB 4.33Å; R211-D217 WeakPolarHBondContact CB-OD2 3.31Å; R211-D217 PolarHBondContact N-OD2 2.96Å; N214-D217 HydrophobicContact CB-CB 3.98Å; N214-D217 WeakPolarHBondContact CB-OD2 3.36Å; N214-D217 PolarHBondContact O-N 2.81Å; N214-D217 PolarHBondContact OD1-N 2.72Å; D217-Q220 WeakPolarHBondContact O-CG 3.43Å; D217-Q220 PolarHBondContact O-NE2 2.85Å
218	V	98.6	Very high	98.3	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-79.3	-47.2	-179.2	178.4	0	0	0	0	111.6	L210 N214 E215 T216 Q220 L221 E222 A246 R249	L210-V218 HydrophobicContact CD2-CG2 4.38Å; N214-V218 WeakPolarHBondContact O-CG2 3.5Å; N214-V218 PolarHBondContact O-N 2.82Å; E215-V218 PolarHBondContact O-N 2.77Å; T216-V218 VanDerWaalsContact C-N 3.32Å; T216-V218 PolarHBondContact O-N 3.12Å; V218-Q220 VanDerWaalsContact C-N 3.29Å; V218-Q220 PolarHBondContact O-N 2.87Å; V218-L221 PolarHBondContact O-N 2.96Å; V218-L221 VanDerWaalsContact O-N 3.09Å; V218-E222 PolarHBondContact O-N 3.26Å; V218-A246 HydrophobicContact CG2-CB 4.04Å; V218-R249 HydrophobicContact CG1-CB 3.72Å; V218-R249 HydrophobicContact CG1-CG 4.44Å
219	S	98.3	Very high	98.3	Very high	52 Å²	52	46.8 Å²	46.8	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-57.5	-38.2	-176.4	-96.6	0	0	0	0	113.4	E215 L221 E222 R249	E215-S219 WeakPolarHBondContact O-CB 3.47Å; E215-S219 PolarHBondContact O-N 3.46Å; E215-S219 PolarHBondContact O-OG 3.43Å; E215-S219 PolarHBondContact OE1-OG 3.3Å; S219-L221 PolarHBondContact O-N 2.8Å; S219-L221 VanDerWaalsContact O-N 3.17Å; S219-E222 WeakPolarHBondContact O-CB 3.22Å; S219-E222 PolarHBondContact O-N 3.32Å; S219-R249 PolarHBondContact OG-NH2 2.95Å
220	Q	98.1	Very high	98.4	Very high	125 Å²	125	44.5 Å²	44.5	58%	0.584	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-13.9	-178.1	78.4	-167.1	-31.3	0	0	113.6	T216 D217 V218	T216-Q220 PolarHBondContact O-N 3.39Å; D217-Q220 WeakPolarHBondContact O-CG 3.43Å; D217-Q220 PolarHBondContact O-NE2 2.85Å; V218-Q220 VanDerWaalsContact C-N 3.29Å; V218-Q220 PolarHBondContact O-N 2.87Å
221	L	98.5	Very high	98.4	Very high	29 Å²	29	44.9 Å²	44.9	15%	0.152	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.8	12.3	-177.9	-67.5	172	0	0	0	112.4	L175 L210 V218 S219 G223 H224 F225 L250	L175-L221 HydrophobicContact CD2-CD1 3.6Å; L175-L221 HydrophobicContact CD2-CD2 4.15Å; L210-L221 HydrophobicContact CD1-CD1 3.63Å; V218-L221 PolarHBondContact O-N 2.96Å; V218-L221 VanDerWaalsContact O-N 3.09Å; S219-L221 PolarHBondContact O-N 2.8Å; S219-L221 VanDerWaalsContact O-N 3.17Å; L221-G223 PolarHBondContact O-N 3.1Å; L221-H224 VanDerWaalsContact O-CB 3.31Å; L221-H224 WeakPolarHBondContact O-CB 3.25Å; L221-H224 PolarHBondContact O-N 2.81Å; L221-F225 HydrophobicContact CB-CE2 4.13Å; L221-F225 HydrophobicContact CD1-CE2 4.34Å; L221-F225 HydrophobicContact CD2-CE2 4.29Å; L221-F225 HydrophobicContact CD2-CZ 4.3Å; L221-F225 HydrophobicContact CG-CE2 4.48Å; L221-L250 HydrophobicContact CB-CD2 3.34Å; L221-L250 HydrophobicContact CD1-CD2 4.23Å; L221-L250 HydrophobicContact CG-CD2 4.43Å
222	E	98.4	Very high	98.2	Very high	108 Å²	108	41.3 Å²	41.3	51%	0.505	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	128.4	-175	-172	155.5	-136.9	0	0	111.7	V218 S219 H224 R249	V218-E222 PolarHBondContact O-N 3.26Å; S219-E222 WeakPolarHBondContact O-CB 3.22Å; S219-E222 PolarHBondContact O-N 3.32Å; E222-H224 PolarHBondContact O-N 3.48Å; E222-R249 CarbonylContact C-O 3.55Å; E222-R249 WeakPolarHBondContact CA-O 3.19Å; E222-R249 HydrophobicContact CG-CB 4.29Å; E222-R249 WeakPolarHBondContact OE1-CG 3.46Å; E222-R249 IonicContact OE1-CZ 3.91Å; E222-R249 IonicContact OE1-NE 3.93Å; E222-R249 PolarHBondContact OE1-NE 3.45Å; E222-R249 IonicContact OE1-NH2 2.77Å; E222-R249 IonicContact OE2-NH2 3.9Å
223	G	98.4	Very high	98.1	Very high	35 Å²	35	40.8 Å²	40.8	36%	0.361	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	10.3	179.2	0	0	0	0	0	115.4	L221 R249 Q252	L221-G223 PolarHBondContact O-N 3.1Å; G223-R249 PolarHBondContact N-O 3.39Å; G223-Q252 WeakPolarHBondContact O-CB 3.39Å
224	H	98.7	Very high	98.1	Very high	80 Å²	80	38 Å²	38	37%	0.37	21%	0.207	S	C	.	.			trans	-80.3	-32.1	-170.9	-169.9	73.7	0	0	0	114.3	E173 L221 E222 L250	E173-H224 VanDerWaalsContact CD-NE2 3.29Å; E173-H224 IonicContact OE1-CE1 3.41Å; E173-H224 IonicContact OE1-NE2 2.78Å; E173-H224 PolarHBondContact OE1-NE2 3.19Å; E173-H224 IonicContact OE2-CD2 3.45Å; E173-H224 IonicContact OE2-CE1 2.57Å; E173-H224 IonicContact OE2-NE2 3.82Å; E173-H224 PolarHBondContact OE2-NE2 2.77Å; L221-H224 VanDerWaalsContact O-CB 3.31Å; L221-H224 WeakPolarHBondContact O-CB 3.25Å; L221-H224 PolarHBondContact O-N 2.81Å; E222-H224 PolarHBondContact O-N 3.48Å; H224-L250 PolarHBondContact N-O 3.43Å
225	F	98.8	Very high	97.7	Very high	1 Å²	1	38.2 Å²	38.2	0%	0.004	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	138.9	-166.3	-61.3	-75.6	0	0	0	114	A149 C151 L175 L221 V228 L250 L251 Q252	A149-F225 HydrophobicContact CB-CD1 4.12Å; C151-F225 HydrophobicContact CB-CB 4.36Å; C151-F225 HydrophobicContact CB-CD1 3.55Å; C151-F225 HydrophobicContact CB-CD2 3.65Å; C151-F225 HydrophobicContact CB-CE1 3.61Å; C151-F225 HydrophobicContact CB-CE2 3.71Å; C151-F225 HydrophobicContact CB-CG 3.56Å; C151-F225 HydrophobicContact CB-CZ 3.7Å; L175-F225 HydrophobicContact CB-CE1 3.82Å; L175-F225 HydrophobicContact CB-CZ 3.78Å; L175-F225 HydrophobicContact CD2-CE1 4.43Å; L175-F225 HydrophobicContact CD2-CE2 4.28Å; L175-F225 HydrophobicContact CD2-CZ 3.54Å; L175-F225 HydrophobicContact CG-CZ 4.3Å; L221-F225 HydrophobicContact CB-CE2 4.13Å; L221-F225 HydrophobicContact CD1-CE2 4.34Å; L221-F225 HydrophobicContact CD2-CE2 4.29Å; L221-F225 HydrophobicContact CD2-CZ 4.3Å; L221-F225 HydrophobicContact CG-CE2 4.48Å; F225-V228 HydrophobicContact CB-CG2 4.06Å; F225-L250 HydrophobicContact CD2-CB 4.09Å; F225-L250 HydrophobicContact CD2-CD2 4.46Å; F225-L250 HydrophobicContact CE2-CD2 4.3Å; F225-L250 PolarHBondContact N-O 2.87Å; F225-L251 WeakPolarHBondContact O-CA 3.4Å; F225-Q252 WeakPolarHBondContact O-CG 3.16Å; F225-Q252 PolarHBondContact O-N 2.96Å
226	D	98.8	Very high	97.3	Very high	35 Å²	35	34.3 Å²	34.3	19%	0.187	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	-41.1	169.4	-60.5	-88.7	0	0	0	111.1	L148 A149 Q252 G255 K256	L148-D226 WeakPolarHBondContact CA-OD2 3.49Å; L148-D226 HydrophobicContact CB-CB 3.9Å; L148-D226 HydrophobicContact CD1-CB 4.08Å; L148-D226 HydrophobicContact CD2-CB 3.96Å; L148-D226 HydrophobicContact CG-CB 4.19Å; A149-D226 PolarHBondContact N-OD2 2.94Å; A149-D226 PolarHBondContact O-N 2.78Å; D226-Q252 PolarHBondContact OD1-NE2 3.01Å; D226-G255 CarbonylContact O-C 3.6Å; D226-G255 WeakPolarHBondContact O-CA 3.45Å; D226-K256 PolarHBondContact O-N 2.98Å
227	I	98.9	Very high	96.9	Very high	13 Å²	13	35 Å²	35	7%	0.067	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.5	177.4	-64.1	177.7	0	0	0	110.3	F145 L148 A149 V150 C151 M229 K256 M258	F145-I227 HydrophobicContact CD1-CD1 3.79Å; F145-I227 HydrophobicContact CE1-CD1 3.82Å; F145-I227 HydrophobicContact CE1-CG2 4.25Å; L148-I227 HydrophobicContact CD1-CD1 3.66Å; L148-I227 HydrophobicContact CD1-CG1 4.03Å; A149-I227 PolarHBondContact O-N 2.96Å; V150-I227 CarbonylContact C-O 3.5Å; V150-I227 WeakPolarHBondContact CA-O 3.4Å; V150-I227 HydrophobicContact CG2-CB 4.47Å; C151-I227 PolarHBondContact N-O 2.89Å; I227-M229 HydrophobicContact CG2-CE 4Å; I227-K256 VanDerWaalsContact CA-O 3.28Å; I227-K256 WeakPolarHBondContact CA-O 3.42Å; I227-M258 HydrophobicContact CG2-CG 4.42Å; I227-M258 HydrophobicContact CG2-SD 4.28Å
228	V	98.9	Very high	96.6	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.8	166.2	172.6	0	0	0	0	107.7	C151 L153 F225 I247 L250 L251 K256 A257 M258	C151-V228 HydrophobicContact CB-CG2 4.22Å; C151-V228 CarbonylContact O-C 3.5Å; C151-V228 WeakPolarHBondContact O-CA 3.21Å; L153-V228 HydrophobicContact CD1-CG1 3.58Å; L153-V228 HydrophobicContact CG-CG1 3.82Å; F225-V228 HydrophobicContact CB-CG2 4.06Å; V228-I247 HydrophobicContact CG1-CG1 4.05Å; V228-I247 HydrophobicContact CG1-CG2 4.46Å; V228-L250 HydrophobicContact CG2-CB 3.98Å; V228-L251 HydrophobicContact CB-CD2 3.92Å; V228-L251 HydrophobicContact CB-CG 4.19Å; V228-L251 HydrophobicContact CG2-CD2 3.56Å; V228-L251 HydrophobicContact CG2-CG 3.78Å; V228-K256 PolarHBondContact N-O 3.26Å; V228-K256 VanDerWaalsContact N-O 3.09Å; V228-A257 CarbonylContact O-C 3.58Å; V228-A257 WeakPolarHBondContact O-CA 3.21Å; V228-M258 PolarHBondContact O-N 3.41Å
229	M	98.9	Very high	96.4	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	151.1	177.2	63.5	-176	62.2	0	0	111.8	L134 F145 V150 C151 E152 L153 A161 V165 I227 M258	L134-M229 HydrophobicContact CD1-CB 4.42Å; L134-M229 HydrophobicContact CD1-SD 4.32Å; L134-M229 HydrophobicContact CD2-CB 4.25Å; L134-M229 HydrophobicContact CD2-CG 4.33Å; L134-M229 HydrophobicContact CD2-SD 4.37Å; F145-M229 HydrophobicContact CD1-CE 4.29Å; F145-M229 HydrophobicContact CE1-CE 3.33Å; F145-M229 HydrophobicContact CZ-CE 3.7Å; V150-M229 HydrophobicContact CG1-CE 3.48Å; V150-M229 VanDerWaalsContact CG1-CE 3.48Å; V150-M229 HydrophobicContact CG1-SD 4.35Å; C151-M229 PolarHBondContact O-N 3.36Å; E152-M229 CarbonylContact C-O 3.49Å; E152-M229 WeakPolarHBondContact CA-O 3.3Å; E152-M229 HydrophobicContact CB-CG 4.17Å; E152-M229 HydrophobicContact CG-CG 4.26Å; L153-M229 PolarHBondContact N-O 2.95Å; A161-M229 HydrophobicContact CB-SD 4.11Å; V165-M229 HydrophobicContact CG2-CE 4.05Å; V165-M229 HydrophobicContact CG2-SD 4.33Å; I227-M229 HydrophobicContact CG2-CE 4Å; M229-M258 WeakPolarHBondContact CA-O 3.32Å; M229-M258 HydrophobicContact CB-CB 4.16Å; M229-M258 WeakPolarHBondContact CB-O 3.21Å
230	C	98.7	Very high	96.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	154.4	170.6	64.5	0	0	0	0	111.1	L153 C233 M258 V259 F260	L153-C230 HydrophobicContact CB-CB 4.13Å; L153-C230 WeakPolarHBondContact O-CB 3.39Å; C230-C233 HydrophobicContact CB-CB 4.35Å; C230-M258 PolarHBondContact N-O 3.22Å; C230-M258 VanDerWaalsContact N-O 3.14Å; C230-V259 WeakPolarHBondContact O-CA 3.36Å; C230-F260 PolarHBondContact O-N 3.15Å
231	A	98.3	Very high	96.4	Very high	8 Å²	8	36.5 Å²	36.5	7%	0.066	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.8	175.8	0	0	0	0	0	111.1	E131 L134 C233 F260	E131-A231 HydrophobicContact CB-CB 4.08Å; E131-A231 WeakPolarHBondContact OE2-CB 3.36Å; L134-A231 HydrophobicContact CB-CB 4.4Å; L134-A231 HydrophobicContact CD2-CB 4Å; A231-C233 PolarHBondContact O-N 3.32Å; A231-C233 PolarHBondContact O-SG 2.79Å; A231-F260 CarbonylContact C-O 3.58Å; A231-F260 VanDerWaalsContact CA-O 3.28Å; A231-F260 WeakPolarHBondContact CA-O 3.39Å
232	D	95.3	Very high	96.4	Very high	11 Å²	11	36.7 Å²	36.7	6%	0.059	20%	0.2	C	C	.	.	S	Bend	trans	52.4	25.7	173.8	-146.2	-1.9	0	0	0	116.1	L234 F235 F260 P262 R264	D232-L234 VanDerWaalsContact C-N 3.31Å; D232-L234 PolarHBondContact O-N 3.16Å; D232-F235 WeakPolarHBondContact O-CD1 3.44Å; D232-F235 WeakPolarHBondContact O-CE1 3.5Å; D232-F260 PolarHBondContact N-O 2.97Å; D232-P262 WeakPolarHBondContact OD1-CD 3.19Å; D232-R264 IonicContact OD1-CZ 2.75Å; D232-R264 IonicContact OD1-NE 3.61Å; D232-R264 PolarHBondContact OD1-NE 3.47Å; D232-R264 IonicContact OD1-NH2 3.98Å; D232-R264 IonicContact OD2-CZ 2.66Å; D232-R264 IonicContact OD2-NE 2.83Å; D232-R264 PolarHBondContact OD2-NE 3.44Å; D232-R264 IonicContact OD2-NH2 3.77Å; D232-R264 PolarHBondContact OD2-NH2 2.67Å
233	C	96.1	Very high	96.4	Very high	9 Å²	9	31.5 Å²	31.5	6%	0.061	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-84.6	1.1	-175.8	-72.8	0	0	0	0	114.5	W212 C230 A231 L243	W212-C233 HydrophobicContact CH2-CB 3.63Å; W212-C233 HydrophobicContact CZ2-CB 4.04Å; C230-C233 HydrophobicContact CB-CB 4.35Å; A231-C233 PolarHBondContact O-N 3.32Å; A231-C233 PolarHBondContact O-SG 2.79Å; C233-L243 HydrophobicContact CB-CD2 3.79Å
234	L	96.5	Very high	96.4	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-86.6	-10.9	-164.1	-51.8	-169.2	0	0	0	114.8	D232 R240 L243 V259 A261 T267 L268 F271 L317	D232-L234 VanDerWaalsContact C-N 3.31Å; D232-L234 PolarHBondContact O-N 3.16Å; L234-R240 PolarHBondContact O-NE 2.75Å; L234-R240 PolarHBondContact O-NH2 3.08Å; L234-L243 HydrophobicContact CD2-CD2 3.81Å; L234-V259 HydrophobicContact CD1-CG1 4.13Å; L234-V259 HydrophobicContact CD2-CG1 4.02Å; L234-V259 HydrophobicContact CG-CG1 4.27Å; L234-A261 HydrophobicContact CB-CB 4.45Å; L234-A261 HydrophobicContact CD1-CB 3.54Å; L234-A261 HydrophobicContact CG-CB 3.73Å; L234-T267 WeakPolarHBondContact O-CB 3.41Å; L234-L268 HydrophobicContact CD1-CB 4.29Å; L234-L268 HydrophobicContact CD1-CD1 4.44Å; L234-L268 HydrophobicContact CD1-CG 4.16Å; L234-F271 HydrophobicContact CB-CB 4.42Å; L234-F271 HydrophobicContact CD1-CB 4.01Å; L234-F271 HydrophobicContact CD1-CD1 3.88Å; L234-F271 HydrophobicContact CD1-CG 3.97Å; L234-F271 HydrophobicContact CD2-CB 4.08Å; L234-F271 HydrophobicContact CD2-CD1 3.91Å; L234-F271 HydrophobicContact CD2-CD2 3.47Å; L234-F271 VanDerWaalsContact CD2-CD2 3.47Å; L234-F271 HydrophobicContact CD2-CE1 4.18Å; L234-F271 HydrophobicContact CD2-CE2 3.76Å; L234-F271 HydrophobicContact CD2-CG 3.53Å; L234-F271 HydrophobicContact CD2-CZ 4.11Å; L234-F271 HydrophobicContact CG-CB 4.4Å; L234-F271 HydrophobicContact CG-CG 4.28Å; L234-L317 HydrophobicContact CD1-CD1 4.38Å
235	F	90.3	Very high	96.4	Very high	61 Å²	61	29.7 Å²	29.7	27%	0.268	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-83.7	-13.9	-171.3	67.7	-94.3	0	0	0	114.4	T122 D232 D237	T122-F235 HydrophobicContact CG2-CZ 4.03Å; D232-F235 WeakPolarHBondContact O-CD1 3.44Å; D232-F235 WeakPolarHBondContact O-CE1 3.5Å; F235-D237 PolarHBondContact O-N 3.5Å; F235-D237 VanDerWaalsContact O-N 3.16Å
236	L	89.1	Confident	96.4	Very high	26 Å²	26	29.6 Å²	29.6	14%	0.136	16%	0.16	C	C	.	.			trans	-81.6	93.2	-178.4	-65.2	168.6	0	0	0	110.8	W212 Q238 Y239 R240	W212-L236 HydrophobicContact CH2-CD1 4.47Å; W212-L236 HydrophobicContact CZ3-CD1 4.35Å; L236-Q238 VanDerWaalsContact C-N 3.27Å; L236-Q238 PolarHBondContact O-N 3.21Å; L236-Y239 HydrophobicContact CB-CD2 4.12Å; L236-Y239 HydrophobicContact CD1-CD2 4.16Å; L236-Y239 PolarHBondContact O-N 3.35Å; L236-Y239 VanDerWaalsContact O-N 3.07Å; L236-R240 PolarHBondContact O-N 3.16Å
237	D	88.4	Confident	96.4	Very high	112 Å²	112	28 Å²	28	60%	0.599	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-45.1	-177.1	-78.4	-29.2	0	0	0	113.4	F235 Y239 R240	F235-D237 PolarHBondContact O-N 3.5Å; F235-D237 VanDerWaalsContact O-N 3.16Å; D237-Y239 VanDerWaalsContact C-N 3.29Å; D237-Y239 PolarHBondContact O-N 3.19Å; D237-R240 IonicContact OD1-CZ 3.31Å; D237-R240 IonicContact OD1-NH1 3.93Å; D237-R240 PolarHBondContact OD1-NH1 3.31Å; D237-R240 IonicContact OD1-NH2 3.08Å; D237-R240 PolarHBondContact OD1-NH2 2.66Å
238	Q	92.1	Very high	96.4	Very high	134 Å²	134	31.1 Å²	31.1	63%	0.626	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.7	-177.4	64.1	-175.9	-16.7	0	0	114.1	L236	L236-Q238 VanDerWaalsContact C-N 3.27Å; L236-Q238 PolarHBondContact O-N 3.21Å
239	Y	95.1	Very high	96.4	Very high	32 Å²	32	32.8 Å²	32.8	13%	0.125	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-4.1	-174.7	-56.1	-53	0	0	0	113.6	F119 D213 L236 D237 A241 S242 L243	F119-Y239 HydrophobicContact CD1-CE2 4.29Å; F119-Y239 HydrophobicContact CD2-CE2 4.18Å; F119-Y239 AromaticContact CD2-CZ 3.83Å; F119-Y239 WeakPolarHBondContact CD2-OH 3.48Å; F119-Y239 AromaticContact CE1-CD2 3.88Å; F119-Y239 HydrophobicContact CE1-CD2 3.88Å; F119-Y239 AromaticContact CE1-CE2 3.65Å; F119-Y239 HydrophobicContact CE1-CE2 3.65Å; F119-Y239 HydrophobicContact CE1-CG 4.48Å; F119-Y239 HydrophobicContact CE2-CD1 4.19Å; F119-Y239 HydrophobicContact CE2-CD2 4.28Å; F119-Y239 AromaticContact CE2-CE1 3.44Å; F119-Y239 HydrophobicContact CE2-CE1 3.44Å; F119-Y239 VanDerWaalsContact CE2-CE1 3.44Å; F119-Y239 AromaticContact CE2-CE2 3.53Å; F119-Y239 HydrophobicContact CE2-CE2 3.53Å; F119-Y239 AromaticContact CE2-CZ 3.06Å; F119-Y239 WeakPolarHBondContact CE2-OH 3.4Å; F119-Y239 AromaticContact CZ-CD1 3.79Å; F119-Y239 HydrophobicContact CZ-CD1 3.79Å; F119-Y239 AromaticContact CZ-CD2 3.56Å; F119-Y239 HydrophobicContact CZ-CD2 3.56Å; F119-Y239 AromaticContact CZ-CE1 3.51Å; F119-Y239 HydrophobicContact CZ-CE1 3.51Å; F119-Y239 AromaticContact CZ-CE2 3.23Å; F119-Y239 HydrophobicContact CZ-CE2 3.23Å; F119-Y239 AromaticContact CZ-CG 3.84Å; F119-Y239 HydrophobicContact CZ-CG 3.84Å; F119-Y239 AromaticContact CZ-CZ 3.23Å; D213-Y239 HydrophobicContact CB-CD1 4.29Å; L236-Y239 HydrophobicContact CB-CD2 4.12Å; L236-Y239 HydrophobicContact CD1-CD2 4.16Å; L236-Y239 PolarHBondContact O-N 3.35Å; L236-Y239 VanDerWaalsContact O-N 3.07Å; D237-Y239 VanDerWaalsContact C-N 3.29Å; D237-Y239 PolarHBondContact O-N 3.19Å; Y239-A241 VanDerWaalsContact C-N 3.32Å; Y239-A241 PolarHBondContact O-N 2.69Å; Y239-S242 CarbonylContact O-C 3.31Å; Y239-S242 WeakPolarHBondContact O-CB 3.5Å; Y239-S242 PolarHBondContact O-N 2.76Å; Y239-S242 VanDerWaalsContact O-N 3.13Å; Y239-L243 PolarHBondContact O-N 3.41Å
240	R	97.5	Very high	96.4	Very high	13 Å²	13	32.7 Å²	32.7	5%	0.049	17%	0.17	C	C	.	.	H	α-helix	trans	-59.1	-40.3	-175.4	-170.4	-175.5	-64.1	112.6	4.6	113.3	L234 L236 D237 V244 F271 L274	L234-R240 PolarHBondContact O-NE 2.75Å; L234-R240 PolarHBondContact O-NH2 3.08Å; L236-R240 PolarHBondContact O-N 3.16Å; D237-R240 IonicContact OD1-CZ 3.31Å; D237-R240 IonicContact OD1-NH1 3.93Å; D237-R240 PolarHBondContact OD1-NH1 3.31Å; D237-R240 IonicContact OD1-NH2 3.08Å; D237-R240 PolarHBondContact OD1-NH2 2.66Å; R240-V244 PolarHBondContact O-N 3.07Å; R240-F271 HydrophobicContact CG-CB 4.22Å; R240-F271 HydrophobicContact CG-CD2 4.24Å; R240-L274 HydrophobicContact CB-CD1 4.23Å; R240-L274 HydrophobicContact CG-CD1 3.75Å
241	A	98.4	Very high	96.4	Very high	57 Å²	57	32.7 Å²	32.7	47%	0.471	17%	0.17	S	C	.	.	H	α-helix	trans	-67.2	-43.6	176.8	0	0	0	0	0	111.4	Y239 L243 V244 D245 L274	Y239-A241 VanDerWaalsContact C-N 3.32Å; Y239-A241 PolarHBondContact O-N 2.69Å; A241-L243 VanDerWaalsContact C-N 3.33Å; A241-L243 PolarHBondContact O-N 3.48Å; A241-V244 PolarHBondContact O-N 3.18Å; A241-D245 PolarHBondContact O-N 2.86Å; A241-L274 HydrophobicContact CB-CD1 4.44Å
242	S	98.6	Very high	96.4	Very high	32 Å²	32	35.3 Å²	35.3	22%	0.224	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-37.6	175.7	-51.5	0	0	0	0	112.4	Y239 V244 D245 A246	Y239-S242 CarbonylContact O-C 3.31Å; Y239-S242 WeakPolarHBondContact O-CB 3.5Å; Y239-S242 PolarHBondContact O-N 2.76Å; Y239-S242 VanDerWaalsContact O-N 3.13Å; S242-V244 PolarHBondContact O-N 3.28Å; S242-D245 PolarHBondContact O-N 2.82Å; S242-A246 VanDerWaalsContact O-CB 3.3Å; S242-A246 WeakPolarHBondContact O-CB 3.48Å; S242-A246 PolarHBondContact O-N 2.84Å
243	L	98.8	Very high	96.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.9	-46.5	173.5	177.2	60.7	0	0	0	111.6	L153 W212 C233 L234 Y239 A241 D245 A246 I247 F271	L153-L243 HydrophobicContact CD1-CD1 4.04Å; W212-L243 HydrophobicContact CD2-CB 4.05Å; W212-L243 HydrophobicContact CD2-CD1 3.75Å; W212-L243 HydrophobicContact CD2-CG 4.44Å; W212-L243 HydrophobicContact CE3-CB 3.63Å; W212-L243 HydrophobicContact CE3-CD1 4.04Å; W212-L243 HydrophobicContact CE3-CG 4.28Å; W212-L243 HydrophobicContact CG-CD1 4.23Å; W212-L243 HydrophobicContact CH2-CD1 4.26Å; W212-L243 HydrophobicContact CH2-CD2 4.39Å; W212-L243 HydrophobicContact CZ2-CD1 3.97Å; W212-L243 HydrophobicContact CZ3-CB 4.05Å; W212-L243 HydrophobicContact CZ3-CD1 4.28Å; W212-L243 HydrophobicContact CZ3-CD2 4.25Å; W212-L243 HydrophobicContact CZ3-CG 4.42Å; C233-L243 HydrophobicContact CB-CD2 3.79Å; L234-L243 HydrophobicContact CD2-CD2 3.81Å; Y239-L243 PolarHBondContact O-N 3.41Å; A241-L243 VanDerWaalsContact C-N 3.33Å; A241-L243 PolarHBondContact O-N 3.48Å; L243-D245 VanDerWaalsContact C-N 3.33Å; L243-D245 PolarHBondContact O-N 3.49Å; L243-A246 PolarHBondContact O-N 3.17Å; L243-I247 HydrophobicContact CD1-CD1 3.9Å; L243-I247 HydrophobicContact CD1-CG1 4.15Å; L243-I247 HydrophobicContact CG-CD1 3.92Å; L243-I247 WeakPolarHBondContact O-CB 3.5Å; L243-I247 VanDerWaalsContact O-CG1 3.23Å; L243-I247 WeakPolarHBondContact O-CG1 3.32Å; L243-I247 PolarHBondContact O-N 3.04Å; L243-F271 HydrophobicContact CD2-CD2 4.37Å; L243-F271 HydrophobicContact CD2-CE2 4Å; L243-F271 HydrophobicContact CG-CE2 4.18Å
244	V	98.8	Very high	96.2	Very high	5 Å²	5	50 Å²	50	3%	0.03	25%	0.248	C	C	.	.	H	α-helix	trans	-61.3	-44.1	177.3	170.3	0	0	0	0	111	R240 A241 S242 K248 F271 L274 A275 A278 F280	R240-V244 PolarHBondContact O-N 3.07Å; A241-V244 PolarHBondContact O-N 3.18Å; S242-V244 PolarHBondContact O-N 3.28Å; V244-K248 WeakPolarHBondContact O-CB 3.43Å; V244-K248 PolarHBondContact O-N 3.4Å; V244-F271 HydrophobicContact CG2-CD2 3.58Å; V244-F271 HydrophobicContact CG2-CE2 3.42Å; V244-F271 VanDerWaalsContact CG2-CE2 3.42Å; V244-F271 HydrophobicContact CG2-CZ 4.26Å; V244-L274 HydrophobicContact CG2-CB 3.95Å; V244-A275 HydrophobicContact CG1-CB 4.27Å; V244-A275 HydrophobicContact CG2-CB 4.28Å; V244-A278 HydrophobicContact CG1-CB 3.46Å; V244-A278 VanDerWaalsContact CG1-CB 3.46Å; V244-F280 HydrophobicContact CG1-CD2 4.49Å; V244-F280 HydrophobicContact CG1-CE2 4.29Å
245	D	98.7	Very high	96.2	Very high	71 Å²	71	50 Å²	50	38%	0.38	25%	0.248	S	C	.	.	H	α-helix	trans	-63.2	-48.6	177.6	-172.6	65.3	0	0	0	111.8	A241 S242 L243 I247 K248 R249	A241-D245 PolarHBondContact O-N 2.86Å; S242-D245 PolarHBondContact O-N 2.82Å; L243-D245 VanDerWaalsContact C-N 3.33Å; L243-D245 PolarHBondContact O-N 3.49Å; D245-I247 PolarHBondContact O-N 3.16Å; D245-K248 WeakPolarHBondContact O-CB 3.48Å; D245-K248 PolarHBondContact O-N 3.46Å; D245-K248 VanDerWaalsContact O-N 3.08Å; D245-R249 WeakPolarHBondContact O-CG 3.32Å; D245-R249 PolarHBondContact O-N 2.94Å; D245-R249 WeakPolarHBondContact OD2-CD 3.43Å; D245-R249 IonicContact OD2-NH1 3.55Å
246	A	98.8	Very high	96.6	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.4	-49	176.7	0	0	0	0	0	111.4	W212 V218 S242 L243 K248 R249 L250	W212-A246 HydrophobicContact CB-CB 3.93Å; W212-A246 HydrophobicContact CG-CB 4.42Å; V218-A246 HydrophobicContact CG2-CB 4.04Å; S242-A246 VanDerWaalsContact O-CB 3.3Å; S242-A246 WeakPolarHBondContact O-CB 3.48Å; S242-A246 PolarHBondContact O-N 2.84Å; L243-A246 PolarHBondContact O-N 3.17Å; A246-K248 VanDerWaalsContact C-N 3.27Å; A246-K248 PolarHBondContact O-N 2.84Å; A246-R249 PolarHBondContact O-N 3.21Å; A246-L250 HydrophobicContact CB-CD1 4.41Å; A246-L250 VanDerWaalsContact O-CB 3.23Å; A246-L250 WeakPolarHBondContact O-CB 3.47Å; A246-L250 WeakPolarHBondContact O-CD1 3.5Å; A246-L250 WeakPolarHBondContact O-CG 3.33Å; A246-L250 PolarHBondContact O-N 3.43Å
247	I	98.8	Very high	97	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-55.5	-45.6	175.5	-68.1	166.6	0	0	0	110.4	L153 V228 L243 D245 R249 L251 A257 F271 F280	L153-I247 HydrophobicContact CD1-CG1 3.76Å; V228-I247 HydrophobicContact CG1-CG1 4.05Å; V228-I247 HydrophobicContact CG1-CG2 4.46Å; L243-I247 HydrophobicContact CD1-CD1 3.9Å; L243-I247 HydrophobicContact CD1-CG1 4.15Å; L243-I247 HydrophobicContact CG-CD1 3.92Å; L243-I247 WeakPolarHBondContact O-CB 3.5Å; L243-I247 VanDerWaalsContact O-CG1 3.23Å; L243-I247 WeakPolarHBondContact O-CG1 3.32Å; L243-I247 PolarHBondContact O-N 3.04Å; D245-I247 PolarHBondContact O-N 3.16Å; I247-R249 PolarHBondContact O-N 3.08Å; I247-L251 HydrophobicContact CG2-CD1 3.82Å; I247-L251 WeakPolarHBondContact O-CB 3.3Å; I247-L251 WeakPolarHBondContact O-CD1 3.46Å; I247-L251 WeakPolarHBondContact O-CG 3.37Å; I247-L251 PolarHBondContact O-N 3.07Å; I247-A257 HydrophobicContact CG2-CB 3.49Å; I247-A257 VanDerWaalsContact CG2-CB 3.49Å; I247-F271 HydrophobicContact CD1-CE2 4.18Å; I247-F271 HydrophobicContact CD1-CZ 3.97Å; I247-F280 HydrophobicContact CG2-CE1 4.44Å; I247-F280 HydrophobicContact CG2-CZ 3.84Å
248	K	98.6	Very high	97.5	Very high	79 Å²	79	46.6 Å²	46.6	34%	0.343	23%	0.227	S	C	.	.	H	α-helix	trans	-63.6	-43.3	-178.5	-173.8	178.7	175.6	-179.3	0	112.9	V244 D245 A246 A278 F280 K321	V244-K248 WeakPolarHBondContact O-CB 3.43Å; V244-K248 PolarHBondContact O-N 3.4Å; D245-K248 WeakPolarHBondContact O-CB 3.48Å; D245-K248 PolarHBondContact O-N 3.46Å; D245-K248 VanDerWaalsContact O-N 3.08Å; A246-K248 VanDerWaalsContact C-N 3.27Å; A246-K248 PolarHBondContact O-N 2.84Å; K248-A278 HydrophobicContact CD-CB 4.39Å; K248-A278 WeakPolarHBondContact CD-O 3.29Å; K248-A278 VanDerWaalsContact CE-O 3.24Å; K248-A278 WeakPolarHBondContact CE-O 3.42Å; K248-A278 PolarHBondContact NZ-O 3.34Å; K248-F280 HydrophobicContact CB-CE2 3.74Å; K248-F280 HydrophobicContact CB-CZ 3.66Å; K248-F280 HydrophobicContact CG-CE2 4.27Å; K248-F280 HydrophobicContact CG-CZ 4.14Å; K248-K321 PolarHBondContact O-NZ 3.38Å
249	R	98.6	Very high	97.9	Very high	35 Å²	35	40.3 Å²	40.3	13%	0.132	20%	0.198	C	C	.	.	H	α-helix	trans	-75.8	-43.4	-175.7	-68.8	177.1	65.5	-169.1	0.3	111.6	E215 V218 S219 E222 G223 D245 A246 I247 L251	E215-R249 IonicContact OE1-CZ 3.64Å; E215-R249 IonicContact OE1-NH1 2.72Å; E215-R249 PolarHBondContact OE1-NH1 3.11Å; E215-R249 IonicContact OE1-NH2 3.84Å; E215-R249 PolarHBondContact OE1-NH2 2.8Å; E215-R249 IonicContact OE2-CZ 2.97Å; E215-R249 IonicContact OE2-NH1 3.39Å; E215-R249 PolarHBondContact OE2-NH1 3.23Å; E215-R249 IonicContact OE2-NH2 3.86Å; V218-R249 HydrophobicContact CG1-CB 3.72Å; V218-R249 HydrophobicContact CG1-CG 4.44Å; S219-R249 PolarHBondContact OG-NH2 2.95Å; E222-R249 CarbonylContact C-O 3.55Å; E222-R249 WeakPolarHBondContact CA-O 3.19Å; E222-R249 HydrophobicContact CG-CB 4.29Å; E222-R249 WeakPolarHBondContact OE1-CG 3.46Å; E222-R249 IonicContact OE1-CZ 3.91Å; E222-R249 IonicContact OE1-NE 3.93Å; E222-R249 PolarHBondContact OE1-NE 3.45Å; E222-R249 IonicContact OE1-NH2 2.77Å; E222-R249 IonicContact OE2-NH2 3.9Å; G223-R249 PolarHBondContact N-O 3.39Å; D245-R249 WeakPolarHBondContact O-CG 3.32Å; D245-R249 PolarHBondContact O-N 2.94Å; D245-R249 WeakPolarHBondContact OD2-CD 3.43Å; D245-R249 IonicContact OD2-NH1 3.55Å; A246-R249 PolarHBondContact O-N 3.21Å; I247-R249 PolarHBondContact O-N 3.08Å; R249-L251 VanDerWaalsContact C-N 3.26Å; R249-L251 PolarHBondContact O-N 3.19Å
250	L	98.8	Very high	98	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-31.9	178	-66.8	173	0	0	0	112.6	L153 L210 L221 H224 F225 V228 A246	L153-L250 HydrophobicContact CD1-CD1 4.05Å; L153-L250 HydrophobicContact CD2-CD1 3.7Å; L153-L250 HydrophobicContact CG-CD1 4.28Å; L210-L250 HydrophobicContact CD1-CD1 4.01Å; L210-L250 HydrophobicContact CD1-CD2 4.26Å; L221-L250 HydrophobicContact CB-CD2 3.34Å; L221-L250 HydrophobicContact CD1-CD2 4.23Å; L221-L250 HydrophobicContact CG-CD2 4.43Å; H224-L250 PolarHBondContact N-O 3.43Å; F225-L250 HydrophobicContact CD2-CB 4.09Å; F225-L250 HydrophobicContact CD2-CD2 4.46Å; F225-L250 HydrophobicContact CE2-CD2 4.3Å; F225-L250 PolarHBondContact N-O 2.87Å; V228-L250 HydrophobicContact CG2-CB 3.98Å; A246-L250 HydrophobicContact CB-CD1 4.41Å; A246-L250 VanDerWaalsContact O-CB 3.23Å; A246-L250 WeakPolarHBondContact O-CB 3.47Å; A246-L250 WeakPolarHBondContact O-CD1 3.5Å; A246-L250 WeakPolarHBondContact O-CG 3.33Å; A246-L250 PolarHBondContact O-N 3.43Å
251	L	98.8	Very high	98.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	131.3	176.7	-72.9	173.7	0	0	0	112.4	F225 V228 I247 R249 K256 A257 F280 K321	F225-L251 WeakPolarHBondContact O-CA 3.4Å; V228-L251 HydrophobicContact CB-CD2 3.92Å; V228-L251 HydrophobicContact CB-CG 4.19Å; V228-L251 HydrophobicContact CG2-CD2 3.56Å; V228-L251 HydrophobicContact CG2-CG 3.78Å; I247-L251 HydrophobicContact CG2-CD1 3.82Å; I247-L251 WeakPolarHBondContact O-CB 3.3Å; I247-L251 WeakPolarHBondContact O-CD1 3.46Å; I247-L251 WeakPolarHBondContact O-CG 3.37Å; I247-L251 PolarHBondContact O-N 3.07Å; R249-L251 VanDerWaalsContact C-N 3.26Å; R249-L251 PolarHBondContact O-N 3.19Å; L251-K256 WeakPolarHBondContact CD2-O 3.11Å; L251-A257 HydrophobicContact CD1-CB 4.19Å; L251-F280 HydrophobicContact CD1-CE1 4.08Å; L251-F280 HydrophobicContact CD1-CZ 4.43Å; L251-K321 HydrophobicContact CB-CD 4.15Å; L251-K321 PolarHBondContact O-NZ 3.02Å
252	Q	97.8	Very high	98	Very high	62 Å²	62	35.5 Å²	35.5	29%	0.29	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	165.8	164.1	74.5	170.2	-27.5	0	0	111.2	G223 F225 D226 R254 G255	G223-Q252 WeakPolarHBondContact O-CB 3.39Å; F225-Q252 WeakPolarHBondContact O-CG 3.16Å; F225-Q252 PolarHBondContact O-N 2.96Å; D226-Q252 PolarHBondContact OD1-NE2 3.01Å; Q252-R254 PolarHBondContact O-N 3.22Å; Q252-G255 PolarHBondContact O-N 3.34Å
253	P	94.4	Very high	98	Very high	103 Å²	103	39.1 Å²	39.1	67%	0.669	18%	0.176	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-52.5	-33.9	-174.2	-30.4	37	0	0	0	115.7
254	R	92.7	Very high	97.8	Very high	226 Å²	226	41.2 Å²	41.2	85%	0.853	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	14.3	178	-63.5	-174.2	177.1	-168.9	-0.6	113.8	Q252	Q252-R254 PolarHBondContact O-N 3.22Å
255	G	97.3	Very high	97.6	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	161	178.8	0	0	0	0	0	112.2	D226 Q252	D226-G255 CarbonylContact O-C 3.6Å; D226-G255 WeakPolarHBondContact O-CA 3.45Å; Q252-G255 PolarHBondContact O-N 3.34Å
256	K	98.2	Very high	97.6	Very high	121 Å²	121	43.1 Å²	43.1	53%	0.526	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	146.3	-179.1	-53.7	-170.5	179.1	172.6	0	111.1	D226 I227 V228 L251 L319 T320	D226-K256 PolarHBondContact O-N 2.98Å; I227-K256 VanDerWaalsContact CA-O 3.28Å; I227-K256 WeakPolarHBondContact CA-O 3.42Å; V228-K256 PolarHBondContact N-O 3.26Å; V228-K256 VanDerWaalsContact N-O 3.09Å; L251-K256 WeakPolarHBondContact CD2-O 3.11Å; K256-L319 CarbonylContact C-O 3.6Å; K256-L319 VanDerWaalsContact CA-O 3.27Å; K256-L319 WeakPolarHBondContact CA-O 3.38Å; K256-T320 HydrophobicContact CD-CG2 4.09Å; K256-T320 HydrophobicContact CG-CG2 3.92Å
257	A	98.8	Very high	97.5	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	140.9	168.8	0	0	0	0	0	111.7	V228 I247 L251 L318 L319	V228-A257 CarbonylContact O-C 3.58Å; V228-A257 WeakPolarHBondContact O-CA 3.21Å; I247-A257 HydrophobicContact CG2-CB 3.49Å; I247-A257 VanDerWaalsContact CG2-CB 3.49Å; L251-A257 HydrophobicContact CD1-CB 4.19Å; A257-L318 WeakPolarHBondContact O-CA 3.48Å; A257-L319 HydrophobicContact CB-CB 3.82Å; A257-L319 HydrophobicContact CB-CD2 4.49Å; A257-L319 PolarHBondContact N-O 2.81Å; A257-L319 PolarHBondContact O-N 3.39Å
258	M	98.8	Very high	97.5	Very high	7 Å²	7	44 Å²	44	3%	0.034	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	110	171.3	-67.7	176.8	57	0	0	109.1	L134 Y137 I144 F145 I227 V228 M229 C230 F260 L318	L134-M258 HydrophobicContact CD1-CE 4.49Å; Y137-M258 HydrophobicContact CD1-CE 3.51Å; Y137-M258 HydrophobicContact CE1-CE 3.44Å; Y137-M258 VanDerWaalsContact CE1-CE 3.44Å; I144-M258 HydrophobicContact CD1-CE 4.23Å; I144-M258 HydrophobicContact CD1-SD 3.89Å; F145-M258 HydrophobicContact CE1-SD 4.25Å; F145-M258 HydrophobicContact CZ-CE 4.47Å; F145-M258 HydrophobicContact CZ-SD 4.18Å; I227-M258 HydrophobicContact CG2-CG 4.42Å; I227-M258 HydrophobicContact CG2-SD 4.28Å; V228-M258 PolarHBondContact O-N 3.41Å; M229-M258 WeakPolarHBondContact CA-O 3.32Å; M229-M258 HydrophobicContact CB-CB 4.16Å; M229-M258 WeakPolarHBondContact CB-O 3.21Å; C230-M258 PolarHBondContact N-O 3.22Å; C230-M258 VanDerWaalsContact N-O 3.14Å; M258-F260 HydrophobicContact CE-CE2 4.4Å; M258-L318 HydrophobicContact CB-CD2 4.48Å; M258-L318 HydrophobicContact CG-CD2 3.72Å
259	V	98.9	Very high	97.5	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.9	-177.8	-177.9	0	0	0	0	109.3	C230 L234 F271 L317 L319	C230-V259 WeakPolarHBondContact O-CA 3.36Å; L234-V259 HydrophobicContact CD1-CG1 4.13Å; L234-V259 HydrophobicContact CD2-CG1 4.02Å; L234-V259 HydrophobicContact CG-CG1 4.27Å; V259-F271 HydrophobicContact CG2-CE1 4.34Å; V259-F271 HydrophobicContact CG2-CZ 4.24Å; V259-L317 HydrophobicContact CB-CB 4.21Å; V259-L317 PolarHBondContact N-O 3.36Å; V259-L317 PolarHBondContact O-N 3.02Å; V259-L319 HydrophobicContact CG2-CD1 4.32Å
260	F	98.8	Very high	97.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	115.4	171	-81.1	-99.5	0	0	0	109.7	V133 L134 Y137 C230 A231 D232 M258 Y288 P314 L315 L316	V133-F260 HydrophobicContact CG1-CD1 3.82Å; V133-F260 HydrophobicContact CG1-CE1 3.77Å; L134-F260 HydrophobicContact CB-CB 4.15Å; L134-F260 HydrophobicContact CB-CD2 3.81Å; L134-F260 HydrophobicContact CB-CE2 4.38Å; L134-F260 HydrophobicContact CB-CG 4.04Å; L134-F260 HydrophobicContact CD1-CD2 3.46Å; L134-F260 VanDerWaalsContact CD1-CD2 3.46Å; L134-F260 HydrophobicContact CD1-CE2 3.61Å; L134-F260 HydrophobicContact CG-CD2 4.11Å; Y137-F260 HydrophobicContact CD1-CE2 4.17Å; Y137-F260 AromaticContact CD1-CZ 3.99Å; Y137-F260 HydrophobicContact CD1-CZ 3.99Å; Y137-F260 AromaticContact CD2-CZ 3.82Å; Y137-F260 HydrophobicContact CD2-CZ 3.82Å; Y137-F260 HydrophobicContact CE2-CZ 4.38Å; Y137-F260 HydrophobicContact CG-CE2 4.16Å; Y137-F260 AromaticContact CG-CZ 3.59Å; Y137-F260 HydrophobicContact CG-CZ 3.59Å; C230-F260 PolarHBondContact O-N 3.15Å; A231-F260 CarbonylContact C-O 3.58Å; A231-F260 VanDerWaalsContact CA-O 3.28Å; A231-F260 WeakPolarHBondContact CA-O 3.39Å; D232-F260 PolarHBondContact N-O 2.97Å; M258-F260 HydrophobicContact CE-CE2 4.4Å; F260-Y288 HydrophobicContact CD1-CE2 4.47Å; F260-Y288 HydrophobicContact CE1-CD1 4.46Å; F260-Y288 AromaticContact CE1-CD2 3.92Å; F260-Y288 HydrophobicContact CE1-CD2 3.92Å; F260-Y288 HydrophobicContact CE1-CE1 4.2Å; F260-Y288 AromaticContact CE1-CE2 3.62Å; F260-Y288 HydrophobicContact CE1-CE2 3.62Å; F260-Y288 HydrophobicContact CE1-CG 4.33Å; F260-Y288 AromaticContact CE1-CZ 3.77Å; F260-Y288 HydrophobicContact CZ-CD2 4.43Å; F260-P314 HydrophobicContact CB-CB 4.25Å; F260-P314 HydrophobicContact CD1-CB 4.21Å; F260-L315 WeakPolarHBondContact CA-O 3.38Å; F260-L316 HydrophobicContact CD1-CB 4.42Å; F260-L316 HydrophobicContact CD2-CD1 4.06Å; F260-L316 HydrophobicContact CE1-CB 3.92Å; F260-L316 HydrophobicContact CE1-CD1 4.48Å; F260-L316 HydrophobicContact CE2-CB 4.49Å; F260-L316 HydrophobicContact CE2-CD1 3.55Å; F260-L316 HydrophobicContact CE2-CG 4.43Å; F260-L316 HydrophobicContact CZ-CB 3.98Å; F260-L316 HydrophobicContact CZ-CD1 3.78Å; F260-L316 HydrophobicContact CZ-CD2 4.15Å; F260-L316 HydrophobicContact CZ-CG 4.18Å
261	A	98.3	Very high	97.5	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	142.2	177	0	0	0	0	0	112	L234 L268 L315	L234-A261 HydrophobicContact CB-CB 4.45Å; L234-A261 HydrophobicContact CD1-CB 3.54Å; L234-A261 HydrophobicContact CG-CB 3.73Å; A261-L268 HydrophobicContact CB-CD1 4.5Å; A261-L268 WeakPolarHBondContact O-CD1 3.21Å; A261-L315 PolarHBondContact N-O 2.93Å; A261-L315 PolarHBondContact O-N 2.94Å
262	P	97.8	Very high	97.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.217	C	C	.	.			trans	-64.6	159.1	166.7	27.9	-36.5	0	0	0	111.2	S130 D232 R264 L311 Y313	S130-P262 WeakPolarHBondContact OG-CD 3.29Å; D232-P262 WeakPolarHBondContact OD1-CD 3.19Å; P262-R264 HydrophobicContact CB-CG 4.2Å; P262-R264 HydrophobicContact CG-CG 3.76Å; P262-R264 VanDerWaalsContact CG-NE 3.34Å; P262-R264 PolarHBondContact O-N 2.78Å; P262-L311 WeakPolarHBondContact CG-O 3.49Å; P262-Y313 VanDerWaalsContact CA-O 3.22Å; P262-Y313 WeakPolarHBondContact CA-O 3.38Å
263	R	97.4	Very high	97.5	Very high	109 Å²	109	46 Å²	46	41%	0.411	22%	0.224	S	C	.	.			trans	-57.8	-38.8	-179.3	-172.3	-179.6	65.2	104.7	-10.9	112.7	G265 T267 L268 N310	R263-G265 WeakPolarHBondContact CG-O 3.49Å; R263-G265 PolarHBondContact NH1-O 3.34Å; R263-G265 PolarHBondContact O-N 3.25Å; R263-T267 PolarHBondContact O-OG1 2.87Å; R263-L268 PolarHBondContact O-N 3.25Å; R263-N310 PolarHBondContact NE-OD1 2.85Å; R263-N310 VanDerWaalsContact NE-OD1 3.09Å; R263-N310 PolarHBondContact NH2-OD1 2.79Å; R263-N310 VanDerWaalsContact NH2-OD1 3.08Å
264	R	94.7	Very high	97.7	Very high	44 Å²	44	43.9 Å²	43.9	17%	0.166	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	41	61.8	-178.5	-76.4	179.2	-170.8	-64.7	-0.4	112.5	D232 P262 N266 T267 N310 L311	D232-R264 IonicContact OD1-CZ 2.75Å; D232-R264 IonicContact OD1-NE 3.61Å; D232-R264 PolarHBondContact OD1-NE 3.47Å; D232-R264 IonicContact OD1-NH2 3.98Å; D232-R264 IonicContact OD2-CZ 2.66Å; D232-R264 IonicContact OD2-NE 2.83Å; D232-R264 PolarHBondContact OD2-NE 3.44Å; D232-R264 IonicContact OD2-NH2 3.77Å; D232-R264 PolarHBondContact OD2-NH2 2.67Å; P262-R264 HydrophobicContact CB-CG 4.2Å; P262-R264 HydrophobicContact CG-CG 3.76Å; P262-R264 VanDerWaalsContact CG-NE 3.34Å; P262-R264 PolarHBondContact O-N 2.78Å; R264-N266 PolarHBondContact O-N 3.44Å; R264-N266 VanDerWaalsContact O-N 3.17Å; R264-T267 WeakPolarHBondContact CB-OG1 3.24Å; R264-T267 WeakPolarHBondContact O-CG2 2.82Å; R264-T267 PolarHBondContact O-N 2.75Å; R264-T267 PolarHBondContact O-OG1 2.93Å; R264-N310 VanDerWaalsContact CA-O 3.32Å; R264-N310 WeakPolarHBondContact CA-O 3.44Å; R264-N310 PolarHBondContact N-O 2.89Å; R264-L311 HydrophobicContact CG-CD2 4.36Å
265	G	95.7	Very high	98	Very high	30 Å²	30	33.1 Å²	33.1	31%	0.309	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	-106.5	-176.6	0	0	0	0	0	110.7	R263 N310	R263-G265 WeakPolarHBondContact CG-O 3.49Å; R263-G265 PolarHBondContact NH1-O 3.34Å; R263-G265 PolarHBondContact O-N 3.25Å; G265-N310 PolarHBondContact N-OD1 3.23Å
266	N	96.8	Very high	98	Very high	86 Å²	86	38.3 Å²	38.3	46%	0.46	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.3	4.4	-179.7	-157.1	39.9	0	0	0	113.4	R264 L268 N269 Q270	R264-N266 PolarHBondContact O-N 3.44Å; R264-N266 VanDerWaalsContact O-N 3.17Å; N266-L268 PolarHBondContact O-N 2.92Å; N266-N269 PolarHBondContact O-N 3.25Å; N266-N269 WeakPolarHBondContact OD1-CB 3.36Å; N266-N269 PolarHBondContact OD1-ND2 3.41Å; N266-Q270 VanDerWaalsContact O-CG 3.3Å; N266-Q270 WeakPolarHBondContact O-CG 3.36Å; N266-Q270 PolarHBondContact O-N 3.21Å
267	T	97.9	Very high	98	Very high	18 Å²	18	41 Å²	41	11%	0.11	20%	0.202	C	C	.	.	H	α-helix	trans	-64.9	-38.9	-172.8	59.7	0	0	0	0	112.3	L234 R263 R264 Q270 F271	L234-T267 WeakPolarHBondContact O-CB 3.41Å; R263-T267 PolarHBondContact O-OG1 2.87Å; R264-T267 WeakPolarHBondContact CB-OG1 3.24Å; R264-T267 WeakPolarHBondContact O-CG2 2.82Å; R264-T267 PolarHBondContact O-N 2.75Å; R264-T267 PolarHBondContact O-OG1 2.93Å; T267-Q270 PolarHBondContact O-N 2.93Å; T267-F271 PolarHBondContact O-N 3.43Å
268	L	98.4	Very high	98	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.1	-45.7	175.1	-176.8	146.2	0	0	0	111.9	L234 A261 R263 N266 F271 C272 L315 L317	L234-L268 HydrophobicContact CD1-CB 4.29Å; L234-L268 HydrophobicContact CD1-CD1 4.44Å; L234-L268 HydrophobicContact CD1-CG 4.16Å; A261-L268 HydrophobicContact CB-CD1 4.5Å; A261-L268 WeakPolarHBondContact O-CD1 3.21Å; R263-L268 PolarHBondContact O-N 3.25Å; N266-L268 PolarHBondContact O-N 2.92Å; L268-F271 WeakPolarHBondContact O-CB 3.48Å; L268-F271 PolarHBondContact O-N 2.97Å; L268-C272 PolarHBondContact O-N 2.89Å; L268-C272 PolarHBondContact O-SG 2.85Å; L268-C272 VanDerWaalsContact O-SG 3.34Å; L268-L315 HydrophobicContact CD1-CB 4.09Å; L268-L315 HydrophobicContact CD1-CD1 3.91Å; L268-L315 HydrophobicContact CD1-CG 4.39Å; L268-L317 HydrophobicContact CD1-CD1 4.43Å; L268-L317 HydrophobicContact CD2-CD1 4.46Å; L268-L317 HydrophobicContact CD2-CD2 4.42Å; L268-L317 HydrophobicContact CG-CD1 4.18Å
269	N	98.4	Very high	97.9	Very high	52 Å²	52	43 Å²	43	28%	0.278	22%	0.222	S	C	.	.	H	α-helix	trans	-67.2	-37.8	177.9	-65.5	-29.2	0	0	0	111.6	N266 F271 C272 N273	N266-N269 PolarHBondContact O-N 3.25Å; N266-N269 WeakPolarHBondContact OD1-CB 3.36Å; N266-N269 PolarHBondContact OD1-ND2 3.41Å; N269-F271 VanDerWaalsContact C-N 3.27Å; N269-F271 PolarHBondContact O-N 3.02Å; N269-C272 PolarHBondContact O-N 3.39Å; N269-N273 PolarHBondContact O-N 3.12Å; N269-N273 PolarHBondContact O-ND2 2.65Å; N269-N273 PolarHBondContact O-OD1 2.77Å
270	Q	98.6	Very high	97.9	Very high	71 Å²	71	43.1 Å²	43.1	33%	0.332	22%	0.222	S	C	.	.	H	α-helix	trans	-60.8	-38.5	173.9	-73.6	169	-39.4	0	0	111.5	N266 T267 L274	N266-Q270 VanDerWaalsContact O-CG 3.3Å; N266-Q270 WeakPolarHBondContact O-CG 3.36Å; N266-Q270 PolarHBondContact O-N 3.21Å; T267-Q270 PolarHBondContact O-N 2.93Å; Q270-L274 WeakPolarHBondContact O-CG 3.43Å; Q270-L274 PolarHBondContact O-N 2.99Å; Q270-L274 VanDerWaalsContact O-N 3.15Å
271	F	98.8	Very high	97.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-47.9	173.5	172.4	-96.4	0	0	0	111.3	L234 R240 L243 V244 I247 V259 T267 L268 N269 N273 L274 A275 L317 L319	L234-F271 HydrophobicContact CB-CB 4.42Å; L234-F271 HydrophobicContact CD1-CB 4.01Å; L234-F271 HydrophobicContact CD1-CD1 3.88Å; L234-F271 HydrophobicContact CD1-CG 3.97Å; L234-F271 HydrophobicContact CD2-CB 4.08Å; L234-F271 HydrophobicContact CD2-CD1 3.91Å; L234-F271 HydrophobicContact CD2-CD2 3.47Å; L234-F271 VanDerWaalsContact CD2-CD2 3.47Å; L234-F271 HydrophobicContact CD2-CE1 4.18Å; L234-F271 HydrophobicContact CD2-CE2 3.76Å; L234-F271 HydrophobicContact CD2-CG 3.53Å; L234-F271 HydrophobicContact CD2-CZ 4.11Å; L234-F271 HydrophobicContact CG-CB 4.4Å; L234-F271 HydrophobicContact CG-CG 4.28Å; R240-F271 HydrophobicContact CG-CB 4.22Å; R240-F271 HydrophobicContact CG-CD2 4.24Å; L243-F271 HydrophobicContact CD2-CD2 4.37Å; L243-F271 HydrophobicContact CD2-CE2 4Å; L243-F271 HydrophobicContact CG-CE2 4.18Å; V244-F271 HydrophobicContact CG2-CD2 3.58Å; V244-F271 HydrophobicContact CG2-CE2 3.42Å; V244-F271 VanDerWaalsContact CG2-CE2 3.42Å; V244-F271 HydrophobicContact CG2-CZ 4.26Å; I247-F271 HydrophobicContact CD1-CE2 4.18Å; I247-F271 HydrophobicContact CD1-CZ 3.97Å; V259-F271 HydrophobicContact CG2-CE1 4.34Å; V259-F271 HydrophobicContact CG2-CZ 4.24Å; T267-F271 PolarHBondContact O-N 3.43Å; L268-F271 WeakPolarHBondContact O-CB 3.48Å; L268-F271 PolarHBondContact O-N 2.97Å; N269-F271 VanDerWaalsContact C-N 3.27Å; N269-F271 PolarHBondContact O-N 3.02Å; F271-N273 VanDerWaalsContact C-N 3.32Å; F271-N273 PolarHBondContact O-N 3.06Å; F271-L274 PolarHBondContact O-N 3.46Å; F271-L274 VanDerWaalsContact O-N 3.11Å; F271-A275 WeakPolarHBondContact O-CB 3.48Å; F271-A275 PolarHBondContact O-N 3.48Å; F271-L317 HydrophobicContact CD1-CD1 3.94Å; F271-L317 HydrophobicContact CE1-CD1 4.07Å; F271-L319 HydrophobicContact CE1-CD1 4.28Å; F271-L319 HydrophobicContact CE1-CD2 3.94Å; F271-L319 HydrophobicContact CZ-CD2 3.89Å
272	C	98.7	Very high	97.9	Very high	15 Å²	15	47.1 Å²	47.1	10%	0.101	25%	0.247	C	C	.	.	H	α-helix	trans	-55.1	-47.2	176.1	-65.9	0	0	0	0	111.9	L268 N269 L274 A275 E276 I282	L268-C272 PolarHBondContact O-N 2.89Å; L268-C272 PolarHBondContact O-SG 2.85Å; L268-C272 VanDerWaalsContact O-SG 3.34Å; N269-C272 PolarHBondContact O-N 3.39Å; C272-L274 VanDerWaalsContact C-N 3.29Å; C272-L274 PolarHBondContact O-N 2.94Å; C272-A275 PolarHBondContact O-N 3.17Å; C272-A275 VanDerWaalsContact O-N 3.17Å; C272-E276 WeakPolarHBondContact O-CG 3.21Å; C272-E276 PolarHBondContact O-N 2.81Å; C272-I282 HydrophobicContact CB-CD1 3.75Å; C272-I282 WeakPolarHBondContact O-CD1 3.48Å
273	N	98.6	Very high	97.9	Very high	82 Å²	82	52.2 Å²	52.2	44%	0.439	27%	0.271	S	S	.	.	H	α-helix	trans	-60.4	-37.3	178.6	-67.6	-17.6	0	0	0	112.7	N269 F271 K277	N269-N273 PolarHBondContact O-N 3.12Å; N269-N273 PolarHBondContact O-ND2 2.65Å; N269-N273 PolarHBondContact O-OD1 2.77Å; F271-N273 VanDerWaalsContact C-N 3.32Å; F271-N273 PolarHBondContact O-N 3.06Å; N273-K277 WeakPolarHBondContact O-CB 3.24Å; N273-K277 WeakPolarHBondContact O-CD 3.45Å; N273-K277 WeakPolarHBondContact O-CG 3.44Å; N273-K277 PolarHBondContact O-N 2.91Å
274	L	98.6	Very high	97.9	Very high	58 Å²	58	52 Å²	52	30%	0.304	27%	0.27	S	S	.	.	H	α-helix	trans	-72	-41.6	176.1	-73.3	168.6	0	0	0	111.3	R240 A241 V244 Q270 F271 C272 K277 A278	R240-L274 HydrophobicContact CB-CD1 4.23Å; R240-L274 HydrophobicContact CG-CD1 3.75Å; A241-L274 HydrophobicContact CB-CD1 4.44Å; V244-L274 HydrophobicContact CG2-CB 3.95Å; Q270-L274 WeakPolarHBondContact O-CG 3.43Å; Q270-L274 PolarHBondContact O-N 2.99Å; Q270-L274 VanDerWaalsContact O-N 3.15Å; F271-L274 PolarHBondContact O-N 3.46Å; F271-L274 VanDerWaalsContact O-N 3.11Å; C272-L274 VanDerWaalsContact C-N 3.29Å; C272-L274 PolarHBondContact O-N 2.94Å; L274-K277 PolarHBondContact O-N 3.28Å; L274-A278 WeakPolarHBondContact O-CB 3.35Å; L274-A278 PolarHBondContact O-N 2.88Å
275	A	98.6	Very high	98.1	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.8	-43.4	177.6	0	0	0	0	0	112.1	V244 F271 C272 A278 G279 F280 I282 L319	V244-A275 HydrophobicContact CG1-CB 4.27Å; V244-A275 HydrophobicContact CG2-CB 4.28Å; F271-A275 WeakPolarHBondContact O-CB 3.48Å; F271-A275 PolarHBondContact O-N 3.48Å; C272-A275 PolarHBondContact O-N 3.17Å; C272-A275 VanDerWaalsContact O-N 3.17Å; A275-A278 CarbonylContact O-C 3.58Å; A275-A278 WeakPolarHBondContact O-CA 3.3Å; A275-A278 PolarHBondContact O-N 3.19Å; A275-A278 VanDerWaalsContact O-N 3.13Å; A275-G279 PolarHBondContact O-N 2.85Å; A275-G279 VanDerWaalsContact O-N 3.15Å; A275-F280 HydrophobicContact CB-CB 4.24Å; A275-F280 HydrophobicContact CB-CD2 3.96Å; A275-F280 HydrophobicContact CB-CG 4.48Å; A275-F280 WeakPolarHBondContact O-CB 2.99Å; A275-F280 WeakPolarHBondContact O-CD2 3.02Å; A275-F280 PolarHBondContact O-N 3.1Å; A275-I282 HydrophobicContact CB-CD1 3.8Å; A275-L319 HydrophobicContact CB-CD2 3.83Å
276	E	98.4	Very high	98.2	Very high	109 Å²	109	55.7 Å²	55.7	51%	0.509	28%	0.281	S	S	.	.	H	α-helix	trans	-61.1	-45.4	173.8	-72.5	175.7	166.5	0	0	111.7	C272 A278 G279 I282	C272-E276 WeakPolarHBondContact O-CG 3.21Å; C272-E276 PolarHBondContact O-N 2.81Å; E276-A278 PolarHBondContact O-N 3.37Å; E276-G279 WeakPolarHBondContact O-CA 3.23Å; E276-G279 PolarHBondContact O-N 3.01Å; E276-I282 HydrophobicContact CG-CD1 3.85Å; E276-I282 HydrophobicContact CG-CG1 4.21Å
277	K	98.3	Very high	98.3	Very high	178 Å²	178	57.4 Å²	57.4	77%	0.774	29%	0.29	S	S	*	.	H	α-helix	trans	-60.7	-32.4	174	-75	173.9	-177.1	-177.7	0	112.8	N273 L274 G279	N273-K277 WeakPolarHBondContact O-CB 3.24Å; N273-K277 WeakPolarHBondContact O-CD 3.45Å; N273-K277 WeakPolarHBondContact O-CG 3.44Å; N273-K277 PolarHBondContact O-N 2.91Å; L274-K277 PolarHBondContact O-N 3.28Å; K277-G279 PolarHBondContact O-N 3.15Å
278	A	97.6	Very high	98.3	Very high	25 Å²	25	57.8 Å²	57.8	21%	0.207	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-2.7	175	0	0	0	0	0	113.1	V244 K248 L274 A275 E276 F280	V244-A278 HydrophobicContact CG1-CB 3.46Å; V244-A278 VanDerWaalsContact CG1-CB 3.46Å; K248-A278 HydrophobicContact CD-CB 4.39Å; K248-A278 WeakPolarHBondContact CD-O 3.29Å; K248-A278 VanDerWaalsContact CE-O 3.24Å; K248-A278 WeakPolarHBondContact CE-O 3.42Å; K248-A278 PolarHBondContact NZ-O 3.34Å; L274-A278 WeakPolarHBondContact O-CB 3.35Å; L274-A278 PolarHBondContact O-N 2.88Å; A275-A278 CarbonylContact O-C 3.58Å; A275-A278 WeakPolarHBondContact O-CA 3.3Å; A275-A278 PolarHBondContact O-N 3.19Å; A275-A278 VanDerWaalsContact O-N 3.13Å; E276-A278 PolarHBondContact O-N 3.37Å; A278-F280 HydrophobicContact CB-CD2 4.38Å
279	G	96.9	Very high	98.3	Very high	24 Å²	24	58.2 Å²	58.2	25%	0.247	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	29.9	175.9	0	0	0	0	0	114.6	A275 E276 K277 H322	A275-G279 PolarHBondContact O-N 2.85Å; A275-G279 VanDerWaalsContact O-N 3.15Å; E276-G279 WeakPolarHBondContact O-CA 3.23Å; E276-G279 PolarHBondContact O-N 3.01Å; K277-G279 PolarHBondContact O-N 3.15Å; G279-H322 PolarHBondContact O-CD2 3.2Å; G279-H322 PolarHBondContact O-N 2.77Å
280	F	98.4	Very high	98.2	Very high	3 Å²	3	62.4 Å²	62.4	1%	0.013	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	139.9	168.3	-70.8	-76.5	0	0	0	112.3	V244 I247 K248 L251 A275 A278 I282 L319 T320 K321	V244-F280 HydrophobicContact CG1-CD2 4.49Å; V244-F280 HydrophobicContact CG1-CE2 4.29Å; I247-F280 HydrophobicContact CG2-CE1 4.44Å; I247-F280 HydrophobicContact CG2-CZ 3.84Å; K248-F280 HydrophobicContact CB-CE2 3.74Å; K248-F280 HydrophobicContact CB-CZ 3.66Å; K248-F280 HydrophobicContact CG-CE2 4.27Å; K248-F280 HydrophobicContact CG-CZ 4.14Å; L251-F280 HydrophobicContact CD1-CE1 4.08Å; L251-F280 HydrophobicContact CD1-CZ 4.43Å; A275-F280 HydrophobicContact CB-CB 4.24Å; A275-F280 HydrophobicContact CB-CD2 3.96Å; A275-F280 HydrophobicContact CB-CG 4.48Å; A275-F280 WeakPolarHBondContact O-CB 2.99Å; A275-F280 WeakPolarHBondContact O-CD2 3.02Å; A275-F280 PolarHBondContact O-N 3.1Å; A278-F280 HydrophobicContact CB-CD2 4.38Å; F280-I282 HydrophobicContact CB-CG1 4.48Å; F280-L319 HydrophobicContact CB-CB 4.4Å; F280-L319 HydrophobicContact CB-CD2 4.4Å; F280-L319 HydrophobicContact CB-CG 4.4Å; F280-L319 HydrophobicContact CD1-CB 3.81Å; F280-L319 HydrophobicContact CD1-CD2 4.35Å; F280-L319 HydrophobicContact CD1-CG 4.5Å; F280-L319 HydrophobicContact CD2-CD2 4.17Å; F280-L319 HydrophobicContact CE1-CB 4.25Å; F280-L319 HydrophobicContact CE2-CD2 4.47Å; F280-L319 HydrophobicContact CG-CB 4.2Å; F280-L319 HydrophobicContact CG-CD2 4.08Å; F280-L319 HydrophobicContact CG-CG 4.42Å; F280-T320 CarbonylContact C-O 3.49Å; F280-T320 VanDerWaalsContact CA-O 3.31Å; F280-T320 WeakPolarHBondContact CA-O 3.27Å; F280-K321 HydrophobicContact CD1-CG 4.18Å; F280-K321 HydrophobicContact CE1-CG 3.71Å; F280-K321 HydrophobicContact CZ-CG 4.46Å
281	S	98.1	Very high	98.2	Very high	46 Å²	46	62.3 Å²	62.3	32%	0.322	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	134.5	155.8	-63.3	0	0	0	0	109.7	L319 T320 H322	S281-L319 WeakPolarHBondContact O-CA 3.34Å; S281-T320 PolarHBondContact N-O 3.3Å; S281-T320 PolarHBondContact O-N 2.96Å; S281-T320 PolarHBondContact O-OG1 3.42Å; S281-H322 PolarHBondContact OG-CE1 3.11Å; S281-H322 PolarHBondContact OG-ND1 2.93Å
282	I	98.4	Very high	98.1	Very high	40 Å²	40	62.3 Å²	62.3	21%	0.205	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.6	-174.3	-48.7	-176.1	0	0	0	110.1	C272 A275 E276 F280 L317 L318 L319	C272-I282 HydrophobicContact CB-CD1 3.75Å; C272-I282 WeakPolarHBondContact O-CD1 3.48Å; A275-I282 HydrophobicContact CB-CD1 3.8Å; E276-I282 HydrophobicContact CG-CD1 3.85Å; E276-I282 HydrophobicContact CG-CG1 4.21Å; F280-I282 HydrophobicContact CB-CG1 4.48Å; I282-L317 HydrophobicContact CG2-CB 4.31Å; I282-L317 HydrophobicContact CG2-CD2 4.32Å; I282-L318 WeakPolarHBondContact CA-O 3.28Å; I282-L319 HydrophobicContact CG1-CG 4.24Å; I282-L319 HydrophobicContact CG2-CD1 4.26Å
283	Q	98.4	Very high	98.1	Very high	107 Å²	107	62.3 Å²	62.3	50%	0.5	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.6	165.5	-55.4	176.1	28.3	0	0	108.5	L317 L318	Q283-L317 CarbonylContact O-C 3.55Å; Q283-L317 WeakPolarHBondContact O-CA 3.39Å; Q283-L318 HydrophobicContact CB-CB 4.27Å; Q283-L318 PolarHBondContact N-O 3Å; Q283-L318 PolarHBondContact O-N 3.04Å
284	R	98.5	Very high	98	Very high	105 Å²	105	62.7 Å²	62.7	40%	0.396	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.1	177.9	174.3	175.9	162.5	170.2	-2.7	109.4	E286 L317	R284-E286 IonicContact CZ-OE1 3.49Å; R284-E286 IonicContact NE-OE1 3.58Å; R284-E286 PolarHBondContact NE-OE1 3.35Å; R284-E286 IonicContact NH2-OE1 2.69Å; R284-E286 PolarHBondContact NH2-OE1 3.2Å; R284-L317 HydrophobicContact CB-CD2 3.78Å; R284-L317 HydrophobicContact CG-CD2 3.82Å
285	H	98.6	Very high	98	Very high	64 Å²	64	63 Å²	63	30%	0.296	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	121.7	177.3	-55.7	-90.7	0	0	0	109.3	Y288 L316	H285-Y288 WeakPolarHBondContact O-CD1 3.44Å; H285-L316 HydrophobicContact CB-CB 4.17Å; H285-L316 HydrophobicContact CB-CD2 4.38Å; H285-L316 HydrophobicContact CB-CG 4.4Å; H285-L316 PolarHBondContact N-O 2.69Å; H285-L316 PolarHBondContact O-N 2.94Å; H285-L316 VanDerWaalsContact O-N 3.08Å
286	E	97.8	Very high	97.9	Very high	87 Å²	87	63.9 Å²	63.9	41%	0.407	31%	0.314	S	S	.	.	S	Bend	trans	-89.1	-46	172.9	-50.1	-162	156.3	0	0	109.9	R284 Y288 Y313 L315	R284-E286 IonicContact CZ-OE1 3.49Å; R284-E286 IonicContact NE-OE1 3.58Å; R284-E286 PolarHBondContact NE-OE1 3.35Å; R284-E286 IonicContact NH2-OE1 2.69Å; R284-E286 PolarHBondContact NH2-OE1 3.2Å; E286-Y288 WeakPolarHBondContact O-CD1 3.45Å; E286-Y288 WeakPolarHBondContact O-CE1 3.38Å; E286-Y313 PolarHBondContact O-OH 2.75Å; E286-L315 HydrophobicContact CB-CD2 4.1Å; E286-L315 HydrophobicContact CG-CD2 3.99Å
287	N	97.5	Very high	97.9	Very high	122 Å²	122	62.1 Å²	62.1	65%	0.652	31%	0.314	S	S	*	.			trans	-104.1	82	176.7	-57	-73.6	0	0	0	109.9	S293	N287-S293 PolarHBondContact OD1-OG 2.69Å
288	Y	98	Very high	97.8	Very high	26 Å²	26	59 Å²	59	10%	0.102	30%	0.301	C	S	.	.			trans	-95.7	-13.6	-179.7	48	-96.2	0	0	0	113.6	V133 Y137 F260 H285 E286 I292 P314 L316	V133-Y288 HydrophobicContact CG1-CE2 3.76Å; Y137-Y288 HydrophobicContact CD2-CD2 4.14Å; Y137-Y288 HydrophobicContact CE2-CD2 4.32Å; F260-Y288 HydrophobicContact CD1-CE2 4.47Å; F260-Y288 HydrophobicContact CE1-CD1 4.46Å; F260-Y288 AromaticContact CE1-CD2 3.92Å; F260-Y288 HydrophobicContact CE1-CD2 3.92Å; F260-Y288 HydrophobicContact CE1-CE1 4.2Å; F260-Y288 AromaticContact CE1-CE2 3.62Å; F260-Y288 HydrophobicContact CE1-CE2 3.62Å; F260-Y288 HydrophobicContact CE1-CG 4.33Å; F260-Y288 AromaticContact CE1-CZ 3.77Å; F260-Y288 HydrophobicContact CZ-CD2 4.43Å; H285-Y288 WeakPolarHBondContact O-CD1 3.44Å; E286-Y288 WeakPolarHBondContact O-CD1 3.45Å; E286-Y288 WeakPolarHBondContact O-CE1 3.38Å; Y288-I292 HydrophobicContact CE2-CB 4.18Å; Y288-I292 HydrophobicContact CE2-CG1 4.26Å; Y288-I292 HydrophobicContact CE2-CG2 3.89Å; Y288-I292 WeakPolarHBondContact OH-CG2 3.45Å; Y288-P314 WeakPolarHBondContact CE1-O 3.44Å; Y288-P314 PolarHBondContact OH-O 3.47Å; Y288-L316 HydrophobicContact CD1-CB 3.63Å; Y288-L316 HydrophobicContact CE1-CB 4.23Å; Y288-L316 HydrophobicContact CG-CB 3.98Å; Y288-L316 HydrophobicContact CG-CD2 4.3Å
289	D	98.4	Very high	97.8	Very high	8 Å²	8	59 Å²	59	4%	0.043	30%	0.297	C	S	.	.			trans	-149.7	137.3	178.9	-179.4	-90.3	0	0	0	111.3	K140 H291 I292 S293	K140-D289 VanDerWaalsContact CD-OD2 3.25Å; K140-D289 WeakPolarHBondContact CD-OD2 3.24Å; K140-D289 WeakPolarHBondContact CE-OD2 3.43Å; K140-D289 IonicContact NZ-OD2 2.7Å; K140-D289 PolarHBondContact NZ-OD2 2.84Å; D289-H291 WeakPolarHBondContact OD1-CA 3.42Å; D289-H291 WeakPolarHBondContact OD1-CB 3.4Å; D289-H291 PolarHBondContact OD1-N 3.25Å; D289-I292 HydrophobicContact CB-CB 4.02Å; D289-I292 HydrophobicContact CB-CG1 3.83Å; D289-I292 WeakPolarHBondContact OD1-CG1 3.3Å; D289-I292 PolarHBondContact OD1-N 2.89Å; D289-S293 VanDerWaalsContact O-CB 3.31Å; D289-S293 WeakPolarHBondContact O-CB 3.38Å; D289-S293 PolarHBondContact O-N 3.21Å; D289-S293 PolarHBondContact O-OG 3.38Å
290	E	97.7	Very high	97.7	Very high	140 Å²	140	62.5 Å²	62.5	65%	0.654	31%	0.305	S	S	*	.	H	α-helix	trans	-65.5	-45.4	-177.5	-173.6	-178.8	175.5	0	0	112.9	S293 N294	E290-S293 PolarHBondContact O-N 2.76Å; E290-N294 WeakPolarHBondContact O-CB 3.4Å; E290-N294 PolarHBondContact O-N 3.26Å; E290-N294 PolarHBondContact O-ND2 3.44Å
291	H	97.1	Very high	97.6	Very high	69 Å²	69	70.7 Å²	70.7	32%	0.319	34%	0.341	S	S	.	.	H	α-helix	trans	-65.6	-43.6	179.8	-59.8	139.6	0	0	0	110.8	F95 Y136 D289 S293 N294 F295	F95-H291 AromaticContact CD1-CE1 3.62Å; F95-H291 AromaticContact CD1-ND1 3.73Å; F95-H291 HydrophobicContact CE1-CB 4.46Å; F95-H291 AromaticContact CE1-CE1 3.45Å; F95-H291 VanDerWaalsContact CE1-CE1 3.45Å; F95-H291 WeakPolarHBondContact CE1-CE1 3.45Å; F95-H291 AromaticContact CE1-CG 3.79Å; F95-H291 AromaticContact CE1-ND1 3.37Å; F95-H291 WeakPolarHBondContact CE1-ND1 3.07Å; F95-H291 AromaticContact CE1-NE2 3.91Å; F95-H291 HydrophobicContact CZ-CB 4.16Å; F95-H291 AromaticContact CZ-CG 3.98Å; F95-H291 AromaticContact CZ-ND1 3.81Å; Y136-H291 PolarHBondContact OH-ND1 3.21Å; D289-H291 WeakPolarHBondContact OD1-CA 3.42Å; D289-H291 WeakPolarHBondContact OD1-CB 3.4Å; D289-H291 PolarHBondContact OD1-N 3.25Å; H291-S293 VanDerWaalsContact C-N 3.34Å; H291-S293 PolarHBondContact O-N 3.15Å; H291-N294 PolarHBondContact O-N 2.8Å; H291-F295 HydrophobicContact CB-CE2 4.28Å; H291-F295 VanDerWaalsContact O-CD2 3.24Å; H291-F295 WeakPolarHBondContact O-CD2 3.43Å; H291-F295 VanDerWaalsContact O-CG 3.31Å; H291-F295 WeakPolarHBondContact O-CG 3.43Å; H291-F295 PolarHBondContact O-N 3.18Å
292	I	98	Very high	97.5	Very high	0 Å²	0	74 Å²	74	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-63	-41.5	177.5	-57.5	-55.4	0	0	0	111.2	L70 V133 Y136 Y288 D289 N294 F295 H296 Y313	L70-I292 HydrophobicContact CD1-CD1 3.58Å; L70-I292 HydrophobicContact CD2-CD1 3.62Å; L70-I292 HydrophobicContact CG-CD1 4.22Å; V133-I292 HydrophobicContact CG1-CG1 4.44Å; V133-I292 HydrophobicContact CG2-CD1 4.2Å; Y136-I292 HydrophobicContact CD1-CD1 4.1Å; Y136-I292 HydrophobicContact CD1-CG1 4.23Å; Y136-I292 HydrophobicContact CE1-CD1 4.22Å; Y136-I292 HydrophobicContact CE1-CG1 4.12Å; Y288-I292 HydrophobicContact CE2-CB 4.18Å; Y288-I292 HydrophobicContact CE2-CG1 4.26Å; Y288-I292 HydrophobicContact CE2-CG2 3.89Å; Y288-I292 WeakPolarHBondContact OH-CG2 3.45Å; D289-I292 HydrophobicContact CB-CB 4.02Å; D289-I292 HydrophobicContact CB-CG1 3.83Å; D289-I292 WeakPolarHBondContact OD1-CG1 3.3Å; D289-I292 PolarHBondContact OD1-N 2.89Å; I292-N294 VanDerWaalsContact C-N 3.34Å; I292-N294 PolarHBondContact O-N 2.99Å; I292-F295 HydrophobicContact CD1-CD2 4.41Å; I292-F295 PolarHBondContact O-N 2.69Å; I292-H296 VanDerWaalsContact O-CB 3.28Å; I292-H296 WeakPolarHBondContact O-CB 3.43Å; I292-H296 PolarHBondContact O-N 2.94Å; I292-Y313 HydrophobicContact CG2-CE2 3.87Å
293	S	97.8	Very high	97.2	Very high	15 Å²	15	74.8 Å²	74.8	11%	0.105	36%	0.356	C	S	.	.	H	α-helix	trans	-65.2	-37.8	176.9	-54.5	0	0	0	0	112	N287 D289 E290 H291 S297	N287-S293 PolarHBondContact OD1-OG 2.69Å; D289-S293 VanDerWaalsContact O-CB 3.31Å; D289-S293 WeakPolarHBondContact O-CB 3.38Å; D289-S293 PolarHBondContact O-N 3.21Å; D289-S293 PolarHBondContact O-OG 3.38Å; E290-S293 PolarHBondContact O-N 2.76Å; H291-S293 VanDerWaalsContact C-N 3.34Å; H291-S293 PolarHBondContact O-N 3.15Å; S293-S297 WeakPolarHBondContact O-CB 3.43Å; S293-S297 PolarHBondContact O-N 3.41Å; S293-S297 PolarHBondContact O-OG 3.17Å
294	N	97.8	Very high	96.8	Very high	90 Å²	90	73.5 Å²	73.5	48%	0.481	36%	0.357	S	S	.	.	H	α-helix	trans	-67.5	-45	174.6	-72.7	-23.5	0	0	0	111.7	E290 H291 I292 S297 K298	E290-N294 WeakPolarHBondContact O-CB 3.4Å; E290-N294 PolarHBondContact O-N 3.26Å; E290-N294 PolarHBondContact O-ND2 3.44Å; H291-N294 PolarHBondContact O-N 2.8Å; I292-N294 VanDerWaalsContact C-N 3.34Å; I292-N294 PolarHBondContact O-N 2.99Å; N294-S297 PolarHBondContact O-N 3.17Å; N294-K298 WeakPolarHBondContact O-CB 3.43Å; N294-K298 PolarHBondContact O-N 2.94Å
295	F	97.1	Very high	96.3	Very high	66 Å²	66	75.1 Å²	75.1	29%	0.289	37%	0.374	S	S	.	.	H	α-helix	trans	-61.2	-45.1	174.4	-67.6	-38.3	0	0	0	111.6	F68 L70 F95 H291 I292 S297 K298 L299	F68-F295 HydrophobicContact CD1-CB 3.93Å; F68-F295 HydrophobicContact CD1-CD2 4.49Å; F68-F295 HydrophobicContact CE1-CB 4.41Å; L70-F295 HydrophobicContact CD2-CD2 4.17Å; L70-F295 HydrophobicContact CD2-CE2 3.73Å; F95-F295 HydrophobicContact CE2-CE2 4.49Å; F95-F295 HydrophobicContact CZ-CE2 4.15Å; F95-F295 HydrophobicContact CZ-CZ 4.15Å; H291-F295 HydrophobicContact CB-CE2 4.28Å; H291-F295 VanDerWaalsContact O-CD2 3.24Å; H291-F295 WeakPolarHBondContact O-CD2 3.43Å; H291-F295 VanDerWaalsContact O-CG 3.31Å; H291-F295 WeakPolarHBondContact O-CG 3.43Å; H291-F295 PolarHBondContact O-N 3.18Å; I292-F295 HydrophobicContact CD1-CD2 4.41Å; I292-F295 PolarHBondContact O-N 2.69Å; F295-S297 PolarHBondContact O-N 2.98Å; F295-K298 PolarHBondContact O-N 3.32Å; F295-L299 VanDerWaalsContact O-CB 3.3Å; F295-L299 WeakPolarHBondContact O-CB 3.1Å; F295-L299 WeakPolarHBondContact O-CD1 3.49Å; F295-L299 WeakPolarHBondContact O-CG 3.29Å; F295-L299 PolarHBondContact O-N 2.93Å
296	H	97.3	Very high	95.8	Very high	17 Å²	17	75.2 Å²	75.2	8%	0.079	38%	0.376	C	S	.	.	H	α-helix	trans	-55.3	-49.8	175.3	172.4	72.5	0	0	0	112.1	I292 K298 L299 K300 Y307 E309 Y313	I292-H296 VanDerWaalsContact O-CB 3.28Å; I292-H296 WeakPolarHBondContact O-CB 3.43Å; I292-H296 PolarHBondContact O-N 2.94Å; H296-K298 PolarHBondContact O-N 3.23Å; H296-L299 PolarHBondContact O-N 3.01Å; H296-K300 WeakPolarHBondContact CE1-CD 3.22Å; H296-K300 WeakPolarHBondContact NE2-CD 3.48Å; H296-K300 WeakPolarHBondContact O-CG 3.38Å; H296-K300 PolarHBondContact O-N 2.97Å; H296-Y307 AromaticContact ND1-CE1 3.69Å; H296-Y307 AromaticContact ND1-CZ 3.72Å; H296-Y307 PolarHBondContact ND1-OH 3.26Å; H296-E309 IonicContact CE1-OE1 3.15Å; H296-E309 IonicContact CE1-OE2 3.87Å; H296-Y313 HydrophobicContact CB-CD2 3.85Å; H296-Y313 HydrophobicContact CB-CE2 3.51Å; H296-Y313 AromaticContact CE1-CD1 3.8Å; H296-Y313 AromaticContact CE1-CG 3.71Å; H296-Y313 AromaticContact CG-CD2 3.72Å; H296-Y313 AromaticContact CG-CE2 3.62Å; H296-Y313 AromaticContact CG-CZ 3.92Å; H296-Y313 AromaticContact ND1-CD1 3.87Å; H296-Y313 AromaticContact ND1-CD2 3.31Å; H296-Y313 VanDerWaalsContact ND1-CD2 3.31Å; H296-Y313 WeakPolarHBondContact ND1-CD2 3.33Å; H296-Y313 AromaticContact ND1-CE2 3.72Å; H296-Y313 AromaticContact ND1-CG 3.38Å
297	S	97.6	Very high	95.5	Very high	72 Å²	72	71.5 Å²	71.5	50%	0.503	36%	0.358	S	S	.	.	H	α-helix	trans	-61.9	-42.9	179.4	-61.4	0	0	0	0	112	S293 N294 F295 K301	S293-S297 WeakPolarHBondContact O-CB 3.43Å; S293-S297 PolarHBondContact O-N 3.41Å; S293-S297 PolarHBondContact O-OG 3.17Å; N294-S297 PolarHBondContact O-N 3.17Å; F295-S297 PolarHBondContact O-N 2.98Å; S297-K301 PolarHBondContact O-N 3.46Å
298	K	97.3	Very high	95.4	Very high	113 Å²	113	69.3 Å²	69.3	49%	0.491	34%	0.343	S	S	.	.	H	α-helix	trans	-64.2	-50.1	176.8	-172.2	-179.2	178.5	-178.4	0	111.6	N294 F295 H296 K300 K301 E302	N294-K298 WeakPolarHBondContact O-CB 3.43Å; N294-K298 PolarHBondContact O-N 2.94Å; F295-K298 PolarHBondContact O-N 3.32Å; H296-K298 PolarHBondContact O-N 3.23Å; K298-K300 VanDerWaalsContact C-N 3.33Å; K298-K300 PolarHBondContact O-N 3.36Å; K298-K301 PolarHBondContact O-N 2.98Å; K298-E302 VanDerWaalsContact CE-CD 3.46Å; K298-E302 WeakPolarHBondContact CE-OE2 3.39Å; K298-E302 HydrophobicContact CG-CG 4.23Å; K298-E302 IonicContact NZ-OE2 3.62Å; K298-E302 WeakPolarHBondContact O-CB 3.23Å; K298-E302 PolarHBondContact O-N 3.5Å
299	L	96.3	Very high	95.3	Very high	24 Å²	24	71.8 Å²	71.8	13%	0.126	36%	0.356	C	S	.	.	H	α-helix	trans	-61.1	-39.5	-178.9	-73.1	165.1	0	0	0	112	F65 F68 F295 H296 K301 N303 Y307	F65-L299 HydrophobicContact CD2-CD2 4.4Å; F65-L299 HydrophobicContact CE2-CD1 3.6Å; F65-L299 HydrophobicContact CE2-CD2 3.84Å; F65-L299 HydrophobicContact CE2-CG 4.38Å; F65-L299 HydrophobicContact CZ-CD1 3.75Å; F68-L299 HydrophobicContact CD1-CD1 4.01Å; F68-L299 HydrophobicContact CE1-CD1 3.83Å; F295-L299 VanDerWaalsContact O-CB 3.3Å; F295-L299 WeakPolarHBondContact O-CB 3.1Å; F295-L299 WeakPolarHBondContact O-CD1 3.49Å; F295-L299 WeakPolarHBondContact O-CG 3.29Å; F295-L299 PolarHBondContact O-N 2.93Å; H296-L299 PolarHBondContact O-N 3.01Å; L299-K301 VanDerWaalsContact C-N 3.29Å; L299-K301 PolarHBondContact O-N 2.95Å; L299-N303 HydrophobicContact CD2-CB 4.2Å; L299-N303 CarbonylContact O-C 3.55Å; L299-N303 VanDerWaalsContact O-C 3.31Å; L299-N303 WeakPolarHBondContact O-CA 3.32Å; L299-N303 WeakPolarHBondContact O-CB 3.44Å; L299-N303 PolarHBondContact O-N 3.29Å; L299-Y307 HydrophobicContact CB-CD1 3.77Å; L299-Y307 HydrophobicContact CB-CD2 3.95Å; L299-Y307 HydrophobicContact CB-CE1 4.13Å; L299-Y307 HydrophobicContact CB-CE2 4.29Å; L299-Y307 HydrophobicContact CB-CG 3.65Å; L299-Y307 HydrophobicContact CD1-CD2 3.87Å; L299-Y307 HydrophobicContact CD1-CE2 3.8Å; L299-Y307 HydrophobicContact CD1-CG 4.44Å; L299-Y307 HydrophobicContact CG-CD2 4.38Å
300	K	95.9	Very high	95.2	Very high	99 Å²	99	72.9 Å²	72.9	43%	0.43	36%	0.362	S	S	.	.	H	α-helix	trans	-62	-36.4	174.3	-79.5	178.3	63.2	166.6	0	113	H296 K298 Y307 E309	H296-K300 WeakPolarHBondContact CE1-CD 3.22Å; H296-K300 WeakPolarHBondContact NE2-CD 3.48Å; H296-K300 WeakPolarHBondContact O-CG 3.38Å; H296-K300 PolarHBondContact O-N 2.97Å; K298-K300 VanDerWaalsContact C-N 3.33Å; K298-K300 PolarHBondContact O-N 3.36Å; K300-Y307 HydrophobicContact CG-CD1 3.93Å; K300-Y307 HydrophobicContact CG-CE1 3.78Å; K300-E309 WeakPolarHBondContact CE-OE2 3.2Å; K300-E309 IonicContact NZ-OE2 3.31Å; K300-E309 PolarHBondContact NZ-OE2 3.3Å
301	K	96.1	Very high	95	Very high	175 Å²	175	67.5 Å²	67.5	76%	0.761	34%	0.338	S	S	*	.	H	α-helix	trans	-83.8	-43.3	-176.9	-173.8	-179.3	179.2	-175.2	0	112.5	S297 K298 L299	S297-K301 PolarHBondContact O-N 3.46Å; K298-K301 PolarHBondContact O-N 2.98Å; L299-K301 VanDerWaalsContact C-N 3.29Å; L299-K301 PolarHBondContact O-N 2.95Å
302	E	96	Very high	94.9	Very high	114 Å²	114	64.5 Å²	64.5	53%	0.533	32%	0.324	S	S	.	.	H	α-helix	trans	-100.7	-21.1	-168.1	-63.3	-179.3	-164.1	0	0	113.1	K298 P304	K298-E302 VanDerWaalsContact CE-CD 3.46Å; K298-E302 WeakPolarHBondContact CE-OE2 3.39Å; K298-E302 HydrophobicContact CG-CG 4.23Å; K298-E302 IonicContact NZ-OE2 3.62Å; K298-E302 WeakPolarHBondContact O-CB 3.23Å; K298-E302 PolarHBondContact O-N 3.5Å; E302-P304 VanDerWaalsContact C-CD 3.44Å
303	N	92.1	Very high	94.9	Very high	58 Å²	58	64.8 Å²	64.8	31%	0.31	33%	0.325	S	S	.	.			trans	-132.4	42.9	-173	-56.1	106.1	0	0	0	114.3	L299 D305 I306 Y307	L299-N303 HydrophobicContact CD2-CB 4.2Å; L299-N303 CarbonylContact O-C 3.55Å; L299-N303 VanDerWaalsContact O-C 3.31Å; L299-N303 WeakPolarHBondContact O-CA 3.32Å; L299-N303 WeakPolarHBondContact O-CB 3.44Å; L299-N303 PolarHBondContact O-N 3.29Å; N303-D305 PolarHBondContact O-N 3.31Å; N303-D305 VanDerWaalsContact O-N 3.16Å; N303-I306 HydrophobicContact CB-CD1 4.06Å; N303-I306 HydrophobicContact CB-CG1 3.76Å; N303-I306 WeakPolarHBondContact O-CG1 3.44Å; N303-I306 PolarHBondContact O-N 3.47Å; N303-I306 VanDerWaalsContact O-N 3.17Å; N303-Y307 WeakPolarHBondContact O-CB 3.22Å; N303-Y307 PolarHBondContact O-N 2.65Å
304	P	90.9	Very high	95	Very high	79 Å²	79	64 Å²	64	51%	0.513	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.9	-175.7	28.8	-36.8	0	0	0	113.8	E302 I306	E302-P304 VanDerWaalsContact C-CD 3.44Å; P304-I306 VanDerWaalsContact C-N 3.28Å; P304-I306 PolarHBondContact O-N 3.35Å
305	D	86.8	Confident	95	Very high	140 Å²	140	60.1 Å²	60.1	75%	0.749	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-23.6	-179.8	-59.1	-39.6	0	0	0	113	N303	N303-D305 PolarHBondContact O-N 3.31Å; N303-D305 VanDerWaalsContact O-N 3.16Å
306	I	88.1	Confident	95.1	Very high	66 Å²	66	57 Å²	57	34%	0.338	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-31.1	179.9	61.4	171.3	0	0	0	112.1	R64 N303 P304 H312	R64-I306 VanDerWaalsContact CG-O 3.29Å; R64-I306 WeakPolarHBondContact CG-O 3.48Å; R64-I306 PolarHBondContact NE-O 3.35Å; N303-I306 HydrophobicContact CB-CD1 4.06Å; N303-I306 HydrophobicContact CB-CG1 3.76Å; N303-I306 WeakPolarHBondContact O-CG1 3.44Å; N303-I306 PolarHBondContact O-N 3.47Å; N303-I306 VanDerWaalsContact O-N 3.17Å; P304-I306 VanDerWaalsContact C-N 3.28Å; P304-I306 PolarHBondContact O-N 3.35Å; I306-H312 PolarHBondContact O-CE1 3.13Å; I306-H312 PolarHBondContact O-ND1 2.94Å
307	Y	92.8	Very high	95.2	Very high	9 Å²	9	56.2 Å²	56.2	4%	0.035	28%	0.281	C	S	.	.			trans	-99.7	117.1	-175.6	-172.7	-100.2	0	0	0	112.4	F65 F68 H296 L299 K300 N303 E309 H312 Y313	F65-Y307 HydrophobicContact CD1-CD2 4.07Å; F65-Y307 HydrophobicContact CD1-CE2 4.32Å; F65-Y307 AromaticContact CD2-CD2 3.88Å; F65-Y307 HydrophobicContact CD2-CD2 3.88Å; F65-Y307 HydrophobicContact CE1-CD2 4.14Å; F65-Y307 HydrophobicContact CE1-CE2 4.05Å; F65-Y307 AromaticContact CE2-CD2 3.97Å; F65-Y307 HydrophobicContact CE2-CD2 3.97Å; F65-Y307 HydrophobicContact CE2-CE2 4.41Å; F65-Y307 AromaticContact CG-CD2 3.92Å; F65-Y307 HydrophobicContact CG-CD2 3.92Å; F65-Y307 HydrophobicContact CZ-CD2 4.09Å; F65-Y307 HydrophobicContact CZ-CE2 4.09Å; F68-Y307 HydrophobicContact CE1-CE2 4.33Å; F68-Y307 HydrophobicContact CZ-CE2 4.05Å; H296-Y307 AromaticContact ND1-CE1 3.69Å; H296-Y307 AromaticContact ND1-CZ 3.72Å; H296-Y307 PolarHBondContact ND1-OH 3.26Å; L299-Y307 HydrophobicContact CB-CD1 3.77Å; L299-Y307 HydrophobicContact CB-CD2 3.95Å; L299-Y307 HydrophobicContact CB-CE1 4.13Å; L299-Y307 HydrophobicContact CB-CE2 4.29Å; L299-Y307 HydrophobicContact CB-CG 3.65Å; L299-Y307 HydrophobicContact CD1-CD2 3.87Å; L299-Y307 HydrophobicContact CD1-CE2 3.8Å; L299-Y307 HydrophobicContact CD1-CG 4.44Å; L299-Y307 HydrophobicContact CG-CD2 4.38Å; K300-Y307 HydrophobicContact CG-CD1 3.93Å; K300-Y307 HydrophobicContact CG-CE1 3.78Å; N303-Y307 WeakPolarHBondContact O-CB 3.22Å; N303-Y307 PolarHBondContact O-N 2.65Å; Y307-E309 HydrophobicContact CE1-CB 4.5Å; Y307-H312 HydrophobicContact CD2-CB 3.82Å; Y307-H312 AromaticContact CD2-ND1 3.97Å; Y307-H312 HydrophobicContact CE2-CB 3.58Å; Y307-Y313 VanDerWaalsContact OH-CB 3.26Å; Y307-Y313 WeakPolarHBondContact OH-CB 3.4Å; Y307-Y313 WeakPolarHBondContact OH-CD2 3.35Å
308	E	94.8	Very high	95.2	Very high	75 Å²	75	55.1 Å²	55.1	35%	0.35	27%	0.269	S	S	.	.			trans	-119.6	112.3	171.9	-175.3	-175.8	152.4	0	0	109.2	R64 N310 L311 H312	R64-E308 IonicContact CZ-OE2 2.65Å; R64-E308 VanDerWaalsContact NH2-CB 3.28Å; R64-E308 IonicContact NH2-OE2 2.77Å; R64-E308 PolarHBondContact NH2-OE2 3.47Å; E308-N310 HydrophobicContact CG-CB 4.29Å; E308-N310 PolarHBondContact O-N 3.14Å; E308-N310 VanDerWaalsContact O-N 3.16Å; E308-L311 HydrophobicContact CB-CB 4.46Å; E308-L311 HydrophobicContact CB-CD1 4.41Å; E308-L311 HydrophobicContact CB-CG 4.44Å; E308-L311 HydrophobicContact CG-CD1 4.43Å; E308-L311 HydrophobicContact CG-CG 4.27Å; E308-L311 PolarHBondContact O-N 3.17Å; E308-L311 VanDerWaalsContact OE2-CD1 3.3Å; E308-L311 WeakPolarHBondContact OE2-CD1 3.42Å; E308-H312 PolarHBondContact N-ND1 2.97Å; E308-H312 WeakPolarHBondContact O-CB 3.34Å; E308-H312 PolarHBondContact O-N 3.01Å
309	E	96.2	Very high	95.3	Very high	78 Å²	78	49.8 Å²	49.8	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-49.2	-43.8	-178.3	170.1	175.6	-175.8	0	0	112.9	H296 K300 Y307 L311 H312 Y313	H296-E309 IonicContact CE1-OE1 3.15Å; H296-E309 IonicContact CE1-OE2 3.87Å; K300-E309 WeakPolarHBondContact CE-OE2 3.2Å; K300-E309 IonicContact NZ-OE2 3.31Å; K300-E309 PolarHBondContact NZ-OE2 3.3Å; Y307-E309 HydrophobicContact CE1-CB 4.5Å; E309-L311 PolarHBondContact O-N 3.09Å; E309-L311 VanDerWaalsContact O-N 3.13Å; E309-H312 PolarHBondContact O-N 3.14Å; E309-Y313 WeakPolarHBondContact O-CB 3.42Å; E309-Y313 PolarHBondContact O-N 3.44Å
310	N	96.1	Very high	95.4	Very high	31 Å²	31	50.4 Å²	50.4	17%	0.166	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-25.7	179.4	178	65.9	0	0	0	113.7	R263 R264 G265 E308	R263-N310 PolarHBondContact NE-OD1 2.85Å; R263-N310 VanDerWaalsContact NE-OD1 3.09Å; R263-N310 PolarHBondContact NH2-OD1 2.79Å; R263-N310 VanDerWaalsContact NH2-OD1 3.08Å; R264-N310 VanDerWaalsContact CA-O 3.32Å; R264-N310 WeakPolarHBondContact CA-O 3.44Å; R264-N310 PolarHBondContact N-O 2.89Å; G265-N310 PolarHBondContact N-OD1 3.23Å; E308-N310 HydrophobicContact CG-CB 4.29Å; E308-N310 PolarHBondContact O-N 3.14Å; E308-N310 VanDerWaalsContact O-N 3.16Å
311	L	93.6	Very high	95.2	Very high	28 Å²	28	48.4 Å²	48.4	15%	0.147	24%	0.243	C	C	.	.	H	α-helix	trans	-107.5	-27.4	-177.7	-60.2	-179.1	0	0	0	113.2	V62 P262 R264 E308 E309	V62-L311 HydrophobicContact CG1-CD1 4.47Å; P262-L311 WeakPolarHBondContact CG-O 3.49Å; R264-L311 HydrophobicContact CG-CD2 4.36Å; E308-L311 HydrophobicContact CB-CB 4.46Å; E308-L311 HydrophobicContact CB-CD1 4.41Å; E308-L311 HydrophobicContact CB-CG 4.44Å; E308-L311 HydrophobicContact CG-CD1 4.43Å; E308-L311 HydrophobicContact CG-CG 4.27Å; E308-L311 PolarHBondContact O-N 3.17Å; E308-L311 VanDerWaalsContact OE2-CD1 3.3Å; E308-L311 WeakPolarHBondContact OE2-CD1 3.42Å; E309-L311 PolarHBondContact O-N 3.09Å; E309-L311 VanDerWaalsContact O-N 3.13Å
312	H	95.3	Very high	94.5	Very high	5 Å²	5	45.7 Å²	45.7	2%	0.023	23%	0.233	C	C	.	.	H	α-helix	trans	-120.6	-18	-165.1	-54.7	150.4	0	0	0	114.5	V62 F65 I306 Y307 E308 E309 P314	V62-H312 PolarHBondContact O-NE2 2.92Å; F65-H312 WeakPolarHBondContact CB-ND1 3.34Å; F65-H312 HydrophobicContact CD1-CB 3.68Å; F65-H312 AromaticContact CD1-CG 3.77Å; F65-H312 HydrophobicContact CE1-CB 4.17Å; F65-H312 HydrophobicContact CG-CB 4.41Å; F65-H312 AromaticContact CG-ND1 3.97Å; I306-H312 PolarHBondContact O-CE1 3.13Å; I306-H312 PolarHBondContact O-ND1 2.94Å; Y307-H312 HydrophobicContact CD2-CB 3.82Å; Y307-H312 AromaticContact CD2-ND1 3.97Å; Y307-H312 HydrophobicContact CE2-CB 3.58Å; E308-H312 PolarHBondContact N-ND1 2.97Å; E308-H312 WeakPolarHBondContact O-CB 3.34Å; E308-H312 PolarHBondContact O-N 3.01Å; E309-H312 PolarHBondContact O-N 3.14Å; H312-P314 WeakPolarHBondContact O-CD 3.48Å
313	Y	98.1	Very high	92.7	Very high	6 Å²	6	47.3 Å²	47.3	2%	0.024	28%	0.279	C	S	.	.			trans	-92.1	107.4	179.7	-169.4	-125.6	0	0	0	110.6	F68 P262 E286 I292 H296 Y307 E309 L315	F68-Y313 HydrophobicContact CZ-CD2 4.25Å; P262-Y313 VanDerWaalsContact CA-O 3.22Å; P262-Y313 WeakPolarHBondContact CA-O 3.38Å; E286-Y313 PolarHBondContact O-OH 2.75Å; I292-Y313 HydrophobicContact CG2-CE2 3.87Å; H296-Y313 HydrophobicContact CB-CD2 3.85Å; H296-Y313 HydrophobicContact CB-CE2 3.51Å; H296-Y313 AromaticContact CE1-CD1 3.8Å; H296-Y313 AromaticContact CE1-CG 3.71Å; H296-Y313 AromaticContact CG-CD2 3.72Å; H296-Y313 AromaticContact CG-CE2 3.62Å; H296-Y313 AromaticContact CG-CZ 3.92Å; H296-Y313 AromaticContact ND1-CD1 3.87Å; H296-Y313 AromaticContact ND1-CD2 3.31Å; H296-Y313 VanDerWaalsContact ND1-CD2 3.31Å; H296-Y313 WeakPolarHBondContact ND1-CD2 3.33Å; H296-Y313 AromaticContact ND1-CE2 3.72Å; H296-Y313 AromaticContact ND1-CG 3.38Å; Y307-Y313 VanDerWaalsContact OH-CB 3.26Å; Y307-Y313 WeakPolarHBondContact OH-CB 3.4Å; Y307-Y313 WeakPolarHBondContact OH-CD2 3.35Å; E309-Y313 WeakPolarHBondContact O-CB 3.42Å; E309-Y313 PolarHBondContact O-N 3.44Å; Y313-L315 HydrophobicContact CD1-CD2 3.92Å; Y313-L315 HydrophobicContact CE1-CD2 3.97Å; Y313-L315 PolarHBondContact O-N 3.23Å
314	P	98.4	Very high	92.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-73.8	132.3	177.8	28.8	-29.6	0	0	0	109.9	V133 F260 Y288 H312	V133-P314 HydrophobicContact CB-CG 3.79Å; V133-P314 HydrophobicContact CG1-CG 3.93Å; V133-P314 HydrophobicContact CG2-CG 3.78Å; F260-P314 HydrophobicContact CB-CB 4.25Å; F260-P314 HydrophobicContact CD1-CB 4.21Å; Y288-P314 WeakPolarHBondContact CE1-O 3.44Å; Y288-P314 PolarHBondContact OH-O 3.47Å; H312-P314 WeakPolarHBondContact O-CD 3.48Å
315	L	98.8	Very high	92.9	Very high	7 Å²	7	45.1 Å²	45.1	4%	0.037	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	147.1	167.4	-58.1	-179.6	0	0	0	108.9	F260 A261 L268 E286 Y313	F260-L315 WeakPolarHBondContact CA-O 3.38Å; A261-L315 PolarHBondContact N-O 2.93Å; A261-L315 PolarHBondContact O-N 2.94Å; L268-L315 HydrophobicContact CD1-CB 4.09Å; L268-L315 HydrophobicContact CD1-CD1 3.91Å; L268-L315 HydrophobicContact CD1-CG 4.39Å; E286-L315 HydrophobicContact CB-CD2 4.1Å; E286-L315 HydrophobicContact CG-CD2 3.99Å; Y313-L315 HydrophobicContact CD1-CD2 3.92Å; Y313-L315 HydrophobicContact CE1-CD2 3.97Å; Y313-L315 PolarHBondContact O-N 3.23Å
316	L	98.8	Very high	93.2	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	122.8	173	167.2	59	0	0	0	109.8	Y137 F260 H285 Y288 L318	Y137-L316 HydrophobicContact CE2-CD2 4.18Å; F260-L316 HydrophobicContact CD1-CB 4.42Å; F260-L316 HydrophobicContact CD2-CD1 4.06Å; F260-L316 HydrophobicContact CE1-CB 3.92Å; F260-L316 HydrophobicContact CE1-CD1 4.48Å; F260-L316 HydrophobicContact CE2-CB 4.49Å; F260-L316 HydrophobicContact CE2-CD1 3.55Å; F260-L316 HydrophobicContact CE2-CG 4.43Å; F260-L316 HydrophobicContact CZ-CB 3.98Å; F260-L316 HydrophobicContact CZ-CD1 3.78Å; F260-L316 HydrophobicContact CZ-CD2 4.15Å; F260-L316 HydrophobicContact CZ-CG 4.18Å; H285-L316 HydrophobicContact CB-CB 4.17Å; H285-L316 HydrophobicContact CB-CD2 4.38Å; H285-L316 HydrophobicContact CB-CG 4.4Å; H285-L316 PolarHBondContact N-O 2.69Å; H285-L316 PolarHBondContact O-N 2.94Å; H285-L316 VanDerWaalsContact O-N 3.08Å; Y288-L316 HydrophobicContact CD1-CB 3.63Å; Y288-L316 HydrophobicContact CE1-CB 4.23Å; Y288-L316 HydrophobicContact CG-CB 3.98Å; Y288-L316 HydrophobicContact CG-CD2 4.3Å; L316-L318 HydrophobicContact CD1-CD2 3.79Å; L316-L318 HydrophobicContact CD1-CG 4.2Å; L316-L318 HydrophobicContact CD2-CD2 4.44Å; L316-L318 HydrophobicContact CD2-CG 4.45Å; L316-L318 HydrophobicContact CG-CD2 4.32Å; L316-L318 HydrophobicContact CG-CG 4.26Å
317	L	98.9	Very high	93.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.7	165.9	-49.1	177.7	0	0	0	109.8	L234 V259 L268 F271 I282 Q283 R284 L319	L234-L317 HydrophobicContact CD1-CD1 4.38Å; V259-L317 HydrophobicContact CB-CB 4.21Å; V259-L317 PolarHBondContact N-O 3.36Å; V259-L317 PolarHBondContact O-N 3.02Å; L268-L317 HydrophobicContact CD1-CD1 4.43Å; L268-L317 HydrophobicContact CD2-CD1 4.46Å; L268-L317 HydrophobicContact CD2-CD2 4.42Å; L268-L317 HydrophobicContact CG-CD1 4.18Å; F271-L317 HydrophobicContact CD1-CD1 3.94Å; F271-L317 HydrophobicContact CE1-CD1 4.07Å; I282-L317 HydrophobicContact CG2-CB 4.31Å; I282-L317 HydrophobicContact CG2-CD2 4.32Å; Q283-L317 CarbonylContact O-C 3.55Å; Q283-L317 WeakPolarHBondContact O-CA 3.39Å; R284-L317 HydrophobicContact CB-CD2 3.78Å; R284-L317 HydrophobicContact CG-CD2 3.82Å; L317-L319 HydrophobicContact CB-CD1 3.71Å
318	L	98.7	Very high	93.5	Very high	48 Å²	48	40.1 Å²	40.1	25%	0.251	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116.7	168.9	-61.3	177.3	0	0	0	109	A257 M258 I282 Q283 L316	A257-L318 WeakPolarHBondContact O-CA 3.48Å; M258-L318 HydrophobicContact CB-CD2 4.48Å; M258-L318 HydrophobicContact CG-CD2 3.72Å; I282-L318 WeakPolarHBondContact CA-O 3.28Å; Q283-L318 HydrophobicContact CB-CB 4.27Å; Q283-L318 PolarHBondContact N-O 3Å; Q283-L318 PolarHBondContact O-N 3.04Å; L316-L318 HydrophobicContact CD1-CD2 3.79Å; L316-L318 HydrophobicContact CD1-CG 4.2Å; L316-L318 HydrophobicContact CD2-CD2 4.44Å; L316-L318 HydrophobicContact CD2-CG 4.45Å; L316-L318 HydrophobicContact CG-CD2 4.32Å; L316-L318 HydrophobicContact CG-CG 4.26Å
319	L	98.7	Very high	93.5	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137	179.1	-75.2	65.1	0	0	0	109.7	K256 A257 V259 F271 A275 F280 S281 I282 L317	K256-L319 CarbonylContact C-O 3.6Å; K256-L319 VanDerWaalsContact CA-O 3.27Å; K256-L319 WeakPolarHBondContact CA-O 3.38Å; A257-L319 HydrophobicContact CB-CB 3.82Å; A257-L319 HydrophobicContact CB-CD2 4.49Å; A257-L319 PolarHBondContact N-O 2.81Å; A257-L319 PolarHBondContact O-N 3.39Å; V259-L319 HydrophobicContact CG2-CD1 4.32Å; F271-L319 HydrophobicContact CE1-CD1 4.28Å; F271-L319 HydrophobicContact CE1-CD2 3.94Å; F271-L319 HydrophobicContact CZ-CD2 3.89Å; A275-L319 HydrophobicContact CB-CD2 3.83Å; F280-L319 HydrophobicContact CB-CB 4.4Å; F280-L319 HydrophobicContact CB-CD2 4.4Å; F280-L319 HydrophobicContact CB-CG 4.4Å; F280-L319 HydrophobicContact CD1-CB 3.81Å; F280-L319 HydrophobicContact CD1-CD2 4.35Å; F280-L319 HydrophobicContact CD1-CG 4.5Å; F280-L319 HydrophobicContact CD2-CD2 4.17Å; F280-L319 HydrophobicContact CE1-CB 4.25Å; F280-L319 HydrophobicContact CE2-CD2 4.47Å; F280-L319 HydrophobicContact CG-CB 4.2Å; F280-L319 HydrophobicContact CG-CD2 4.08Å; F280-L319 HydrophobicContact CG-CG 4.42Å; S281-L319 WeakPolarHBondContact O-CA 3.34Å; I282-L319 HydrophobicContact CG1-CG 4.24Å; I282-L319 HydrophobicContact CG2-CD1 4.26Å; L317-L319 HydrophobicContact CB-CD1 3.71Å
320	T	97.9	Very high	93.3	Very high	38 Å²	38	34.9 Å²	34.9	23%	0.233	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	135.1	175.5	44.6	0	0	0	0	109.4	K256 F280 S281	K256-T320 HydrophobicContact CD-CG2 4.09Å; K256-T320 HydrophobicContact CG-CG2 3.92Å; F280-T320 CarbonylContact C-O 3.49Å; F280-T320 VanDerWaalsContact CA-O 3.31Å; F280-T320 WeakPolarHBondContact CA-O 3.27Å; S281-T320 PolarHBondContact N-O 3.3Å; S281-T320 PolarHBondContact O-N 2.96Å; S281-T320 PolarHBondContact O-OG1 3.42Å
321	K	92	Very high	93.1	Very high	56 Å²	56	35.2 Å²	35.2	24%	0.243	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	137.9	175.8	-65.6	169.4	78.6	157.9	0	108.7	K248 L251 F280 G323	K248-K321 PolarHBondContact O-NZ 3.38Å; L251-K321 HydrophobicContact CB-CD 4.15Å; L251-K321 PolarHBondContact O-NZ 3.02Å; F280-K321 HydrophobicContact CD1-CG 4.18Å; F280-K321 HydrophobicContact CE1-CG 3.71Å; F280-K321 HydrophobicContact CZ-CG 4.46Å; K321-G323 PolarHBondContact O-N 2.99Å
322	H	81.6	Confident	93	Very high	119 Å²	119	35.8 Å²	35.8	55%	0.551	24%	0.241	S	C	*	.			trans	-59.1	126.5	164	-69.5	-66.8	0	0	0	108	G279 S281	G279-H322 PolarHBondContact O-CD2 3.2Å; G279-H322 PolarHBondContact O-N 2.77Å; S281-H322 PolarHBondContact OG-CE1 3.11Å; S281-H322 PolarHBondContact OG-ND1 2.93Å
323	G	59.1	Low	92.8	Very high	147 Å²	147	38.5 Å²	38.5	100%	1.515	26%	0.261	S	S	*	.			trans	-66.7	0	-179.9	0	0	0	0	0	113.2	K321	K321-G323 PolarHBondContact O-N 2.99Å

Retrieved 323 of 323 residues in 66.8 ms (Link to these results)

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