A0A087XSU6_POEFO Loading...

hypoxia-inducible factor-proline dioxygenase

AlphaFold DB , UniProt , Accession A0A087XSU6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 528 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	35.6	Very low	31.5	Very low	216 Å²	216	151.7 Å²	151.7	100%	1.064	79%	0.79	S	S	*	*				0	74.4	0	-51.2	178.2	-164.3	0	0	108.2
2	E	31.9	Very low	31.2	Very low	180 Å²	180	150.4 Å²	150.4	84%	0.841	79%	0.794	S	S	*	*			cis	63	137.6	30.2	-60.4	162.9	117.6	0	0	112.9
3	S	32	Very low	30.9	Very low	95 Å²	95	150.5 Å²	150.5	66%	0.664	80%	0.795	S	S	*	*			cis	-164.4	175.1	-4.6	-103.2	0	0	0	0	108.8
4	L	35.9	Very low	30.7	Very low	160 Å²	160	146.8 Å²	146.8	84%	0.838	79%	0.787	S	S	*	*			cis	-100.8	-163.5	8.2	-73.1	63	0	0	0	110.2
5	G	29.1	Very low	30.5	Very low	66 Å²	66	152.1 Å²	152.1	68%	0.68	79%	0.792	S	S	*	*			cis	88.8	157.8	7.9	0	0	0	0	0	114.1
6	L	32.6	Very low	30.5	Very low	155 Å²	155	153.1 Å²	153.1	81%	0.812	80%	0.797	S	S	*	*			cis	-171.7	163.1	-6.1	-162.7	73.4	0	0	0	109
7	K	30.8	Very low	30.3	Very low	162 Å²	162	148.1 Å²	148.1	70%	0.704	79%	0.792	S	S	*	*			trans	74.9	144.6	165.6	-67	178.5	167.6	-86.1	0	118
8	E	29.8	Very low	30.6	Very low	145 Å²	145	147 Å²	147	68%	0.678	79%	0.794	S	S	*	*			cis	-154	175.1	-17.4	-131.1	169	139.1	0	0	114.4
9	L	31.4	Very low	30.5	Very low	140 Å²	140	145.6 Å²	145.6	73%	0.733	79%	0.791	S	S	*	*			trans	-48.5	150.2	178.5	-68.5	152.3	0	0	0	116.5
10	L	27.8	Very low	30.4	Very low	172 Å²	172	146.3 Å²	146.3	90%	0.901	79%	0.792	S	S	*	*				-158.5	153.6	107.5	-106.7	169.5	0	0	0	112.1
11	K	29.6	Very low	30.3	Very low	178 Å²	178	148.5 Å²	148.5	77%	0.774	80%	0.795	S	S	*	*			trans	-143.6	117.2	-173.7	-171.5	-177.2	-172.1	179.7	0	110.1
12	T	27.4	Very low	29.9	Very low	136 Å²	136	143.7 Å²	143.7	83%	0.834	78%	0.782	S	S	*	*			trans	-134.3	142	172	46.6	0	0	0	0	110.3
13	N	27.5	Very low	29.8	Very low	151 Å²	151	143.6 Å²	143.6	81%	0.807	78%	0.782	S	S	*	*			trans	-94.9	156.6	179.7	-62.1	-52.1	0	0	0	111
14	S	27.8	Very low	29.8	Very low	99 Å²	99	142.9 Å²	142.9	69%	0.692	78%	0.777	S	S	*	*				137.7	123.2	119.8	-162.4	0	0	0	0	116
15	R	28.6	Very low	29.8	Very low	227 Å²	227	143.3 Å²	143.3	86%	0.857	78%	0.775	S	S	*	*			trans	79.2	145.9	140.1	-88.3	179.4	179.3	-158.4	-1.5	123
16	L	30.2	Very low	30	Very low	168 Å²	168	146.7 Å²	146.7	88%	0.88	77%	0.773	S	S	*	*			trans	85	113.1	153.8	-70.5	158	0	0	0	120.6
17	G	28	Very low	30.2	Very low	68 Å²	68	148.6 Å²	148.6	70%	0.701	77%	0.769	S	S	*	*				99.1	124.3	129.7	0	0	0	0	0	117.8
18	P	35.7	Very low	30.3	Very low	128 Å²	128	150.3 Å²	150.3	83%	0.831	77%	0.771	S	S	*	*			trans	-84.5	144.3	166	34.5	-31.9	0	0	0	111.2
19	T	26.9	Very low	30.6	Very low	121 Å²	121	146.4 Å²	146.4	74%	0.742	76%	0.76	S	S	*	*			trans	-122.7	118.7	164.4	-57.2	0	0	0	0	108.8	F21	T19-F21 HydrophobicContact CG2-CD2 4.14Å; T19-F21 HydrophobicContact CG2-CE2 4.05Å
20	I	29.9	Very low	30.9	Very low	158 Å²	158	145.5 Å²	145.5	81%	0.81	75%	0.752	S	S	*	*			trans	-83.6	133.4	173.7	-63.2	170.1	0	0	0	107.9
21	F	27.9	Very low	31.4	Very low	193 Å²	193	144.2 Å²	144.2	85%	0.846	74%	0.741	S	S	*	*			trans	-111.7	139.1	162.2	-99.4	-89.4	0	0	0	110	T19	T19-F21 HydrophobicContact CG2-CD2 4.14Å; T19-F21 HydrophobicContact CG2-CE2 4.05Å
22	S	27.1	Very low	31.6	Very low	115 Å²	115	139 Å²	139	80%	0.804	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-82.2	135.5	-172.7	-166.7	0	0	0	0	111.5
23	E	29.1	Very low	32	Very low	179 Å²	179	138.8 Å²	138.8	84%	0.836	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-76.2	129.2	173.7	-166.7	169.7	-149.4	0	0	110
24	S	32.1	Very low	32.5	Very low	79 Å²	79	136.5 Å²	136.5	55%	0.552	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-81.5	141.3	-165.6	61.6	0	0	0	0	114.2	E26	S24-E26 VanDerWaalsContact C-N 3.26Å; S24-E26 PolarHBondContact O-N 3.33Å
25	Q	36.7	Very low	32.8	Very low	170 Å²	170	140 Å²	140	79%	0.794	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-17.8	-168.1	-154.7	160.3	-72.4	0	0	114.2	R28 S29	Q25-R28 PolarHBondContact O-N 3.2Å; Q25-S29 PolarHBondContact O-N 3.45Å
26	E	32.9	Very low	32.9	Very low	136 Å²	136	133.5 Å²	133.5	64%	0.636	68%	0.682	S	S	*	*	H	α-helix	trans	-66.7	-39	-173	-65.3	173.1	111.8	0	0	114.2	S24 R28 S29 Q30	S24-E26 VanDerWaalsContact C-N 3.26Å; S24-E26 PolarHBondContact O-N 3.33Å; E26-R28 PolarHBondContact O-N 3.09Å; E26-S29 WeakPolarHBondContact O-CB 3.3Å; E26-S29 PolarHBondContact O-N 3.09Å; E26-S29 VanDerWaalsContact O-N 3.13Å; E26-Q30 PolarHBondContact O-N 3.4Å; E26-Q30 VanDerWaalsContact O-N 3.09Å
27	R	35.9	Very low	33	Very low	196 Å²	196	129.4 Å²	129.4	74%	0.74	67%	0.667	S	S	*	*	H	α-helix	trans	-59.9	-34.3	178.1	-84.4	-173	171.8	-179.1	-1.2	111.9	Q31	R27-Q31 VanDerWaalsContact O-CB 3.3Å; R27-Q31 WeakPolarHBondContact O-CB 3.49Å; R27-Q31 PolarHBondContact O-N 3.13Å; R27-Q31 VanDerWaalsContact O-N 3.13Å
28	R	34.3	Very low	33.4	Very low	197 Å²	197	133.7 Å²	133.7	74%	0.743	66%	0.664	S	S	*	*	H	α-helix	trans	-71.6	-37.1	178.7	-158.3	174.8	-169.2	170.8	4.1	111.5	Q25 E26 T32	Q25-R28 PolarHBondContact O-N 3.2Å; E26-R28 PolarHBondContact O-N 3.09Å; R28-T32 WeakPolarHBondContact O-CB 3.49Å; R28-T32 PolarHBondContact O-N 3.25Å; R28-T32 VanDerWaalsContact O-N 3.09Å; R28-T32 PolarHBondContact O-OG1 3.31Å
29	S	36.2	Very low	33.4	Very low	63 Å²	63	133.5 Å²	133.5	44%	0.441	65%	0.652	S	S	.	*	H	α-helix	trans	-63.6	-54.4	175.4	-56.2	0	0	0	0	111.4	Q25 E26 Q31 T32 E33	Q25-S29 PolarHBondContact O-N 3.45Å; E26-S29 WeakPolarHBondContact O-CB 3.3Å; E26-S29 PolarHBondContact O-N 3.09Å; E26-S29 VanDerWaalsContact O-N 3.13Å; S29-Q31 VanDerWaalsContact C-N 3.32Å; S29-Q31 PolarHBondContact O-N 3.13Å; S29-T32 WeakPolarHBondContact O-CA 3.39Å; S29-T32 WeakPolarHBondContact O-CB 3.47Å; S29-T32 PolarHBondContact O-N 2.69Å; S29-E33 PolarHBondContact O-N 3.45Å
30	Q	37.6	Very low	33.7	Very low	122 Å²	122	130.8 Å²	130.8	57%	0.57	64%	0.641	S	S	*	*	H	α-helix	trans	-59.3	-41.6	179.8	-68.3	179.4	-4.9	0	0	112.2	E26 T32 E33 I34	E26-Q30 PolarHBondContact O-N 3.4Å; E26-Q30 VanDerWaalsContact O-N 3.09Å; Q30-T32 VanDerWaalsContact C-N 3.26Å; Q30-T32 PolarHBondContact O-N 2.9Å; Q30-E33 PolarHBondContact O-N 3.35Å; Q30-I34 WeakPolarHBondContact O-CD1 3.26Å; Q30-I34 VanDerWaalsContact O-CG1 3.26Å; Q30-I34 WeakPolarHBondContact O-CG1 3.44Å; Q30-I34 PolarHBondContact O-N 3.06Å
31	Q	37.8	Very low	34.3	Very low	145 Å²	145	128.4 Å²	128.4	68%	0.678	63%	0.63	S	S	*	*	H	α-helix	trans	-66.2	-28.3	176.8	-165.4	170	37	0	0	112.7	R27 S29 Y35	R27-Q31 VanDerWaalsContact O-CB 3.3Å; R27-Q31 WeakPolarHBondContact O-CB 3.49Å; R27-Q31 PolarHBondContact O-N 3.13Å; R27-Q31 VanDerWaalsContact O-N 3.13Å; S29-Q31 VanDerWaalsContact C-N 3.32Å; S29-Q31 PolarHBondContact O-N 3.13Å; Q31-Y35 PolarHBondContact O-N 3.36Å
32	T	35	Very low	34.9	Very low	69 Å²	69	121.2 Å²	121.2	42%	0.423	60%	0.6	S	S	.	*	H	α-helix	trans	-78.8	-40.5	175.7	-55.3	0	0	0	0	111.9	R28 S29 Q30 Y35 N36	R28-T32 WeakPolarHBondContact O-CB 3.49Å; R28-T32 PolarHBondContact O-N 3.25Å; R28-T32 VanDerWaalsContact O-N 3.09Å; R28-T32 PolarHBondContact O-OG1 3.31Å; S29-T32 WeakPolarHBondContact O-CA 3.39Å; S29-T32 WeakPolarHBondContact O-CB 3.47Å; S29-T32 PolarHBondContact O-N 2.69Å; Q30-T32 VanDerWaalsContact C-N 3.26Å; Q30-T32 PolarHBondContact O-N 2.9Å; T32-Y35 WeakPolarHBondContact O-CB 3.39Å; T32-Y35 PolarHBondContact O-N 2.98Å; T32-Y35 VanDerWaalsContact O-N 3.14Å; T32-N36 VanDerWaalsContact O-CG 3.23Å; T32-N36 PolarHBondContact O-N 3.32Å; T32-N36 PolarHBondContact O-ND2 3.14Å
33	E	34.5	Very low	35.7	Very low	131 Å²	131	116.5 Å²	116.5	61%	0.612	57%	0.569	S	S	*	*	H	α-helix	trans	-63.6	-41.4	176.2	-70.9	177.8	150.7	0	0	112	S29 Q30 Y35 N36 S37	S29-E33 PolarHBondContact O-N 3.45Å; Q30-E33 PolarHBondContact O-N 3.35Å; E33-Y35 VanDerWaalsContact C-N 3.3Å; E33-Y35 PolarHBondContact O-N 3.47Å; E33-N36 PolarHBondContact O-N 2.95Å; E33-S37 WeakPolarHBondContact O-CB 3.42Å; E33-S37 PolarHBondContact O-N 3.37Å
34	I	38.9	Very low	36.5	Very low	102 Å²	102	110 Å²	110	52%	0.523	54%	0.54	S	S	.	.	H	α-helix	trans	-60.9	-40.1	172.3	-67.6	167.5	0	0	0	110.8	Q30 Y38	Q30-I34 WeakPolarHBondContact O-CD1 3.26Å; Q30-I34 VanDerWaalsContact O-CG1 3.26Å; Q30-I34 WeakPolarHBondContact O-CG1 3.44Å; Q30-I34 PolarHBondContact O-N 3.06Å; I34-Y38 HydrophobicContact CG2-CD2 4.03Å; I34-Y38 HydrophobicContact CG2-CE2 3.69Å; I34-Y38 WeakPolarHBondContact O-CD2 3.15Å; I34-Y38 PolarHBondContact O-N 3.44Å
35	Y	33.5	Very low	36.8	Very low	173 Å²	173	111.8 Å²	111.8	68%	0.678	54%	0.543	S	S	*	.	H	α-helix	trans	-66.5	-44.2	177.8	-149.3	-95.5	0	0	0	112.2	Q31 T32 E33 S37 Y38 Q39	Q31-Y35 PolarHBondContact O-N 3.36Å; T32-Y35 WeakPolarHBondContact O-CB 3.39Å; T32-Y35 PolarHBondContact O-N 2.98Å; T32-Y35 VanDerWaalsContact O-N 3.14Å; E33-Y35 VanDerWaalsContact C-N 3.3Å; E33-Y35 PolarHBondContact O-N 3.47Å; Y35-S37 PolarHBondContact O-N 3.34Å; Y35-Y38 PolarHBondContact O-N 3.14Å; Y35-Q39 PolarHBondContact O-N 2.9Å; Y35-Q39 VanDerWaalsContact O-N 3.08Å
36	N	31.4	Very low	37	Very low	91 Å²	91	107.3 Å²	107.3	49%	0.487	54%	0.543	S	S	.	.	H	α-helix	trans	-65.2	-37.8	178.5	-68.5	-16.5	0	0	0	112.2	T32 E33 Q39	T32-N36 VanDerWaalsContact O-CG 3.23Å; T32-N36 PolarHBondContact O-N 3.32Å; T32-N36 PolarHBondContact O-ND2 3.14Å; E33-N36 PolarHBondContact O-N 2.95Å; N36-Q39 PolarHBondContact O-N 2.88Å
37	S	31.7	Very low	38	Very low	81 Å²	81	102.2 Å²	102.2	57%	0.566	52%	0.519	S	S	*	.	H	α-helix	trans	-57.7	-48	174.8	176.9	0	0	0	0	111.9	E33 Y35	E33-S37 WeakPolarHBondContact O-CB 3.42Å; E33-S37 PolarHBondContact O-N 3.37Å; Y35-S37 PolarHBondContact O-N 3.34Å
38	Y	37.2	Very low	38.8	Very low	159 Å²	159	96.9 Å²	96.9	62%	0.624	51%	0.51	S	S	*	.	H	α-helix	trans	-75.7	-23.6	179.6	-66.9	-55	0	0	0	114.1	I34 Y35 A40 D41 M42	I34-Y38 HydrophobicContact CG2-CD2 4.03Å; I34-Y38 HydrophobicContact CG2-CE2 3.69Å; I34-Y38 WeakPolarHBondContact O-CD2 3.15Å; I34-Y38 PolarHBondContact O-N 3.44Å; Y35-Y38 PolarHBondContact O-N 3.14Å; Y38-A40 PolarHBondContact O-N 3.41Å; Y38-A40 VanDerWaalsContact O-N 3.15Å; Y38-D41 PolarHBondContact O-N 3.09Å; Y38-M42 WeakPolarHBondContact O-CG 3.4Å
39	Q	35.4	Very low	40.1	Very low	124 Å²	124	89.3 Å²	89.3	58%	0.579	49%	0.49	S	S	*	.	H	α-helix	trans	-60.2	-26.1	179.2	-173.5	170.4	-15	0	0	113.2	Y35 N36 D41	Y35-Q39 PolarHBondContact O-N 2.9Å; Y35-Q39 VanDerWaalsContact O-N 3.08Å; N36-Q39 PolarHBondContact O-N 2.88Å; Q39-D41 PolarHBondContact O-N 3.35Å
40	A	32.3	Very low	40.5	Very low	63 Å²	63	88.9 Å²	88.9	52%	0.521	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.1	-176.7	0	0	0	0	0	115.4	Y38 N45	Y38-A40 PolarHBondContact O-N 3.41Å; Y38-A40 VanDerWaalsContact O-N 3.15Å; A40-N45 PolarHBondContact O-ND2 3.13Å
41	D	43.7	Very low	40.9	Very low	109 Å²	109	87.5 Å²	87.5	58%	0.583	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	11	-172.4	-164.7	41.9	0	0	0	113.8	Y38 Q39 G43 Y299	Y38-D41 PolarHBondContact O-N 3.09Å; Q39-D41 PolarHBondContact O-N 3.35Å; D41-G43 PolarHBondContact O-N 3.5Å; D41-Y299 PolarHBondContact OD2-OH 3.37Å
42	M	40.3	Very low	41.7	Very low	42 Å²	42	84.7 Å²	84.7	21%	0.207	49%	0.49	C	S	.	.	S	Bend	trans	-73.8	17.8	-177	-71.4	-69	-80.7	0	0	114.9	Y38 L44 P302 C303	Y38-M42 WeakPolarHBondContact O-CG 3.4Å; M42-L44 WeakPolarHBondContact O-CG 3.37Å; M42-L44 PolarHBondContact O-N 3.08Å; M42-L44 VanDerWaalsContact O-N 3.1Å; M42-P302 HydrophobicContact CE-CB 4.23Å; M42-P302 HydrophobicContact CE-CG 4.2Å; M42-C303 WeakPolarHBondContact CE-SG 3.47Å
43	G	42.7	Very low	42.5	Very low	16 Å²	16	85.4 Å²	85.4	17%	0.165	51%	0.511	C	S	.	.	S	Bend	trans	60.1	20.9	179.6	0	0	0	0	0	114.5	D41 F47	D41-G43 PolarHBondContact O-N 3.5Å; G43-F47 WeakPolarHBondContact O-CE2 3.27Å
44	L	46.4	Very low	43.7	Very low	43 Å²	43	81 Å²	81	23%	0.225	49%	0.493	C	S	.	.			trans	-119.8	8.9	-171.2	-79.5	171.9	0	0	0	115	M42 G46 F47 Y307	M42-L44 WeakPolarHBondContact O-CG 3.37Å; M42-L44 PolarHBondContact O-N 3.08Å; M42-L44 VanDerWaalsContact O-N 3.1Å; L44-G46 PolarHBondContact O-N 3.37Å; L44-F47 VanDerWaalsContact C-CD2 3.45Å; L44-Y307 HydrophobicContact CD1-CD1 4.16Å; L44-Y307 HydrophobicContact CD1-CD2 3.5Å; L44-Y307 HydrophobicContact CD1-CE1 3.98Å; L44-Y307 HydrophobicContact CD1-CE2 3.3Å; L44-Y307 HydrophobicContact CD1-CG 3.95Å
45	N	38.1	Very low	45	Very low	115 Å²	115	81 Å²	81	62%	0.615	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	94.9	-175.6	-64.8	-22.7	0	0	0	112.7	A40	A40-N45 PolarHBondContact O-ND2 3.13Å
46	G	41.1	Very low	46.9	Very low	76 Å²	76	74.2 Å²	74.2	78%	0.784	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.7	-1.2	166.1	0	0	0	0	0	116.9	L44 C48	L44-G46 PolarHBondContact O-N 3.37Å; G46-C48 PolarHBondContact O-N 3.1Å
47	F	54.9	Low	48.5	Very low	29 Å²	29	70.5 Å²	70.5	13%	0.127	45%	0.449	C	S	.	.			trans	-83.8	-7.4	-166	-52.5	-64.2	0	0	0	116.4	G43 L44 V457 N459	G43-F47 WeakPolarHBondContact O-CE2 3.27Å; L44-F47 VanDerWaalsContact C-CD2 3.45Å; F47-V457 VanDerWaalsContact O-O 3.06Å; F47-N459 WeakPolarHBondContact CB-O 2.92Å; F47-N459 WeakPolarHBondContact CD1-O 3.42Å; F47-N459 WeakPolarHBondContact O-CB 3.27Å; F47-N459 PolarHBondContact O-N 3.41Å; F47-N459 PolarHBondContact O-ND2 2.95Å; F47-N459 VanDerWaalsContact O-ND2 3.08Å
48	C	52.8	Low	50	Low	84 Å²	84	69.9 Å²	69.9	57%	0.568	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	117.2	-176.5	-70.3	0	0	0	0	112.7	G46 V456 V457	G46-C48 PolarHBondContact O-N 3.1Å; C48-V456 HydrophobicContact CB-CB 4.17Å; C48-V456 HydrophobicContact CB-CG1 4.29Å; C48-V457 WeakPolarHBondContact CA-O 3.39Å
49	A	59.9	Low	51.8	Low	39 Å²	39	67 Å²	67	32%	0.322	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	164.1	171	0	0	0	0	0	112.4	V456 V457 N459	A49-V456 WeakPolarHBondContact O-CA 3.19Å; A49-V457 PolarHBondContact N-O 3.14Å; A49-V457 PolarHBondContact O-N 2.85Å; A49-N459 VanDerWaalsContact CB-ND2 3.28Å; A49-N459 WeakPolarHBondContact CB-ND2 3.47Å
50	G	44.4	Very low	53.2	Low	53 Å²	53	63.4 Å²	63.4	55%	0.546	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-68.1	152.9	170.6	0	0	0	0	0	112.3	T52	G50-T52 PolarHBondContact O-N 2.64Å
51	P	47.8	Very low	54.6	Low	93 Å²	93	61.6 Å²	61.6	60%	0.604	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-69.9	118.2	-174.4	27.3	-34.4	0	0	0	113.2	V457	P51-V457 HydrophobicContact CB-CG2 4.21Å
52	T	54.2	Low	55.8	Low	86 Å²	86	59.1 Å²	59.1	53%	0.528	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-93.7	137.2	161.6	50.9	0	0	0	0	109.7	G50 T54	G50-T52 PolarHBondContact O-N 2.64Å; T52-T54 PolarHBondContact O-N 3.01Å
53	G	51.8	Low	57	Low	85 Å²	85	60.2 Å²	60.2	88%	0.876	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-74.7	122.2	-175.2	0	0	0	0	0	112.8
54	T	58.8	Low	57.9	Low	37 Å²	37	62.5 Å²	62.5	23%	0.227	42%	0.416	C	S	.	.			trans	-134	135.4	169.9	50.4	0	0	0	0	111	T52 R416 Y450 E479	T52-T54 PolarHBondContact O-N 3.01Å; T54-R416 PolarHBondContact O-NH1 3.39Å; T54-R416 WeakPolarHBondContact OG1-CD 3.43Å; T54-Y450 PolarHBondContact OG1-OH 3.42Å; T54-E479 VanDerWaalsContact CB-OE1 3.25Å; T54-E479 WeakPolarHBondContact CB-OE1 3.5Å; T54-E479 VanDerWaalsContact CG2-OE1 3.31Å; T54-E479 WeakPolarHBondContact CG2-OE1 3.4Å; T54-E479 PolarHBondContact OG1-OE1 3.15Å
55	Q	66	Low	58.3	Low	103 Å²	103	62.9 Å²	62.9	48%	0.481	43%	0.426	S	S	.	.			trans	-65	144.1	175.3	-69.5	-178	-57.2	0	0	110.8	L60 D63	Q55-L60 HydrophobicContact CB-CD2 4.42Å; Q55-L60 HydrophobicContact CB-CG 4.16Å; Q55-D63 PolarHBondContact NE2-OD2 3.39Å
56	T	73.3	Confident	59.3	Low	31 Å²	31	60.8 Å²	60.8	19%	0.19	42%	0.42	C	S	.	.	B	Isolated β-bridge	trans	-80.6	160.4	173.2	63.9	0	0	0	0	112.3	A58 E59 L60 R416	T56-A58 PolarHBondContact O-N 2.67Å; T56-E59 VanDerWaalsContact CB-OE2 3.29Å; T56-E59 WeakPolarHBondContact CB-OE2 3.37Å; T56-E59 WeakPolarHBondContact CG2-OE2 3.42Å; T56-E59 PolarHBondContact N-OE2 3.13Å; T56-E59 PolarHBondContact O-N 3.15Å; T56-E59 VanDerWaalsContact OG1-CD 3.27Å; T56-E59 WeakPolarHBondContact OG1-CG 3.32Å; T56-E59 PolarHBondContact OG1-N 3.49Å; T56-E59 VanDerWaalsContact OG1-N 3.16Å; T56-E59 PolarHBondContact OG1-OE2 3.39Å; T56-L60 WeakPolarHBondContact O-CG 3.48Å; T56-L60 PolarHBondContact O-N 2.86Å; T56-R416 CarbonylContact C-O 3.48Å; T56-R416 WeakPolarHBondContact CA-O 3.48Å; T56-R416 VanDerWaalsContact CB-O 3.31Å; T56-R416 WeakPolarHBondContact CB-O 3.28Å; T56-R416 HydrophobicContact CG2-CG 4.25Å
57	A	66.2	Low	60	Low	12 Å²	12	64 Å²	64	10%	0.099	42%	0.415	C	S	.	.	H	α-helix	trans	-52	-43.2	167.1	0	0	0	0	0	110.7	E59 L60 L61 I353 V415 R416 H417	A57-E59 PolarHBondContact O-N 3.34Å; A57-L60 PolarHBondContact O-N 3.42Å; A57-L61 HydrophobicContact CB-CD1 4.48Å; A57-L61 WeakPolarHBondContact O-CB 3.2Å; A57-L61 VanDerWaalsContact O-CD1 3.23Å; A57-L61 WeakPolarHBondContact O-CD1 3.19Å; A57-L61 WeakPolarHBondContact O-CG 3.45Å; A57-L61 PolarHBondContact O-N 3.3Å; A57-I353 HydrophobicContact CB-CG2 4.36Å; A57-V415 HydrophobicContact CB-CG2 3.89Å; A57-R416 PolarHBondContact N-O 2.97Å; A57-H417 HydrophobicContact CB-CB 4.05Å
58	A	63.5	Low	59.6	Low	69 Å²	69	68 Å²	68	57%	0.57	44%	0.441	S	S	*	.	H	α-helix	trans	-62.7	-40.7	179.7	0	0	0	0	0	112.6	T56 A62	T56-A58 PolarHBondContact O-N 2.67Å; A58-A62 WeakPolarHBondContact O-CB 3.44Å; A58-A62 PolarHBondContact O-N 2.83Å
59	E	74.3	Confident	59.1	Low	97 Å²	97	69.8 Å²	69.8	45%	0.453	45%	0.446	S	S	.	.	H	α-helix	trans	-68.6	-47	174.9	-70.5	155.4	143.8	0	0	111.2	T56 A57 L61 A62 D63	T56-E59 VanDerWaalsContact CB-OE2 3.29Å; T56-E59 WeakPolarHBondContact CB-OE2 3.37Å; T56-E59 WeakPolarHBondContact CG2-OE2 3.42Å; T56-E59 PolarHBondContact N-OE2 3.13Å; T56-E59 PolarHBondContact O-N 3.15Å; T56-E59 VanDerWaalsContact OG1-CD 3.27Å; T56-E59 WeakPolarHBondContact OG1-CG 3.32Å; T56-E59 PolarHBondContact OG1-N 3.49Å; T56-E59 VanDerWaalsContact OG1-N 3.16Å; T56-E59 PolarHBondContact OG1-OE2 3.39Å; A57-E59 PolarHBondContact O-N 3.34Å; E59-L61 VanDerWaalsContact C-N 3.3Å; E59-L61 PolarHBondContact O-N 2.83Å; E59-A62 WeakPolarHBondContact O-CB 3.47Å; E59-A62 PolarHBondContact O-N 2.9Å; E59-A62 VanDerWaalsContact O-N 3.09Å; E59-D63 WeakPolarHBondContact O-CB 3.46Å; E59-D63 PolarHBondContact O-N 3.49Å
60	L	64.3	Low	57.9	Low	50 Å²	50	72.7 Å²	72.7	26%	0.262	46%	0.463	S	S	.	.	H	α-helix	trans	-59.7	-38.4	175.7	-71.6	166.6	0	0	0	112.8	Q55 T56 A57 M64 V415	Q55-L60 HydrophobicContact CB-CD2 4.42Å; Q55-L60 HydrophobicContact CB-CG 4.16Å; T56-L60 WeakPolarHBondContact O-CG 3.48Å; T56-L60 PolarHBondContact O-N 2.86Å; A57-L60 PolarHBondContact O-N 3.42Å; L60-M64 WeakPolarHBondContact O-CB 3.42Å; L60-M64 WeakPolarHBondContact O-CG 3.18Å; L60-M64 PolarHBondContact O-N 2.9Å; L60-V415 HydrophobicContact CD1-CB 3.77Å; L60-V415 HydrophobicContact CD1-CG1 3.81Å; L60-V415 HydrophobicContact CD1-CG2 3.82Å
61	L	62.9	Low	57.8	Low	24 Å²	24	76.1 Å²	76.1	13%	0.126	48%	0.476	C	S	.	.	H	α-helix	trans	-66.6	-38.4	175.2	-73.4	163.2	0	0	0	111.5	A57 E59 A65 Q345 I348 I353	A57-L61 HydrophobicContact CB-CD1 4.48Å; A57-L61 WeakPolarHBondContact O-CB 3.2Å; A57-L61 VanDerWaalsContact O-CD1 3.23Å; A57-L61 WeakPolarHBondContact O-CD1 3.19Å; A57-L61 WeakPolarHBondContact O-CG 3.45Å; A57-L61 PolarHBondContact O-N 3.3Å; E59-L61 VanDerWaalsContact C-N 3.3Å; E59-L61 PolarHBondContact O-N 2.83Å; L61-A65 VanDerWaalsContact O-CB 3.27Å; L61-A65 WeakPolarHBondContact O-CB 3.44Å; L61-A65 PolarHBondContact O-N 3.16Å; L61-Q345 VanDerWaalsContact CD1-OE1 3.31Å; L61-Q345 VanDerWaalsContact CD2-CD 3.47Å; L61-Q345 HydrophobicContact CD2-CG 4.18Å; L61-I348 HydrophobicContact CB-CD1 4.43Å; L61-I348 HydrophobicContact CD2-CB 4.17Å; L61-I348 HydrophobicContact CD2-CD1 3.48Å; L61-I348 VanDerWaalsContact CD2-CD1 3.48Å; L61-I348 HydrophobicContact CD2-CG1 4.38Å; L61-I348 HydrophobicContact CD2-CG2 4.11Å; L61-I353 HydrophobicContact CD1-CD1 4.34Å; L61-I353 HydrophobicContact CD2-CD1 3.47Å; L61-I353 VanDerWaalsContact CD2-CD1 3.47Å; L61-I353 HydrophobicContact CG-CD1 3.95Å
62	A	68.1	Low	57.2	Low	58 Å²	58	74.7 Å²	74.7	48%	0.479	48%	0.479	S	S	.	.	H	α-helix	trans	-70.6	-44.1	175.1	0	0	0	0	0	111.9	A58 E59 M64 A65 S66	A58-A62 WeakPolarHBondContact O-CB 3.44Å; A58-A62 PolarHBondContact O-N 2.83Å; E59-A62 WeakPolarHBondContact O-CB 3.47Å; E59-A62 PolarHBondContact O-N 2.9Å; E59-A62 VanDerWaalsContact O-N 3.09Å; A62-M64 PolarHBondContact O-N 3.36Å; A62-A65 CarbonylContact O-C 3.51Å; A62-A65 PolarHBondContact O-N 3.21Å; A62-S66 PolarHBondContact O-N 3.43Å
63	D	66.4	Low	56.3	Low	64 Å²	64	78.6 Å²	78.6	34%	0.342	50%	0.495	S	S	.	.	H	α-helix	trans	-58.9	-48.9	176	-75.9	-9.6	0	0	0	110.4	Q55 E59 A65 S66 Q67	Q55-D63 PolarHBondContact NE2-OD2 3.39Å; E59-D63 WeakPolarHBondContact O-CB 3.46Å; E59-D63 PolarHBondContact O-N 3.49Å; D63-A65 PolarHBondContact O-N 3.04Å; D63-S66 PolarHBondContact O-N 3.27Å; D63-S66 VanDerWaalsContact O-N 3.16Å; D63-S66 PolarHBondContact O-OG 2.95Å; D63-Q67 WeakPolarHBondContact O-CG 3.27Å; D63-Q67 PolarHBondContact O-N 3.2Å; D63-Q67 VanDerWaalsContact O-N 3.09Å
64	M	59.9	Low	55.4	Low	64 Å²	64	80.9 Å²	80.9	32%	0.315	49%	0.492	S	S	.	.	H	α-helix	trans	-62.7	-38.5	176	-74.9	-170.5	72.1	0	0	112.9	L60 A62 S66 Q67 T68 I348	L60-M64 WeakPolarHBondContact O-CB 3.42Å; L60-M64 WeakPolarHBondContact O-CG 3.18Å; L60-M64 PolarHBondContact O-N 2.9Å; A62-M64 PolarHBondContact O-N 3.36Å; M64-S66 VanDerWaalsContact C-N 3.3Å; M64-S66 PolarHBondContact O-N 3.04Å; M64-Q67 PolarHBondContact O-N 3.13Å; M64-T68 PolarHBondContact O-N 3.02Å; M64-I348 HydrophobicContact CB-CD1 3.61Å; M64-I348 HydrophobicContact CB-CG1 4.26Å; M64-I348 HydrophobicContact CE-CG1 4.05Å; M64-I348 HydrophobicContact CE-CG2 4Å; M64-I348 HydrophobicContact CG-CD1 4.45Å; M64-I348 HydrophobicContact SD-CD1 4.2Å; M64-I348 HydrophobicContact SD-CG1 4.24Å; M64-I348 HydrophobicContact SD-CG2 3.74Å
65	A	56.3	Low	54.1	Low	51 Å²	51	83.7 Å²	83.7	42%	0.421	51%	0.513	S	S	.	.	H	α-helix	trans	-72.1	-21.1	175.6	0	0	0	0	0	113.6	L61 A62 D63 T68 N69	L61-A65 VanDerWaalsContact O-CB 3.27Å; L61-A65 WeakPolarHBondContact O-CB 3.44Å; L61-A65 PolarHBondContact O-N 3.16Å; A62-A65 CarbonylContact O-C 3.51Å; A62-A65 PolarHBondContact O-N 3.21Å; D63-A65 PolarHBondContact O-N 3.04Å; A65-T68 PolarHBondContact O-OG1 3.42Å; A65-T68 VanDerWaalsContact O-OG1 3.09Å; A65-N69 PolarHBondContact O-ND2 2.61Å
66	S	58.4	Low	52.4	Low	72 Å²	72	84.7 Å²	84.7	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-76.8	-39.8	171.8	80	0	0	0	0	111.7	A62 D63 M64 T68 N69	A62-S66 PolarHBondContact O-N 3.43Å; D63-S66 PolarHBondContact O-N 3.27Å; D63-S66 VanDerWaalsContact O-N 3.16Å; D63-S66 PolarHBondContact O-OG 2.95Å; M64-S66 VanDerWaalsContact C-N 3.3Å; M64-S66 PolarHBondContact O-N 3.04Å; S66-T68 VanDerWaalsContact C-N 3.31Å; S66-T68 PolarHBondContact O-N 2.97Å; S66-N69 PolarHBondContact O-N 2.81Å
67	Q	55.7	Low	50.6	Low	142 Å²	142	89.8 Å²	89.8	66%	0.664	56%	0.56	S	S	*	*	H	α-helix	trans	-68.2	-27.1	-177.8	-70.6	177.9	33.6	0	0	113.3	D63 M64 N69	D63-Q67 WeakPolarHBondContact O-CG 3.27Å; D63-Q67 PolarHBondContact O-N 3.2Å; D63-Q67 VanDerWaalsContact O-N 3.09Å; M64-Q67 PolarHBondContact O-N 3.13Å; Q67-N69 PolarHBondContact O-N 3.28Å
68	T	45.8	Very low	49	Very low	113 Å²	113	98.8 Å²	98.8	69%	0.693	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-9.6	172.4	53	0	0	0	0	113.7	M64 A65 S66	M64-T68 PolarHBondContact O-N 3.02Å; A65-T68 PolarHBondContact O-OG1 3.42Å; A65-T68 VanDerWaalsContact O-OG1 3.09Å; S66-T68 VanDerWaalsContact C-N 3.31Å; S66-T68 PolarHBondContact O-N 2.97Å
69	N	44.1	Very low	47.4	Very low	122 Å²	122	104.7 Å²	104.7	65%	0.652	61%	0.612	S	S	*	*			trans	-112.4	52.2	-180	-71.9	-79.1	0	0	0	112.1	A65 S66 Q67 P71	A65-N69 PolarHBondContact O-ND2 2.61Å; S66-N69 PolarHBondContact O-N 2.81Å; Q67-N69 PolarHBondContact O-N 3.28Å; N69-P71 WeakPolarHBondContact O-CD 3.38Å
70	S	33.8	Very low	45.4	Very low	100 Å²	100	105.4 Å²	105.4	70%	0.699	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-64.8	125.9	169.3	-68.4	0	0	0	0	110.7
71	P	43.3	Very low	43.9	Very low	125 Å²	125	112.9 Å²	112.9	81%	0.812	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-61	142.2	174.7	-23.5	34.5	0	0	0	112.1	N69	N69-P71 WeakPolarHBondContact O-CD 3.38Å
72	G	34.4	Very low	42.4	Very low	64 Å²	64	118 Å²	118	66%	0.66	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-62	148.7	-179.3	0	0	0	0	0	113.4	T74	G72-T74 PolarHBondContact O-N 3.3Å; G72-T74 VanDerWaalsContact O-N 3.12Å
73	I	34.9	Very low	40.5	Very low	168 Å²	168	118.6 Å²	118.6	86%	0.862	71%	0.708	S	S	*	*			trans	-56.4	114.5	179.6	-61.5	171.5	0	0	0	110.1	S75	I73-S75 PolarHBondContact O-N 2.83Å
74	T	32.8	Very low	38.7	Very low	132 Å²	132	122.1 Å²	122.1	81%	0.81	73%	0.732	S	S	*	*			trans	-83.3	100.4	174.7	36.1	0	0	0	0	110.9	G72	G72-T74 PolarHBondContact O-N 3.3Å; G72-T74 VanDerWaalsContact O-N 3.12Å
75	S	31.2	Very low	38.1	Very low	97 Å²	97	124 Å²	124	68%	0.678	75%	0.748	S	S	*	*			trans	-54.7	126.2	173	-58	0	0	0	0	111.4	I73 T77	I73-S75 PolarHBondContact O-N 2.83Å; S75-T77 PolarHBondContact O-N 2.99Å; S75-T77 VanDerWaalsContact O-N 3.07Å
76	P	31.9	Very low	36.8	Very low	124 Å²	124	129 Å²	129	81%	0.805	77%	0.767	S	S	*	*			trans	-78.7	96	-175.2	29.9	-34.7	0	0	0	112.1	K78	P76-K78 PolarHBondContact O-N 3.43Å
77	T	33.8	Very low	35.3	Very low	138 Å²	138	134.9 Å²	134.9	85%	0.847	78%	0.78	S	S	*	*			trans	-68.5	93.6	176	-37.9	0	0	0	0	111.5	S75	S75-T77 PolarHBondContact O-N 2.99Å; S75-T77 VanDerWaalsContact O-N 3.07Å
78	K	34.2	Very low	34	Very low	200 Å²	200	135.2 Å²	135.2	87%	0.87	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-79.4	133.3	170.9	-89.8	-173.1	172.5	-179.2	0	111.5	P76	P76-K78 PolarHBondContact O-N 3.43Å
79	Q	30	Very low	33.2	Very low	193 Å²	193	133.3 Å²	133.3	90%	0.902	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-73.5	155	176	-63.6	-178.2	-0.5	0	0	111.8
80	S	32.1	Very low	32.5	Very low	113 Å²	113	131.1 Å²	131.1	79%	0.79	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-100.7	142.6	-179.8	50.8	0	0	0	0	112.6
81	K	32.6	Very low	32.4	Very low	207 Å²	207	132.8 Å²	132.8	90%	0.9	80%	0.801	S	S	*	*			trans	-167	117.4	154.3	-113.5	163.8	-173.9	177.1	0	113.6
82	S	31	Very low	31.6	Very low	132 Å²	132	133.2 Å²	133.2	92%	0.923	80%	0.801	S	S	*	*			trans	42.9	121.9	147.4	-149.4	0	0	0	0	121.8
83	G	28	Very low	31.2	Very low	70 Å²	70	135.2 Å²	135.2	72%	0.722	81%	0.805	S	S	*	*			trans	167.8	115.4	164.6	0	0	0	0	0	112.7
84	V	28.6	Very low	32	Very low	138 Å²	138	132.2 Å²	132.2	84%	0.836	80%	0.796	S	S	*	*			trans	-155.1	153.7	-167.6	173.7	0	0	0	0	108.5
85	P	47.8	Very low	31.8	Very low	102 Å²	102	131.4 Å²	131.4	66%	0.662	80%	0.796	S	S	*	*			cis	-124	-176	-10.8	35.2	-17.6	0	0	0	114
86	L	28.3	Very low	31.8	Very low	156 Å²	156	130.7 Å²	130.7	82%	0.817	80%	0.796	S	S	*	*				-179	106.9	117.7	-98	161.6	0	0	0	115.4
87	Y	26.3	Very low	31.6	Very low	196 Å²	196	130.8 Å²	130.8	77%	0.769	80%	0.795	S	S	*	*			trans	50.8	136.5	137.5	-101.2	-109.4	0	0	0	126
88	N	29.3	Very low	31.5	Very low	149 Å²	149	129.9 Å²	129.9	80%	0.797	79%	0.789	S	S	*	*			trans	59.1	136.7	157.5	-72.5	-4.3	0	0	0	120.9
89	G	29.8	Very low	31.2	Very low	73 Å²	73	128.7 Å²	128.7	75%	0.753	79%	0.786	S	S	*	*			cis	165.2	151.2	-9.5	0	0	0	0	0	114.7
90	G	28.3	Very low	31.1	Very low	76 Å²	76	123.2 Å²	123.2	78%	0.784	77%	0.774	S	S	*	*			trans	86.1	156.4	172.1	0	0	0	0	0	116.2
91	V	31	Very low	30.9	Very low	136 Å²	136	123 Å²	123	82%	0.824	77%	0.772	S	S	*	*			cis	-151.2	128.9	-8.1	142.6	0	0	0	0	109.4
92	V	28.3	Very low	30.8	Very low	134 Å²	134	121.9 Å²	121.9	81%	0.812	77%	0.77	S	S	*	*			trans	54.7	127.7	146.3	178.5	0	0	0	0	122
93	S	25.5	Very low	30.8	Very low	105 Å²	105	119.6 Å²	119.6	73%	0.734	76%	0.76	S	S	*	*			trans	-91.1	-150.2	167.8	-41.6	0	0	0	0	110.6
94	P	51.3	Low	30.9	Very low	106 Å²	106	125.6 Å²	125.6	69%	0.688	77%	0.769	S	S	*	*			cis	-136.1	-171.1	-17.9	40.4	-21.3	0	0	0	114.9
95	S	28.8	Very low	30.8	Very low	114 Å²	114	124.2 Å²	124.2	80%	0.797	77%	0.772	S	S	*	*			trans	73.5	160.4	152.4	-53.6	0	0	0	0	117.7
96	A	31.2	Very low	29.9	Very low	83 Å²	83	127.5 Å²	127.5	69%	0.686	78%	0.783	S	S	*	*			cis	-150.3	164.2	7	0	0	0	0	0	114.2
97	T	28.3	Very low	29.8	Very low	126 Å²	126	123.6 Å²	123.6	77%	0.773	77%	0.774	S	S	*	*			trans	1.8	151.9	140.5	55.1	0	0	0	0	120.2
98	V	30.2	Very low	29.9	Very low	119 Å²	119	123.3 Å²	123.3	72%	0.721	78%	0.779	S	S	*	*			cis	-163.4	-174.7	8.2	111.9	0	0	0	0	112.2
99	E	29.4	Very low	30.2	Very low	174 Å²	174	121.7 Å²	121.7	81%	0.813	78%	0.775	S	S	*	*			trans	-43.5	173.5	163.8	-36	163	113	0	0	115.2
100	A	27	Very low	30.8	Very low	79 Å²	79	123.8 Å²	123.8	65%	0.653	78%	0.775	S	S	*	*			cis	-161.5	164.2	8.8	0	0	0	0	0	113.1
101	S	29.2	Very low	31	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	78%	0.776	S	S	*	*			trans	62.1	136	134.8	-66.7	0	0	0	0	125.3
102	Q	30.5	Very low	30.8	Very low	183 Å²	183	127.2 Å²	127.2	86%	0.855	77%	0.773	S	S	*	*			trans	84.4	109.1	143.7	-73.6	176.9	17.2	0	0	123
103	A	30.6	Very low	31	Very low	85 Å²	85	131.4 Å²	131.4	70%	0.702	78%	0.776	S	S	*	*				76	121.8	120.9	0	0	0	0	0	123.2
104	E	29.2	Very low	32.1	Very low	195 Å²	195	132.3 Å²	132.3	91%	0.911	78%	0.78	S	S	*	*			trans	48.6	108.7	140.1	-58.7	-171	123.5	0	0	121.9
105	A	27.7	Very low	31.1	Very low	110 Å²	110	131.7 Å²	131.7	91%	0.909	78%	0.783	S	S	*	*			trans	-156.9	160.2	141.3	0	0	0	0	0	112.6
106	L	27.3	Very low	31.4	Very low	170 Å²	170	134.9 Å²	134.9	89%	0.89	79%	0.786	S	S	*	*			trans	-81.5	149.9	-172.4	-86	140.9	0	0	0	115.7
107	A	27.2	Very low	31.4	Very low	75 Å²	75	137.2 Å²	137.2	62%	0.62	79%	0.791	S	S	*	*			trans	53	135.2	140	0	0	0	0	0	121.9
108	H	28.2	Very low	31.5	Very low	189 Å²	189	140 Å²	140	88%	0.875	80%	0.795	S	S	*	*				-170.5	157	104	-103.6	-74.6	0	0	0	112.7
109	T	36.4	Very low	31.4	Very low	116 Å²	116	137.9 Å²	137.9	71%	0.712	80%	0.798	S	S	*	*			trans	-124.4	157.4	174.8	44.3	0	0	0	0	111.5
110	P	41.8	Very low	31.5	Very low	117 Å²	117	139.1 Å²	139.1	76%	0.76	81%	0.806	S	S	*	*			trans	-113	133.4	145.9	27.6	-13.7	0	0	0	110.3
111	H	32.3	Very low	31.6	Very low	174 Å²	174	139 Å²	139	81%	0.806	81%	0.812	S	S	*	*				63.1	131.3	69.5	-75.5	-79.8	0	0	0	112.6
112	S	26.4	Very low	31.6	Very low	110 Å²	110	138.2 Å²	138.2	77%	0.769	81%	0.812	S	S	*	*			cis	-152.7	162.4	35.2	-62.7	0	0	0	0	115.7
113	Y	32	Very low	31.7	Very low	222 Å²	222	138.8 Å²	138.8	87%	0.871	81%	0.812	S	S	*	*			trans	-113.6	171	158.3	-103.6	-87.8	0	0	0	109.3
114	P	48.5	Very low	31.7	Very low	124 Å²	124	141.4 Å²	141.4	81%	0.805	82%	0.819	S	S	*	*			trans	-135.3	170.3	139.1	38.5	-27.6	0	0	0	114.6
115	A	31.3	Very low	31.7	Very low	92 Å²	92	135.8 Å²	135.8	76%	0.76	81%	0.814	S	S	*	*			trans	-157.9	-171.4	178	0	0	0	0	0	108.5
116	Q	34.6	Very low	31.7	Very low	182 Å²	182	134.5 Å²	134.5	85%	0.85	81%	0.811	S	S	*	*			cis	-157.2	-121.3	10.4	-158.8	179.4	94.9	0	0	109.7
117	V	32	Very low	31.7	Very low	131 Å²	131	131.6 Å²	131.6	79%	0.794	81%	0.805	S	S	*	*			trans	87.8	153.8	164.7	-169.3	0	0	0	0	117
118	E	30.6	Very low	31.8	Very low	185 Å²	185	134.2 Å²	134.2	86%	0.864	81%	0.813	S	S	*	*			trans	-113.8	174.8	-144.9	-52.6	157	98.3	0	0	114.8
119	G	28.5	Very low	31.8	Very low	75 Å²	75	130.8 Å²	130.8	77%	0.773	81%	0.809	S	S	*	*			trans	148.5	103.9	150	0	0	0	0	0	119.4
120	M	31.1	Very low	31.2	Very low	199 Å²	199	131.3 Å²	131.3	98%	0.98	81%	0.812	S	S	*	*			trans	7.7	133.7	152.2	-107.2	62.2	164.7	0	0	121.7
121	G	28.5	Very low	30.5	Very low	77 Å²	77	135.7 Å²	135.7	79%	0.794	82%	0.82	S	S	*	*			trans	167.4	81.7	156.7	0	0	0	0	0	121.6
122	A	29.7	Very low	30.3	Very low	91 Å²	91	134.4 Å²	134.4	75%	0.752	82%	0.819	S	S	*	*			trans	35.4	124.7	147.2	0	0	0	0	0	125
123	K	31.2	Very low	30.4	Very low	196 Å²	196	134.3 Å²	134.3	85%	0.852	82%	0.818	S	S	*	*			trans	62.9	144	145.8	-55.7	176.2	179.9	177.3	0	117.8
124	T	30.8	Very low	30.5	Very low	140 Å²	140	134.9 Å²	134.9	86%	0.859	82%	0.819	S	S	*	*			cis	-164.9	147.9	46	-53.7	0	0	0	0	112.2
125	G	29.5	Very low	29.4	Very low	77 Å²	77	133.2 Å²	133.2	79%	0.794	81%	0.81	S	S	*	*			trans	84.6	142	168.6	0	0	0	0	0	115.3
126	G	27.5	Very low	29.3	Very low	82 Å²	82	136 Å²	136	85%	0.845	81%	0.811	S	S	*	*			cis	115.7	124.2	2.7	0	0	0	0	0	111.8
127	S	27.9	Very low	29.1	Very low	109 Å²	109	133.1 Å²	133.1	76%	0.762	81%	0.806	S	S	*	*			cis	-149.9	154.8	1.6	-164.3	0	0	0	0	111.8
128	V	28.3	Very low	28.9	Very low	131 Å²	131	134 Å²	134	79%	0.794	80%	0.803	S	S	*	*			trans	-88.7	152	155.9	172.9	0	0	0	0	108.1
129	C	28.1	Very low	29.1	Very low	117 Å²	117	133 Å²	133	79%	0.791	80%	0.799	S	S	*	*			trans	-127.9	116.1	178	-67.9	0	0	0	0	112.2
130	T	25.6	Very low	29.1	Very low	127 Å²	127	137 Å²	137	78%	0.779	80%	0.802	S	S	*	*			trans	-134.4	131.2	160.1	-49.2	0	0	0	0	106.9
131	F	25.6	Very low	29.2	Very low	209 Å²	209	130.3 Å²	130.3	92%	0.917	78%	0.784	S	S	*	*			trans	-145.2	158.2	175.9	-115.3	-85.7	0	0	0	110.8
132	N	27.8	Very low	29.2	Very low	147 Å²	147	133.2 Å²	133.2	79%	0.786	78%	0.782	S	S	*	*			trans	-154.2	162.6	-170.2	-160.9	1.4	0	0	0	112.5
133	S	29.5	Very low	29.5	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	79%	0.786	S	S	*	*			trans	69.4	153.9	-178	86.2	0	0	0	0	115.1
134	R	33.5	Very low	29.6	Very low	234 Å²	234	136.2 Å²	136.2	88%	0.883	78%	0.783	S	S	*	*			cis	-149.4	172.7	10.5	-104.6	-162.4	172.5	164.7	-3.9	107.8
135	S	26.3	Very low	29.8	Very low	88 Å²	88	133.3 Å²	133.3	62%	0.615	77%	0.773	S	S	*	*			cis	-174.8	-163.7	-16.3	52.2	0	0	0	0	108.7
136	L	29.1	Very low	30	Very low	152 Å²	152	137.3 Å²	137.3	80%	0.796	77%	0.77	S	S	*	*			trans	83.4	136	170.6	-56	-179.3	0	0	0	117.6
137	T	28.9	Very low	30.2	Very low	120 Å²	120	139.1 Å²	139.1	74%	0.736	76%	0.761	S	S	*	*			cis	-167.9	161.6	-31.1	6.7	0	0	0	0	112.4
138	M	28.9	Very low	30.4	Very low	149 Å²	149	140.3 Å²	140.3	73%	0.734	76%	0.757	S	S	*	*			trans	87.6	117.3	163.1	-59.6	-160.4	69.2	0	0	121.4
139	E	33.8	Very low	30.3	Very low	165 Å²	165	139.2 Å²	139.2	77%	0.771	75%	0.754	S	S	*	*			trans	45.1	133.6	136.1	-57	-173	151.1	0	0	121.5
140	D	30.5	Very low	30.3	Very low	159 Å²	159	138.7 Å²	138.7	85%	0.85	75%	0.752	S	S	*	*			cis	-161.1	-161	-18.5	-143.9	46.7	0	0	0	107.9
141	G	31.8	Very low	30.6	Very low	59 Å²	59	140.9 Å²	140.9	61%	0.608	76%	0.758	S	S	*	*			cis	173.6	-164.4	7.3	0	0	0	0	0	115.3
142	D	29.5	Very low	30.7	Very low	138 Å²	138	134.9 Å²	134.9	74%	0.738	76%	0.755	S	S	*	*			trans	47.9	103.6	173.9	-136.5	18.4	0	0	0	121.5
143	R	35.1	Very low	31	Very low	220 Å²	220	134.4 Å²	134.4	83%	0.83	76%	0.758	S	S	*	*			trans	26.7	138.4	132	-57.2	177.2	175.7	167.6	-2.5	119.1
144	T	33.6	Very low	31	Very low	130 Å²	130	140.7 Å²	140.7	80%	0.798	77%	0.765	S	S	*	*			cis	-166.8	-174	23.6	-8.3	0	0	0	0	108.9
145	A	35.1	Very low	31	Very low	78 Å²	78	141 Å²	141	65%	0.645	77%	0.766	S	S	*	*			cis	-161.8	167	3.3	0	0	0	0	0	112.2
146	H	33.8	Very low	31.3	Very low	161 Å²	161	144.5 Å²	144.5	75%	0.745	78%	0.776	S	S	*	*			trans	6.9	144.4	143.4	-60.8	-79.7	0	0	0	121.6
147	D	31.3	Very low	31.2	Very low	121 Å²	121	144.7 Å²	144.7	65%	0.647	78%	0.778	S	S	*	*			cis	-163.9	162.8	-0.5	-120.4	-17.9	0	0	0	116.9
148	I	31.6	Very low	31.3	Very low	133 Å²	133	148 Å²	148	68%	0.682	79%	0.785	S	S	*	*			trans	54.7	110.9	147.8	-65.7	161.2	0	0	0	118.9
149	C	26.9	Very low	31.3	Very low	109 Å²	109	146 Å²	146	74%	0.736	78%	0.777	S	S	*	*				65.9	142.7	80.3	-125.8	0	0	0	0	115.1
150	S	27.3	Very low	31.3	Very low	105 Å²	105	146.3 Å²	146.3	73%	0.734	78%	0.783	S	S	*	*			cis	-151.2	177.2	29.1	-55.5	0	0	0	0	114.7
151	L	31.8	Very low	31.3	Very low	174 Å²	174	146.6 Å²	146.6	91%	0.911	78%	0.777	S	S	*	*			trans	-76.6	165.1	179.9	-57.7	99.7	0	0	0	114.9
152	G	28.3	Very low	31.2	Very low	82 Å²	82	150.4 Å²	150.4	85%	0.845	79%	0.788	S	S	*	*			trans	-171.5	71.3	171.2	0	0	0	0	0	117
153	T	34.2	Very low	31.2	Very low	138 Å²	138	154.2 Å²	154.2	85%	0.847	79%	0.792	S	S	*	*			trans	-83.4	133.7	171	47	0	0	0	0	113.2
154	R	29.8	Very low	30.9	Very low	240 Å²	240	151 Å²	151	91%	0.906	79%	0.787	S	S	*	*			trans	-163.9	146	143.5	-111.7	165.7	-164	-148	1.9	112.9
155	R	33.9	Very low	30.6	Very low	240 Å²	240	149.8 Å²	149.8	91%	0.906	79%	0.789	S	S	*	*			trans	-87	145.8	158	-63.6	179.7	-177.8	173.7	0	108.5
156	I	32.6	Very low	30.4	Very low	162 Å²	162	154 Å²	154	83%	0.831	80%	0.795	S	S	*	*			trans	-134.8	149	151.2	-49.4	179.6	0	0	0	106.5
157	N	27.1	Very low	30.2	Very low	156 Å²	156	155.8 Å²	155.8	83%	0.834	80%	0.804	S	S	*	*			trans	-132.1	121	-177.2	179.1	83.6	0	0	0	107.7
158	E	29.9	Very low	30	Very low	189 Å²	189	158.6 Å²	158.6	88%	0.883	81%	0.814	S	S	*	*			trans	-143.8	152.2	177.7	-153.1	160.1	-125.2	0	0	111.9
159	D	30.6	Very low	29.9	Very low	108 Å²	108	160.4 Å²	160.4	58%	0.578	82%	0.819	S	S	*	*			trans	-110.4	132.7	-161	-175.6	27.2	0	0	0	110.1	K161	D159-K161 WeakPolarHBondContact OD2-CE 3.47Å; D159-K161 IonicContact OD2-NZ 2.92Å; D159-K161 PolarHBondContact OD2-NZ 2.85Å
160	L	32.5	Very low	29.9	Very low	170 Å²	170	162.9 Å²	162.9	89%	0.89	82%	0.82	S	S	*	*			trans	-136.8	104.6	169.8	-141.1	93.7	0	0	0	111.8
161	K	31.9	Very low	30.1	Very low	166 Å²	166	167.7 Å²	167.7	72%	0.722	83%	0.828	S	S	*	*			trans	-90.5	122	179	-65.5	164.2	-177	133.1	0	111.3	D159	D159-K161 WeakPolarHBondContact OD2-CE 3.47Å; D159-K161 IonicContact OD2-NZ 2.92Å; D159-K161 PolarHBondContact OD2-NZ 2.85Å
162	V	29	Very low	29.9	Very low	139 Å²	139	171.3 Å²	171.3	84%	0.842	83%	0.829	S	S	*	*			trans	-138.6	136.9	151.3	171.6	0	0	0	0	109.1
163	R	29.7	Very low	30.1	Very low	218 Å²	218	177.7 Å²	177.7	82%	0.823	83%	0.828	S	S	*	*			trans	-90	175.1	173.6	-46.9	170.4	173.5	159.1	-5.1	108.4
164	Q	27.4	Very low	29.7	Very low	153 Å²	153	179 Å²	179	72%	0.715	83%	0.829	S	S	*	*			cis	-167.2	136.8	12	-158.3	164.9	-42.8	0	0	107.9
165	A	28.7	Very low	29.7	Very low	103 Å²	103	170.7 Å²	170.7	85%	0.851	82%	0.819	S	S	*	*			trans	-160.8	121.6	158.4	0	0	0	0	0	110.4
166	Q	30.8	Very low	29.6	Very low	166 Å²	166	167.6 Å²	167.6	78%	0.776	82%	0.815	S	S	*	*			trans	-93.7	139.6	168.2	-69.2	158.7	-96.7	0	0	109.1
167	Q	28.6	Very low	29.3	Very low	200 Å²	200	165.3 Å²	165.3	94%	0.935	80%	0.804	S	S	*	*			trans	-154.3	109.8	138.5	-115.1	168.5	34.2	0	0	111.1
168	Q	28.5	Very low	29.4	Very low	180 Å²	180	168.9 Å²	168.9	84%	0.841	81%	0.806	S	S	*	*			trans	-85.1	130	158.7	-65.3	167.4	-54	0	0	107.5
169	Q	29.2	Very low	29.4	Very low	170 Å²	170	166.2 Å²	166.2	79%	0.794	80%	0.798	S	S	*	*			trans	-164.2	113.4	139.2	-109.3	167	35.6	0	0	113.5
170	Q	27	Very low	29.4	Very low	161 Å²	161	167.8 Å²	167.8	75%	0.752	81%	0.811	S	S	*	*				56.3	103	121.4	-63.9	179.2	-2	0	0	120.7	R172	Q170-R172 PolarHBondContact O-N 3.08Å
171	K	31.2	Very low	29.1	Very low	207 Å²	207	163 Å²	163	90%	0.9	80%	0.803	S	S	*	*				42.5	78.6	112.9	-169.1	-170	179.3	180	0	115.8
172	R	27.6	Very low	29.1	Very low	250 Å²	250	160.8 Å²	160.8	94%	0.943	81%	0.808	S	S	*	*			trans	-113.1	105.1	153.4	-73.2	-159	173.2	-153.2	-1.1	112	Q170	Q170-R172 PolarHBondContact O-N 3.08Å
173	R	31.1	Very low	29.1	Very low	216 Å²	216	163.4 Å²	163.4	82%	0.815	81%	0.811	S	S	*	*			trans	-58	126.8	160	173.8	-159.6	-159	-169.7	8.1	108.5
174	N	27.5	Very low	29.2	Very low	164 Å²	164	161.1 Å²	161.1	88%	0.877	81%	0.814	S	S	*	*			trans	-140.2	151.1	155	-123.1	10.6	0	0	0	109.6
175	G	29.3	Very low	29.3	Very low	67 Å²	67	162.1 Å²	162.1	69%	0.691	82%	0.823	S	S	*	*			trans	-110.4	141.3	170.4	0	0	0	0	0	108.8
176	E	31.2	Very low	29.3	Very low	175 Å²	175	163.9 Å²	163.9	82%	0.818	82%	0.818	S	S	*	*			trans	-97.1	118.4	-179.2	-66.7	164.5	151.1	0	0	108.6
177	N	27.5	Very low	29.1	Very low	113 Å²	113	159.4 Å²	159.4	60%	0.604	82%	0.816	S	S	*	*			trans	-107.7	121.6	175.3	-155.9	78.6	0	0	0	106.9	D179	N177-D179 PolarHBondContact ND2-OD2 3.03Å
178	W	29.1	Very low	29.3	Very low	232 Å²	232	158 Å²	158	88%	0.879	81%	0.809	S	S	*	*			trans	-103.2	94.2	178.3	-76.5	96.7	0	0	0	109.5
179	D	29.2	Very low	29.3	Very low	133 Å²	133	156.3 Å²	156.3	71%	0.711	81%	0.811	S	S	*	*			trans	-94.8	129.7	163.6	-71.6	-63.8	0	0	0	108.8	N177 G181	N177-D179 PolarHBondContact ND2-OD2 3.03Å; D179-G181 PolarHBondContact O-N 2.84Å
180	V	30.4	Very low	29.5	Very low	140 Å²	140	152.8 Å²	152.8	85%	0.848	81%	0.811	S	S	*	*			trans	-87.3	105.4	174.8	176.4	0	0	0	0	108.1
181	G	27.2	Very low	29.4	Very low	70 Å²	70	148.8 Å²	148.8	72%	0.722	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-77.1	130.4	174.2	0	0	0	0	0	111.7	D179	D179-G181 PolarHBondContact O-N 2.84Å
182	S	31.5	Very low	29.4	Very low	120 Å²	120	144.7 Å²	144.7	84%	0.839	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-86.4	130.8	164.6	-58.6	0	0	0	0	110
183	E	28.6	Very low	30.7	Very low	194 Å²	194	139.1 Å²	139.1	91%	0.907	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-76.7	132.1	178.5	-58.9	179.7	132.4	0	0	111.2
184	I	31	Very low	30.5	Very low	169 Å²	169	132.3 Å²	132.3	87%	0.867	80%	0.804	S	S	*	*			trans	-131.8	127	157.1	-62.9	-176.3	0	0	0	107.5
185	L	29.4	Very low	30.7	Very low	175 Å²	175	133.4 Å²	133.4	92%	0.916	81%	0.809	S	S	*	*			trans	-76.4	138.2	-173.3	-169.3	69.6	0	0	0	111.4
186	N	29.6	Very low	30.5	Very low	140 Å²	140	133.9 Å²	133.9	75%	0.749	81%	0.814	S	S	*	*			trans	-98.4	140.6	179.4	-152.6	8	0	0	0	111
187	G	27	Very low	30.3	Very low	71 Å²	71	131.7 Å²	131.7	73%	0.732	82%	0.816	S	S	*	*			trans	-133.9	111.8	-177	0	0	0	0	0	112.3
188	H	31.4	Very low	30.5	Very low	170 Å²	170	131.9 Å²	131.9	79%	0.787	83%	0.827	S	S	*	*			trans	-83.7	142.1	-178.1	-83.9	-94.9	0	0	0	113.5
189	V	30.2	Very low	30.6	Very low	146 Å²	146	125.3 Å²	125.3	89%	0.885	82%	0.822	S	S	*	*			trans	-135	149.1	143.1	179.7	0	0	0	0	107.4
190	A	32.8	Very low	30.7	Very low	96 Å²	96	126.6 Å²	126.6	79%	0.793	83%	0.828	S	S	*	*			trans	-130.5	153.6	-178.6	0	0	0	0	0	111.5
191	G	25.1	Very low	30.8	Very low	77 Å²	77	124.6 Å²	124.6	79%	0.794	82%	0.821	S	S	*	*			trans	179.7	126	175.3	0	0	0	0	0	114
192	S	31.5	Very low	30.8	Very low	120 Å²	120	128.4 Å²	128.4	84%	0.839	83%	0.825	S	S	*	*			trans	-138.4	175.6	170.8	-51.8	0	0	0	0	107.4
193	P	54.4	Low	30.7	Very low	133 Å²	133	128.6 Å²	128.6	86%	0.864	82%	0.824	S	S	*	*			cis	-126.7	-174.4	-8.6	40.3	-24.3	0	0	0	113.1
194	G	26.2	Very low	30.7	Very low	74 Å²	74	123.4 Å²	123.4	76%	0.763	82%	0.823	S	S	*	*			trans	-165	139.7	171	0	0	0	0	0	114.4
195	L	31.7	Very low	30.7	Very low	187 Å²	187	120.5 Å²	120.5	98%	0.979	82%	0.824	S	S	*	*			trans	-90.7	165.3	-179.3	-56	94.8	0	0	0	112.8
196	G	26	Very low	30.6	Very low	77 Å²	77	116 Å²	116	79%	0.794	82%	0.82	S	S	*	*			trans	156	126.4	156.1	0	0	0	0	0	115.3
197	C	27	Very low	30.7	Very low	129 Å²	129	118.9 Å²	118.9	87%	0.872	83%	0.829	S	S	*	*			trans	-100.1	162.2	-174.8	-59.2	0	0	0	0	114.7
198	S	31.4	Very low	31	Very low	117 Å²	117	121.5 Å²	121.5	82%	0.818	84%	0.836	S	S	*	*			trans	78.9	112.6	139.9	-170.3	0	0	0	0	121.1
199	A	31.4	Very low	31.1	Very low	94 Å²	94	120.1 Å²	120.1	78%	0.777	84%	0.835	S	S	*	*				-172.1	154.3	117.5	0	0	0	0	0	111.8
200	D	31.1	Very low	31.2	Very low	159 Å²	159	120.4 Å²	120.4	85%	0.85	83%	0.83	S	S	*	*			trans	-76.7	-179.3	174.9	-46	-87.1	0	0	0	111.7
201	S	31.4	Very low	31.1	Very low	98 Å²	98	124.3 Å²	124.3	69%	0.685	83%	0.829	S	S	*	*			cis	-161.9	150.7	16.9	-177	0	0	0	0	109.9
202	D	28.4	Very low	31.4	Very low	151 Å²	151	131.5 Å²	131.5	81%	0.807	83%	0.833	S	S	*	*				173.8	167.5	104.2	-134.8	-41.6	0	0	0	113.2
203	C	29.5	Very low	31.4	Very low	123 Å²	123	137.8 Å²	137.8	83%	0.831	84%	0.838	S	S	*	*			trans	-102.2	157.1	-163.2	-65.6	0	0	0	0	114.7
204	G	27.4	Very low	30.1	Very low	85 Å²	85	139.7 Å²	139.7	88%	0.876	83%	0.833	S	S	*	*			trans	169.9	41.1	172.4	0	0	0	0	0	118.9
205	A	31.1	Very low	30.4	Very low	108 Å²	108	143 Å²	143	89%	0.893	83%	0.832	S	S	*	*			trans	-110.6	122.8	174.1	0	0	0	0	0	111.4
206	G	28.8	Very low	30.4	Very low	81 Å²	81	137.9 Å²	137.9	84%	0.835	82%	0.817	S	S	*	*			trans	-108.7	117.4	178.4	0	0	0	0	0	112.3
207	E	31.3	Very low	30.6	Very low	201 Å²	201	141.7 Å²	141.7	94%	0.939	82%	0.819	S	S	*	*			trans	-75.7	150.7	168.9	-65.6	-172.3	118.3	0	0	111.7
208	S	32.2	Very low	30.6	Very low	125 Å²	125	139.1 Å²	139.1	87%	0.874	81%	0.814	S	S	*	*			trans	-150	126.5	153.7	51.4	0	0	0	0	110.6
209	D	35.1	Very low	30.5	Very low	142 Å²	142	139.6 Å²	139.6	76%	0.759	81%	0.812	S	S	*	*			trans	-128.3	153.3	174.4	-179.4	17.5	0	0	0	108.1
210	L	32.2	Very low	30.5	Very low	151 Å²	151	142.1 Å²	142.1	79%	0.791	82%	0.817	S	S	*	*			trans	167.3	101.3	146.8	-91.9	167.6	0	0	0	113.8
211	K	30.7	Very low	30.4	Very low	178 Å²	178	138.6 Å²	138.6	77%	0.774	81%	0.81	S	S	*	*			trans	36.5	105.5	135.8	-73.8	172.2	177.4	161.9	0	121.4
212	R	30.4	Very low	30.4	Very low	229 Å²	229	138.9 Å²	138.9	86%	0.864	81%	0.813	S	S	*	*				35.7	126	110.5	-174.8	-173	-65.6	-132.3	-0.4	119.8
213	R	30.9	Very low	30.3	Very low	251 Å²	251	141.4 Å²	141.4	95%	0.947	82%	0.816	S	S	*	*			trans	-127.6	171.4	147.8	-72.4	-170.2	-177	179.7	2.9	111.4
214	K	28.9	Very low	30.3	Very low	174 Å²	174	141.2 Å²	141.2	76%	0.757	82%	0.817	S	S	*	*			trans	-157.5	150.1	-168.3	-170.3	-158.7	174.3	-166.3	0	111.3
215	L	31.4	Very low	30.5	Very low	144 Å²	144	142.9 Å²	142.9	75%	0.754	81%	0.814	S	S	*	*			trans	69.4	154.1	164.6	-85.3	163.7	0	0	0	116.3
216	A	31.3	Very low	30.5	Very low	79 Å²	79	146.3 Å²	146.3	65%	0.653	81%	0.812	S	S	*	*			cis	-150.8	158.1	-0.3	0	0	0	0	0	114.1
217	D	30.8	Very low	30.8	Very low	157 Å²	157	148.7 Å²	148.7	84%	0.84	81%	0.813	S	S	*	*			trans	50.7	155.7	144.5	-125.5	-44.4	0	0	0	123.9
218	G	27	Very low	30.7	Very low	74 Å²	74	150.7 Å²	150.7	76%	0.763	81%	0.812	S	S	*	*			trans	160.3	87.9	176.7	0	0	0	0	0	114
219	T	29.8	Very low	30.7	Very low	127 Å²	127	156.5 Å²	156.5	78%	0.779	82%	0.815	S	S	*	*			trans	-98.8	122.1	-175.8	-64.3	0	0	0	0	113.7
220	V	31.1	Very low	30.4	Very low	147 Å²	147	156.6 Å²	156.6	89%	0.891	82%	0.82	S	S	*	*			trans	-147	143.6	152.1	-176.3	0	0	0	0	109.1
221	A	29.5	Very low	30.3	Very low	85 Å²	85	153.9 Å²	153.9	70%	0.702	82%	0.819	S	S	*	*			trans	-105.7	152.4	178.2	0	0	0	0	0	112.9
222	S	29.8	Very low	30.3	Very low	105 Å²	105	156.8 Å²	156.8	73%	0.734	83%	0.825	S	S	*	*				162.9	154.9	108.3	60.2	0	0	0	0	115.4
223	K	27.6	Very low	30	Very low	203 Å²	203	152.2 Å²	152.2	88%	0.883	82%	0.823	S	S	*	*			trans	73.6	137.8	161.8	-68.5	173.6	-179.2	176.5	0	119.2
224	S	30.2	Very low	30.1	Very low	120 Å²	120	146.7 Å²	146.7	84%	0.839	82%	0.817	S	S	*	*			trans	-93	162.6	176.7	46.7	0	0	0	0	112
225	S	30.5	Very low	30.2	Very low	119 Å²	119	144 Å²	144	83%	0.832	82%	0.815	S	S	*	*			trans	-131.7	120.9	170.8	48.4	0	0	0	0	111.1
226	E	31.3	Very low	30.3	Very low	181 Å²	181	143 Å²	143	85%	0.846	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-80.8	148.2	172.5	-60.2	176.7	117.2	0	0	111.2	R228	E226-R228 PolarHBondContact O-N 3.33Å
227	P	35.4	Very low	30	Very low	131 Å²	131	147.2 Å²	147.2	85%	0.851	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-73.3	117.1	169.1	29.9	-32.4	0	0	0	110.8	R229	P227-R229 PolarHBondContact O-N 2.9Å
228	R	29	Very low	29.9	Very low	243 Å²	243	151.3 Å²	151.3	92%	0.917	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-62.1	130.2	-179.9	-87.9	179.9	163.7	178.1	-5.3	113	E226	E226-R228 PolarHBondContact O-N 3.33Å
229	R	31.8	Very low	30	Very low	247 Å²	247	154.7 Å²	154.7	93%	0.932	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-64.4	130.7	157.6	-102.3	179.4	-174.5	138.8	3	110.1	P227	P227-R229 PolarHBondContact O-N 2.9Å
230	V	29.1	Very low	29.9	Very low	144 Å²	144	152.1 Å²	152.1	87%	0.873	84%	0.835	S	S	*	*			trans	-89.5	104.8	165.3	179.2	0	0	0	0	108.5
231	A	28.9	Very low	29.7	Very low	93 Å²	93	151.2 Å²	151.2	77%	0.769	83%	0.83	S	S	*	*			trans	-85.5	137.8	169.4	0	0	0	0	0	109.9
232	R	31	Very low	29.6	Very low	240 Å²	240	155.2 Å²	155.2	91%	0.906	84%	0.84	S	S	*	*			trans	-116.2	110.2	176.1	-149.3	176.5	-167.1	173.4	3.4	108.7
233	T	25.3	Very low	29.5	Very low	133 Å²	133	155.6 Å²	155.6	82%	0.816	84%	0.842	S	S	*	*			trans	-72.9	132	-175.8	-43.4	0	0	0	0	111.1
234	V	32.5	Very low	29.6	Very low	134 Å²	134	151.9 Å²	151.9	81%	0.812	84%	0.842	S	S	*	*			trans	-127.2	136	166	178.6	0	0	0	0	107.8
235	T	30.4	Very low	29.6	Very low	117 Å²	117	151.9 Å²	151.9	72%	0.718	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-81.7	148.7	-176.2	38.6	0	0	0	0	112.6
236	P	33.3	Very low	29.5	Very low	123 Å²	123	151.7 Å²	151.7	80%	0.799	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-81.1	131.4	175.3	32.2	-32.9	0	0	0	111.3
237	L	26.6	Very low	29.4	Very low	168 Å²	168	151.4 Å²	151.4	88%	0.88	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-93.1	134.2	163.3	-124.1	81.6	0	0	0	109.9
238	R	27.7	Very low	29.1	Very low	243 Å²	243	152.9 Å²	152.9	92%	0.917	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-74.7	137.9	170	-74.7	176.6	167.3	176.9	-5.2	110
239	V	29.8	Very low	29.2	Very low	146 Å²	146	149.5 Å²	149.5	89%	0.885	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-100.3	127.8	151.9	178.8	0	0	0	0	107
240	G	27.4	Very low	29.7	Very low	72 Å²	72	143.2 Å²	143.2	74%	0.742	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-84.3	135.7	-178.7	0	0	0	0	0	112
241	V	27.2	Very low	29.6	Very low	129 Å²	129	143 Å²	143	78%	0.782	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-79.6	133.9	161.7	178.8	0	0	0	0	107.9
242	N	27.7	Very low	29.5	Very low	169 Å²	169	143.7 Å²	143.7	90%	0.904	82%	0.817	S	S	*	*			trans	-137.2	116.9	162.9	-111.8	-2.2	0	0	0	108.6
243	S	27.6	Very low	29.5	Very low	112 Å²	112	137.8 Å²	137.8	78%	0.783	81%	0.812	S	S	*	*			trans	-96.9	136	176.5	-56.9	0	0	0	0	109.8
244	S	29.6	Very low	30.3	Very low	125 Å²	125	137.5 Å²	137.5	87%	0.874	81%	0.813	S	S	*	*			trans	-143.6	146.4	159.8	56.3	0	0	0	0	109
245	S	29.1	Very low	30.1	Very low	120 Å²	120	139.2 Å²	139.2	84%	0.839	81%	0.812	S	S	*	*			trans	-135.8	134.3	-162.1	56	0	0	0	0	112.2
246	S	28.1	Very low	30.1	Very low	116 Å²	116	140.4 Å²	140.4	81%	0.811	81%	0.814	S	S	*	*			trans	-159.1	154.4	157.7	46.4	0	0	0	0	111
247	H	30.7	Very low	29.9	Very low	174 Å²	174	138.7 Å²	138.7	81%	0.806	81%	0.81	S	S	*	*			trans	-84	156.3	-166.9	-47.5	-84.2	0	0	0	113.5
248	N	28.1	Very low	30	Very low	162 Å²	162	137.9 Å²	137.9	87%	0.866	81%	0.807	S	S	*	*				-179.8	145.1	106.5	-87.2	-26.9	0	0	0	114.2
249	H	30.7	Very low	30.1	Very low	173 Å²	173	134 Å²	134	80%	0.801	80%	0.801	S	S	*	*			trans	-88.6	163.1	157.6	-95.8	-62.8	0	0	0	108.7
250	P	43.6	Very low	30.1	Very low	115 Å²	115	138.2 Å²	138.2	75%	0.747	80%	0.801	S	S	*	*			cis	-124.5	170.5	44.3	31	-10	0	0	0	113.3
251	N	27.3	Very low	30.3	Very low	139 Å²	139	141.6 Å²	141.6	74%	0.743	80%	0.802	S	S	*	*			cis	80.7	139.9	33.1	-159.3	36	0	0	0	115.5
252	C	25.6	Very low	30.3	Very low	108 Å²	108	139 Å²	139	73%	0.73	80%	0.802	S	S	*	*			trans	102.1	108.6	173.1	-64.5	0	0	0	0	119.2
253	S	32	Very low	30.6	Very low	115 Å²	115	137.7 Å²	137.7	80%	0.804	79%	0.79	S	S	*	*			trans	-78.2	165.2	140.5	-47.1	0	0	0	0	110.2
254	P	42.2	Very low	30.9	Very low	128 Å²	128	142.5 Å²	142.5	83%	0.831	79%	0.792	S	S	*	*			trans	-130.1	-179.1	138.5	37.7	-27.9	0	0	0	112.6
255	E	28.4	Very low	30.8	Very low	169 Å²	169	141.6 Å²	141.6	79%	0.79	79%	0.793	S	S	*	*			trans	-119.1	171.2	-163.9	-42.8	175.1	128.1	0	0	115.1
256	N	28.7	Very low	30.8	Very low	142 Å²	142	140.7 Å²	140.7	76%	0.759	79%	0.793	S	S	*	*			trans	79.3	158.1	137.3	-83.2	-45.1	0	0	0	123.1
257	A	29.1	Very low	31.1	Very low	87 Å²	87	140.7 Å²	140.7	72%	0.719	79%	0.793	S	S	*	*			trans	90.6	72.5	155.9	0	0	0	0	0	122.6
258	N	30.1	Very low	31.7	Very low	151 Å²	151	138.3 Å²	138.3	81%	0.807	79%	0.793	S	S	*	*				38.2	127.7	120.7	-72.2	-23.5	0	0	0	124.3
259	M	29.7	Very low	32	Very low	162 Å²	162	137.8 Å²	137.8	80%	0.798	79%	0.79	S	S	*	*				74.3	111.2	128.3	-69.9	-75.8	167.5	0	0	123
260	R	29	Very low	32.4	Very low	234 Å²	234	135.3 Å²	135.3	88%	0.883	79%	0.789	S	S	*	*				-179.4	140.2	100.4	-99.5	179.5	173.9	-172.4	-2	115.9
261	N	31.7	Very low	31.8	Very low	143 Å²	143	134.6 Å²	134.6	77%	0.765	79%	0.793	S	S	*	*			trans	19.6	144.9	156.3	-62	14.3	0	0	0	123.6
262	G	27.6	Very low	32	Very low	76 Å²	76	132.8 Å²	132.8	78%	0.784	80%	0.797	S	S	*	*			trans	-161.2	-26.8	172.9	0	0	0	0	0	120.5
263	H	34	Very low	32.4	Very low	141 Å²	141	134 Å²	134	65%	0.653	80%	0.801	S	S	*	*			trans	55.1	126.7	167.2	-79.8	-79.2	0	0	0	123.5
264	Y	32.8	Very low	32.5	Very low	212 Å²	212	134.3 Å²	134.3	83%	0.831	80%	0.8	S	S	*	*			trans	64.9	111.4	147.3	-66.7	-59.2	0	0	0	123.6
265	A	28.6	Very low	32	Very low	106 Å²	106	133.7 Å²	133.7	88%	0.876	80%	0.799	S	S	*	*			trans	-152.9	165.5	131	0	0	0	0	0	108.9
266	A	29.7	Very low	32.3	Very low	102 Å²	102	133.2 Å²	133.2	84%	0.843	80%	0.801	S	S	*	*			trans	-124.4	168.9	-171	0	0	0	0	0	114.7
267	S	33.2	Very low	32.6	Very low	116 Å²	116	132 Å²	132	81%	0.811	80%	0.801	S	S	*	*			trans	-65.8	167.8	-171.4	-39.8	0	0	0	0	115.8
268	P	43.8	Very low	32.7	Very low	124 Å²	124	133.1 Å²	133.1	81%	0.805	80%	0.804	S	S	*	*				-135.9	-177.8	97.1	39.5	-29	0	0	0	115.2
269	D	33.5	Very low	33.2	Very low	150 Å²	150	133.4 Å²	133.4	80%	0.802	80%	0.803	S	S	*	*			trans	-67.1	174.3	-173.6	-52.6	-70.6	0	0	0	115.5
270	P	40.5	Very low	33.7	Very low	121 Å²	121	130.8 Å²	130.8	79%	0.786	80%	0.799	S	S	*	*				-145.7	147	104.8	38.1	-24.3	0	0	0	118
271	A	29.6	Very low	34.1	Very low	101 Å²	101	122.7 Å²	122.7	84%	0.835	79%	0.788	S	S	*	*			trans	66.6	143.1	142.5	0	0	0	0	0	121.5
272	A	31.5	Very low	34.6	Very low	100 Å²	100	123.8 Å²	123.8	83%	0.826	79%	0.793	S	S	*	*			trans	-98.6	158.9	-178.7	0	0	0	0	0	113.4
273	V	33.8	Very low	35.3	Very low	133 Å²	133	127.3 Å²	127.3	81%	0.806	79%	0.793	S	S	*	*			trans	-119.9	138.3	170	-176.7	0	0	0	0	108.4
274	P	35.2	Very low	35.6	Very low	122 Å²	122	125 Å²	125	79%	0.792	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69.5	133.2	-173.9	-18.9	32.3	0	0	0	113.2
275	S	32.3	Very low	36	Very low	116 Å²	116	119.6 Å²	119.6	81%	0.811	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-77.4	121	171.1	51.8	0	0	0	0	111.4
276	L	35	Very low	36.7	Very low	159 Å²	159	119.8 Å²	119.8	83%	0.832	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-61.6	143	160.4	-83.4	148.3	0	0	0	109.6	S278	L276-S278 PolarHBondContact O-N 3.33Å; L276-S278 VanDerWaalsContact O-N 3.14Å
277	P	33.1	Very low	37.5	Very low	115 Å²	115	118.7 Å²	118.7	75%	0.747	78%	0.782	S	S	*	*			trans	-69.1	113.8	179.9	27.7	-33.3	0	0	0	110.2	I279	P277-I279 PolarHBondContact O-N 2.89Å; P277-I279 VanDerWaalsContact O-N 3.09Å
278	S	33.2	Very low	38.7	Very low	112 Å²	112	116.4 Å²	116.4	78%	0.783	76%	0.763	S	S	*	*			trans	-55.3	115.3	169.2	-58.9	0	0	0	0	109.5	L276 P280	L276-S278 PolarHBondContact O-N 3.33Å; L276-S278 VanDerWaalsContact O-N 3.14Å; S278-P280 VanDerWaalsContact O-CD 3.27Å; S278-P280 WeakPolarHBondContact O-CD 3.32Å; S278-P280 VanDerWaalsContact O-N 3.16Å
279	I	40	Very low	40	Very low	156 Å²	156	114.5 Å²	114.5	80%	0.8	76%	0.757	S	S	*	*			trans	-55.9	121.3	170.6	-63.6	174.4	0	0	0	107	P277 G281	P277-I279 PolarHBondContact O-N 2.89Å; P277-I279 VanDerWaalsContact O-N 3.09Å; I279-G281 PolarHBondContact O-N 2.83Å
280	P	39.1	Very low	42.7	Very low	108 Å²	108	110.7 Å²	110.7	70%	0.701	73%	0.732	S	S	*	*			trans	-63.6	108.6	175.8	-21	33.4	0	0	0	108.5	S278 L282	S278-P280 VanDerWaalsContact O-CD 3.27Å; S278-P280 WeakPolarHBondContact O-CD 3.32Å; S278-P280 VanDerWaalsContact O-N 3.16Å; P280-L282 PolarHBondContact O-N 2.88Å; P280-L282 VanDerWaalsContact O-N 3.1Å
281	G	38.8	Very low	45.2	Very low	63 Å²	63	107.1 Å²	107.1	65%	0.649	71%	0.71	S	S	*	*			trans	-57.8	118	168.7	0	0	0	0	0	107.7	I279 L283	I279-G281 PolarHBondContact O-N 2.83Å; G281-L283 VanDerWaalsContact C-N 3.32Å; G281-L283 PolarHBondContact O-N 2.95Å
282	L	41.8	Very low	48.3	Very low	166 Å²	166	102.3 Å²	102.3	87%	0.869	67%	0.67	S	S	*	*			trans	-66.5	94	179.9	-78.2	95.6	0	0	0	109.3	P280	P280-L282 PolarHBondContact O-N 2.88Å; P280-L282 VanDerWaalsContact O-N 3.1Å
283	L	41.7	Very low	51.3	Low	150 Å²	150	101.6 Å²	101.6	79%	0.785	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-52.7	128.7	148.8	-87.7	77	0	0	0	106.4	G281	G281-L283 VanDerWaalsContact C-N 3.32Å; G281-L283 PolarHBondContact O-N 2.95Å
284	P	41.4	Very low	54.2	Low	94 Å²	94	100.2 Å²	100.2	61%	0.61	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-58.3	133.2	170.7	25.8	-32.9	0	0	0	107.8	A286	P284-A286 PolarHBondContact O-N 3.19Å
285	P	41	Very low	57.1	Low	97 Å²	97	95 Å²	95	63%	0.63	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-58.2	134.4	-176.5	23	-33.1	0	0	0	110	G287 T288	P285-G287 PolarHBondContact O-N 3.15Å; P285-T288 PolarHBondContact O-N 3.01Å; P285-T288 VanDerWaalsContact O-N 3.1Å; P285-T288 PolarHBondContact O-OG1 3.01Å
286	A	42	Very low	60.1	Low	111 Å²	111	89.5 Å²	89.5	92%	0.917	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	121.3	176.5	0	0	0	0	0	109	P284	P284-A286 PolarHBondContact O-N 3.19Å
287	G	47.9	Very low	62.9	Low	79 Å²	79	87 Å²	87	81%	0.814	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	33.6	-171.2	0	0	0	0	0	115.1	P285 A289	P285-G287 PolarHBondContact O-N 3.15Å; G287-A289 PolarHBondContact O-N 2.92Å
288	T	57.4	Low	65.8	Low	68 Å²	68	85.8 Å²	85.8	42%	0.417	52%	0.523	S	S	.	.			trans	-57.1	108.1	154.2	-63.5	0	0	0	0	108.1	P285	P285-T288 PolarHBondContact O-N 3.01Å; P285-T288 VanDerWaalsContact O-N 3.1Å; P285-T288 PolarHBondContact O-OG1 3.01Å
289	A	72.4	Confident	68.7	Low	83 Å²	83	81.7 Å²	81.7	69%	0.686	49%	0.491	S	S	*	.			trans	-59.6	148.4	179.4	0	0	0	0	0	111.8	G287 S291	G287-A289 PolarHBondContact O-N 2.92Å; A289-S291 PolarHBondContact O-N 2.66Å
290	W	88.4	Confident	71.4	Confident	71 Å²	71	74.4 Å²	74.4	27%	0.269	45%	0.453	S	S	.	.			trans	-58.8	137.7	173.2	-172.9	95.3	0	0	0	110.2	A292 I295 F315 H377 E380 A381	W290-A292 HydrophobicContact CH2-CB 3.69Å; W290-A292 HydrophobicContact CZ3-CB 3.91Å; W290-I295 HydrophobicContact CD2-CD1 4.42Å; W290-I295 HydrophobicContact CZ2-CD1 4.07Å; W290-F315 AromaticContact CZ2-CE2 3.98Å; W290-F315 HydrophobicContact CZ2-CE2 3.98Å; W290-F315 AromaticContact CZ2-CZ 3.85Å; W290-F315 HydrophobicContact CZ2-CZ 3.85Å; W290-F315 AromaticContact NE1-CE2 3.75Å; W290-F315 AromaticContact NE1-CZ 3.97Å; W290-F315 PolarHBondContact NE1-O 3.46Å; W290-H377 AromaticContact CD1-CD2 3.96Å; W290-H377 AromaticContact CD2-CD2 3.54Å; W290-H377 AromaticContact CE2-CD2 3.52Å; W290-H377 AromaticContact CE2-CG 3.89Å; W290-H377 AromaticContact CE3-CD2 3.98Å; W290-H377 AromaticContact CG-CD2 3.88Å; W290-H377 HydrophobicContact CH2-CB 3.87Å; W290-H377 VanDerWaalsContact CH2-O 3.24Å; W290-H377 WeakPolarHBondContact CH2-O 3.26Å; W290-H377 HydrophobicContact CZ2-CB 3.51Å; W290-H377 AromaticContact CZ2-CD2 3.99Å; W290-H377 AromaticContact CZ2-CG 3.87Å; W290-H377 VanDerWaalsContact CZ2-O 3.23Å; W290-H377 WeakPolarHBondContact CZ2-O 3.34Å; W290-H377 AromaticContact NE1-CD2 3.74Å; W290-E380 HydrophobicContact CH2-CB 4.23Å; W290-A381 HydrophobicContact CZ2-CB 4.44Å
291	S	94.1	Very high	74	Confident	46 Å²	46	69.9 Å²	69.9	32%	0.322	42%	0.423	S	S	.	.			trans	-150.9	112.8	-174.7	174.6	0	0	0	0	111.1	A289 E293 R294 I295	A289-S291 PolarHBondContact O-N 2.66Å; S291-E293 VanDerWaalsContact C-N 3.3Å; S291-E293 PolarHBondContact O-N 3.1Å; S291-R294 PolarHBondContact O-N 2.92Å; S291-R294 PolarHBondContact OG-N 2.78Å; S291-I295 WeakPolarHBondContact O-CG1 3.1Å; S291-I295 PolarHBondContact O-N 3.15Å
292	A	94.4	Very high	76.7	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-55.1	-45	173.7	0	0	0	0	0	112.1	W290 R294 I295 A296 E380 A381	W290-A292 HydrophobicContact CH2-CB 3.69Å; W290-A292 HydrophobicContact CZ3-CB 3.91Å; A292-R294 PolarHBondContact O-N 3.39Å; A292-I295 PolarHBondContact O-N 3.11Å; A292-A296 WeakPolarHBondContact O-CB 3.37Å; A292-A296 PolarHBondContact O-N 3.35Å; A292-E380 HydrophobicContact CB-CB 3.88Å; A292-E380 VanDerWaalsContact CB-CD 3.48Å; A292-E380 HydrophobicContact CB-CG 3.47Å; A292-E380 VanDerWaalsContact CB-CG 3.47Å; A292-E380 WeakPolarHBondContact CB-OE1 3.31Å; A292-A381 HydrophobicContact CB-CB 4.36Å
293	E	94.4	Very high	79.3	Confident	85 Å²	85	61.2 Å²	61.2	40%	0.397	37%	0.366	S	S	.	.	H	α-helix	trans	-56	-49.4	177.5	170.8	158.4	158.6	0	0	111.9	S291 K297 Y384	S291-E293 VanDerWaalsContact C-N 3.3Å; S291-E293 PolarHBondContact O-N 3.1Å; E293-K297 VanDerWaalsContact CD-NZ 3.3Å; E293-K297 HydrophobicContact CG-CD 3.91Å; E293-K297 WeakPolarHBondContact O-CB 3.28Å; E293-K297 WeakPolarHBondContact O-CG 3.45Å; E293-K297 PolarHBondContact O-N 2.83Å; E293-K297 IonicContact OE1-NZ 2.64Å; E293-K297 PolarHBondContact OE1-NZ 2.91Å; E293-K297 IonicContact OE2-NZ 3.83Å; E293-Y384 HydrophobicContact CB-CD2 3.97Å; E293-Y384 HydrophobicContact CB-CE1 4.38Å; E293-Y384 HydrophobicContact CB-CE2 3.5Å; E293-Y384 VanDerWaalsContact CB-CE2 3.5Å; E293-Y384 HydrophobicContact CG-CE1 4.14Å; E293-Y384 HydrophobicContact CG-CE2 3.81Å; E293-Y384 WeakPolarHBondContact CG-OH 3.49Å; E293-Y384 VanDerWaalsContact OE2-CE2 3.27Å; E293-Y384 WeakPolarHBondContact OE2-CE2 3.49Å; E293-Y384 VanDerWaalsContact OE2-CZ 3.25Å; E293-Y384 PolarHBondContact OE2-OH 2.72Å
294	R	94.4	Very high	81.8	Confident	104 Å²	104	54.3 Å²	54.3	39%	0.392	33%	0.329	S	S	.	.	H	α-helix	trans	-64.2	-46.3	-178.9	-174.6	177.3	171.9	173.9	-5.1	110.8	S291 A292 Q298	S291-R294 PolarHBondContact O-N 2.92Å; S291-R294 PolarHBondContact OG-N 2.78Å; A292-R294 PolarHBondContact O-N 3.39Å; R294-Q298 HydrophobicContact CG-CG 4.31Å; R294-Q298 VanDerWaalsContact O-CB 3.27Å; R294-Q298 WeakPolarHBondContact O-CB 3.38Å; R294-Q298 WeakPolarHBondContact O-CG 3.5Å; R294-Q298 PolarHBondContact O-N 3.34Å
295	I	95.7	Very high	84.2	Confident	13 Å²	13	56.1 Å²	56.1	7%	0.067	33%	0.328	C	S	.	.	H	α-helix	trans	-64.6	-43.6	-179	-65.4	167	0	0	0	110.8	W290 S291 A292 Y299 I300 F315	W290-I295 HydrophobicContact CD2-CD1 4.42Å; W290-I295 HydrophobicContact CZ2-CD1 4.07Å; S291-I295 WeakPolarHBondContact O-CG1 3.1Å; S291-I295 PolarHBondContact O-N 3.15Å; A292-I295 PolarHBondContact O-N 3.11Å; I295-Y299 WeakPolarHBondContact O-CB 3.33Å; I295-Y299 PolarHBondContact O-N 2.81Å; I295-I300 HydrophobicContact CG2-CD1 3.94Å; I295-I300 HydrophobicContact CG2-CG1 4.11Å; I295-I300 PolarHBondContact O-N 2.67Å; I295-I300 VanDerWaalsContact O-N 3.11Å; I295-F315 HydrophobicContact CD1-CD2 4.07Å; I295-F315 HydrophobicContact CD1-CE2 3.89Å; I295-F315 HydrophobicContact CG2-CE2 4.3Å
296	A	95.3	Very high	86.6	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.328	C	S	.	.	I	π-helix	trans	-60.9	-54.2	176.7	0	0	0	0	0	112	A292 I300 I301 Y384 S385	A292-A296 WeakPolarHBondContact O-CB 3.37Å; A292-A296 PolarHBondContact O-N 3.35Å; A296-I300 PolarHBondContact O-N 3.18Å; A296-I301 HydrophobicContact CB-CD1 4.26Å; A296-I301 WeakPolarHBondContact O-CB 3.43Å; A296-I301 WeakPolarHBondContact O-CD1 3.27Å; A296-I301 WeakPolarHBondContact O-CG1 3.4Å; A296-I301 PolarHBondContact O-N 3.07Å; A296-Y384 HydrophobicContact CB-CD1 3.58Å; A296-Y384 HydrophobicContact CB-CG 4.06Å; A296-S385 WeakPolarHBondContact CA-OG 3.42Å; A296-S385 WeakPolarHBondContact CB-OG 3.39Å
297	K	94.4	Very high	89	Confident	105 Å²	105	58.8 Å²	58.8	46%	0.457	30%	0.303	S	S	.	.	I	π-helix	trans	-68.5	-41.3	-175.7	-73.3	-179.7	178.1	171.3	0	113.5	E293 P302 Y384	E293-K297 VanDerWaalsContact CD-NZ 3.3Å; E293-K297 HydrophobicContact CG-CD 3.91Å; E293-K297 WeakPolarHBondContact O-CB 3.28Å; E293-K297 WeakPolarHBondContact O-CG 3.45Å; E293-K297 PolarHBondContact O-N 2.83Å; E293-K297 IonicContact OE1-NZ 2.64Å; E293-K297 PolarHBondContact OE1-NZ 2.91Å; E293-K297 IonicContact OE2-NZ 3.83Å; K297-P302 WeakPolarHBondContact O-CD 3.22Å; K297-Y384 HydrophobicContact CD-CE1 4.46Å; K297-Y384 WeakPolarHBondContact CE-OH 3.48Å; K297-Y384 HydrophobicContact CG-CE1 4.13Å; K297-Y384 PolarHBondContact NZ-OH 2.9Å; K297-Y384 VanDerWaalsContact NZ-OH 3.14Å
298	Q	93.8	Very high	91.2	Very high	90 Å²	90	55.5 Å²	55.5	42%	0.421	27%	0.269	S	S	.	.	I	π-helix	trans	-86.1	-31.2	-173.7	-64.3	-177.9	-18.1	0	0	113	R294 P302	R294-Q298 HydrophobicContact CG-CG 4.31Å; R294-Q298 VanDerWaalsContact O-CB 3.27Å; R294-Q298 WeakPolarHBondContact O-CB 3.38Å; R294-Q298 WeakPolarHBondContact O-CG 3.5Å; R294-Q298 PolarHBondContact O-N 3.34Å; Q298-P302 WeakPolarHBondContact O-CG 3.39Å
299	Y	94.1	Very high	93	Very high	27 Å²	27	52.6 Å²	52.6	11%	0.106	25%	0.251	C	S	.	.	I	π-helix	trans	-119.9	-62.8	-173.5	-55.7	-95.5	0	0	0	112.5	D41 I295 P302 C303 K312	D41-Y299 PolarHBondContact OD2-OH 3.37Å; I295-Y299 WeakPolarHBondContact O-CB 3.33Å; I295-Y299 PolarHBondContact O-N 2.81Å; Y299-P302 WeakPolarHBondContact O-CD 3.49Å; Y299-P302 WeakPolarHBondContact O-CG 3.19Å; Y299-C303 WeakPolarHBondContact O-CB 3.33Å; Y299-C303 PolarHBondContact O-N 2.84Å; Y299-C303 PolarHBondContact O-SG 3.31Å; Y299-C303 VanDerWaalsContact O-SG 3.34Å; Y299-K312 HydrophobicContact CD1-CD 3.92Å; Y299-K312 HydrophobicContact CD2-CD 4.2Å; Y299-K312 HydrophobicContact CE1-CD 3.97Å; Y299-K312 HydrophobicContact CE2-CD 4.25Å; Y299-K312 HydrophobicContact CG-CD 4.05Å
300	I	96	Very high	94.2	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.01	22%	0.219	C	C	.	.	I	π-helix	trans	-64.2	-53.8	-166.6	-52.3	177	0	0	0	111.9	I295 A296 C303 M304 A381 S385 L391 I469	I295-I300 HydrophobicContact CG2-CD1 3.94Å; I295-I300 HydrophobicContact CG2-CG1 4.11Å; I295-I300 PolarHBondContact O-N 2.67Å; I295-I300 VanDerWaalsContact O-N 3.11Å; A296-I300 PolarHBondContact O-N 3.18Å; I300-C303 PolarHBondContact O-N 2.85Å; I300-M304 HydrophobicContact CG2-CG 3.9Å; I300-M304 WeakPolarHBondContact O-CB 3.33Å; I300-M304 WeakPolarHBondContact O-CG 3.34Å; I300-M304 PolarHBondContact O-N 3.36Å; I300-A381 HydrophobicContact CD1-CB 3.89Å; I300-S385 WeakPolarHBondContact CB-OG 3.37Å; I300-S385 WeakPolarHBondContact CG2-OG 3.21Å; I300-L391 HydrophobicContact CG2-CD1 4.49Å; I300-L391 HydrophobicContact CG2-CD2 4.49Å; I300-I469 HydrophobicContact CB-CD1 4.46Å; I300-I469 HydrophobicContact CD1-CD1 3.65Å; I300-I469 HydrophobicContact CG1-CD1 3.75Å; I300-I469 HydrophobicContact CG2-CD1 3.93Å
301	I	95.4	Very high	94.7	Very high	14 Å²	14	45.4 Å²	45.4	7%	0.072	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-52.6	-177.4	-65.7	160.7	0	0	0	112.2	A296 K305 Q390	A296-I301 HydrophobicContact CB-CD1 4.26Å; A296-I301 WeakPolarHBondContact O-CB 3.43Å; A296-I301 WeakPolarHBondContact O-CD1 3.27Å; A296-I301 WeakPolarHBondContact O-CG1 3.4Å; A296-I301 PolarHBondContact O-N 3.07Å; I301-K305 HydrophobicContact CG2-CD 4.14Å; I301-K305 WeakPolarHBondContact O-CB 2.81Å; I301-K305 VanDerWaalsContact O-CG 3.27Å; I301-K305 WeakPolarHBondContact O-CG 3.43Å; I301-K305 PolarHBondContact O-N 3.04Å; I301-Q390 HydrophobicContact CD1-CB 4.15Å; I301-Q390 HydrophobicContact CG1-CB 4.18Å; I301-Q390 HydrophobicContact CG2-CB 4.16Å
302	P	95.1	Very high	94.8	Very high	46 Å²	46	44.8 Å²	44.8	30%	0.299	20%	0.198	S	C	.	.	H	α-helix	trans	-64.9	-43.4	179.2	22.5	-31.5	0	0	0	112.7	M42 K297 Q298 Y299 K305 Y306	M42-P302 HydrophobicContact CE-CB 4.23Å; M42-P302 HydrophobicContact CE-CG 4.2Å; K297-P302 WeakPolarHBondContact O-CD 3.22Å; Q298-P302 WeakPolarHBondContact O-CG 3.39Å; Y299-P302 WeakPolarHBondContact O-CD 3.49Å; Y299-P302 WeakPolarHBondContact O-CG 3.19Å; P302-K305 PolarHBondContact O-N 3.45Å; P302-Y306 PolarHBondContact O-N 3.34Å; P302-Y306 VanDerWaalsContact O-N 3.13Å
303	C	95.5	Very high	95	Very high	1 Å²	1	47 Å²	47	1%	0.007	21%	0.21	C	C	.	.	H	α-helix	trans	-67.8	-43.5	-177.6	-70.6	0	0	0	0	112.7	M42 Y299 I300 K305 Y306 Y307 G308 I309 C310	M42-C303 WeakPolarHBondContact CE-SG 3.47Å; Y299-C303 WeakPolarHBondContact O-CB 3.33Å; Y299-C303 PolarHBondContact O-N 2.84Å; Y299-C303 PolarHBondContact O-SG 3.31Å; Y299-C303 VanDerWaalsContact O-SG 3.34Å; I300-C303 PolarHBondContact O-N 2.85Å; C303-K305 VanDerWaalsContact C-N 3.3Å; C303-K305 PolarHBondContact O-N 3.4Å; C303-Y306 PolarHBondContact O-N 3.26Å; C303-Y307 HydrophobicContact CB-CD2 4.4Å; C303-Y307 WeakPolarHBondContact O-CA 3.4Å; C303-Y307 WeakPolarHBondContact O-CB 3.32Å; C303-Y307 PolarHBondContact O-N 3.43Å; C303-G308 PolarHBondContact O-N 3.33Å; C303-G308 VanDerWaalsContact O-N 3.13Å; C303-I309 CarbonylContact C-O 3.58Å; C303-I309 WeakPolarHBondContact CB-O 3.38Å; C303-C310 HydrophobicContact CB-CB 3.6Å
304	M	94.8	Very high	95	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.02	22%	0.222	C	C	.	.	H	α-helix	trans	-68.9	-27.2	179	-67.6	-59.9	-60.2	0	0	113.3	I300 G308 C310 L391 L428 I469 W471	I300-M304 HydrophobicContact CG2-CG 3.9Å; I300-M304 WeakPolarHBondContact O-CB 3.33Å; I300-M304 WeakPolarHBondContact O-CG 3.34Å; I300-M304 PolarHBondContact O-N 3.36Å; M304-G308 WeakPolarHBondContact O-CA 3.45Å; M304-C310 HydrophobicContact CG-CB 4.13Å; M304-C310 HydrophobicContact SD-CB 4.01Å; M304-L391 HydrophobicContact CB-CD2 3.39Å; M304-L391 HydrophobicContact CG-CD2 3.89Å; M304-L428 HydrophobicContact CE-CD2 3.5Å; M304-L428 VanDerWaalsContact CE-CD2 3.5Å; M304-I469 HydrophobicContact CE-CG2 4.24Å; M304-I469 HydrophobicContact SD-CB 4.22Å; M304-I469 HydrophobicContact SD-CG2 3.86Å; M304-W471 HydrophobicContact CE-CD2 3.84Å; M304-W471 HydrophobicContact CE-CG 3.99Å; M304-W471 HydrophobicContact CE-CZ2 4.09Å; M304-W471 PolarHBondContact O-NE1 3.45Å
305	K	92.5	Very high	95.2	Very high	133 Å²	133	43.9 Å²	43.9	58%	0.578	20%	0.204	S	C	*	.	H	α-helix	trans	-72.9	-43.7	173.1	-78.1	-179.5	-179.3	-176.2	0	113.3	I301 P302 C303 Q390	I301-K305 HydrophobicContact CG2-CD 4.14Å; I301-K305 WeakPolarHBondContact O-CB 2.81Å; I301-K305 VanDerWaalsContact O-CG 3.27Å; I301-K305 WeakPolarHBondContact O-CG 3.43Å; I301-K305 PolarHBondContact O-N 3.04Å; P302-K305 PolarHBondContact O-N 3.45Å; C303-K305 VanDerWaalsContact C-N 3.3Å; C303-K305 PolarHBondContact O-N 3.4Å; K305-Q390 WeakPolarHBondContact CE-O 3.44Å
306	Y	90.6	Very high	95.2	Very high	165 Å²	165	44.4 Å²	44.4	65%	0.647	21%	0.206	S	C	*	.	H	α-helix	trans	-94.9	-48.2	-172.4	-173.6	-90.6	0	0	0	113.1	P302 C303 K454	P302-Y306 PolarHBondContact O-N 3.34Å; P302-Y306 VanDerWaalsContact O-N 3.13Å; C303-Y306 PolarHBondContact O-N 3.26Å; Y306-K454 PolarHBondContact O-NZ 3.31Å
307	Y	92.1	Very high	95.1	Very high	98 Å²	98	45.8 Å²	45.8	38%	0.384	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-38.9	-179.3	-61.2	-74.5	0	0	0	112	L44 C303 I309 K454	L44-Y307 HydrophobicContact CD1-CD1 4.16Å; L44-Y307 HydrophobicContact CD1-CD2 3.5Å; L44-Y307 HydrophobicContact CD1-CE1 3.98Å; L44-Y307 HydrophobicContact CD1-CE2 3.3Å; L44-Y307 HydrophobicContact CD1-CG 3.95Å; C303-Y307 HydrophobicContact CB-CD2 4.4Å; C303-Y307 WeakPolarHBondContact O-CA 3.4Å; C303-Y307 WeakPolarHBondContact O-CB 3.32Å; C303-Y307 PolarHBondContact O-N 3.43Å; Y307-I309 VanDerWaalsContact C-N 3.26Å; Y307-I309 WeakPolarHBondContact CB-O 3.4Å; Y307-K454 PolarHBondContact O-NZ 2.87Å
308	G	93.7	Very high	95	Very high	10 Å²	10	42.7 Å²	42.7	10%	0.103	22%	0.219	C	C	.	.	S	Bend	trans	82.8	7.2	-168.3	0	0	0	0	0	113.6	C303 M304 W471 N476	C303-G308 PolarHBondContact O-N 3.33Å; C303-G308 VanDerWaalsContact O-N 3.13Å; M304-G308 WeakPolarHBondContact O-CA 3.45Å; G308-W471 VanDerWaalsContact O-CD1 3.28Å; G308-W471 PolarHBondContact O-N 3.36Å; G308-N476 PolarHBondContact O-ND2 2.86Å; G308-N476 VanDerWaalsContact O-ND2 3.15Å
309	I	96.4	Very high	95.1	Very high	7 Å²	7	47.5 Å²	47.5	4%	0.036	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	142	179.8	-58.6	169	0	0	0	106.1	C303 Y307 I449 P451 A458 L468 I469 F470	C303-I309 CarbonylContact C-O 3.58Å; C303-I309 WeakPolarHBondContact CB-O 3.38Å; Y307-I309 VanDerWaalsContact C-N 3.26Å; Y307-I309 WeakPolarHBondContact CB-O 3.4Å; I309-I449 HydrophobicContact CD1-CB 4Å; I309-I449 HydrophobicContact CD1-CD1 3.91Å; I309-I449 HydrophobicContact CD1-CG2 3.72Å; I309-I449 HydrophobicContact CG1-CD1 4.31Å; I309-I449 HydrophobicContact CG2-CD1 4.27Å; I309-P451 HydrophobicContact CD1-CG 3.81Å; I309-A458 HydrophobicContact CD1-CB 3.99Å; I309-L468 HydrophobicContact CG2-CD1 3.71Å; I309-I469 CarbonylContact C-O 3.57Å; I309-I469 WeakPolarHBondContact CA-O 3.33Å; I309-F470 HydrophobicContact CB-CB 4.42Å; I309-F470 HydrophobicContact CG1-CB 3.98Å; I309-F470 HydrophobicContact CG2-CB 4.47Å
310	C	97.7	Very high	95.2	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.014	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138.5	171.8	-178.1	0	0	0	0	109.9	C303 M304 L468 I469	C303-C310 HydrophobicContact CB-CB 3.6Å; M304-C310 HydrophobicContact CG-CB 4.13Å; M304-C310 HydrophobicContact SD-CB 4.01Å; C310-L468 WeakPolarHBondContact O-CA 3.38Å; C310-I469 HydrophobicContact CB-CB 4.32Å; C310-I469 PolarHBondContact N-O 3.4Å; C310-I469 PolarHBondContact O-N 3.33Å
311	V	97.9	Very high	95.3	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.4	172.9	-177.9	0	0	0	0	108.1	I460 R466 L467 L468	V311-I460 HydrophobicContact CG2-CD1 3.94Å; V311-R466 HydrophobicContact CG1-CG 3.88Å; V311-L467 CarbonylContact C-O 3.46Å; V311-L467 WeakPolarHBondContact CA-O 3.14Å; V311-L468 HydrophobicContact CG2-CD1 4.08Å
312	K	97.4	Very high	95.4	Very high	34 Å²	34	49.7 Å²	49.7	15%	0.148	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	104.4	170.6	179.8	60.7	176.9	68.5	0	109.2	Y299 N314 F315 L467	Y299-K312 HydrophobicContact CD1-CD 3.92Å; Y299-K312 HydrophobicContact CD2-CD 4.2Å; Y299-K312 HydrophobicContact CE1-CD 3.97Å; Y299-K312 HydrophobicContact CE2-CD 4.25Å; Y299-K312 HydrophobicContact CG-CD 4.05Å; K312-N314 PolarHBondContact NZ-O 3.18Å; K312-F315 HydrophobicContact CG-CB 4.43Å; K312-F315 HydrophobicContact CG-CD2 4.35Å; K312-L467 PolarHBondContact N-O 2.88Å; K312-L467 PolarHBondContact O-N 2.92Å
313	D	97.1	Very high	95.5	Very high	46 Å²	46	48.3 Å²	48.3	25%	0.246	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	149.3	167.2	-72.6	-46.5	0	0	0	110.9	R466	D313-R466 VanDerWaalsContact CG-NH2 3.34Å; D313-R466 WeakPolarHBondContact OD1-CB 3.19Å; D313-R466 IonicContact OD1-CZ 3.86Å; D313-R466 VanDerWaalsContact OD1-CZ 3.31Å; D313-R466 IonicContact OD1-NE 3.95Å; D313-R466 PolarHBondContact OD1-NE 2.9Å; D313-R466 IonicContact OD1-NH2 2.92Å; D313-R466 PolarHBondContact OD1-NH2 3.13Å; D313-R466 VanDerWaalsContact OD1-NH2 3.15Å; D313-R466 IonicContact OD2-CZ 2.83Å; D313-R466 IonicContact OD2-NE 3.01Å; D313-R466 IonicContact OD2-NH2 3.23Å; D313-R466 PolarHBondContact OD2-NH2 3.23Å
314	N	95.8	Very high	95.7	Very high	120 Å²	120	48.3 Å²	48.3	64%	0.642	25%	0.249	S	C	*	.	S	Bend	trans	55	61.2	-173.7	-51.3	-81.3	0	0	0	110.6	K312 D465	K312-N314 PolarHBondContact NZ-O 3.18Å; N314-D465 VanDerWaalsContact CA-OD2 3.25Å; N314-D465 WeakPolarHBondContact CA-OD2 3.49Å; N314-D465 PolarHBondContact N-O 3.1Å
315	F	97.3	Very high	95.8	Very high	4 Å²	4	49 Å²	49	2%	0.018	25%	0.252	C	S	.	.	S	Bend	trans	-80.3	-42.5	-176.8	174.2	-114	0	0	0	113.1	W290 I295 K312 L374 H377 I378 Y432 D465 L467	W290-F315 AromaticContact CZ2-CE2 3.98Å; W290-F315 HydrophobicContact CZ2-CE2 3.98Å; W290-F315 AromaticContact CZ2-CZ 3.85Å; W290-F315 HydrophobicContact CZ2-CZ 3.85Å; W290-F315 AromaticContact NE1-CE2 3.75Å; W290-F315 AromaticContact NE1-CZ 3.97Å; W290-F315 PolarHBondContact NE1-O 3.46Å; I295-F315 HydrophobicContact CD1-CD2 4.07Å; I295-F315 HydrophobicContact CD1-CE2 3.89Å; I295-F315 HydrophobicContact CG2-CE2 4.3Å; K312-F315 HydrophobicContact CG-CB 4.43Å; K312-F315 HydrophobicContact CG-CD2 4.35Å; F315-L374 HydrophobicContact CD1-CD1 4.32Å; F315-L374 HydrophobicContact CE1-CD1 4.13Å; F315-H377 HydrophobicContact CE1-CB 4.15Å; F315-H377 HydrophobicContact CZ-CB 4.05Å; F315-I378 HydrophobicContact CE1-CG1 3.81Å; F315-I378 HydrophobicContact CZ-CG1 4.12Å; F315-Y432 HydrophobicContact CB-CE2 4.26Å; F315-Y432 HydrophobicContact CD1-CD2 4.21Å; F315-Y432 HydrophobicContact CD1-CE2 4.08Å; F315-D465 PolarHBondContact N-O 3.24Å; F315-D465 PolarHBondContact N-OD1 3.11Å; F315-D465 PolarHBondContact N-OD2 2.98Å; F315-L467 HydrophobicContact CB-CB 3.85Å; F315-L467 HydrophobicContact CD1-CB 4.05Å; F315-L467 HydrophobicContact CD1-CD2 4Å; F315-L467 HydrophobicContact CD2-CB 4.22Å; F315-L467 HydrophobicContact CD2-CD2 3.7Å; F315-L467 HydrophobicContact CE1-CD2 3.91Å; F315-L467 HydrophobicContact CE2-CD2 3.6Å; F315-L467 HydrophobicContact CG-CB 3.76Å; F315-L467 HydrophobicContact CG-CD2 3.91Å; F315-L467 HydrophobicContact CG-CG 4.45Å; F315-L467 HydrophobicContact CZ-CD2 3.72Å
316	L	95.7	Very high	96.1	Very high	23 Å²	23	49 Å²	49	12%	0.12	25%	0.253	C	S	.	.	S	Bend	trans	-104.3	-24	178.6	-61.2	-172	0	0	0	113.4	L320 V324 L374 H377 Y432 D465	L316-L320 HydrophobicContact CB-CB 4.19Å; L316-L320 HydrophobicContact CB-CD2 4.19Å; L316-L320 HydrophobicContact CB-CG 4.36Å; L316-L320 HydrophobicContact CD1-CD2 3.92Å; L316-L320 HydrophobicContact CD1-CG 3.9Å; L316-L320 HydrophobicContact CD2-CD2 4.16Å; L316-L320 HydrophobicContact CG-CD2 4.33Å; L316-V324 HydrophobicContact CD1-CG2 4.17Å; L316-L374 HydrophobicContact CD1-CB 4Å; L316-L374 HydrophobicContact CD1-CD1 3.78Å; L316-L374 HydrophobicContact CD1-CG 4.43Å; L316-L374 HydrophobicContact CD2-CD1 4.33Å; L316-L374 HydrophobicContact CG-CD1 4.26Å; L316-H377 HydrophobicContact CD2-CB 3.95Å; L316-Y432 HydrophobicContact CD1-CE1 4.25Å; L316-Y432 HydrophobicContact CD1-CE2 4.38Å; L316-Y432 HydrophobicContact CG-CE2 4.18Å; L316-D465 PolarHBondContact N-OD1 3.01Å; L316-D465 PolarHBondContact N-OD2 3.41Å
317	G	94.2	Very high	96.4	Very high	29 Å²	29	42.6 Å²	42.6	30%	0.299	23%	0.228	S	C	.	.			trans	83.8	150.4	-165.5	0	0	0	0	0	112.2	Q319 L320 G321 D465	G317-Q319 VanDerWaalsContact C-N 3.3Å; G317-Q319 PolarHBondContact O-N 3.02Å; G317-Q319 VanDerWaalsContact O-N 3.11Å; G317-L320 PolarHBondContact O-N 2.66Å; G317-G321 PolarHBondContact O-N 2.76Å; G317-G321 VanDerWaalsContact O-N 3.07Å; G317-D465 VanDerWaalsContact CA-OD2 3.3Å; G317-D465 WeakPolarHBondContact CA-OD2 3.39Å; G317-D465 PolarHBondContact N-OD2 3.27Å
318	G	92.8	Very high	96.7	Very high	41 Å²	41	38 Å²	38	42%	0.423	21%	0.21	S	C	.	.	H	α-helix	trans	-57.6	-31.9	-167.5	0	0	0	0	0	115.9	D322	G318-D322 WeakPolarHBondContact O-CB 3.33Å; G318-D322 VanDerWaalsContact O-CG 3.25Å; G318-D322 PolarHBondContact O-N 2.86Å
319	Q	95	Very high	96.8	Very high	191 Å²	191	41 Å²	41	89%	0.893	22%	0.222	S	C	*	.	H	α-helix	trans	-65	-46.7	179.9	-67.9	-173	4	0	0	112.7	G317 G323	G317-Q319 VanDerWaalsContact C-N 3.3Å; G317-Q319 PolarHBondContact O-N 3.02Å; G317-Q319 VanDerWaalsContact O-N 3.11Å; Q319-G323 PolarHBondContact O-N 2.82Å
320	L	95.9	Very high	96.7	Very high	46 Å²	46	43.1 Å²	43.1	24%	0.241	24%	0.24	C	C	.	.	H	α-helix	trans	-79.4	-36.7	-179.1	-176.1	62.4	0	0	0	111.1	L316 G317 D322 G323 V324 T373	L316-L320 HydrophobicContact CB-CB 4.19Å; L316-L320 HydrophobicContact CB-CD2 4.19Å; L316-L320 HydrophobicContact CB-CG 4.36Å; L316-L320 HydrophobicContact CD1-CD2 3.92Å; L316-L320 HydrophobicContact CD1-CG 3.9Å; L316-L320 HydrophobicContact CD2-CD2 4.16Å; L316-L320 HydrophobicContact CG-CD2 4.33Å; G317-L320 PolarHBondContact O-N 2.66Å; L320-D322 VanDerWaalsContact C-N 3.26Å; L320-D322 PolarHBondContact O-N 2.89Å; L320-G323 WeakPolarHBondContact O-CA 3.42Å; L320-G323 PolarHBondContact O-N 2.73Å; L320-V324 WeakPolarHBondContact O-CG2 3.32Å; L320-V324 PolarHBondContact O-N 3.06Å; L320-T373 HydrophobicContact CD1-CG2 4.26Å; L320-T373 HydrophobicContact CD2-CG2 3.72Å
321	G	97.6	Very high	96.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.3	-37.3	170.2	0	0	0	0	0	112.9	G317 V324 L325	G317-G321 PolarHBondContact O-N 2.76Å; G317-G321 VanDerWaalsContact O-N 3.07Å; G321-V324 PolarHBondContact O-N 3.05Å; G321-L325 WeakPolarHBondContact O-CB 3.29Å; G321-L325 PolarHBondContact O-N 2.92Å
322	D	98.2	Very high	96.4	Very high	43 Å²	43	45.2 Å²	45.2	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-32.7	174	-85.2	27.5	0	0	0	113	G318 L320 K326 K436 F464	G318-D322 WeakPolarHBondContact O-CB 3.33Å; G318-D322 VanDerWaalsContact O-CG 3.25Å; G318-D322 PolarHBondContact O-N 2.86Å; L320-D322 VanDerWaalsContact C-N 3.26Å; L320-D322 PolarHBondContact O-N 2.89Å; D322-K326 WeakPolarHBondContact O-CD 3.35Å; D322-K326 WeakPolarHBondContact O-CG 3.35Å; D322-K326 PolarHBondContact O-N 3.46Å; D322-K326 VanDerWaalsContact O-N 3.13Å; D322-K436 WeakPolarHBondContact OD1-CE 3.14Å; D322-K436 IonicContact OD1-NZ 3.99Å; D322-K436 PolarHBondContact OD1-NZ 2.97Å; D322-K436 IonicContact OD2-NZ 2.72Å; D322-K436 PolarHBondContact OD2-NZ 2.92Å; D322-F464 WeakPolarHBondContact OD1-CZ 3.31Å
323	G	98	Very high	96.2	Very high	17 Å²	17	51.5 Å²	51.5	18%	0.175	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-50.6	170.4	0	0	0	0	0	111.3	Q319 L320 L325 K326 E327	Q319-G323 PolarHBondContact O-N 2.82Å; L320-G323 WeakPolarHBondContact O-CA 3.42Å; L320-G323 PolarHBondContact O-N 2.73Å; G323-L325 PolarHBondContact O-N 2.89Å; G323-K326 PolarHBondContact O-N 2.92Å; G323-E327 WeakPolarHBondContact O-CG 3.13Å; G323-E327 PolarHBondContact O-N 3.33Å; G323-E327 VanDerWaalsContact O-N 3.09Å
324	V	98.4	Very high	96	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.7	-44.8	177.4	-178	0	0	0	0	111.5	L316 L320 G321 K326 E327 V328 I371 L374 Y432 L434 I492	L316-V324 HydrophobicContact CD1-CG2 4.17Å; L320-V324 WeakPolarHBondContact O-CG2 3.32Å; L320-V324 PolarHBondContact O-N 3.06Å; G321-V324 PolarHBondContact O-N 3.05Å; V324-K326 PolarHBondContact O-N 3.23Å; V324-E327 PolarHBondContact O-N 2.83Å; V324-V328 HydrophobicContact CG1-CG2 4.49Å; V324-V328 WeakPolarHBondContact O-CG2 3.3Å; V324-V328 PolarHBondContact O-N 2.74Å; V324-I371 HydrophobicContact CG1-CG1 4.05Å; V324-L374 HydrophobicContact CG1-CD2 3.92Å; V324-L374 HydrophobicContact CG2-CB 4.04Å; V324-L374 HydrophobicContact CG2-CD2 4.34Å; V324-Y432 HydrophobicContact CB-CE1 4.47Å; V324-Y432 HydrophobicContact CG1-CD1 4.46Å; V324-Y432 HydrophobicContact CG1-CE1 4.24Å; V324-L434 HydrophobicContact CB-CD2 4.06Å; V324-L434 HydrophobicContact CG1-CD1 4.17Å; V324-L434 HydrophobicContact CG1-CD2 3.72Å; V324-I492 HydrophobicContact CG1-CD1 3.44Å; V324-I492 VanDerWaalsContact CG1-CD1 3.44Å
325	L	98.2	Very high	95.6	Very high	18 Å²	18	48.3 Å²	48.3	9%	0.094	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-47.6	178.6	174.7	58.2	0	0	0	111.6	G321 G323 E327 V328 E329 L434 K436 F464 Y490	G321-L325 WeakPolarHBondContact O-CB 3.29Å; G321-L325 PolarHBondContact O-N 2.92Å; G323-L325 PolarHBondContact O-N 2.89Å; L325-E327 VanDerWaalsContact C-N 3.34Å; L325-E327 PolarHBondContact O-N 2.97Å; L325-V328 PolarHBondContact O-N 3.32Å; L325-E329 HydrophobicContact CD1-CG 3.95Å; L325-E329 HydrophobicContact CG-CG 4.46Å; L325-E329 WeakPolarHBondContact O-CG 3.07Å; L325-E329 PolarHBondContact O-N 2.68Å; L325-L434 HydrophobicContact CB-CD2 4.25Å; L325-L434 HydrophobicContact CD1-CB 4.22Å; L325-K436 HydrophobicContact CD2-CD 4.13Å; L325-K436 HydrophobicContact CD2-CG 4.26Å; L325-F464 HydrophobicContact CB-CE2 4.46Å; L325-F464 HydrophobicContact CD2-CE2 4.35Å; L325-Y490 HydrophobicContact CD1-CD2 4.1Å; L325-Y490 HydrophobicContact CD1-CE2 4.46Å
326	K	97.8	Very high	95.3	Very high	135 Å²	135	52.4 Å²	52.4	59%	0.587	30%	0.297	S	S	*	.	H	α-helix	trans	-60.1	-42.1	178.2	-71.8	164	-172.7	169.6	0	112.4	D322 G323 V324 E329 A330	D322-K326 WeakPolarHBondContact O-CD 3.35Å; D322-K326 WeakPolarHBondContact O-CG 3.35Å; D322-K326 PolarHBondContact O-N 3.46Å; D322-K326 VanDerWaalsContact O-N 3.13Å; G323-K326 PolarHBondContact O-N 2.92Å; V324-K326 PolarHBondContact O-N 3.23Å; K326-E329 PolarHBondContact O-N 2.87Å; K326-A330 WeakPolarHBondContact O-CB 3.37Å; K326-A330 PolarHBondContact O-N 3.44Å
327	E	97.5	Very high	95.1	Very high	30 Å²	30	51.9 Å²	51.9	14%	0.14	29%	0.294	C	S	.	.	H	α-helix	trans	-64.3	-39.8	176.5	-70.6	179	-178.3	0	0	111.7	G323 V324 L325 L331 E367 C368 Q369 S370 I371	G323-E327 WeakPolarHBondContact O-CG 3.13Å; G323-E327 PolarHBondContact O-N 3.33Å; G323-E327 VanDerWaalsContact O-N 3.09Å; V324-E327 PolarHBondContact O-N 2.83Å; L325-E327 VanDerWaalsContact C-N 3.34Å; L325-E327 PolarHBondContact O-N 2.97Å; E327-L331 VanDerWaalsContact O-CB 3.23Å; E327-L331 WeakPolarHBondContact O-CB 3.44Å; E327-L331 PolarHBondContact O-N 2.97Å; E327-E367 WeakPolarHBondContact CG-O 3.46Å; E327-C368 WeakPolarHBondContact OE2-CA 3.46Å; E327-Q369 PolarHBondContact OE1-N 3.5Å; E327-Q369 VanDerWaalsContact OE1-N 3.08Å; E327-Q369 PolarHBondContact OE2-N 2.81Å; E327-S370 VanDerWaalsContact CD-CB 3.42Å; E327-S370 VanDerWaalsContact CD-N 3.29Å; E327-S370 VanDerWaalsContact CD-OG 3.28Å; E327-S370 VanDerWaalsContact OE1-CB 3.27Å; E327-S370 WeakPolarHBondContact OE1-CB 3Å; E327-S370 PolarHBondContact OE1-N 3.26Å; E327-S370 PolarHBondContact OE1-OG 2.96Å; E327-S370 WeakPolarHBondContact OE2-CA 3.34Å; E327-S370 WeakPolarHBondContact OE2-CB 3.13Å; E327-S370 PolarHBondContact OE2-N 3.47Å; E327-I371 HydrophobicContact CB-CD1 3.79Å; E327-I371 HydrophobicContact CB-CG1 4.18Å; E327-I371 WeakPolarHBondContact OE2-CG1 3.42Å; E327-I371 PolarHBondContact OE2-N 2.99Å
328	V	97.4	Very high	94.9	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-68.7	-39.6	176	169.6	0	0	0	0	112.4	V324 L325 L331 N332 I371 V404 L434 Y490 I492	V324-V328 HydrophobicContact CG1-CG2 4.49Å; V324-V328 WeakPolarHBondContact O-CG2 3.3Å; V324-V328 PolarHBondContact O-N 2.74Å; L325-V328 PolarHBondContact O-N 3.32Å; V328-L331 PolarHBondContact O-N 2.76Å; V328-N332 WeakPolarHBondContact O-CB 3.49Å; V328-N332 PolarHBondContact O-N 3.15Å; V328-I371 HydrophobicContact CG2-CD1 4.01Å; V328-I371 HydrophobicContact CG2-CG1 4.46Å; V328-V404 HydrophobicContact CB-CG1 4.23Å; V328-V404 HydrophobicContact CG1-CG1 3.65Å; V328-V404 HydrophobicContact CG2-CG1 3.65Å; V328-L434 HydrophobicContact CB-CD1 4.13Å; V328-L434 HydrophobicContact CG1-CD1 4.23Å; V328-L434 HydrophobicContact CG2-CD1 3.75Å; V328-Y490 HydrophobicContact CG1-CD1 3.49Å; V328-Y490 VanDerWaalsContact CG1-CD1 3.49Å; V328-Y490 HydrophobicContact CG1-CD2 4.32Å; V328-Y490 HydrophobicContact CG1-CE1 3.92Å; V328-Y490 HydrophobicContact CG1-CG 3.71Å; V328-I492 HydrophobicContact CG2-CD1 3.87Å; V328-I492 HydrophobicContact CG2-CG1 4.26Å
329	E	96.1	Very high	94.6	Very high	74 Å²	74	58.5 Å²	58.5	35%	0.346	31%	0.313	S	S	.	.	H	α-helix	trans	-65.1	-44.9	175.7	-73.1	178.6	149.3	0	0	111.6	L325 K326 L331 N332 Q333 Y490	L325-E329 HydrophobicContact CD1-CG 3.95Å; L325-E329 HydrophobicContact CG-CG 4.46Å; L325-E329 WeakPolarHBondContact O-CG 3.07Å; L325-E329 PolarHBondContact O-N 2.68Å; K326-E329 PolarHBondContact O-N 2.87Å; E329-L331 PolarHBondContact O-N 2.8Å; E329-N332 PolarHBondContact O-N 2.82Å; E329-Q333 VanDerWaalsContact O-CG 3.3Å; E329-Q333 WeakPolarHBondContact O-CG 3.16Å; E329-Q333 PolarHBondContact O-N 2.87Å; E329-Y490 HydrophobicContact CG-CE2 3.78Å
330	A	95.7	Very high	94	Very high	52 Å²	52	49.7 Å²	49.7	43%	0.43	27%	0.273	S	S	.	.	H	α-helix	trans	-62.7	-40.4	173.4	0	0	0	0	0	112	K326 N332 Q333 S334	K326-A330 WeakPolarHBondContact O-CB 3.37Å; K326-A330 PolarHBondContact O-N 3.44Å; A330-N332 VanDerWaalsContact C-N 3.29Å; A330-N332 PolarHBondContact O-N 3.04Å; A330-Q333 PolarHBondContact O-N 2.96Å; A330-S334 WeakPolarHBondContact O-CB 3.48Å; A330-S334 PolarHBondContact O-N 3.35Å; A330-S334 PolarHBondContact O-OG 2.93Å
331	L	94.3	Very high	93.2	Very high	11 Å²	11	53.9 Å²	53.9	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-39.6	174.9	-167.6	76.3	0	0	0	111.4	E327 V328 E329 S334 K336 F337 A359 V361 V404	E327-L331 VanDerWaalsContact O-CB 3.23Å; E327-L331 WeakPolarHBondContact O-CB 3.44Å; E327-L331 PolarHBondContact O-N 2.97Å; V328-L331 PolarHBondContact O-N 2.76Å; E329-L331 PolarHBondContact O-N 2.8Å; L331-S334 PolarHBondContact O-OG 3.02Å; L331-K336 HydrophobicContact CD1-CB 4.43Å; L331-K336 HydrophobicContact CD1-CD 3.74Å; L331-F337 HydrophobicContact CB-CE2 4Å; L331-F337 HydrophobicContact CD2-CE2 3.75Å; L331-F337 HydrophobicContact CD2-CZ 4.14Å; L331-F337 HydrophobicContact CG-CD2 4.34Å; L331-F337 HydrophobicContact CG-CE2 3.73Å; L331-A359 HydrophobicContact CD2-CB 3.77Å; L331-A359 HydrophobicContact CG-CB 4.38Å; L331-V361 HydrophobicContact CD2-CG2 3.81Å; L331-V404 HydrophobicContact CD2-CB 4.08Å; L331-V404 HydrophobicContact CD2-CG1 4.25Å; L331-V404 HydrophobicContact CD2-CG2 3.91Å
332	N	93.6	Very high	92.2	Very high	36 Å²	36	56.3 Å²	56.3	19%	0.193	30%	0.304	C	S	.	.	H	α-helix	trans	-67.8	-50.5	177.2	-165.3	25.1	0	0	0	111.4	V328 E329 A330 S334 G335 F337 Y490	V328-N332 WeakPolarHBondContact O-CB 3.49Å; V328-N332 PolarHBondContact O-N 3.15Å; E329-N332 PolarHBondContact O-N 2.82Å; A330-N332 VanDerWaalsContact C-N 3.29Å; A330-N332 PolarHBondContact O-N 3.04Å; N332-S334 PolarHBondContact O-N 3.36Å; N332-G335 PolarHBondContact O-N 2.73Å; N332-G335 VanDerWaalsContact O-N 3.11Å; N332-F337 HydrophobicContact CB-CD2 4.24Å; N332-F337 HydrophobicContact CB-CE2 3.93Å; N332-Y490 HydrophobicContact CB-CE1 4.12Å; N332-Y490 PolarHBondContact ND2-OH 3.44Å
333	Q	93.4	Very high	90.7	Very high	165 Å²	165	60.3 Å²	60.3	77%	0.771	33%	0.33	S	S	*	.	H	α-helix	trans	-58.1	-33.2	176.9	-68.9	169.3	19.4	0	0	112.8	E329 A330 G335	E329-Q333 VanDerWaalsContact O-CG 3.3Å; E329-Q333 WeakPolarHBondContact O-CG 3.16Å; E329-Q333 PolarHBondContact O-N 2.87Å; A330-Q333 PolarHBondContact O-N 2.96Å; Q333-G335 PolarHBondContact O-N 2.76Å
334	S	92.6	Very high	88.8	Confident	54 Å²	54	63.4 Å²	63.4	38%	0.378	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-0.3	179	73.3	0	0	0	0	115.5	A330 L331 N332 K336	A330-S334 WeakPolarHBondContact O-CB 3.48Å; A330-S334 PolarHBondContact O-N 3.35Å; A330-S334 PolarHBondContact O-OG 2.93Å; L331-S334 PolarHBondContact O-OG 3.02Å; N332-S334 PolarHBondContact O-N 3.36Å; S334-K336 PolarHBondContact O-N 3.37Å; S334-K336 VanDerWaalsContact O-N 3.17Å; S334-K336 WeakPolarHBondContact OG-CD 3.48Å; S334-K336 VanDerWaalsContact OG-CE 3.28Å; S334-K336 WeakPolarHBondContact OG-CE 3.46Å; S334-K336 VanDerWaalsContact OG-CG 3.31Å; S334-K336 WeakPolarHBondContact OG-CG 3.39Å; S334-K336 PolarHBondContact OG-NZ 2.89Å
335	G	88.8	Confident	86.7	Confident	45 Å²	45	68.2 Å²	68.2	46%	0.464	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	17.8	176.6	0	0	0	0	0	114.6	N332 Q333 F337 R338	N332-G335 PolarHBondContact O-N 2.73Å; N332-G335 VanDerWaalsContact O-N 3.11Å; Q333-G335 PolarHBondContact O-N 2.76Å; G335-F337 VanDerWaalsContact C-N 3.31Å; G335-R338 PolarHBondContact O-NH1 2.88Å
336	K	89.7	Confident	84.7	Confident	90 Å²	90	71.8 Å²	71.8	39%	0.391	40%	0.403	S	S	.	.			trans	-75.6	-17.9	178.3	-68.2	168.5	-166.3	153.6	0	113	L331 S334 E367	L331-K336 HydrophobicContact CD1-CB 4.43Å; L331-K336 HydrophobicContact CD1-CD 3.74Å; S334-K336 PolarHBondContact O-N 3.37Å; S334-K336 VanDerWaalsContact O-N 3.17Å; S334-K336 WeakPolarHBondContact OG-CD 3.48Å; S334-K336 VanDerWaalsContact OG-CE 3.28Å; S334-K336 WeakPolarHBondContact OG-CE 3.46Å; S334-K336 VanDerWaalsContact OG-CG 3.31Å; S334-K336 WeakPolarHBondContact OG-CG 3.39Å; S334-K336 PolarHBondContact OG-NZ 2.89Å; K336-E367 IonicContact NZ-OE2 2.62Å; K336-E367 PolarHBondContact NZ-OE2 3.34Å
337	F	91.1	Very high	82.9	Confident	12 Å²	12	72.3 Å²	72.3	5%	0.053	41%	0.413	C	S	.	.			trans	-68.4	147.6	179.4	-84	-103.6	0	0	0	113.5	L331 N332 G335 Q357 I358 A359 V404 C406	L331-F337 HydrophobicContact CB-CE2 4Å; L331-F337 HydrophobicContact CD2-CE2 3.75Å; L331-F337 HydrophobicContact CD2-CZ 4.14Å; L331-F337 HydrophobicContact CG-CD2 4.34Å; L331-F337 HydrophobicContact CG-CE2 3.73Å; N332-F337 HydrophobicContact CB-CD2 4.24Å; N332-F337 HydrophobicContact CB-CE2 3.93Å; G335-F337 VanDerWaalsContact C-N 3.31Å; F337-Q357 HydrophobicContact CB-CB 4.11Å; F337-Q357 HydrophobicContact CD1-CB 3.97Å; F337-Q357 WeakPolarHBondContact CD1-O 3.42Å; F337-I358 WeakPolarHBondContact CA-O 3.18Å; F337-A359 HydrophobicContact CD1-CB 4.23Å; F337-A359 HydrophobicContact CD2-CB 4.04Å; F337-A359 HydrophobicContact CE1-CB 4.24Å; F337-A359 HydrophobicContact CE2-CB 4.08Å; F337-A359 HydrophobicContact CG-CB 4.14Å; F337-A359 HydrophobicContact CZ-CB 4.19Å; F337-V404 HydrophobicContact CE1-CB 4.5Å; F337-V404 HydrophobicContact CE1-CG1 4.3Å; F337-V404 WeakPolarHBondContact CE1-O 3.35Å; F337-V404 HydrophobicContact CZ-CB 4.11Å; F337-V404 HydrophobicContact CZ-CG1 3.68Å; F337-C406 HydrophobicContact CD1-CB 3.7Å; F337-C406 HydrophobicContact CE1-CB 3.42Å; F337-C406 VanDerWaalsContact CE1-CB 3.42Å; F337-C406 HydrophobicContact CZ-CB 4.15Å
338	R	90.7	Very high	81.2	Confident	158 Å²	158	72 Å²	72	60%	0.596	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.6	152.9	177.7	-60.6	-66.4	176.4	-96.9	3	109.8	G335 G340 Q357 I358	G335-R338 PolarHBondContact O-NH1 2.88Å; R338-G340 PolarHBondContact O-N 3.31Å; R338-Q357 CarbonylContact O-C 3.45Å; R338-Q357 VanDerWaalsContact O-CA 3.27Å; R338-Q357 WeakPolarHBondContact O-CA 3.37Å; R338-I358 PolarHBondContact N-O 3.01Å; R338-I358 PolarHBondContact O-N 3.39Å
339	G	86.8	Confident	79.9	Confident	52 Å²	52	74.2 Å²	74.2	54%	0.536	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	140.2	178	0	0	0	0	0	112.6
340	G	81.5	Confident	78.9	Confident	5 Å²	5	72.2 Å²	72.2	5%	0.052	42%	0.42	C	S	.	.			trans	-52.6	139.3	-177.1	0	0	0	0	0	112.7	R338 S350 D356	R338-G340 PolarHBondContact O-N 3.31Å; G340-S350 WeakPolarHBondContact O-CB 3.19Å; G340-S350 PolarHBondContact O-OG 2.97Å; G340-D356 PolarHBondContact N-O 3.41Å
341	Q	79.9	Confident	78	Confident	135 Å²	135	78.9 Å²	78.9	63%	0.631	43%	0.434	S	S	*	.			trans	-106.1	156.3	-175.7	-66.4	-175.3	-22.5	0	0	112	R354	Q341-R354 PolarHBondContact O-NH1 2.87Å
342	L	76.9	Confident	77.3	Confident	51 Å²	51	82.2 Å²	82.2	27%	0.267	45%	0.452	S	S	.	.			trans	-116	151.4	178.2	-61	171.3	0	0	0	109.5	I353	L342-I353 HydrophobicContact CD1-CB 4.45Å; L342-I353 HydrophobicContact CD1-CD1 3.78Å; L342-I353 HydrophobicContact CD1-CG1 4.39Å; L342-I353 HydrophobicContact CD2-CB 4.4Å; L342-I353 HydrophobicContact CD2-CG2 4.06Å
343	V	65.8	Low	76.7	Confident	127 Å²	127	81 Å²	81	77%	0.77	45%	0.445	S	S	*	.	S	Bend	trans	-73.8	-35.1	-174.2	-179.2	0	0	0	0	112.3
344	S	59.6	Low	76.5	Confident	82 Å²	82	74 Å²	74	57%	0.573	41%	0.412	S	S	*	.	S	Bend	trans	-164.6	87	-179.5	59.5	0	0	0	0	115.5
345	Q	53.4	Low	76.4	Confident	101 Å²	101	72.8 Å²	72.8	47%	0.472	41%	0.408	S	S	.	.			trans	-155.2	142.9	152	-104.7	113	-1.2	0	0	109.4	L61	L61-Q345 VanDerWaalsContact CD1-OE1 3.31Å; L61-Q345 VanDerWaalsContact CD2-CD 3.47Å; L61-Q345 HydrophobicContact CD2-CG 4.18Å
346	A	56.4	Low	76.6	Confident	92 Å²	92	70.8 Å²	70.8	76%	0.76	39%	0.387	S	S	*	.	S	Bend	trans	-92.9	-33.6	178.9	0	0	0	0	0	112.5
347	D	60.2	Low	76.8	Confident	147 Å²	147	70.2 Å²	70.2	79%	0.786	39%	0.385	S	S	*	.	S	Bend	trans	-104.2	-8.1	-157.8	-42.7	-75.4	0	0	0	114.2
348	I	62.2	Low	77	Confident	22 Å²	22	70 Å²	70	11%	0.113	39%	0.385	C	S	.	.	S	Bend	trans	-110.1	119.1	-178.9	-68.1	172.8	0	0	0	109.7	L61 M64 S350 I353	L61-I348 HydrophobicContact CB-CD1 4.43Å; L61-I348 HydrophobicContact CD2-CB 4.17Å; L61-I348 HydrophobicContact CD2-CD1 3.48Å; L61-I348 VanDerWaalsContact CD2-CD1 3.48Å; L61-I348 HydrophobicContact CD2-CG1 4.38Å; L61-I348 HydrophobicContact CD2-CG2 4.11Å; M64-I348 HydrophobicContact CB-CD1 3.61Å; M64-I348 HydrophobicContact CB-CG1 4.26Å; M64-I348 HydrophobicContact CE-CG1 4.05Å; M64-I348 HydrophobicContact CE-CG2 4Å; M64-I348 HydrophobicContact CG-CD1 4.45Å; M64-I348 HydrophobicContact SD-CD1 4.2Å; M64-I348 HydrophobicContact SD-CG1 4.24Å; M64-I348 HydrophobicContact SD-CG2 3.74Å; I348-S350 PolarHBondContact O-N 2.95Å; I348-I353 HydrophobicContact CG2-CD1 3.99Å; I348-I353 HydrophobicContact CG2-CG1 4.28Å
349	P	68.8	Low	77.3	Confident	47 Å²	47	63 Å²	63	31%	0.305	36%	0.36	S	S	.	.			trans	-60.5	123.4	-178.9	-25.1	34.6	0	0	0	112	R351 N352	P349-R351 HydrophobicContact CB-CG 3.92Å; P349-R351 PolarHBondContact O-N 2.82Å; P349-N352 WeakPolarHBondContact O-CB 3.47Å; P349-N352 PolarHBondContact O-N 2.89Å
350	S	76.4	Confident	77.7	Confident	32 Å²	32	65.9 Å²	65.9	22%	0.224	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-51	-35.5	-177	-170.5	0	0	0	0	113.8	G340 I348 N352 I353 R354	G340-S350 WeakPolarHBondContact O-CB 3.19Å; G340-S350 PolarHBondContact O-OG 2.97Å; I348-S350 PolarHBondContact O-N 2.95Å; S350-N352 PolarHBondContact O-N 2.94Å; S350-N352 VanDerWaalsContact O-N 3.1Å; S350-I353 PolarHBondContact O-N 3.49Å; S350-R354 PolarHBondContact O-N 3.42Å
351	R	76.5	Confident	78.4	Confident	193 Å²	193	65.9 Å²	65.9	73%	0.728	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-54.5	-24.8	175	67.7	178.5	-178.2	-114	-2.7	115.2	P349 I353 R354	P349-R351 HydrophobicContact CB-CG 3.92Å; P349-R351 PolarHBondContact O-N 2.82Å; R351-I353 VanDerWaalsContact C-N 3.29Å; R351-R354 WeakPolarHBondContact CA-O 3.38Å
352	N	78.2	Confident	79.1	Confident	80 Å²	80	64.6 Å²	64.6	43%	0.428	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-77.8	-18.5	177.1	-67	23.8	0	0	0	111.9	P349 S350	P349-N352 WeakPolarHBondContact O-CB 3.47Å; P349-N352 PolarHBondContact O-N 2.89Å; S350-N352 PolarHBondContact O-N 2.94Å; S350-N352 VanDerWaalsContact O-N 3.1Å
353	I	81.6	Confident	79.7	Confident	10 Å²	10	62.8 Å²	62.8	5%	0.051	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-43.3	-175.8	-53.2	-164.7	0	0	0	110	A57 L61 L342 I348 S350 R351 Y414 V415	A57-I353 HydrophobicContact CB-CG2 4.36Å; L61-I353 HydrophobicContact CD1-CD1 4.34Å; L61-I353 HydrophobicContact CD2-CD1 3.47Å; L61-I353 VanDerWaalsContact CD2-CD1 3.47Å; L61-I353 HydrophobicContact CG-CD1 3.95Å; L342-I353 HydrophobicContact CD1-CB 4.45Å; L342-I353 HydrophobicContact CD1-CD1 3.78Å; L342-I353 HydrophobicContact CD1-CG1 4.39Å; L342-I353 HydrophobicContact CD2-CB 4.4Å; L342-I353 HydrophobicContact CD2-CG2 4.06Å; I348-I353 HydrophobicContact CG2-CD1 3.99Å; I348-I353 HydrophobicContact CG2-CG1 4.28Å; S350-I353 PolarHBondContact O-N 3.49Å; R351-I353 VanDerWaalsContact C-N 3.29Å; I353-Y414 HydrophobicContact CG2-CD1 4.35Å; I353-Y414 HydrophobicContact CG2-CE1 3.99Å; I353-Y414 WeakPolarHBondContact O-CA 3.36Å; I353-Y414 VanDerWaalsContact O-CD1 3.31Å; I353-Y414 WeakPolarHBondContact O-CD1 3.36Å; I353-V415 HydrophobicContact CB-CG2 4.3Å; I353-V415 HydrophobicContact CG2-CG2 3.57Å; I353-V415 PolarHBondContact O-N 3.24Å
354	R	90	Very high	80.9	Confident	19 Å²	19	63.7 Å²	63.7	7%	0.072	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-138.5	126	179	61.4	-170.8	-64	173.8	7.9	111.5	Q341 S350 R351 D356 G413 Y414	Q341-R354 PolarHBondContact O-NH1 2.87Å; S350-R354 PolarHBondContact O-N 3.42Å; R351-R354 WeakPolarHBondContact CA-O 3.38Å; R354-D356 WeakPolarHBondContact CB-OD1 3.45Å; R354-D356 IonicContact CZ-OD1 2.66Å; R354-D356 IonicContact CZ-OD2 2.73Å; R354-D356 IonicContact NE-OD1 2.79Å; R354-D356 PolarHBondContact NE-OD1 2.94Å; R354-D356 IonicContact NE-OD2 3.24Å; R354-D356 IonicContact NH2-OD1 3.41Å; R354-D356 PolarHBondContact NH2-OD1 3.28Å; R354-D356 IonicContact NH2-OD2 3.68Å; R354-D356 PolarHBondContact NH2-OD2 3.32Å; R354-G413 WeakPolarHBondContact CA-O 3.21Å; R354-Y414 HydrophobicContact CB-CD1 3.65Å; R354-Y414 HydrophobicContact CB-CD2 4.21Å; R354-Y414 HydrophobicContact CB-CE1 3.95Å; R354-Y414 HydrophobicContact CB-CE2 4.49Å; R354-Y414 HydrophobicContact CB-CG 3.79Å
355	G	89.4	Confident	82.3	Confident	28 Å²	28	62.9 Å²	62.9	29%	0.289	32%	0.323	S	S	.	.			trans	-92.4	10.9	-179.5	0	0	0	0	0	114.6	G413	G355-G413 PolarHBondContact N-O 3.35Å
356	D	92.6	Very high	83.9	Confident	4 Å²	4	69.7 Å²	69.7	2%	0.021	35%	0.345	C	S	.	.			trans	-92.1	161.7	-174.6	70.2	-30.8	0	0	0	113.8	G340 R354 I358 C406 Y407	G340-D356 PolarHBondContact N-O 3.41Å; R354-D356 WeakPolarHBondContact CB-OD1 3.45Å; R354-D356 IonicContact CZ-OD1 2.66Å; R354-D356 IonicContact CZ-OD2 2.73Å; R354-D356 IonicContact NE-OD1 2.79Å; R354-D356 PolarHBondContact NE-OD1 2.94Å; R354-D356 IonicContact NE-OD2 3.24Å; R354-D356 IonicContact NH2-OD1 3.41Å; R354-D356 PolarHBondContact NH2-OD1 3.28Å; R354-D356 IonicContact NH2-OD2 3.68Å; R354-D356 PolarHBondContact NH2-OD2 3.32Å; D356-I358 WeakPolarHBondContact OD2-CG2 3.28Å; D356-C406 WeakPolarHBondContact CA-O 3.47Å; D356-Y407 HydrophobicContact CB-CD1 4.02Å; D356-Y407 HydrophobicContact CB-CD2 3.68Å; D356-Y407 HydrophobicContact CB-CE1 3.83Å; D356-Y407 HydrophobicContact CB-CE2 3.46Å; D356-Y407 VanDerWaalsContact CB-CE2 3.46Å; D356-Y407 HydrophobicContact CB-CG 3.93Å
357	Q	94.2	Very high	85.5	Confident	77 Å²	77	71.3 Å²	71.3	36%	0.36	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	144.9	166.2	-53.3	179.7	-7.4	0	0	108.3	F337 R338 A405 C406	F337-Q357 HydrophobicContact CB-CB 4.11Å; F337-Q357 HydrophobicContact CD1-CB 3.97Å; F337-Q357 WeakPolarHBondContact CD1-O 3.42Å; R338-Q357 CarbonylContact O-C 3.45Å; R338-Q357 VanDerWaalsContact O-CA 3.27Å; R338-Q357 WeakPolarHBondContact O-CA 3.37Å; Q357-A405 CarbonylContact O-C 3.56Å; Q357-A405 WeakPolarHBondContact O-CA 3.22Å; Q357-C406 HydrophobicContact CB-CB 4.3Å; Q357-C406 PolarHBondContact N-O 2.88Å; Q357-C406 PolarHBondContact O-N 2.81Å
358	I	95.8	Very high	87.1	Confident	8 Å²	8	64.5 Å²	64.5	4%	0.041	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	153.5	-177.8	65.6	175.4	0	0	0	112.9	F337 R338 D356 M403 V404 A405	F337-I358 WeakPolarHBondContact CA-O 3.18Å; R338-I358 PolarHBondContact N-O 3.01Å; R338-I358 PolarHBondContact O-N 3.39Å; D356-I358 WeakPolarHBondContact OD2-CG2 3.28Å; I358-M403 HydrophobicContact CB-CG 3.91Å; I358-M403 HydrophobicContact CB-SD 4.24Å; I358-M403 HydrophobicContact CD1-CG 4.3Å; I358-M403 HydrophobicContact CD1-SD 3.97Å; I358-M403 HydrophobicContact CG2-CE 4.19Å; I358-M403 HydrophobicContact CG2-CG 3.95Å; I358-M403 HydrophobicContact CG2-SD 3.78Å; I358-V404 CarbonylContact C-O 3.51Å; I358-V404 WeakPolarHBondContact CA-O 3.37Å; I358-A405 HydrophobicContact CG2-CB 4.24Å
359	A	96.1	Very high	88.7	Confident	10 Å²	10	68.3 Å²	68.3	8%	0.083	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	144.1	168.4	0	0	0	0	0	109.9	L331 F337 V404	L331-A359 HydrophobicContact CD2-CB 3.77Å; L331-A359 HydrophobicContact CG-CB 4.38Å; F337-A359 HydrophobicContact CD1-CB 4.23Å; F337-A359 HydrophobicContact CD2-CB 4.04Å; F337-A359 HydrophobicContact CE1-CB 4.24Å; F337-A359 HydrophobicContact CE2-CB 4.08Å; F337-A359 HydrophobicContact CG-CB 4.14Å; F337-A359 HydrophobicContact CZ-CB 4.19Å; A359-V404 PolarHBondContact N-O 2.87Å; A359-V404 PolarHBondContact O-N 2.85Å
360	W	96.1	Very high	90.1	Very high	113 Å²	113	67.1 Å²	67.1	43%	0.428	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	111.6	-176	-73.1	100.4	0	0	0	112.2	K401 A402 M403 W495	W360-K401 HydrophobicContact CB-CD 4.27Å; W360-K401 HydrophobicContact CE3-CB 3.82Å; W360-K401 HydrophobicContact CZ3-CB 4.42Å; W360-A402 CarbonylContact C-O 3.36Å; W360-A402 WeakPolarHBondContact CA-O 3.32Å; W360-M403 HydrophobicContact CD2-CB 4.23Å; W360-M403 HydrophobicContact CD2-CG 4.42Å; W360-M403 HydrophobicContact CE3-CB 3.86Å; W360-M403 HydrophobicContact CH2-CB 3.93Å; W360-M403 HydrophobicContact CH2-CG 4.38Å; W360-M403 HydrophobicContact CZ2-CB 4.23Å; W360-M403 HydrophobicContact CZ2-CG 4.2Å; W360-M403 HydrophobicContact CZ2-SD 4.23Å; W360-M403 HydrophobicContact CZ3-CB 3.71Å; W360-W495 HydrophobicContact CH2-CE3 4.29Å; W360-W495 AromaticContact CH2-CZ3 3.64Å; W360-W495 HydrophobicContact CH2-CZ3 3.64Å; W360-W495 HydrophobicContact CZ3-CZ3 4.1Å
361	V	96.1	Very high	91.1	Very high	6 Å²	6	65.6 Å²	65.6	4%	0.036	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.3	-170.4	176.7	0	0	0	0	110.7	L331 C368 I371 K401 A402 V404	L331-V361 HydrophobicContact CD2-CG2 3.81Å; V361-C368 HydrophobicContact CG1-CB 3.63Å; V361-I371 HydrophobicContact CG1-CG2 3.91Å; V361-K401 WeakPolarHBondContact O-CB 3.47Å; V361-A402 PolarHBondContact N-O 3.29Å; V361-A402 PolarHBondContact O-N 2.96Å; V361-V404 HydrophobicContact CB-CG2 4.39Å; V361-V404 HydrophobicContact CG2-CG2 3.82Å
362	K	94.3	Very high	92.1	Very high	107 Å²	107	57.1 Å²	57.1	47%	0.465	27%	0.272	S	S	.	.			trans	-78	-31.1	174.3	-74.2	-173.7	170.1	-168.2	0	112.7	Q364 E365 M375 K401	K362-Q364 HydrophobicContact CB-CB 4.32Å; K362-E365 WeakPolarHBondContact CB-OE1 3.32Å; K362-E365 WeakPolarHBondContact CB-OE2 3.43Å; K362-E365 PolarHBondContact N-OE1 2.97Å; K362-E365 PolarHBondContact N-OE2 2.82Å; K362-E365 VanDerWaalsContact N-OE2 3.12Å; K362-M375 WeakPolarHBondContact O-CE 3.38Å; K362-K401 HydrophobicContact CG-CD 4.26Å; K362-K401 HydrophobicContact CG-CG 4.49Å
363	G	90.3	Very high	93	Very high	13 Å²	13	56 Å²	56	13%	0.134	27%	0.268	C	S	.	.	S	Bend	trans	86.2	22.3	-168.3	0	0	0	0	0	112.5	E365 G372	G363-E365 PolarHBondContact N-OE2 3.05Å; G363-G372 WeakPolarHBondContact O-CA 3.33Å
364	Q	90.2	Very high	93.8	Very high	146 Å²	146	55.5 Å²	55.5	68%	0.682	27%	0.266	S	S	*	.			trans	-129.3	-9.7	-179.2	-67.3	178.1	-32.9	0	0	111.9	K362	K362-Q364 HydrophobicContact CB-CB 4.32Å
365	E	90.6	Very high	94.2	Very high	65 Å²	65	54.7 Å²	54.7	30%	0.304	26%	0.263	S	S	.	.	S	Bend	trans	-66.1	142.6	175.9	-60.1	85.4	165	0	0	110.3	K362 G363 E367 C368 Q369	K362-E365 WeakPolarHBondContact CB-OE1 3.32Å; K362-E365 WeakPolarHBondContact CB-OE2 3.43Å; K362-E365 PolarHBondContact N-OE1 2.97Å; K362-E365 PolarHBondContact N-OE2 2.82Å; K362-E365 VanDerWaalsContact N-OE2 3.12Å; G363-E365 PolarHBondContact N-OE2 3.05Å; E365-E367 PolarHBondContact O-N 3.37Å; E365-C368 HydrophobicContact CB-CB 4.06Å; E365-C368 PolarHBondContact O-N 3.47Å; E365-Q369 PolarHBondContact O-NE2 2.87Å
366	R	85.8	Confident	94.6	Very high	245 Å²	245	55.7 Å²	55.7	93%	0.925	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-25.7	-174.5	-68.3	-176.7	178.9	177	-1.1	114.2
367	E	89.7	Confident	94.8	Very high	126 Å²	126	57.4 Å²	57.4	59%	0.589	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	11.6	-177.6	-54.6	172.3	139.2	0	0	112.5	E327 K336 E365	E327-E367 WeakPolarHBondContact CG-O 3.46Å; K336-E367 IonicContact NZ-OE2 2.62Å; K336-E367 PolarHBondContact NZ-OE2 3.34Å; E365-E367 PolarHBondContact O-N 3.37Å
368	C	93.6	Very high	95	Very high	4 Å²	4	53.8 Å²	53.8	3%	0.027	26%	0.259	C	S	.	.			trans	-138.8	37.3	-171.3	-56.6	0	0	0	0	112.6	E327 V361 E365 I371 G372	E327-C368 WeakPolarHBondContact OE2-CA 3.46Å; V361-C368 HydrophobicContact CG1-CB 3.63Å; E365-C368 HydrophobicContact CB-CB 4.06Å; E365-C368 PolarHBondContact O-N 3.47Å; C368-I371 HydrophobicContact CB-CB 4.3Å; C368-I371 HydrophobicContact CB-CD1 4.18Å; C368-G372 PolarHBondContact O-N 2.61Å
369	Q	96.1	Very high	95.1	Very high	102 Å²	102	54.9 Å²	54.9	48%	0.477	27%	0.265	S	S	.	.	H	α-helix	trans	-75.8	-41.9	-174.4	-62.5	-63.1	-67.9	0	0	111.8	E327 E365 I371 G372 T373	E327-Q369 PolarHBondContact OE1-N 3.5Å; E327-Q369 VanDerWaalsContact OE1-N 3.08Å; E327-Q369 PolarHBondContact OE2-N 2.81Å; E365-Q369 PolarHBondContact O-NE2 2.87Å; Q369-I371 VanDerWaalsContact C-N 3.35Å; Q369-G372 CarbonylContact O-C 3.57Å; Q369-G372 WeakPolarHBondContact O-CA 3.48Å; Q369-G372 PolarHBondContact O-N 3.15Å; Q369-T373 PolarHBondContact O-N 3.09Å; Q369-T373 PolarHBondContact O-OG1 3.2Å; Q369-T373 VanDerWaalsContact O-OG1 3.13Å
370	S	97.8	Very high	95.1	Very high	22 Å²	22	59.6 Å²	59.6	15%	0.154	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-40.1	175	-42.4	0	0	0	0	111	E327 G372 T373 L374	E327-S370 VanDerWaalsContact CD-CB 3.42Å; E327-S370 VanDerWaalsContact CD-N 3.29Å; E327-S370 VanDerWaalsContact CD-OG 3.28Å; E327-S370 VanDerWaalsContact OE1-CB 3.27Å; E327-S370 WeakPolarHBondContact OE1-CB 3Å; E327-S370 PolarHBondContact OE1-N 3.26Å; E327-S370 PolarHBondContact OE1-OG 2.96Å; E327-S370 WeakPolarHBondContact OE2-CA 3.34Å; E327-S370 WeakPolarHBondContact OE2-CB 3.13Å; E327-S370 PolarHBondContact OE2-N 3.47Å; S370-G372 VanDerWaalsContact C-N 3.28Å; S370-G372 PolarHBondContact O-N 3.46Å; S370-T373 PolarHBondContact O-N 3.34Å; S370-L374 PolarHBondContact O-N 3.46Å
371	I	97.9	Very high	95.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.1	-41.1	169.7	-66.6	165.6	0	0	0	110.3	V324 E327 V328 V361 C368 Q369 L374 M375 A402 I492	V324-I371 HydrophobicContact CG1-CG1 4.05Å; E327-I371 HydrophobicContact CB-CD1 3.79Å; E327-I371 HydrophobicContact CB-CG1 4.18Å; E327-I371 WeakPolarHBondContact OE2-CG1 3.42Å; E327-I371 PolarHBondContact OE2-N 2.99Å; V328-I371 HydrophobicContact CG2-CD1 4.01Å; V328-I371 HydrophobicContact CG2-CG1 4.46Å; V361-I371 HydrophobicContact CG1-CG2 3.91Å; C368-I371 HydrophobicContact CB-CB 4.3Å; C368-I371 HydrophobicContact CB-CD1 4.18Å; Q369-I371 VanDerWaalsContact C-N 3.35Å; I371-L374 PolarHBondContact O-N 2.9Å; I371-M375 HydrophobicContact CG2-SD 3.85Å; I371-M375 WeakPolarHBondContact O-CG 3.44Å; I371-M375 PolarHBondContact O-N 3.04Å; I371-A402 HydrophobicContact CG2-CB 4.44Å; I371-I492 HydrophobicContact CG1-CD1 4.12Å
372	G	97.9	Very high	95.2	Very high	15 Å²	15	54 Å²	54	16%	0.155	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-45.5	172.2	0	0	0	0	0	113.4	G363 C368 Q369 S370 M375 A376	G363-G372 WeakPolarHBondContact O-CA 3.33Å; C368-G372 PolarHBondContact O-N 2.61Å; Q369-G372 CarbonylContact O-C 3.57Å; Q369-G372 WeakPolarHBondContact O-CA 3.48Å; Q369-G372 PolarHBondContact O-N 3.15Å; S370-G372 VanDerWaalsContact C-N 3.28Å; S370-G372 PolarHBondContact O-N 3.46Å; G372-M375 PolarHBondContact O-N 2.74Å; G372-A376 PolarHBondContact O-N 2.73Å
373	T	97.6	Very high	95.2	Very high	55 Å²	55	53.3 Å²	53.3	34%	0.337	27%	0.265	S	S	.	.	H	α-helix	trans	-62.4	-45.5	176	-47	0	0	0	0	111.9	L320 Q369 S370 M375 A376 H377	L320-T373 HydrophobicContact CD1-CG2 4.26Å; L320-T373 HydrophobicContact CD2-CG2 3.72Å; Q369-T373 PolarHBondContact O-N 3.09Å; Q369-T373 PolarHBondContact O-OG1 3.2Å; Q369-T373 VanDerWaalsContact O-OG1 3.13Å; S370-T373 PolarHBondContact O-N 3.34Å; T373-M375 VanDerWaalsContact C-N 3.32Å; T373-M375 PolarHBondContact O-N 2.92Å; T373-A376 PolarHBondContact O-N 3.16Å; T373-H377 PolarHBondContact O-N 2.9Å; T373-H377 PolarHBondContact O-ND1 3.03Å; T373-H377 VanDerWaalsContact O-ND1 3.16Å
374	L	98.2	Very high	95.4	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-54	-48.5	172.5	165	66.9	0	0	0	111.3	F315 L316 V324 S370 I371 A376 H377 I378 Y432 I492	F315-L374 HydrophobicContact CD1-CD1 4.32Å; F315-L374 HydrophobicContact CE1-CD1 4.13Å; L316-L374 HydrophobicContact CD1-CB 4Å; L316-L374 HydrophobicContact CD1-CD1 3.78Å; L316-L374 HydrophobicContact CD1-CG 4.43Å; L316-L374 HydrophobicContact CD2-CD1 4.33Å; L316-L374 HydrophobicContact CG-CD1 4.26Å; V324-L374 HydrophobicContact CG1-CD2 3.92Å; V324-L374 HydrophobicContact CG2-CB 4.04Å; V324-L374 HydrophobicContact CG2-CD2 4.34Å; S370-L374 PolarHBondContact O-N 3.46Å; I371-L374 PolarHBondContact O-N 2.9Å; L374-A376 VanDerWaalsContact C-N 3.35Å; L374-A376 PolarHBondContact O-N 2.9Å; L374-H377 PolarHBondContact O-N 3.33Å; L374-I378 HydrophobicContact CD1-CD1 3.81Å; L374-I378 HydrophobicContact CD1-CG1 4.1Å; L374-I378 HydrophobicContact CG-CD1 4.18Å; L374-I378 WeakPolarHBondContact O-CG1 3.21Å; L374-I378 PolarHBondContact O-N 2.83Å; L374-Y432 HydrophobicContact CD1-CD1 3.76Å; L374-Y432 HydrophobicContact CD1-CD2 3.83Å; L374-Y432 HydrophobicContact CD1-CE1 4.08Å; L374-Y432 HydrophobicContact CD1-CE2 4.17Å; L374-Y432 HydrophobicContact CD1-CG 3.61Å; L374-Y432 HydrophobicContact CD2-CD1 3.43Å; L374-Y432 VanDerWaalsContact CD2-CD1 3.43Å; L374-Y432 HydrophobicContact CD2-CE1 4.02Å; L374-Y432 HydrophobicContact CD2-CG 3.91Å; L374-Y432 HydrophobicContact CG-CD1 4.26Å; L374-Y432 HydrophobicContact CG-CG 4.44Å; L374-I492 HydrophobicContact CD2-CB 4.38Å; L374-I492 HydrophobicContact CD2-CD1 3.64Å; L374-I492 HydrophobicContact CD2-CG2 4.39Å
375	M	98.1	Very high	95.6	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-61.6	-42.9	-179.7	-70.4	165.6	68.8	0	0	111.4	K362 I371 G372 T373 I378 D379 A402	K362-M375 WeakPolarHBondContact O-CE 3.38Å; I371-M375 HydrophobicContact CG2-SD 3.85Å; I371-M375 WeakPolarHBondContact O-CG 3.44Å; I371-M375 PolarHBondContact O-N 3.04Å; G372-M375 PolarHBondContact O-N 2.74Å; T373-M375 VanDerWaalsContact C-N 3.32Å; T373-M375 PolarHBondContact O-N 2.92Å; M375-I378 PolarHBondContact O-N 2.87Å; M375-D379 WeakPolarHBondContact O-CB 3.25Å; M375-D379 PolarHBondContact O-N 2.84Å; M375-A402 HydrophobicContact CE-CB 3.94Å; M375-A402 HydrophobicContact CG-CB 4.23Å; M375-A402 HydrophobicContact SD-CB 3.51Å; M375-A402 VanDerWaalsContact SD-CB 3.51Å
376	A	97.6	Very high	95.6	Very high	49 Å²	49	46.7 Å²	46.7	41%	0.405	23%	0.231	S	C	.	.	H	α-helix	trans	-64.4	-38.5	175.3	0	0	0	0	0	112.9	G372 T373 L374 D379 E380	G372-A376 PolarHBondContact O-N 2.73Å; T373-A376 PolarHBondContact O-N 3.16Å; L374-A376 VanDerWaalsContact C-N 3.35Å; L374-A376 PolarHBondContact O-N 2.9Å; A376-D379 PolarHBondContact O-N 3.37Å; A376-E380 PolarHBondContact O-N 2.95Å
377	H	97.8	Very high	95.6	Very high	40 Å²	40	37.2 Å²	37.2	19%	0.185	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-38.6	176.4	-75.9	29.4	0	0	0	112.1	W290 F315 L316 T373 L374 A381	W290-H377 AromaticContact CD1-CD2 3.96Å; W290-H377 AromaticContact CD2-CD2 3.54Å; W290-H377 AromaticContact CE2-CD2 3.52Å; W290-H377 AromaticContact CE2-CG 3.89Å; W290-H377 AromaticContact CE3-CD2 3.98Å; W290-H377 AromaticContact CG-CD2 3.88Å; W290-H377 HydrophobicContact CH2-CB 3.87Å; W290-H377 VanDerWaalsContact CH2-O 3.24Å; W290-H377 WeakPolarHBondContact CH2-O 3.26Å; W290-H377 HydrophobicContact CZ2-CB 3.51Å; W290-H377 AromaticContact CZ2-CD2 3.99Å; W290-H377 AromaticContact CZ2-CG 3.87Å; W290-H377 VanDerWaalsContact CZ2-O 3.23Å; W290-H377 WeakPolarHBondContact CZ2-O 3.34Å; W290-H377 AromaticContact NE1-CD2 3.74Å; F315-H377 HydrophobicContact CE1-CB 4.15Å; F315-H377 HydrophobicContact CZ-CB 4.05Å; L316-H377 HydrophobicContact CD2-CB 3.95Å; T373-H377 PolarHBondContact O-N 2.9Å; T373-H377 PolarHBondContact O-ND1 3.03Å; T373-H377 VanDerWaalsContact O-ND1 3.16Å; L374-H377 PolarHBondContact O-N 3.33Å; H377-A381 WeakPolarHBondContact O-CB 3.19Å; H377-A381 PolarHBondContact O-N 2.78Å
378	I	97.9	Very high	95.3	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-66.5	-43.6	171.4	-59.1	171.4	0	0	0	109.9	F315 L374 M375 E380 A381 I382 C430 L467 Y496	F315-I378 HydrophobicContact CE1-CG1 3.81Å; F315-I378 HydrophobicContact CZ-CG1 4.12Å; L374-I378 HydrophobicContact CD1-CD1 3.81Å; L374-I378 HydrophobicContact CD1-CG1 4.1Å; L374-I378 HydrophobicContact CG-CD1 4.18Å; L374-I378 WeakPolarHBondContact O-CG1 3.21Å; L374-I378 PolarHBondContact O-N 2.83Å; M375-I378 PolarHBondContact O-N 2.87Å; I378-E380 PolarHBondContact O-N 2.86Å; I378-A381 PolarHBondContact O-N 3.34Å; I378-I382 HydrophobicContact CG2-CG1 3.83Å; I378-I382 WeakPolarHBondContact O-CB 3.26Å; I378-I382 VanDerWaalsContact O-CG1 3.26Å; I378-I382 WeakPolarHBondContact O-CG1 3.31Å; I378-I382 PolarHBondContact O-N 2.75Å; I378-C430 HydrophobicContact CG2-CB 4.04Å; I378-L467 HydrophobicContact CD1-CD1 3.88Å; I378-L467 HydrophobicContact CG1-CD1 4.1Å; I378-L467 HydrophobicContact CG1-CD2 4.35Å; I378-Y496 HydrophobicContact CG2-CE2 3.93Å; I378-Y496 WeakPolarHBondContact CG2-OH 3.36Å
379	D	97.4	Very high	94.7	Very high	31 Å²	31	43 Å²	43	17%	0.166	24%	0.24	C	C	.	.	H	α-helix	trans	-56.5	-51.4	179.2	-74.3	-31.1	0	0	0	112.3	M375 A376 A381 I382 L383 R399 Y496	M375-D379 WeakPolarHBondContact O-CB 3.25Å; M375-D379 PolarHBondContact O-N 2.84Å; A376-D379 PolarHBondContact O-N 3.37Å; D379-A381 PolarHBondContact O-N 2.82Å; D379-I382 PolarHBondContact O-N 3.31Å; D379-L383 VanDerWaalsContact O-CB 3.26Å; D379-L383 WeakPolarHBondContact O-CB 3.23Å; D379-L383 WeakPolarHBondContact O-CG 3.24Å; D379-L383 PolarHBondContact O-N 2.64Å; D379-R399 WeakPolarHBondContact OD1-CD 3.07Å; D379-R399 IonicContact OD1-CZ 3.24Å; D379-R399 IonicContact OD1-NE 3.94Å; D379-R399 PolarHBondContact OD1-NE 2.94Å; D379-R399 IonicContact OD1-NH2 2.74Å; D379-R399 IonicContact OD2-CZ 3.96Å; D379-R399 VanDerWaalsContact OD2-CZ 3.24Å; D379-R399 IonicContact OD2-NE 3.28Å; D379-R399 PolarHBondContact OD2-NE 3.04Å; D379-R399 IonicContact OD2-NH2 3.77Å; D379-R399 PolarHBondContact OD2-NH2 3.5Å; D379-Y496 PolarHBondContact N-OH 2.73Å; D379-Y496 WeakPolarHBondContact OD1-CE1 3.39Å; D379-Y496 VanDerWaalsContact OD1-CZ 3.31Å; D379-Y496 PolarHBondContact OD1-OH 3.05Å
380	E	96.9	Very high	94.1	Very high	108 Å²	108	41.2 Å²	41.2	51%	0.505	23%	0.232	S	C	.	.	H	α-helix	trans	-62.8	-43.1	-179.5	-163.1	-166.6	139.1	0	0	111.5	W290 A292 A376 I378 Y384	W290-E380 HydrophobicContact CH2-CB 4.23Å; A292-E380 HydrophobicContact CB-CB 3.88Å; A292-E380 VanDerWaalsContact CB-CD 3.48Å; A292-E380 HydrophobicContact CB-CG 3.47Å; A292-E380 VanDerWaalsContact CB-CG 3.47Å; A292-E380 WeakPolarHBondContact CB-OE1 3.31Å; A376-E380 PolarHBondContact O-N 2.95Å; I378-E380 PolarHBondContact O-N 2.86Å; E380-Y384 VanDerWaalsContact O-CB 3.32Å; E380-Y384 WeakPolarHBondContact O-CB 3.25Å; E380-Y384 PolarHBondContact O-N 3.02Å
381	A	96.6	Very high	93.5	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-66.2	-38.5	178.4	0	0	0	0	0	113	W290 A292 I300 H377 I378 D379 S385	W290-A381 HydrophobicContact CZ2-CB 4.44Å; A292-A381 HydrophobicContact CB-CB 4.36Å; I300-A381 HydrophobicContact CD1-CB 3.89Å; H377-A381 WeakPolarHBondContact O-CB 3.19Å; H377-A381 PolarHBondContact O-N 2.78Å; I378-A381 PolarHBondContact O-N 3.34Å; D379-A381 PolarHBondContact O-N 2.82Å; A381-S385 WeakPolarHBondContact O-CB 3.4Å; A381-S385 PolarHBondContact O-N 2.68Å; A381-S385 VanDerWaalsContact O-N 3.07Å; A381-S385 PolarHBondContact O-OG 3.4Å
382	I	96.5	Very high	92.7	Very high	1 Å²	1	42 Å²	42	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-73.8	-42.2	177.5	-69.1	-67.1	0	0	0	111.3	I378 D379 S385 A386 I396 L428 I469 Y496	I378-I382 HydrophobicContact CG2-CG1 3.83Å; I378-I382 WeakPolarHBondContact O-CB 3.26Å; I378-I382 VanDerWaalsContact O-CG1 3.26Å; I378-I382 WeakPolarHBondContact O-CG1 3.31Å; I378-I382 PolarHBondContact O-N 2.75Å; D379-I382 PolarHBondContact O-N 3.31Å; I382-S385 PolarHBondContact O-N 2.96Å; I382-A386 WeakPolarHBondContact O-CB 3.41Å; I382-A386 PolarHBondContact O-N 2.77Å; I382-I396 HydrophobicContact CG2-CD1 3.5Å; I382-L428 HydrophobicContact CD1-CD1 4.3Å; I382-L428 HydrophobicContact CG2-CD1 4.22Å; I382-I469 HydrophobicContact CD1-CD1 3.93Å; I382-I469 HydrophobicContact CD1-CG1 4.42Å; I382-I469 HydrophobicContact CD1-CG2 4.1Å; I382-Y496 HydrophobicContact CB-CE1 4.33Å; I382-Y496 HydrophobicContact CB-CE2 4.3Å; I382-Y496 HydrophobicContact CG1-CD2 4.39Å; I382-Y496 HydrophobicContact CG1-CE2 3.89Å; I382-Y496 HydrophobicContact CG2-CD1 3.89Å; I382-Y496 HydrophobicContact CG2-CD2 4.06Å; I382-Y496 HydrophobicContact CG2-CE1 3.99Å; I382-Y496 HydrophobicContact CG2-CE2 4.16Å; I382-Y496 HydrophobicContact CG2-CG 3.95Å
383	L	94.6	Very high	91.9	Very high	93 Å²	93	49 Å²	49	49%	0.487	28%	0.277	S	S	.	.	H	α-helix	trans	-64.8	-41.8	176.6	-71.3	170.5	0	0	0	111.5	D379 S385 A386 A387 I396	D379-L383 VanDerWaalsContact O-CB 3.26Å; D379-L383 WeakPolarHBondContact O-CB 3.23Å; D379-L383 WeakPolarHBondContact O-CG 3.24Å; D379-L383 PolarHBondContact O-N 2.64Å; L383-S385 VanDerWaalsContact C-N 3.31Å; L383-S385 PolarHBondContact O-N 3.05Å; L383-A386 PolarHBondContact O-N 2.85Å; L383-A387 PolarHBondContact O-N 3.29Å; L383-I396 HydrophobicContact CD2-CG2 4.44Å
384	Y	94.4	Very high	91.3	Very high	70 Å²	70	47.8 Å²	47.8	28%	0.275	27%	0.27	S	S	.	.	H	α-helix	trans	-60.5	-42.5	171.8	-161.7	-67.2	0	0	0	111	E293 A296 K297 E380 A387	E293-Y384 HydrophobicContact CB-CD2 3.97Å; E293-Y384 HydrophobicContact CB-CE1 4.38Å; E293-Y384 HydrophobicContact CB-CE2 3.5Å; E293-Y384 VanDerWaalsContact CB-CE2 3.5Å; E293-Y384 HydrophobicContact CG-CE1 4.14Å; E293-Y384 HydrophobicContact CG-CE2 3.81Å; E293-Y384 WeakPolarHBondContact CG-OH 3.49Å; E293-Y384 VanDerWaalsContact OE2-CE2 3.27Å; E293-Y384 WeakPolarHBondContact OE2-CE2 3.49Å; E293-Y384 VanDerWaalsContact OE2-CZ 3.25Å; E293-Y384 PolarHBondContact OE2-OH 2.72Å; A296-Y384 HydrophobicContact CB-CD1 3.58Å; A296-Y384 HydrophobicContact CB-CG 4.06Å; K297-Y384 HydrophobicContact CD-CE1 4.46Å; K297-Y384 WeakPolarHBondContact CE-OH 3.48Å; K297-Y384 HydrophobicContact CG-CE1 4.13Å; K297-Y384 PolarHBondContact NZ-OH 2.9Å; K297-Y384 VanDerWaalsContact NZ-OH 3.14Å; E380-Y384 VanDerWaalsContact O-CB 3.32Å; E380-Y384 WeakPolarHBondContact O-CB 3.25Å; E380-Y384 PolarHBondContact O-N 3.02Å; Y384-A387 WeakPolarHBondContact O-CB 3.36Å; Y384-A387 PolarHBondContact O-N 3.09Å
385	S	93.8	Very high	91.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.7	-36.1	180	-59.2	0	0	0	0	113.4	A296 I300 A381 I382 L383 Q390 L391	A296-S385 WeakPolarHBondContact CA-OG 3.42Å; A296-S385 WeakPolarHBondContact CB-OG 3.39Å; I300-S385 WeakPolarHBondContact CB-OG 3.37Å; I300-S385 WeakPolarHBondContact CG2-OG 3.21Å; A381-S385 WeakPolarHBondContact O-CB 3.4Å; A381-S385 PolarHBondContact O-N 2.68Å; A381-S385 VanDerWaalsContact O-N 3.07Å; A381-S385 PolarHBondContact O-OG 3.4Å; I382-S385 PolarHBondContact O-N 2.96Å; L383-S385 VanDerWaalsContact C-N 3.31Å; L383-S385 PolarHBondContact O-N 3.05Å; S385-Q390 CarbonylContact O-C 3.57Å; S385-Q390 VanDerWaalsContact O-CB 3.31Å; S385-Q390 WeakPolarHBondContact O-CB 3.43Å; S385-L391 WeakPolarHBondContact O-CG 3.39Å; S385-L391 PolarHBondContact O-N 3.23Å
386	A	90.8	Very high	90.9	Very high	15 Å²	15	53.1 Å²	53.1	12%	0.124	30%	0.302	C	S	.	.	H	α-helix	trans	-78.7	-22.4	178.3	0	0	0	0	0	113.1	I382 L383 G389 I396	I382-A386 WeakPolarHBondContact O-CB 3.41Å; I382-A386 PolarHBondContact O-N 2.77Å; L383-A386 PolarHBondContact O-N 2.85Å; A386-G389 PolarHBondContact O-N 3.03Å; A386-I396 HydrophobicContact CB-CB 4.46Å; A386-I396 HydrophobicContact CB-CD1 3.79Å; A386-I396 HydrophobicContact CB-CG1 4.12Å
387	A	87.3	Confident	90.6	Very high	45 Å²	45	56 Å²	56	37%	0.372	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-52.2	142.9	178.3	0	0	0	0	0	112	L383 Y384 G389 Q390	L383-A387 PolarHBondContact O-N 3.29Å; Y384-A387 WeakPolarHBondContact O-CB 3.36Å; Y384-A387 PolarHBondContact O-N 3.09Å; A387-G389 PolarHBondContact O-N 3.31Å; A387-G389 VanDerWaalsContact O-N 3.13Å; A387-Q390 WeakPolarHBondContact O-CB 3.38Å; A387-Q390 WeakPolarHBondContact O-CG 3.41Å; A387-Q390 PolarHBondContact O-N 3.34Å
388	K	82.3	Confident	90.4	Very high	204 Å²	204	55.5 Å²	55.5	89%	0.887	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	56.5	27.2	178.1	-50.9	176.8	-176.4	177.7	0	113.9	Q390	K388-Q390 VanDerWaalsContact C-N 3.3Å; K388-Q390 PolarHBondContact O-N 2.74Å
389	G	80.4	Confident	90.4	Very high	47 Å²	47	59 Å²	59	49%	0.485	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	69.6	22.7	178.6	0	0	0	0	0	114	A386 A387 L391 G392	A386-G389 PolarHBondContact O-N 3.03Å; A387-G389 PolarHBondContact O-N 3.31Å; A387-G389 VanDerWaalsContact O-N 3.13Å; G389-L391 VanDerWaalsContact C-N 3.3Å; G389-L391 PolarHBondContact O-N 3.04Å; G389-G392 CarbonylContact C-O 3.55Å; G389-G392 WeakPolarHBondContact CA-O 3.3Å; G389-G392 PolarHBondContact O-N 2.9Å; G389-G392 VanDerWaalsContact O-N 3.16Å
390	Q	84.8	Confident	90.4	Very high	66 Å²	66	58.7 Å²	58.7	31%	0.308	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-18.8	-174.9	-68.3	-172.5	-21.3	0	0	113.3	I301 K305 S385 A387 K388	I301-Q390 HydrophobicContact CD1-CB 4.15Å; I301-Q390 HydrophobicContact CG1-CB 4.18Å; I301-Q390 HydrophobicContact CG2-CB 4.16Å; K305-Q390 WeakPolarHBondContact CE-O 3.44Å; S385-Q390 CarbonylContact O-C 3.57Å; S385-Q390 VanDerWaalsContact O-CB 3.31Å; S385-Q390 WeakPolarHBondContact O-CB 3.43Å; A387-Q390 WeakPolarHBondContact O-CB 3.38Å; A387-Q390 WeakPolarHBondContact O-CG 3.41Å; A387-Q390 PolarHBondContact O-N 3.34Å; K388-Q390 VanDerWaalsContact C-N 3.3Å; K388-Q390 PolarHBondContact O-N 2.74Å
391	L	84.3	Confident	90.4	Very high	3 Å²	3	58 Å²	58	2%	0.016	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	49.7	162.2	-69.4	178.4	0	0	0	111.7	I300 M304 S385 G389 L428 W471	I300-L391 HydrophobicContact CG2-CD1 4.49Å; I300-L391 HydrophobicContact CG2-CD2 4.49Å; M304-L391 HydrophobicContact CB-CD2 3.39Å; M304-L391 HydrophobicContact CG-CD2 3.89Å; S385-L391 WeakPolarHBondContact O-CG 3.39Å; S385-L391 PolarHBondContact O-N 3.23Å; G389-L391 VanDerWaalsContact C-N 3.3Å; G389-L391 PolarHBondContact O-N 3.04Å; L391-L428 HydrophobicContact CD1-CD1 3.84Å; L391-W471 HydrophobicContact CB-CH2 4.12Å; L391-W471 WeakPolarHBondContact O-CH2 3.36Å
392	G	80.5	Confident	90.5	Very high	35 Å²	35	58 Å²	58	36%	0.361	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	-148.1	177.7	0	0	0	0	0	112.8	G389 C394	G389-G392 CarbonylContact C-O 3.55Å; G389-G392 WeakPolarHBondContact CA-O 3.3Å; G389-G392 PolarHBondContact O-N 2.9Å; G389-G392 VanDerWaalsContact O-N 3.16Å; G392-C394 VanDerWaalsContact C-N 3.27Å; G392-C394 PolarHBondContact O-N 3.17Å
393	N	83.1	Confident	90.5	Very high	162 Å²	162	58.5 Å²	58.5	87%	0.866	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	6.6	-173.5	-62	-0.2	0	0	0	113.8
394	C	85	Confident	90.7	Very high	29 Å²	29	54 Å²	54	20%	0.196	30%	0.302	C	S	.	.			trans	-78.8	124.9	-176.6	-66.8	0	0	0	0	111.6	G392 D498	G392-C394 VanDerWaalsContact C-N 3.27Å; G392-C394 PolarHBondContact O-N 3.17Å; C394-D498 WeakPolarHBondContact CA-OD2 3.32Å
395	V	92.3	Very high	90.8	Very high	93 Å²	93	50.9 Å²	50.9	56%	0.564	29%	0.291	S	S	*	.			trans	-101.5	97	177.8	-179.3	0	0	0	0	108.7	N397 D498 A499	V395-N397 PolarHBondContact O-N 3.03Å; V395-D498 PolarHBondContact N-OD2 3.08Å; V395-A499 HydrophobicContact CB-CB 4.16Å; V395-A499 HydrophobicContact CG1-CB 4.05Å; V395-A499 WeakPolarHBondContact O-CB 3.31Å; V395-A499 PolarHBondContact O-N 2.98Å
396	I	93.9	Very high	90.9	Very high	21 Å²	21	50.9 Å²	50.9	11%	0.108	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	114.8	-177.5	-58.8	-177.6	0	0	0	110.2	I382 L383 A386 L428 Y496 F497	I382-I396 HydrophobicContact CG2-CD1 3.5Å; L383-I396 HydrophobicContact CD2-CG2 4.44Å; A386-I396 HydrophobicContact CB-CB 4.46Å; A386-I396 HydrophobicContact CB-CD1 3.79Å; A386-I396 HydrophobicContact CB-CG1 4.12Å; I396-L428 HydrophobicContact CD1-CD1 3.66Å; I396-Y496 HydrophobicContact CG2-CD1 3.68Å; I396-Y496 HydrophobicContact CG2-CG 4.28Å; I396-F497 WeakPolarHBondContact CA-O 3.34Å
397	N	91.9	Very high	91	Very high	111 Å²	111	50.7 Å²	50.7	59%	0.594	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120	7.5	177.4	75.8	-14	0	0	0	114.4	V395 A499	V395-N397 PolarHBondContact O-N 3.03Å; N397-A499 HydrophobicContact CB-CB 4.02Å; N397-A499 WeakPolarHBondContact ND2-CB 3.21Å
398	G	94.3	Very high	91.2	Very high	29 Å²	29	51.1 Å²	51.1	30%	0.299	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	170	-179.5	177.3	0	0	0	0	0	113.2	F497	G398-F497 PolarHBondContact O-N 3.04Å
399	R	97.2	Very high	91.4	Very high	75 Å²	75	41.4 Å²	41.4	28%	0.283	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	174.5	-179.2	56.9	153.9	171.7	81.2	-0.8	112.7	D379 V494 W495 Y496 F497	D379-R399 WeakPolarHBondContact OD1-CD 3.07Å; D379-R399 IonicContact OD1-CZ 3.24Å; D379-R399 IonicContact OD1-NE 3.94Å; D379-R399 PolarHBondContact OD1-NE 2.94Å; D379-R399 IonicContact OD1-NH2 2.74Å; D379-R399 IonicContact OD2-CZ 3.96Å; D379-R399 VanDerWaalsContact OD2-CZ 3.24Å; D379-R399 IonicContact OD2-NE 3.28Å; D379-R399 PolarHBondContact OD2-NE 3.04Å; D379-R399 IonicContact OD2-NH2 3.77Å; D379-R399 PolarHBondContact OD2-NH2 3.5Å; R399-V494 HydrophobicContact CB-CG1 4.04Å; R399-V494 HydrophobicContact CG-CG1 4.33Å; R399-W495 CarbonylContact C-O 3.49Å; R399-W495 WeakPolarHBondContact CA-O 2.96Å; R399-W495 VanDerWaalsContact CB-O 3.23Å; R399-W495 WeakPolarHBondContact CB-O 3.48Å; R399-Y496 HydrophobicContact CB-CD1 3.69Å; R399-Y496 HydrophobicContact CB-CE1 3.79Å; R399-Y496 HydrophobicContact CB-CG 4.15Å; R399-Y496 HydrophobicContact CG-CD1 4.38Å; R399-Y496 HydrophobicContact CG-CE1 4.02Å; R399-F497 VanDerWaalsContact C-CE2 3.49Å
400	T	97.4	Very high	91.7	Very high	24 Å²	24	46.6 Å²	46.6	15%	0.147	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-70.2	171	168.4	60.8	0	0	0	0	112.4	W495 F497	T400-W495 HydrophobicContact CG2-CB 3.99Å; T400-W495 HydrophobicContact CG2-CE3 4.05Å; T400-W495 PolarHBondContact N-O 2.88Å; T400-W495 PolarHBondContact OG1-N 3.23Å; T400-F497 HydrophobicContact CG2-CE2 4.21Å; T400-F497 HydrophobicContact CG2-CZ 3.74Å
401	K	97.4	Very high	91.9	Very high	95 Å²	95	44.8 Å²	44.8	41%	0.413	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-57.9	163.9	149.9	-74.2	-171.1	-176.4	-169.4	0	110.4	W360 V361 K362 M403	W360-K401 HydrophobicContact CB-CD 4.27Å; W360-K401 HydrophobicContact CE3-CB 3.82Å; W360-K401 HydrophobicContact CZ3-CB 4.42Å; V361-K401 WeakPolarHBondContact O-CB 3.47Å; K362-K401 HydrophobicContact CG-CD 4.26Å; K362-K401 HydrophobicContact CG-CG 4.49Å; K401-M403 PolarHBondContact O-N 2.92Å
402	A	97.9	Very high	92.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	126.4	166.3	0	0	0	0	0	110.1	W360 V361 I371 M375 I492 V494	W360-A402 CarbonylContact C-O 3.36Å; W360-A402 WeakPolarHBondContact CA-O 3.32Å; V361-A402 PolarHBondContact N-O 3.29Å; V361-A402 PolarHBondContact O-N 2.96Å; I371-A402 HydrophobicContact CG2-CB 4.44Å; M375-A402 HydrophobicContact CE-CB 3.94Å; M375-A402 HydrophobicContact CG-CB 4.23Å; M375-A402 HydrophobicContact SD-CB 3.51Å; M375-A402 VanDerWaalsContact SD-CB 3.51Å; A402-I492 HydrophobicContact CB-CG2 3.77Å; A402-V494 HydrophobicContact CB-CG2 4.25Å
403	M	98	Very high	92.8	Very high	11 Å²	11	44.2 Å²	44.2	5%	0.054	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	100.7	164	-172.8	-173.2	78	0	0	107.7	I358 W360 K401 A405 T493 W495	I358-M403 HydrophobicContact CB-CG 3.91Å; I358-M403 HydrophobicContact CB-SD 4.24Å; I358-M403 HydrophobicContact CD1-CG 4.3Å; I358-M403 HydrophobicContact CD1-SD 3.97Å; I358-M403 HydrophobicContact CG2-CE 4.19Å; I358-M403 HydrophobicContact CG2-CG 3.95Å; I358-M403 HydrophobicContact CG2-SD 3.78Å; W360-M403 HydrophobicContact CD2-CB 4.23Å; W360-M403 HydrophobicContact CD2-CG 4.42Å; W360-M403 HydrophobicContact CE3-CB 3.86Å; W360-M403 HydrophobicContact CH2-CB 3.93Å; W360-M403 HydrophobicContact CH2-CG 4.38Å; W360-M403 HydrophobicContact CZ2-CB 4.23Å; W360-M403 HydrophobicContact CZ2-CG 4.2Å; W360-M403 HydrophobicContact CZ2-SD 4.23Å; W360-M403 HydrophobicContact CZ3-CB 3.71Å; K401-M403 PolarHBondContact O-N 2.92Å; M403-A405 HydrophobicContact CE-CB 4.29Å; M403-T493 PolarHBondContact N-O 2.85Å; M403-T493 PolarHBondContact O-N 3.33Å; M403-W495 HydrophobicContact CB-CH2 4.33Å; M403-W495 HydrophobicContact CB-CZ3 3.9Å; M403-W495 HydrophobicContact CE-CH2 3.72Å; M403-W495 HydrophobicContact CE-CZ3 4.46Å; M403-W495 HydrophobicContact SD-CH2 3.76Å; M403-W495 HydrophobicContact SD-CZ3 4.18Å
404	V	97.9	Very high	93.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	126.6	169	-168.1	0	0	0	0	107.4	V328 L331 F337 I358 A359 V361 I492	V328-V404 HydrophobicContact CB-CG1 4.23Å; V328-V404 HydrophobicContact CG1-CG1 3.65Å; V328-V404 HydrophobicContact CG2-CG1 3.65Å; L331-V404 HydrophobicContact CD2-CB 4.08Å; L331-V404 HydrophobicContact CD2-CG1 4.25Å; L331-V404 HydrophobicContact CD2-CG2 3.91Å; F337-V404 HydrophobicContact CE1-CB 4.5Å; F337-V404 HydrophobicContact CE1-CG1 4.3Å; F337-V404 WeakPolarHBondContact CE1-O 3.35Å; F337-V404 HydrophobicContact CZ-CB 4.11Å; F337-V404 HydrophobicContact CZ-CG1 3.68Å; I358-V404 CarbonylContact C-O 3.51Å; I358-V404 WeakPolarHBondContact CA-O 3.37Å; A359-V404 PolarHBondContact N-O 2.87Å; A359-V404 PolarHBondContact O-N 2.85Å; V361-V404 HydrophobicContact CB-CG2 4.39Å; V361-V404 HydrophobicContact CG2-CG2 3.82Å; V404-I492 HydrophobicContact CG1-CG1 4.24Å; V404-I492 HydrophobicContact CG2-CG1 4.29Å
405	A	96.9	Very high	93.8	Very high	3 Å²	3	38.5 Å²	38.5	3%	0.025	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	142.6	-177.4	0	0	0	0	0	111.7	Q357 I358 M403 Y407 Y490 A491	Q357-A405 CarbonylContact O-C 3.56Å; Q357-A405 WeakPolarHBondContact O-CA 3.22Å; I358-A405 HydrophobicContact CG2-CB 4.24Å; M403-A405 HydrophobicContact CE-CB 4.29Å; A405-Y407 HydrophobicContact CB-CE2 4.18Å; A405-Y490 WeakPolarHBondContact O-CA 3.36Å; A405-A491 PolarHBondContact N-O 3.49Å; A405-A491 PolarHBondContact O-N 3.35Å; A405-A491 VanDerWaalsContact O-N 3.12Å
406	C	94.8	Very high	93.9	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.007	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	111.1	-175.1	166.7	0	0	0	0	108.1	F337 D356 Q357 P408 T488 Y490	F337-C406 HydrophobicContact CD1-CB 3.7Å; F337-C406 HydrophobicContact CE1-CB 3.42Å; F337-C406 VanDerWaalsContact CE1-CB 3.42Å; F337-C406 HydrophobicContact CZ-CB 4.15Å; D356-C406 WeakPolarHBondContact CA-O 3.47Å; Q357-C406 HydrophobicContact CB-CB 4.3Å; Q357-C406 PolarHBondContact N-O 2.88Å; Q357-C406 PolarHBondContact O-N 2.81Å; C406-P408 WeakPolarHBondContact O-CD 3.44Å; C406-T488 HydrophobicContact CB-CG2 4.29Å; C406-T488 WeakPolarHBondContact SG-CG2 3.43Å; C406-Y490 HydrophobicContact CB-CD1 4.3Å; C406-Y490 HydrophobicContact CB-CE1 4.27Å
407	Y	93.8	Very high	94	Very high	11 Å²	11	36.6 Å²	36.6	4%	0.043	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	104.1	174	-73.1	-111.4	0	0	0	107.3	D356 A405 G409 V480 R489	D356-Y407 HydrophobicContact CB-CD1 4.02Å; D356-Y407 HydrophobicContact CB-CD2 3.68Å; D356-Y407 HydrophobicContact CB-CE1 3.83Å; D356-Y407 HydrophobicContact CB-CE2 3.46Å; D356-Y407 VanDerWaalsContact CB-CE2 3.46Å; D356-Y407 HydrophobicContact CB-CG 3.93Å; A405-Y407 HydrophobicContact CB-CE2 4.18Å; Y407-G409 PolarHBondContact O-N 3.05Å; Y407-G409 VanDerWaalsContact O-N 3.09Å; Y407-V480 HydrophobicContact CD1-CG1 4.24Å; Y407-V480 HydrophobicContact CE1-CB 4.18Å; Y407-V480 HydrophobicContact CE1-CG1 3.82Å; Y407-R489 PolarHBondContact N-O 3.28Å; Y407-R489 PolarHBondContact O-N 2.85Å
408	P	90.4	Very high	94.1	Very high	53 Å²	53	33 Å²	33	34%	0.344	18%	0.184	S	C	.	.			trans	-81.7	17.2	-165.4	34.3	-38.7	0	0	0	114.8	C406	C406-P408 WeakPolarHBondContact O-CD 3.44Å
409	G	87.1	Confident	94.2	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.01	17%	0.173	C	C	.	.	S	Bend	trans	85.2	-148.2	-174.9	0	0	0	0	0	113.5	Y407 G411 A412 S483 T485	Y407-G409 PolarHBondContact O-N 3.05Å; Y407-G409 VanDerWaalsContact O-N 3.09Å; G409-G411 PolarHBondContact O-N 2.88Å; G409-G411 VanDerWaalsContact O-N 3.13Å; G409-A412 WeakPolarHBondContact O-CB 3.3Å; G409-A412 PolarHBondContact O-N 3.27Å; G409-S483 CarbonylContact C-O 3.53Å; G409-S483 WeakPolarHBondContact CA-O 3.48Å; G409-T485 WeakPolarHBondContact CA-O 3.36Å
410	N	87.3	Confident	94.1	Very high	155 Å²	155	29.1 Å²	29.1	83%	0.829	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	32	175.7	-62.3	-21.3	0	0	0	115.3	A412 S483	N410-A412 VanDerWaalsContact C-N 3.35Å; N410-S483 PolarHBondContact N-O 2.88Å
411	G	88.8	Confident	93.9	Very high	28 Å²	28	32 Å²	32	29%	0.289	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	4.6	-177.8	0	0	0	0	0	114.5	G409 G413 P482 S483	G409-G411 PolarHBondContact O-N 2.88Å; G409-G411 VanDerWaalsContact O-N 3.13Å; G411-G413 PolarHBondContact O-N 2.77Å; G411-P482 WeakPolarHBondContact O-CB 3.33Å; G411-S483 WeakPolarHBondContact CA-O 3.36Å; G411-S483 PolarHBondContact N-O 2.65Å
412	A	90.8	Very high	93.5	Very high	13 Å²	13	33.1 Å²	33.1	11%	0.107	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	125	177.7	0	0	0	0	0	111.5	G409 N410 S483	G409-A412 WeakPolarHBondContact O-CB 3.3Å; G409-A412 PolarHBondContact O-N 3.27Å; N410-A412 VanDerWaalsContact C-N 3.35Å; A412-S483 PolarHBondContact O-N 3.12Å
413	G	93	Very high	93.2	Very high	13 Å²	13	34.7 Å²	34.7	13%	0.134	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	-164.6	175.3	0	0	0	0	0	110.7	R354 G355 G411 V480	R354-G413 WeakPolarHBondContact CA-O 3.21Å; G355-G413 PolarHBondContact N-O 3.35Å; G411-G413 PolarHBondContact O-N 2.77Å; G413-V480 CarbonylContact C-O 3.54Å; G413-V480 VanDerWaalsContact CA-O 3.28Å; G413-V480 WeakPolarHBondContact CA-O 3.36Å
414	Y	94.6	Very high	93	Very high	36 Å²	36	36 Å²	36	14%	0.141	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	115.4	174.3	-167.8	-6.2	0	0	0	107.9	I353 R354 H417 E479 V480	I353-Y414 HydrophobicContact CG2-CD1 4.35Å; I353-Y414 HydrophobicContact CG2-CE1 3.99Å; I353-Y414 WeakPolarHBondContact O-CA 3.36Å; I353-Y414 VanDerWaalsContact O-CD1 3.31Å; I353-Y414 WeakPolarHBondContact O-CD1 3.36Å; R354-Y414 HydrophobicContact CB-CD1 3.65Å; R354-Y414 HydrophobicContact CB-CD2 4.21Å; R354-Y414 HydrophobicContact CB-CE1 3.95Å; R354-Y414 HydrophobicContact CB-CE2 4.49Å; R354-Y414 HydrophobicContact CB-CG 3.79Å; Y414-H417 AromaticContact CD1-CE1 3.73Å; Y414-H417 AromaticContact CD1-ND1 3.62Å; Y414-H417 AromaticContact CD2-CE1 3.37Å; Y414-H417 WeakPolarHBondContact CD2-CE1 3.25Å; Y414-H417 AromaticContact CD2-NE2 3.93Å; Y414-H417 AromaticContact CE1-CE1 3.61Å; Y414-H417 AromaticContact CE1-CG 3.91Å; Y414-H417 AromaticContact CE1-ND1 3.48Å; Y414-H417 WeakPolarHBondContact CE1-ND1 3.36Å; Y414-H417 AromaticContact CE2-CE1 3.21Å; Y414-H417 WeakPolarHBondContact CE2-CE1 3.31Å; Y414-H417 AromaticContact CE2-ND1 3.97Å; Y414-H417 AromaticContact CE2-NE2 3.3Å; Y414-H417 VanDerWaalsContact CE2-NE2 3.3Å; Y414-H417 WeakPolarHBondContact CE2-NE2 3.37Å; Y414-H417 AromaticContact CG-CE1 3.63Å; Y414-H417 AromaticContact CG-ND1 3.95Å; Y414-H417 AromaticContact CZ-CD2 3.76Å; Y414-H417 AromaticContact CZ-CE1 3.33Å; Y414-H417 AromaticContact CZ-CG 3.93Å; Y414-H417 AromaticContact CZ-ND1 3.65Å; Y414-H417 AromaticContact CZ-NE2 3.36Å; Y414-H417 PolarHBondContact OH-NE2 3.24Å; Y414-E479 CarbonylContact O-C 3.1Å; Y414-E479 WeakPolarHBondContact O-CA 3.46Å; Y414-E479 WeakPolarHBondContact O-CB 3.46Å; Y414-V480 PolarHBondContact N-O 2.73Å; Y414-V480 PolarHBondContact O-N 3.24Å
415	V	94.1	Very high	92.8	Very high	36 Å²	36	36 Å²	36	22%	0.218	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	160.3	-176.9	-53.7	0	0	0	0	112.2	A57 L60 I353 H417	A57-V415 HydrophobicContact CB-CG2 3.89Å; L60-V415 HydrophobicContact CD1-CB 3.77Å; L60-V415 HydrophobicContact CD1-CG1 3.81Å; L60-V415 HydrophobicContact CD1-CG2 3.82Å; I353-V415 HydrophobicContact CB-CG2 4.3Å; I353-V415 HydrophobicContact CG2-CG2 3.57Å; I353-V415 PolarHBondContact O-N 3.24Å; V415-H417 PolarHBondContact O-N 2.6Å; V415-H417 PolarHBondContact O-ND1 2.84Å
416	R	94.9	Very high	92.8	Very high	53 Å²	53	37.2 Å²	37.2	20%	0.2	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	112.7	-166.3	-174.6	177.9	171.2	-141.2	-1.7	113	T54 T56 A57 Y450 H478 E479	T54-R416 PolarHBondContact O-NH1 3.39Å; T54-R416 WeakPolarHBondContact OG1-CD 3.43Å; T56-R416 CarbonylContact C-O 3.48Å; T56-R416 WeakPolarHBondContact CA-O 3.48Å; T56-R416 VanDerWaalsContact CB-O 3.31Å; T56-R416 WeakPolarHBondContact CB-O 3.28Å; T56-R416 HydrophobicContact CG2-CG 4.25Å; A57-R416 PolarHBondContact N-O 2.97Å; R416-Y450 HydrophobicContact CG-CD2 4.38Å; R416-Y450 HydrophobicContact CG-CE2 4.41Å; R416-H478 CarbonylContact C-O 3.55Å; R416-H478 VanDerWaalsContact CA-O 3.3Å; R416-H478 WeakPolarHBondContact CA-O 3.37Å; R416-E479 HydrophobicContact CB-CB 3.86Å; R416-E479 HydrophobicContact CG-CB 4.48Å
417	H	94.8	Very high	92.9	Very high	20 Å²	20	37.4 Å²	37.4	9%	0.093	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	165.1	-175.2	62.1	-73.6	0	0	0	111.6	A57 Y414 V415 P477 H478	A57-H417 HydrophobicContact CB-CB 4.05Å; Y414-H417 AromaticContact CD1-CE1 3.73Å; Y414-H417 AromaticContact CD1-ND1 3.62Å; Y414-H417 AromaticContact CD2-CE1 3.37Å; Y414-H417 WeakPolarHBondContact CD2-CE1 3.25Å; Y414-H417 AromaticContact CD2-NE2 3.93Å; Y414-H417 AromaticContact CE1-CE1 3.61Å; Y414-H417 AromaticContact CE1-CG 3.91Å; Y414-H417 AromaticContact CE1-ND1 3.48Å; Y414-H417 WeakPolarHBondContact CE1-ND1 3.36Å; Y414-H417 AromaticContact CE2-CE1 3.21Å; Y414-H417 WeakPolarHBondContact CE2-CE1 3.31Å; Y414-H417 AromaticContact CE2-ND1 3.97Å; Y414-H417 AromaticContact CE2-NE2 3.3Å; Y414-H417 VanDerWaalsContact CE2-NE2 3.3Å; Y414-H417 WeakPolarHBondContact CE2-NE2 3.37Å; Y414-H417 AromaticContact CG-CE1 3.63Å; Y414-H417 AromaticContact CG-ND1 3.95Å; Y414-H417 AromaticContact CZ-CD2 3.76Å; Y414-H417 AromaticContact CZ-CE1 3.33Å; Y414-H417 AromaticContact CZ-CG 3.93Å; Y414-H417 AromaticContact CZ-ND1 3.65Å; Y414-H417 AromaticContact CZ-NE2 3.36Å; Y414-H417 PolarHBondContact OH-NE2 3.24Å; V415-H417 PolarHBondContact O-N 2.6Å; V415-H417 PolarHBondContact O-ND1 2.84Å; H417-P477 CarbonylContact O-C 3.55Å; H417-P477 VanDerWaalsContact O-CA 3.3Å; H417-P477 WeakPolarHBondContact O-CA 3.2Å; H417-H478 AromaticContact CE1-CD2 3.82Å; H417-H478 AromaticContact CE1-NE2 3.59Å; H417-H478 PolarHBondContact N-O 2.92Å; H417-H478 PolarHBondContact ND1-O 3.43Å; H417-H478 AromaticContact NE2-CE1 3.97Å; H417-H478 AromaticContact NE2-NE2 3.37Å; H417-H478 PolarHBondContact NE2-NE2 3.46Å; H417-H478 PolarHBondContact O-N 3.26Å
418	V	95.8	Very high	93.1	Very high	36 Å²	36	36.9 Å²	36.9	22%	0.218	22%	0.218	C	C	.	.			trans	-100.6	139.4	163.5	171.9	0	0	0	0	106.5	P421 P477	V418-P421 HydrophobicContact CB-CB 4.26Å; V418-P421 HydrophobicContact CG1-CB 4.27Å; V418-P477 HydrophobicContact CG2-CB 3.91Å; V418-P477 HydrophobicContact CG2-CG 3.9Å
419	D	95.5	Very high	93.5	Very high	16 Å²	16	34.4 Å²	34.4	9%	0.086	20%	0.202	C	C	.	.	S	Bend	trans	-69.8	-51.9	-175.2	-132.5	-30.7	0	0	0	110.6	P421 R426 T429 S472 H478 W495	D419-P421 VanDerWaalsContact O-CD 3.28Å; D419-P421 WeakPolarHBondContact O-CD 3.27Å; D419-R426 VanDerWaalsContact O-CZ 3.28Å; D419-R426 PolarHBondContact O-NH1 2.69Å; D419-R426 PolarHBondContact O-NH2 2.86Å; D419-R426 IonicContact OD1-CZ 3.99Å; D419-R426 IonicContact OD1-NH1 2.76Å; D419-R426 PolarHBondContact OD1-NH1 3.16Å; D419-T429 VanDerWaalsContact OD2-CG2 3.25Å; D419-T429 WeakPolarHBondContact OD2-CG2 3.02Å; D419-T429 PolarHBondContact OD2-OG1 2.59Å; D419-S472 WeakPolarHBondContact CA-O 3.21Å; D419-S472 WeakPolarHBondContact CB-O 3.4Å; D419-S472 PolarHBondContact N-O 2.96Å; D419-H478 IonicContact OD2-CE1 3.31Å; D419-W495 PolarHBondContact OD1-NE1 3.38Å; D419-W495 PolarHBondContact OD2-NE1 2.9Å
420	N	95.4	Very high	94.1	Very high	7 Å²	7	34.3 Å²	34.3	4%	0.037	20%	0.201	C	C	.	.	S	Bend	trans	-113.9	84.6	173.6	-179.4	10.4	0	0	0	110.9	G423 D424 R426 S472 E501	N420-G423 WeakPolarHBondContact OD1-CA 3.39Å; N420-G423 PolarHBondContact OD1-N 3.16Å; N420-D424 PolarHBondContact OD1-N 2.91Å; N420-R426 HydrophobicContact CB-CB 4.21Å; N420-R426 WeakPolarHBondContact CB-O 3.33Å; N420-R426 PolarHBondContact ND2-N 3.3Å; N420-R426 PolarHBondContact ND2-O 2.75Å; N420-S472 PolarHBondContact N-O 3.09Å; N420-E501 PolarHBondContact ND2-OE1 2.93Å
421	P	91.9	Very high	94.6	Very high	83 Å²	83	27.7 Å²	27.7	54%	0.539	17%	0.165	S	C	.	.	S	Bend	trans	-82.4	-17.2	179.5	31.4	-34.6	0	0	0	113.8	V418 D419	V418-P421 HydrophobicContact CB-CB 4.26Å; V418-P421 HydrophobicContact CG1-CB 4.27Å; D419-P421 VanDerWaalsContact O-CD 3.28Å; D419-P421 WeakPolarHBondContact O-CD 3.27Å
422	N	89.6	Confident	95.1	Very high	119 Å²	119	26.3 Å²	26.3	64%	0.636	15%	0.152	S	C	*	.	S	Bend	trans	-122.5	1.4	-161.3	-74.7	-38.5	0	0	0	115
423	G	92.3	Very high	95.5	Very high	34 Å²	34	25.8 Å²	25.8	35%	0.351	15%	0.147	S	C	.	.			trans	74.4	58.7	-174.8	0	0	0	0	0	112.2	N420 E501 A505	N420-G423 WeakPolarHBondContact OD1-CA 3.39Å; N420-G423 PolarHBondContact OD1-N 3.16Å; G423-E501 VanDerWaalsContact C-OE1 3.24Å; G423-E501 WeakPolarHBondContact CA-OE1 3.36Å; G423-A505 WeakPolarHBondContact O-CB 3.18Å
424	D	92.8	Very high	95.7	Very high	38 Å²	38	25.2 Å²	25.2	20%	0.203	14%	0.141	C	C	.	.			trans	-90.1	-2.5	177.8	80.1	15.5	0	0	0	114.4	N420 R426 E501 R502	N420-D424 PolarHBondContact OD1-N 2.91Å; D424-R426 WeakPolarHBondContact OD1-CB 3.5Å; D424-R426 VanDerWaalsContact OD1-CG 3.27Å; D424-R426 WeakPolarHBondContact OD1-CG 3.41Å; D424-R426 IonicContact OD1-CZ 3.6Å; D424-R426 PolarHBondContact OD1-N 2.75Å; D424-R426 IonicContact OD1-NE 2.92Å; D424-R426 PolarHBondContact OD1-NE 3.45Å; D424-R426 VanDerWaalsContact OD1-NE 3.09Å; D424-R426 IonicContact OD1-NH2 2.74Å; D424-R426 IonicContact OD2-CZ 3.15Å; D424-R426 VanDerWaalsContact OD2-CZ 3.28Å; D424-R426 IonicContact OD2-NE 2.69Å; D424-R426 PolarHBondContact OD2-NE 2.69Å; D424-R426 IonicContact OD2-NH2 2.68Å; D424-R426 PolarHBondContact OD2-NH2 3.49Å; D424-E501 PolarHBondContact N-OE1 3.24Å; D424-R502 WeakPolarHBondContact O-CD 3.42Å; D424-R502 PolarHBondContact O-NH1 3.09Å
425	G	95.3	Very high	95.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	101.6	-12.8	-178.9	0	0	0	0	0	115	C427 F497 D498 E501	G425-C427 PolarHBondContact O-N 3.5Å; G425-F497 CarbonylContact O-C 3.59Å; G425-F497 WeakPolarHBondContact O-CA 3.49Å; G425-D498 PolarHBondContact O-N 3Å; G425-E501 WeakPolarHBondContact CA-OE1 3.34Å; G425-E501 PolarHBondContact N-OE1 3.25Å
426	R	97	Very high	96	Very high	28 Å²	28	26.3 Å²	26.3	11%	0.106	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	117.2	179.7	-70.6	-179.7	-72.1	142.1	-2	111.1	D419 N420 D424 S472 W495 Y496 F497	D419-R426 VanDerWaalsContact O-CZ 3.28Å; D419-R426 PolarHBondContact O-NH1 2.69Å; D419-R426 PolarHBondContact O-NH2 2.86Å; D419-R426 IonicContact OD1-CZ 3.99Å; D419-R426 IonicContact OD1-NH1 2.76Å; D419-R426 PolarHBondContact OD1-NH1 3.16Å; N420-R426 HydrophobicContact CB-CB 4.21Å; N420-R426 WeakPolarHBondContact CB-O 3.33Å; N420-R426 PolarHBondContact ND2-N 3.3Å; N420-R426 PolarHBondContact ND2-O 2.75Å; D424-R426 WeakPolarHBondContact OD1-CB 3.5Å; D424-R426 VanDerWaalsContact OD1-CG 3.27Å; D424-R426 WeakPolarHBondContact OD1-CG 3.41Å; D424-R426 IonicContact OD1-CZ 3.6Å; D424-R426 PolarHBondContact OD1-N 2.75Å; D424-R426 IonicContact OD1-NE 2.92Å; D424-R426 PolarHBondContact OD1-NE 3.45Å; D424-R426 VanDerWaalsContact OD1-NE 3.09Å; D424-R426 IonicContact OD1-NH2 2.74Å; D424-R426 IonicContact OD2-CZ 3.15Å; D424-R426 VanDerWaalsContact OD2-CZ 3.28Å; D424-R426 IonicContact OD2-NE 2.69Å; D424-R426 PolarHBondContact OD2-NE 2.69Å; D424-R426 IonicContact OD2-NH2 2.68Å; D424-R426 PolarHBondContact OD2-NH2 3.49Å; R426-S472 WeakPolarHBondContact O-CB 3.32Å; R426-W495 HydrophobicContact CB-CB 4.33Å; R426-W495 VanDerWaalsContact CD-CG 3.49Å; R426-W495 HydrophobicContact CG-CB 3.77Å; R426-W495 HydrophobicContact CG-CG 4.23Å; R426-Y496 WeakPolarHBondContact CA-O 3.35Å; R426-F497 HydrophobicContact CG-CD1 3.88Å; R426-F497 HydrophobicContact CG-CE1 3.55Å
427	C	96.4	Very high	95.9	Very high	5 Å²	5	30.7 Å²	30.7	3%	0.034	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-38	-176.9	62.8	0	0	0	0	113.3	G425 W471 S472 Y496 D498	G425-C427 PolarHBondContact O-N 3.5Å; C427-W471 WeakPolarHBondContact O-CA 3.3Å; C427-S472 PolarHBondContact O-N 3.06Å; C427-Y496 PolarHBondContact N-O 2.96Å; C427-Y496 PolarHBondContact SG-O 3.12Å; C427-Y496 VanDerWaalsContact SG-O 3.41Å; C427-D498 HydrophobicContact CB-CB 4.08Å; C427-D498 PolarHBondContact SG-N 2.79Å
428	L	97.6	Very high	96	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.7	178.5	-64	172.2	0	0	0	111.5	M304 I382 L391 I396 I469 W471 S472 W495 Y496	M304-L428 HydrophobicContact CE-CD2 3.5Å; M304-L428 VanDerWaalsContact CE-CD2 3.5Å; I382-L428 HydrophobicContact CD1-CD1 4.3Å; I382-L428 HydrophobicContact CG2-CD1 4.22Å; L391-L428 HydrophobicContact CD1-CD1 3.84Å; I396-L428 HydrophobicContact CD1-CD1 3.66Å; L428-I469 HydrophobicContact CD2-CG2 4.46Å; L428-W471 HydrophobicContact CD2-CD2 3.96Å; L428-W471 HydrophobicContact CD2-CE3 3.45Å; L428-W471 VanDerWaalsContact CD2-CE3 3.45Å; L428-W471 HydrophobicContact CD2-CH2 4.11Å; L428-W471 HydrophobicContact CD2-CZ3 3.53Å; L428-W471 HydrophobicContact CG-CE3 4.32Å; L428-W471 HydrophobicContact CG-CZ3 4.16Å; L428-S472 WeakPolarHBondContact CA-OG 3.1Å; L428-S472 PolarHBondContact N-OG 2.92Å; L428-W495 VanDerWaalsContact O-CA 3.32Å; L428-W495 WeakPolarHBondContact O-CA 3.49Å; L428-Y496 PolarHBondContact O-N 3.45Å
429	T	98.6	Very high	95.9	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	123.5	169.2	-55.6	0	0	0	0	108.3	D419 I431 I469 F470 S472 T493 W495	D419-T429 VanDerWaalsContact OD2-CG2 3.25Å; D419-T429 WeakPolarHBondContact OD2-CG2 3.02Å; D419-T429 PolarHBondContact OD2-OG1 2.59Å; T429-I431 HydrophobicContact CG2-CD1 4.26Å; T429-I431 HydrophobicContact CG2-CG1 3.95Å; T429-I469 WeakPolarHBondContact O-CA 3.5Å; T429-F470 HydrophobicContact CG2-CE1 3.76Å; T429-F470 HydrophobicContact CG2-CE2 4.17Å; T429-F470 HydrophobicContact CG2-CZ 3.53Å; T429-F470 PolarHBondContact N-O 3.09Å; T429-F470 PolarHBondContact O-N 3.43Å; T429-S472 PolarHBondContact N-OG 2.8Å; T429-S472 PolarHBondContact OG1-OG 3.28Å; T429-T493 HydrophobicContact CG2-CG2 3.9Å; T429-W495 PolarHBondContact OG1-NE1 2.82Å
430	C	98.7	Very high	95.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.9	172.8	-62.3	0	0	0	0	108.9	I378 L468 T493 V494 Y496	I378-C430 HydrophobicContact CG2-CB 4.04Å; C430-L468 CarbonylContact C-O 3.59Å; C430-L468 WeakPolarHBondContact CA-O 3.41Å; C430-T493 CarbonylContact O-C 3.55Å; C430-T493 WeakPolarHBondContact O-CA 3.49Å; C430-V494 PolarHBondContact N-O 3.22Å; C430-V494 PolarHBondContact O-N 3.01Å; C430-Y496 HydrophobicContact CB-CE2 4.36Å
431	I	98.8	Very high	95.7	Very high	15 Å²	15	40.5 Å²	40.5	8%	0.077	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	122	178.7	-50	-175.3	0	0	0	108.9	T429 Y433 L468 F470 A491 I492 T493	T429-I431 HydrophobicContact CG2-CD1 4.26Å; T429-I431 HydrophobicContact CG2-CG1 3.95Å; I431-Y433 HydrophobicContact CG2-CD1 4.17Å; I431-Y433 HydrophobicContact CG2-CE1 3.69Å; I431-Y433 HydrophobicContact CG2-CE2 4.21Å; I431-L468 HydrophobicContact CB-CB 4.42Å; I431-L468 HydrophobicContact CB-CD2 4.49Å; I431-L468 HydrophobicContact CD1-CD2 4.32Å; I431-L468 PolarHBondContact N-O 3.12Å; I431-L468 PolarHBondContact O-N 3.47Å; I431-F470 HydrophobicContact CD1-CE1 3.88Å; I431-F470 HydrophobicContact CD1-CZ 4.34Å; I431-F470 HydrophobicContact CG1-CE1 4.29Å; I431-A491 HydrophobicContact CG2-CB 3.93Å; I431-I492 CarbonylContact C-O 3.51Å; I431-I492 WeakPolarHBondContact CA-O 3.23Å; I431-T493 HydrophobicContact CG1-CG2 4.12Å
432	Y	98.9	Very high	95.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.8	171.4	-175	-110.5	0	0	0	110.2	F315 L316 V324 L374 L434 D465 R466 L467 A491 I492	F315-Y432 HydrophobicContact CB-CE2 4.26Å; F315-Y432 HydrophobicContact CD1-CD2 4.21Å; F315-Y432 HydrophobicContact CD1-CE2 4.08Å; L316-Y432 HydrophobicContact CD1-CE1 4.25Å; L316-Y432 HydrophobicContact CD1-CE2 4.38Å; L316-Y432 HydrophobicContact CG-CE2 4.18Å; V324-Y432 HydrophobicContact CB-CE1 4.47Å; V324-Y432 HydrophobicContact CG1-CD1 4.46Å; V324-Y432 HydrophobicContact CG1-CE1 4.24Å; L374-Y432 HydrophobicContact CD1-CD1 3.76Å; L374-Y432 HydrophobicContact CD1-CD2 3.83Å; L374-Y432 HydrophobicContact CD1-CE1 4.08Å; L374-Y432 HydrophobicContact CD1-CE2 4.17Å; L374-Y432 HydrophobicContact CD1-CG 3.61Å; L374-Y432 HydrophobicContact CD2-CD1 3.43Å; L374-Y432 VanDerWaalsContact CD2-CD1 3.43Å; L374-Y432 HydrophobicContact CD2-CE1 4.02Å; L374-Y432 HydrophobicContact CD2-CG 3.91Å; L374-Y432 HydrophobicContact CG-CD1 4.26Å; L374-Y432 HydrophobicContact CG-CG 4.44Å; Y432-L434 HydrophobicContact CD1-CD2 3.95Å; Y432-L434 HydrophobicContact CD1-CG 4.25Å; Y432-L434 HydrophobicContact CE1-CD2 3.55Å; Y432-L434 HydrophobicContact CE1-CG 4.33Å; Y432-D465 VanDerWaalsContact CE2-OD1 3.23Å; Y432-D465 WeakPolarHBondContact CE2-OD1 3.23Å; Y432-D465 PolarHBondContact OH-OD1 3.06Å; Y432-R466 WeakPolarHBondContact CA-O 3.28Å; Y432-L467 HydrophobicContact CD2-CB 4.39Å; Y432-A491 CarbonylContact O-C 3.59Å; Y432-A491 WeakPolarHBondContact O-CA 3.22Å; Y432-I492 PolarHBondContact N-O 3.37Å; Y432-I492 PolarHBondContact O-N 3.09Å
433	Y	98.7	Very high	95.9	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.008	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	147.4	-175.7	-69	-62.9	0	0	0	112.6	I431 I460 P462 L463 D465 R466 L468 A491	I431-Y433 HydrophobicContact CG2-CD1 4.17Å; I431-Y433 HydrophobicContact CG2-CE1 3.69Å; I431-Y433 HydrophobicContact CG2-CE2 4.21Å; Y433-I460 HydrophobicContact CE2-CG2 4.24Å; Y433-P462 HydrophobicContact CD1-CB 3.59Å; Y433-P462 HydrophobicContact CE1-CB 3.73Å; Y433-P462 HydrophobicContact CG-CB 4.04Å; Y433-L463 CarbonylContact C-O 3.59Å; Y433-L463 WeakPolarHBondContact CB-O 3.32Å; Y433-D465 PolarHBondContact O-N 3.07Å; Y433-R466 HydrophobicContact CD2-CB 4.23Å; Y433-R466 HydrophobicContact CD2-CG 4.1Å; Y433-R466 PolarHBondContact N-O 3.46Å; Y433-L468 HydrophobicContact CE2-CB 4.16Å; Y433-L468 HydrophobicContact CE2-CD2 4.13Å; Y433-A491 HydrophobicContact CD1-CB 3.83Å; Y433-A491 HydrophobicContact CE1-CB 3.95Å
434	L	98.4	Very high	96.1	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.181	C	C	.	.			trans	-127.7	8.9	-164.6	-70.1	168.6	0	0	0	113.5	V324 L325 V328 Y432 K436 I492	V324-L434 HydrophobicContact CB-CD2 4.06Å; V324-L434 HydrophobicContact CG1-CD1 4.17Å; V324-L434 HydrophobicContact CG1-CD2 3.72Å; L325-L434 HydrophobicContact CB-CD2 4.25Å; L325-L434 HydrophobicContact CD1-CB 4.22Å; V328-L434 HydrophobicContact CB-CD1 4.13Å; V328-L434 HydrophobicContact CG1-CD1 4.23Å; V328-L434 HydrophobicContact CG2-CD1 3.75Å; Y432-L434 HydrophobicContact CD1-CD2 3.95Å; Y432-L434 HydrophobicContact CD1-CG 4.25Å; Y432-L434 HydrophobicContact CE1-CD2 3.55Å; Y432-L434 HydrophobicContact CE1-CG 4.33Å; L434-K436 PolarHBondContact O-N 2.82Å; L434-I492 HydrophobicContact CD1-CD1 4.07Å; L434-I492 HydrophobicContact CD1-CG1 4.11Å
435	N	97.6	Very high	96.2	Very high	7 Å²	7	33.9 Å²	33.9	4%	0.037	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-95	96.3	-163.4	-48.5	-72.3	0	0	0	111.4	W438 P462 F464 R489 Y490	N435-W438 HydrophobicContact CB-CB 3.92Å; N435-W438 HydrophobicContact CB-CD2 4.04Å; N435-W438 HydrophobicContact CB-CE3 3.74Å; N435-W438 HydrophobicContact CB-CG 4.14Å; N435-P462 VanDerWaalsContact CB-O 3.3Å; N435-P462 WeakPolarHBondContact CB-O 3.3Å; N435-P462 PolarHBondContact ND2-O 3.47Å; N435-F464 PolarHBondContact O-N 2.93Å; N435-F464 VanDerWaalsContact O-N 3.11Å; N435-R489 VanDerWaalsContact OD1-CA 3.32Å; N435-R489 WeakPolarHBondContact OD1-CA 3.39Å; N435-Y490 PolarHBondContact ND2-O 2.93Å; N435-Y490 PolarHBondContact OD1-N 3.13Å; N435-Y490 PolarHBondContact OD1-O 3.39Å
436	K	96.3	Very high	96.3	Very high	87 Å²	87	35.4 Å²	35.4	38%	0.378	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	139.6	177.3	-69.3	-172.3	174.7	-171.7	0	110.9	D322 L325 L434 W438 F464	D322-K436 WeakPolarHBondContact OD1-CE 3.14Å; D322-K436 IonicContact OD1-NZ 3.99Å; D322-K436 PolarHBondContact OD1-NZ 2.97Å; D322-K436 IonicContact OD2-NZ 2.72Å; D322-K436 PolarHBondContact OD2-NZ 2.92Å; L325-K436 HydrophobicContact CD2-CD 4.13Å; L325-K436 HydrophobicContact CD2-CG 4.26Å; L434-K436 PolarHBondContact O-N 2.82Å; K436-W438 VanDerWaalsContact C-N 3.26Å; K436-W438 PolarHBondContact O-N 3.17Å; K436-F464 HydrophobicContact CD-CD2 4.43Å; K436-F464 HydrophobicContact CG-CB 3.93Å; K436-F464 HydrophobicContact CG-CD1 4.38Å; K436-F464 HydrophobicContact CG-CD2 3.62Å; K436-F464 HydrophobicContact CG-CE2 4.21Å; K436-F464 HydrophobicContact CG-CG 3.73Å
437	N	94.5	Very high	96.3	Very high	145 Å²	145	34.2 Å²	34.2	78%	0.775	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	41.3	173.9	-50.8	-30.9	0	0	0	113	D439	N437-D439 PolarHBondContact O-N 2.96Å
438	W	95.4	Very high	96.4	Very high	11 Å²	11	34.8 Å²	34.8	4%	0.042	18%	0.177	C	C	.	.			trans	-92.5	95	-176.5	-168.8	-79.4	0	0	0	112.2	N435 K436 H443 G444 P462 L463 S483 T485 R487 R489	N435-W438 HydrophobicContact CB-CB 3.92Å; N435-W438 HydrophobicContact CB-CD2 4.04Å; N435-W438 HydrophobicContact CB-CE3 3.74Å; N435-W438 HydrophobicContact CB-CG 4.14Å; K436-W438 VanDerWaalsContact C-N 3.26Å; K436-W438 PolarHBondContact O-N 3.17Å; W438-H443 HydrophobicContact CD2-CB 4.08Å; W438-H443 HydrophobicContact CE3-CB 4.46Å; W438-H443 HydrophobicContact CH2-CB 3.97Å; W438-H443 HydrophobicContact CZ2-CB 3.51Å; W438-H443 HydrophobicContact CZ3-CB 4.43Å; W438-G444 PolarHBondContact NE1-O 3.06Å; W438-P462 HydrophobicContact CD2-CG 4.39Å; W438-P462 HydrophobicContact CG-CG 4.15Å; W438-L463 HydrophobicContact CB-CD2 4.4Å; W438-L463 WeakPolarHBondContact O-CD2 3.5Å; W438-S483 WeakPolarHBondContact CH2-OG 3.11Å; W438-T485 HydrophobicContact CH2-CG2 3.3Å; W438-T485 HydrophobicContact CZ2-CG2 4.02Å; W438-T485 HydrophobicContact CZ3-CG2 3.87Å; W438-R487 HydrophobicContact CZ3-CB 4.22Å; W438-R489 HydrophobicContact CH2-CB 3.57Å; W438-R489 HydrophobicContact CH2-CG 4.37Å; W438-R489 HydrophobicContact CZ2-CB 4.1Å; W438-R489 HydrophobicContact CZ2-CG 4.47Å; W438-R489 HydrophobicContact CZ3-CB 3.96Å
439	D	94.3	Very high	96.4	Very high	59 Å²	59	34.8 Å²	34.8	32%	0.316	18%	0.177	S	C	.	.			trans	-76.9	121.2	163.3	165	41.9	0	0	0	110.7	N437 K441 T442 H443	N437-D439 PolarHBondContact O-N 2.96Å; D439-K441 VanDerWaalsContact C-N 3.29Å; D439-K441 PolarHBondContact O-N 2.9Å; D439-K441 WeakPolarHBondContact OD1-CB 3.08Å; D439-K441 WeakPolarHBondContact OD1-CG 3.49Å; D439-K441 PolarHBondContact OD1-N 2.61Å; D439-T442 VanDerWaalsContact OD2-CB 3.32Å; D439-T442 WeakPolarHBondContact OD2-CB 3.3Å; D439-T442 VanDerWaalsContact OD2-CG2 3.3Å; D439-T442 WeakPolarHBondContact OD2-CG2 3.41Å; D439-T442 PolarHBondContact OD2-N 3.43Å; D439-T442 PolarHBondContact OD2-OG1 2.8Å; D439-H443 PolarHBondContact N-ND1 3.02Å; D439-H443 VanDerWaalsContact O-CB 3.25Å; D439-H443 WeakPolarHBondContact O-CB 3.23Å; D439-H443 VanDerWaalsContact O-CG 3.3Å; D439-H443 PolarHBondContact O-N 2.92Å; D439-H443 PolarHBondContact O-ND1 3.04Å
440	V	94	Very high	96.2	Very high	24 Å²	24	35.7 Å²	35.7	15%	0.145	18%	0.181	C	C	.	.	H	α-helix	trans	-71.2	-19.9	177	-68	0	0	0	0	113.9	G444 L446 E461	V440-G444 VanDerWaalsContact O-CA 3.31Å; V440-G444 WeakPolarHBondContact O-CA 3.35Å; V440-G444 PolarHBondContact O-N 3.42Å; V440-L446 HydrophobicContact CG1-CD1 4.22Å; V440-E461 HydrophobicContact CB-CG 4.48Å; V440-E461 HydrophobicContact CG1-CB 3.78Å; V440-E461 HydrophobicContact CG1-CG 3.73Å; V440-E461 HydrophobicContact CG2-CG 3.92Å; V440-E461 WeakPolarHBondContact CG2-OE1 3.43Å
441	K	92.6	Very high	96	Very high	192 Å²	192	36.2 Å²	36.2	84%	0.835	19%	0.185	S	C	*	.	H	α-helix	trans	-72.3	-39.2	-179	-59.8	171.1	-177	171.1	0	111.9	D439	D439-K441 VanDerWaalsContact C-N 3.29Å; D439-K441 PolarHBondContact O-N 2.9Å; D439-K441 WeakPolarHBondContact OD1-CB 3.08Å; D439-K441 WeakPolarHBondContact OD1-CG 3.49Å; D439-K441 PolarHBondContact OD1-N 2.61Å
442	T	92.2	Very high	95.6	Very high	96 Å²	96	40 Å²	40	59%	0.589	20%	0.202	S	C	*	.	H	α-helix	trans	-91.5	-37.4	176.5	51.2	0	0	0	0	113.4	D439	D439-T442 VanDerWaalsContact OD2-CB 3.32Å; D439-T442 WeakPolarHBondContact OD2-CB 3.3Å; D439-T442 VanDerWaalsContact OD2-CG2 3.3Å; D439-T442 WeakPolarHBondContact OD2-CG2 3.41Å; D439-T442 PolarHBondContact OD2-N 3.43Å; D439-T442 PolarHBondContact OD2-OG1 2.8Å
443	H	94.4	Very high	95	Very high	25 Å²	25	44 Å²	44	12%	0.116	24%	0.243	C	C	.	.	H	α-helix	trans	-93.9	-23.5	-174	-52.2	117.9	0	0	0	114.4	W438 D439 Y484 T485	W438-H443 HydrophobicContact CD2-CB 4.08Å; W438-H443 HydrophobicContact CE3-CB 4.46Å; W438-H443 HydrophobicContact CH2-CB 3.97Å; W438-H443 HydrophobicContact CZ2-CB 3.51Å; W438-H443 HydrophobicContact CZ3-CB 4.43Å; D439-H443 PolarHBondContact N-ND1 3.02Å; D439-H443 VanDerWaalsContact O-CB 3.25Å; D439-H443 WeakPolarHBondContact O-CB 3.23Å; D439-H443 VanDerWaalsContact O-CG 3.3Å; D439-H443 PolarHBondContact O-N 2.92Å; D439-H443 PolarHBondContact O-ND1 3.04Å; H443-Y484 PolarHBondContact O-N 2.79Å; H443-T485 HydrophobicContact CB-CG2 3.7Å; H443-T485 PolarHBondContact CD2-OG1 3.25Å
444	G	94.9	Very high	94.3	Very high	13 Å²	13	48 Å²	48	13%	0.134	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	74.5	-143.1	-171.7	0	0	0	0	0	112.8	W438 V440 L446	W438-G444 PolarHBondContact NE1-O 3.06Å; V440-G444 VanDerWaalsContact O-CA 3.31Å; V440-G444 WeakPolarHBondContact O-CA 3.35Å; V440-G444 PolarHBondContact O-N 3.42Å; G444-L446 VanDerWaalsContact C-N 3.26Å; G444-L446 PolarHBondContact O-N 2.79Å
445	G	95	Very high	93.7	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.298	C	S	.	.			trans	71.6	12.1	173.8	0	0	0	0	0	116	K481 P482 R489	G445-K481 WeakPolarHBondContact CA-O 3.37Å; G445-P482 PolarHBondContact N-O 2.8Å; G445-R489 VanDerWaalsContact O-CZ 3.31Å; G445-R489 PolarHBondContact O-NE 2.88Å; G445-R489 PolarHBondContact O-NH2 3.22Å
446	L	96.9	Very high	93.3	Very high	33 Å²	33	57.4 Å²	57.4	17%	0.173	31%	0.313	C	S	.	.			trans	-60.3	133.4	176.6	-176.2	71.9	0	0	0	111	V440 G444 Q448 N459 E461 K481	V440-L446 HydrophobicContact CG1-CD1 4.22Å; G444-L446 VanDerWaalsContact C-N 3.26Å; G444-L446 PolarHBondContact O-N 2.79Å; L446-Q448 HydrophobicContact CD2-CG 4.07Å; L446-Q448 HydrophobicContact CG-CG 4.46Å; L446-N459 HydrophobicContact CD1-CB 4.11Å; L446-N459 HydrophobicContact CD2-CB 4.08Å; L446-N459 HydrophobicContact CG-CB 4.46Å; L446-E461 HydrophobicContact CD1-CG 3.99Å; L446-K481 HydrophobicContact CB-CB 4.38Å; L446-K481 HydrophobicContact CB-CG 4.36Å; L446-K481 WeakPolarHBondContact O-CB 3.37Å; L446-K481 PolarHBondContact O-N 3.5Å
447	L	98.1	Very high	93.1	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.6	165.3	-177.1	82.8	0	0	0	108.7	I449 N459 I460 L468 E479 V480	L447-I449 HydrophobicContact CD2-CD1 3.83Å; L447-I449 HydrophobicContact CD2-CG1 3.77Å; L447-I449 HydrophobicContact CG-CG1 4.17Å; L447-N459 CarbonylContact O-C 3.58Å; L447-I460 HydrophobicContact CB-CB 4.26Å; L447-I460 HydrophobicContact CD2-CB 4.32Å; L447-I460 HydrophobicContact CD2-CG1 4.36Å; L447-I460 PolarHBondContact N-O 3.28Å; L447-I460 PolarHBondContact O-N 3.2Å; L447-L468 HydrophobicContact CD2-CD2 3.34Å; L447-E479 CarbonylContact C-O 3.53Å; L447-E479 WeakPolarHBondContact CA-O 3.46Å; L447-E479 WeakPolarHBondContact CD1-O 3.46Å; L447-V480 HydrophobicContact CD1-CG2 3.7Å
448	Q	97.8	Very high	93.1	Very high	17 Å²	17	46.9 Å²	46.9	8%	0.079	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123	167.3	-69.9	-160.9	-55.2	0	0	109.8	L446 Y450 V457 N459 H478 E479 K481	L446-Q448 HydrophobicContact CD2-CG 4.07Å; L446-Q448 HydrophobicContact CG-CG 4.46Å; Q448-Y450 HydrophobicContact CB-CE2 3.81Å; Q448-Y450 PolarHBondContact OE1-OH 3.18Å; Q448-Y450 VanDerWaalsContact OE1-OH 3.06Å; Q448-V457 HydrophobicContact CB-CG1 3.77Å; Q448-V457 HydrophobicContact CG-CG1 4.05Å; Q448-N459 WeakPolarHBondContact CG-OD1 3.27Å; Q448-N459 PolarHBondContact NE2-OD1 3.32Å; Q448-H478 CarbonylContact O-C 3.49Å; Q448-H478 WeakPolarHBondContact O-CA 3.22Å; Q448-H478 WeakPolarHBondContact O-CB 3.5Å; Q448-E479 HydrophobicContact CB-CG 4.1Å; Q448-E479 PolarHBondContact N-O 2.74Å; Q448-E479 PolarHBondContact O-N 2.97Å; Q448-K481 VanDerWaalsContact CD-CE 3.47Å
449	I	97.7	Very high	93.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	139.9	171.4	-49.9	172.1	0	0	0	108.4	I309 L447 P451 V457 A458 I460 L468 F470 N476 H478	I309-I449 HydrophobicContact CD1-CB 4Å; I309-I449 HydrophobicContact CD1-CD1 3.91Å; I309-I449 HydrophobicContact CD1-CG2 3.72Å; I309-I449 HydrophobicContact CG1-CD1 4.31Å; I309-I449 HydrophobicContact CG2-CD1 4.27Å; L447-I449 HydrophobicContact CD2-CD1 3.83Å; L447-I449 HydrophobicContact CD2-CG1 3.77Å; L447-I449 HydrophobicContact CG-CG1 4.17Å; I449-P451 WeakPolarHBondContact O-CD 3.38Å; I449-V457 CarbonylContact O-C 3.58Å; I449-V457 WeakPolarHBondContact O-CA 3.31Å; I449-V457 WeakPolarHBondContact O-CG1 3.23Å; I449-A458 HydrophobicContact CB-CB 4.35Å; I449-A458 PolarHBondContact N-O 2.78Å; I449-A458 PolarHBondContact O-N 2.87Å; I449-I460 HydrophobicContact CD1-CG1 4.25Å; I449-L468 HydrophobicContact CD1-CD1 4.32Å; I449-L468 HydrophobicContact CD1-CD2 4.41Å; I449-F470 HydrophobicContact CD1-CD1 4.12Å; I449-F470 HydrophobicContact CD1-CE1 4.48Å; I449-F470 HydrophobicContact CD1-CG 4.3Å; I449-N476 HydrophobicContact CG2-CB 3.69Å; I449-H478 HydrophobicContact CB-CB 4.18Å; I449-H478 HydrophobicContact CG1-CB 3.85Å; I449-H478 HydrophobicContact CG2-CB 4.24Å
450	Y	95.9	Very high	93.4	Very high	20 Å²	20	44.9 Å²	44.9	8%	0.078	25%	0.252	C	S	.	.			trans	-118.5	73.5	-175.3	-66.3	-100.6	0	0	0	111.4	T54 R416 Q448 E452 V457 P477 E479	T54-Y450 PolarHBondContact OG1-OH 3.42Å; R416-Y450 HydrophobicContact CG-CD2 4.38Å; R416-Y450 HydrophobicContact CG-CE2 4.41Å; Q448-Y450 HydrophobicContact CB-CE2 3.81Å; Q448-Y450 PolarHBondContact OE1-OH 3.18Å; Q448-Y450 VanDerWaalsContact OE1-OH 3.06Å; Y450-E452 PolarHBondContact O-N 2.92Å; Y450-V457 HydrophobicContact CD1-CG1 4.24Å; Y450-V457 HydrophobicContact CD1-CG2 3.65Å; Y450-V457 HydrophobicContact CE1-CB 4.48Å; Y450-V457 HydrophobicContact CE1-CG1 4.04Å; Y450-V457 HydrophobicContact CE1-CG2 3.57Å; Y450-V457 HydrophobicContact CE2-CG1 4.31Å; Y450-V457 HydrophobicContact CG-CG1 4.47Å; Y450-P477 WeakPolarHBondContact CB-O 3.33Å; Y450-P477 PolarHBondContact N-O 3.21Å; Y450-P477 WeakPolarHBondContact O-CD 3.44Å; Y450-E479 HydrophobicContact CE2-CG 4.3Å; Y450-E479 PolarHBondContact OH-OE1 2.88Å; Y450-E479 VanDerWaalsContact OH-OE1 3.05Å
451	P	93.1	Very high	93.6	Very high	12 Å²	12	46.7 Å²	46.7	8%	0.078	26%	0.259	C	S	.	.			trans	-53.9	128.7	-171.6	-27.1	34.7	0	0	0	114.3	I309 I449 G453 K454 V456 R475	I309-P451 HydrophobicContact CD1-CG 3.81Å; I449-P451 WeakPolarHBondContact O-CD 3.38Å; P451-G453 PolarHBondContact O-N 3.11Å; P451-K454 HydrophobicContact CB-CB 4.21Å; P451-K454 HydrophobicContact CB-CD 3.94Å; P451-K454 HydrophobicContact CB-CG 4.21Å; P451-K454 PolarHBondContact O-N 2.79Å; P451-K454 VanDerWaalsContact O-N 3.15Å; P451-V456 WeakPolarHBondContact CD-O 3.46Å; P451-R475 CarbonylContact C-O 3.55Å; P451-R475 WeakPolarHBondContact CA-O 3.46Å
452	E	90.4	Very high	93.8	Very high	95 Å²	95	37.5 Å²	37.5	44%	0.444	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	133.5	179.4	-172.4	170.9	-166	0	0	111.1	Y450 K454 R474 R475	Y450-E452 PolarHBondContact O-N 2.92Å; E452-K454 VanDerWaalsContact C-N 3.31Å; E452-K454 PolarHBondContact O-N 3.3Å; E452-R474 IonicContact OE1-CZ 2.96Å; E452-R474 IonicContact OE1-NE 3.09Å; E452-R474 IonicContact OE1-NH2 2.88Å; E452-R474 PolarHBondContact OE1-NH2 3.33Å; E452-R474 IonicContact OE2-CZ 2.65Å; E452-R474 IonicContact OE2-NE 2.75Å; E452-R474 PolarHBondContact OE2-NE 3.17Å; E452-R474 IonicContact OE2-NH2 3.51Å; E452-R475 PolarHBondContact N-O 3.1Å
453	G	86.3	Confident	94.1	Very high	83 Å²	83	35.2 Å²	35.2	86%	0.856	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.4	5.9	-178.8	0	0	0	0	0	115.8	P451	P451-G453 PolarHBondContact O-N 3.11Å
454	K	84.4	Confident	94.3	Very high	86 Å²	86	36 Å²	36	37%	0.374	21%	0.206	S	C	.	.			trans	-121	132.2	178.6	-52.5	-174.6	-178.5	177.1	0	111.4	Y306 Y307 P451 E452 V456	Y306-K454 PolarHBondContact O-NZ 3.31Å; Y307-K454 PolarHBondContact O-NZ 2.87Å; P451-K454 HydrophobicContact CB-CB 4.21Å; P451-K454 HydrophobicContact CB-CD 3.94Å; P451-K454 HydrophobicContact CB-CG 4.21Å; P451-K454 PolarHBondContact O-N 2.79Å; P451-K454 VanDerWaalsContact O-N 3.15Å; E452-K454 VanDerWaalsContact C-N 3.31Å; E452-K454 PolarHBondContact O-N 3.3Å; K454-V456 HydrophobicContact CB-CG2 4.1Å; K454-V456 PolarHBondContact O-N 3.43Å
455	N	85.2	Confident	94.4	Very high	149 Å²	149	35.5 Å²	35.5	80%	0.797	20%	0.2	S	C	*	.	S	Bend	trans	-81.9	38.6	178.4	-69	-22.4	0	0	0	113
456	V	89	Confident	94.6	Very high	57 Å²	57	35.7 Å²	35.7	35%	0.345	20%	0.201	S	C	.	.			trans	-136.3	144.9	179.1	-62.6	0	0	0	0	110.6	C48 A49 P451 K454	C48-V456 HydrophobicContact CB-CB 4.17Å; C48-V456 HydrophobicContact CB-CG1 4.29Å; A49-V456 WeakPolarHBondContact O-CA 3.19Å; P451-V456 WeakPolarHBondContact CD-O 3.46Å; K454-V456 HydrophobicContact CB-CG2 4.1Å; K454-V456 PolarHBondContact O-N 3.43Å
457	V	93.4	Very high	94.7	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	125.3	171.2	-174.9	0	0	0	0	108.1	F47 C48 A49 P51 Q448 I449 Y450	F47-V457 VanDerWaalsContact O-O 3.06Å; C48-V457 WeakPolarHBondContact CA-O 3.39Å; A49-V457 PolarHBondContact N-O 3.14Å; A49-V457 PolarHBondContact O-N 2.85Å; P51-V457 HydrophobicContact CB-CG2 4.21Å; Q448-V457 HydrophobicContact CB-CG1 3.77Å; Q448-V457 HydrophobicContact CG-CG1 4.05Å; I449-V457 CarbonylContact O-C 3.58Å; I449-V457 WeakPolarHBondContact O-CA 3.31Å; I449-V457 WeakPolarHBondContact O-CG1 3.23Å; Y450-V457 HydrophobicContact CD1-CG1 4.24Å; Y450-V457 HydrophobicContact CD1-CG2 3.65Å; Y450-V457 HydrophobicContact CE1-CB 4.48Å; Y450-V457 HydrophobicContact CE1-CG1 4.04Å; Y450-V457 HydrophobicContact CE1-CG2 3.57Å; Y450-V457 HydrophobicContact CE2-CG1 4.31Å; Y450-V457 HydrophobicContact CG-CG1 4.47Å
458	A	95	Very high	94.7	Very high	10 Å²	10	34.1 Å²	34.1	8%	0.083	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	108.5	176.5	0	0	0	0	0	109.9	I309 I449 I460	I309-A458 HydrophobicContact CD1-CB 3.99Å; I449-A458 HydrophobicContact CB-CB 4.35Å; I449-A458 PolarHBondContact N-O 2.78Å; I449-A458 PolarHBondContact O-N 2.87Å; A458-I460 HydrophobicContact CB-CD1 4.35Å
459	N	96.9	Very high	94.8	Very high	26 Å²	26	33.5 Å²	33.5	14%	0.139	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	100.2	-179.3	-61.3	-54.8	0	0	0	110.1	F47 A49 L446 L447 Q448	F47-N459 WeakPolarHBondContact CB-O 2.92Å; F47-N459 WeakPolarHBondContact CD1-O 3.42Å; F47-N459 WeakPolarHBondContact O-CB 3.27Å; F47-N459 PolarHBondContact O-N 3.41Å; F47-N459 PolarHBondContact O-ND2 2.95Å; F47-N459 VanDerWaalsContact O-ND2 3.08Å; A49-N459 VanDerWaalsContact CB-ND2 3.28Å; A49-N459 WeakPolarHBondContact CB-ND2 3.47Å; L446-N459 HydrophobicContact CD1-CB 4.11Å; L446-N459 HydrophobicContact CD2-CB 4.08Å; L446-N459 HydrophobicContact CG-CB 4.46Å; L447-N459 CarbonylContact O-C 3.58Å; Q448-N459 WeakPolarHBondContact CG-OD1 3.27Å; Q448-N459 PolarHBondContact NE2-OD1 3.32Å
460	I	97.7	Very high	94.8	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	110.1	-179.1	-43.8	-56.2	0	0	0	110.2	V311 Y433 L447 I449 A458 L468	V311-I460 HydrophobicContact CG2-CD1 3.94Å; Y433-I460 HydrophobicContact CE2-CG2 4.24Å; L447-I460 HydrophobicContact CB-CB 4.26Å; L447-I460 HydrophobicContact CD2-CB 4.32Å; L447-I460 HydrophobicContact CD2-CG1 4.36Å; L447-I460 PolarHBondContact N-O 3.28Å; L447-I460 PolarHBondContact O-N 3.2Å; I449-I460 HydrophobicContact CD1-CG1 4.25Å; A458-I460 HydrophobicContact CB-CD1 4.35Å; I460-L468 HydrophobicContact CG1-CD1 4.19Å; I460-L468 HydrophobicContact CG1-CD2 4.41Å; I460-L468 HydrophobicContact CG2-CD1 4.46Å; I460-L468 HydrophobicContact CG2-CD2 4.24Å
461	E	97.8	Very high	94.8	Very high	61 Å²	61	33.4 Å²	33.4	29%	0.285	19%	0.189	S	C	.	.			trans	-69.8	137.1	171.9	-53	-169	177	0	0	110.3	V440 L446 L463 R466	V440-E461 HydrophobicContact CB-CG 4.48Å; V440-E461 HydrophobicContact CG1-CB 3.78Å; V440-E461 HydrophobicContact CG1-CG 3.73Å; V440-E461 HydrophobicContact CG2-CG 3.92Å; V440-E461 WeakPolarHBondContact CG2-OE1 3.43Å; L446-E461 HydrophobicContact CD1-CG 3.99Å; E461-L463 HydrophobicContact CB-CD2 4.01Å; E461-L463 HydrophobicContact CB-CG 3.93Å; E461-L463 PolarHBondContact O-N 2.88Å; E461-R466 WeakPolarHBondContact O-CD 3.01Å; E461-R466 PolarHBondContact O-NH1 2.84Å
462	P	97.6	Very high	95	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.			trans	-84.4	47.4	-171.1	37.8	-39.4	0	0	0	112.5	Y433 N435 W438	Y433-P462 HydrophobicContact CD1-CB 3.59Å; Y433-P462 HydrophobicContact CE1-CB 3.73Å; Y433-P462 HydrophobicContact CG-CB 4.04Å; N435-P462 VanDerWaalsContact CB-O 3.3Å; N435-P462 WeakPolarHBondContact CB-O 3.3Å; N435-P462 PolarHBondContact ND2-O 3.47Å; W438-P462 HydrophobicContact CD2-CG 4.39Å; W438-P462 HydrophobicContact CG-CG 4.15Å
463	L	98.3	Very high	95.3	Very high	47 Å²	47	30 Å²	30	25%	0.246	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-66.7	151.1	-171	-54.3	-176	0	0	0	113.3	Y433 W438 E461 R466	Y433-L463 CarbonylContact C-O 3.59Å; Y433-L463 WeakPolarHBondContact CB-O 3.32Å; W438-L463 HydrophobicContact CB-CD2 4.4Å; W438-L463 WeakPolarHBondContact O-CD2 3.5Å; E461-L463 HydrophobicContact CB-CD2 4.01Å; E461-L463 HydrophobicContact CB-CG 3.93Å; E461-L463 PolarHBondContact O-N 2.88Å; L463-R466 WeakPolarHBondContact O-CB 3.25Å; L463-R466 PolarHBondContact O-N 3Å
464	F	98.6	Very high	95.7	Very high	43 Å²	43	33.8 Å²	33.8	19%	0.189	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	138.6	173.8	173.6	-92	0	0	0	113	D322 L325 N435 K436 R466	D322-F464 WeakPolarHBondContact OD1-CZ 3.31Å; L325-F464 HydrophobicContact CB-CE2 4.46Å; L325-F464 HydrophobicContact CD2-CE2 4.35Å; N435-F464 PolarHBondContact O-N 2.93Å; N435-F464 VanDerWaalsContact O-N 3.11Å; K436-F464 HydrophobicContact CD-CD2 4.43Å; K436-F464 HydrophobicContact CG-CB 3.93Å; K436-F464 HydrophobicContact CG-CD1 4.38Å; K436-F464 HydrophobicContact CG-CD2 3.62Å; K436-F464 HydrophobicContact CG-CE2 4.21Å; K436-F464 HydrophobicContact CG-CG 3.73Å; F464-R466 PolarHBondContact O-N 3.35Å
465	D	98.2	Very high	96.2	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	25	-179.5	-161.2	26.4	0	0	0	115.1	N314 F315 L316 G317 Y432 Y433	N314-D465 VanDerWaalsContact CA-OD2 3.25Å; N314-D465 WeakPolarHBondContact CA-OD2 3.49Å; N314-D465 PolarHBondContact N-O 3.1Å; F315-D465 PolarHBondContact N-O 3.24Å; F315-D465 PolarHBondContact N-OD1 3.11Å; F315-D465 PolarHBondContact N-OD2 2.98Å; L316-D465 PolarHBondContact N-OD1 3.01Å; L316-D465 PolarHBondContact N-OD2 3.41Å; G317-D465 VanDerWaalsContact CA-OD2 3.3Å; G317-D465 WeakPolarHBondContact CA-OD2 3.39Å; G317-D465 PolarHBondContact N-OD2 3.27Å; Y432-D465 VanDerWaalsContact CE2-OD1 3.23Å; Y432-D465 WeakPolarHBondContact CE2-OD1 3.23Å; Y432-D465 PolarHBondContact OH-OD1 3.06Å; Y433-D465 PolarHBondContact O-N 3.07Å
466	R	98.6	Very high	96.7	Very high	5 Å²	5	27.1 Å²	27.1	2%	0.019	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	121	168.5	177.3	171.7	-78.1	179.5	-8.3	110.6	V311 D313 Y432 Y433 E461 L463 F464	V311-R466 HydrophobicContact CG1-CG 3.88Å; D313-R466 VanDerWaalsContact CG-NH2 3.34Å; D313-R466 WeakPolarHBondContact OD1-CB 3.19Å; D313-R466 IonicContact OD1-CZ 3.86Å; D313-R466 VanDerWaalsContact OD1-CZ 3.31Å; D313-R466 IonicContact OD1-NE 3.95Å; D313-R466 PolarHBondContact OD1-NE 2.9Å; D313-R466 IonicContact OD1-NH2 2.92Å; D313-R466 PolarHBondContact OD1-NH2 3.13Å; D313-R466 VanDerWaalsContact OD1-NH2 3.15Å; D313-R466 IonicContact OD2-CZ 2.83Å; D313-R466 IonicContact OD2-NE 3.01Å; D313-R466 IonicContact OD2-NH2 3.23Å; D313-R466 PolarHBondContact OD2-NH2 3.23Å; Y432-R466 WeakPolarHBondContact CA-O 3.28Å; Y433-R466 HydrophobicContact CD2-CB 4.23Å; Y433-R466 HydrophobicContact CD2-CG 4.1Å; Y433-R466 PolarHBondContact N-O 3.46Å; E461-R466 WeakPolarHBondContact O-CD 3.01Å; E461-R466 PolarHBondContact O-NH1 2.84Å; L463-R466 WeakPolarHBondContact O-CB 3.25Å; L463-R466 PolarHBondContact O-N 3Å; F464-R466 PolarHBondContact O-N 3.35Å
467	L	98.7	Very high	97.1	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.01	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.8	162.5	-179.7	64.4	0	0	0	109.8	V311 K312 F315 I378 Y432 I469	V311-L467 CarbonylContact C-O 3.46Å; V311-L467 WeakPolarHBondContact CA-O 3.14Å; K312-L467 PolarHBondContact N-O 2.88Å; K312-L467 PolarHBondContact O-N 2.92Å; F315-L467 HydrophobicContact CB-CB 3.85Å; F315-L467 HydrophobicContact CD1-CB 4.05Å; F315-L467 HydrophobicContact CD1-CD2 4Å; F315-L467 HydrophobicContact CD2-CB 4.22Å; F315-L467 HydrophobicContact CD2-CD2 3.7Å; F315-L467 HydrophobicContact CE1-CD2 3.91Å; F315-L467 HydrophobicContact CE2-CD2 3.6Å; F315-L467 HydrophobicContact CG-CB 3.76Å; F315-L467 HydrophobicContact CG-CD2 3.91Å; F315-L467 HydrophobicContact CG-CG 4.45Å; F315-L467 HydrophobicContact CZ-CD2 3.72Å; I378-L467 HydrophobicContact CD1-CD1 3.88Å; I378-L467 HydrophobicContact CG1-CD1 4.1Å; I378-L467 HydrophobicContact CG1-CD2 4.35Å; Y432-L467 HydrophobicContact CD2-CB 4.39Å; L467-I469 HydrophobicContact CD2-CD1 4.05Å; L467-I469 HydrophobicContact CD2-CG1 4.28Å; L467-I469 HydrophobicContact CG-CD1 4.39Å; L467-I469 HydrophobicContact CG-CG1 4.12Å
468	L	98.7	Very high	97.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.1	171.9	166.7	68.3	0	0	0	108.8	I309 C310 V311 C430 I431 Y433 L447 I449 I460 F470	I309-L468 HydrophobicContact CG2-CD1 3.71Å; C310-L468 WeakPolarHBondContact O-CA 3.38Å; V311-L468 HydrophobicContact CG2-CD1 4.08Å; C430-L468 CarbonylContact C-O 3.59Å; C430-L468 WeakPolarHBondContact CA-O 3.41Å; I431-L468 HydrophobicContact CB-CB 4.42Å; I431-L468 HydrophobicContact CB-CD2 4.49Å; I431-L468 HydrophobicContact CD1-CD2 4.32Å; I431-L468 PolarHBondContact N-O 3.12Å; I431-L468 PolarHBondContact O-N 3.47Å; Y433-L468 HydrophobicContact CE2-CB 4.16Å; Y433-L468 HydrophobicContact CE2-CD2 4.13Å; L447-L468 HydrophobicContact CD2-CD2 3.34Å; I449-L468 HydrophobicContact CD1-CD1 4.32Å; I449-L468 HydrophobicContact CD1-CD2 4.41Å; I460-L468 HydrophobicContact CG1-CD1 4.19Å; I460-L468 HydrophobicContact CG1-CD2 4.41Å; I460-L468 HydrophobicContact CG2-CD1 4.46Å; I460-L468 HydrophobicContact CG2-CD2 4.24Å; L468-F470 HydrophobicContact CD1-CD1 4.27Å; L468-F470 HydrophobicContact CD2-CD1 4.08Å; L468-F470 HydrophobicContact CD2-CE1 4.01Å; L468-F470 HydrophobicContact CG-CD1 3.95Å; L468-F470 HydrophobicContact CG-CE1 4.3Å
469	I	98.5	Very high	97.4	Very high	3 Å²	3	26 Å²	26	2%	0.015	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.3	176.1	-53.4	161.9	0	0	0	108.2	I300 M304 I309 C310 I382 L428 T429 L467	I300-I469 HydrophobicContact CB-CD1 4.46Å; I300-I469 HydrophobicContact CD1-CD1 3.65Å; I300-I469 HydrophobicContact CG1-CD1 3.75Å; I300-I469 HydrophobicContact CG2-CD1 3.93Å; M304-I469 HydrophobicContact CE-CG2 4.24Å; M304-I469 HydrophobicContact SD-CB 4.22Å; M304-I469 HydrophobicContact SD-CG2 3.86Å; I309-I469 CarbonylContact C-O 3.57Å; I309-I469 WeakPolarHBondContact CA-O 3.33Å; C310-I469 HydrophobicContact CB-CB 4.32Å; C310-I469 PolarHBondContact N-O 3.4Å; C310-I469 PolarHBondContact O-N 3.33Å; I382-I469 HydrophobicContact CD1-CD1 3.93Å; I382-I469 HydrophobicContact CD1-CG1 4.42Å; I382-I469 HydrophobicContact CD1-CG2 4.1Å; L428-I469 HydrophobicContact CD2-CG2 4.46Å; T429-I469 WeakPolarHBondContact O-CA 3.5Å; L467-I469 HydrophobicContact CD2-CD1 4.05Å; L467-I469 HydrophobicContact CD2-CG1 4.28Å; L467-I469 HydrophobicContact CG-CD1 4.39Å; L467-I469 HydrophobicContact CG-CG1 4.12Å
470	F	98	Very high	97.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	160.6	173.5	61.7	-87.7	0	0	0	112.3	I309 T429 I431 I449 L468 S472 N476 H478	I309-F470 HydrophobicContact CB-CB 4.42Å; I309-F470 HydrophobicContact CG1-CB 3.98Å; I309-F470 HydrophobicContact CG2-CB 4.47Å; T429-F470 HydrophobicContact CG2-CE1 3.76Å; T429-F470 HydrophobicContact CG2-CE2 4.17Å; T429-F470 HydrophobicContact CG2-CZ 3.53Å; T429-F470 PolarHBondContact N-O 3.09Å; T429-F470 PolarHBondContact O-N 3.43Å; I431-F470 HydrophobicContact CD1-CE1 3.88Å; I431-F470 HydrophobicContact CD1-CZ 4.34Å; I431-F470 HydrophobicContact CG1-CE1 4.29Å; I449-F470 HydrophobicContact CD1-CD1 4.12Å; I449-F470 HydrophobicContact CD1-CE1 4.48Å; I449-F470 HydrophobicContact CD1-CG 4.3Å; L468-F470 HydrophobicContact CD1-CD1 4.27Å; L468-F470 HydrophobicContact CD2-CD1 4.08Å; L468-F470 HydrophobicContact CD2-CE1 4.01Å; L468-F470 HydrophobicContact CG-CD1 3.95Å; L468-F470 HydrophobicContact CG-CE1 4.3Å; F470-S472 PolarHBondContact O-N 3.03Å; F470-N476 HydrophobicContact CD2-CB 3.77Å; F470-N476 HydrophobicContact CE2-CB 4.42Å; F470-H478 AromaticContact CE2-CE1 3.49Å; F470-H478 VanDerWaalsContact CE2-CE1 3.49Å; F470-H478 WeakPolarHBondContact CE2-CE1 3.46Å; F470-H478 AromaticContact CE2-ND1 3.58Å; F470-H478 AromaticContact CZ-CE1 3.6Å; F470-H478 AromaticContact CZ-ND1 3.89Å; F470-H478 AromaticContact CZ-NE2 3.84Å
471	W	97.5	Very high	97.3	Very high	18 Å²	18	27.4 Å²	27.4	7%	0.068	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	126	174.3	-60.9	110.6	0	0	0	110.8	M304 G308 L391 C427 L428 D473 R475 N476	M304-W471 HydrophobicContact CE-CD2 3.84Å; M304-W471 HydrophobicContact CE-CG 3.99Å; M304-W471 HydrophobicContact CE-CZ2 4.09Å; M304-W471 PolarHBondContact O-NE1 3.45Å; G308-W471 VanDerWaalsContact O-CD1 3.28Å; G308-W471 PolarHBondContact O-N 3.36Å; L391-W471 HydrophobicContact CB-CH2 4.12Å; L391-W471 WeakPolarHBondContact O-CH2 3.36Å; C427-W471 WeakPolarHBondContact O-CA 3.3Å; L428-W471 HydrophobicContact CD2-CD2 3.96Å; L428-W471 HydrophobicContact CD2-CE3 3.45Å; L428-W471 VanDerWaalsContact CD2-CE3 3.45Å; L428-W471 HydrophobicContact CD2-CH2 4.11Å; L428-W471 HydrophobicContact CD2-CZ3 3.53Å; L428-W471 HydrophobicContact CG-CE3 4.32Å; L428-W471 HydrophobicContact CG-CZ3 4.16Å; W471-D473 VanDerWaalsContact C-N 3.29Å; W471-D473 PolarHBondContact O-N 2.89Å; W471-R475 HydrophobicContact CB-CB 4.46Å; W471-R475 VanDerWaalsContact CD2-CZ 3.48Å; W471-R475 VanDerWaalsContact CE2-NH1 3.32Å; W471-R475 VanDerWaalsContact CE3-NH2 3.28Å; W471-R475 VanDerWaalsContact CG-NH1 3.34Å; W471-N476 PolarHBondContact N-ND2 2.63Å; W471-N476 VanDerWaalsContact N-ND2 3.19Å; W471-N476 WeakPolarHBondContact O-CB 3.19Å; W471-N476 PolarHBondContact O-ND2 3.32Å
472	S	97.3	Very high	97.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.119	C	C	.	.			trans	-70.4	-18.7	-173.8	-60.3	0	0	0	0	114.9	D419 N420 R426 C427 L428 T429 F470	D419-S472 WeakPolarHBondContact CA-O 3.21Å; D419-S472 WeakPolarHBondContact CB-O 3.4Å; D419-S472 PolarHBondContact N-O 2.96Å; N420-S472 PolarHBondContact N-O 3.09Å; R426-S472 WeakPolarHBondContact O-CB 3.32Å; C427-S472 PolarHBondContact O-N 3.06Å; L428-S472 WeakPolarHBondContact CA-OG 3.1Å; L428-S472 PolarHBondContact N-OG 2.92Å; T429-S472 PolarHBondContact N-OG 2.8Å; T429-S472 PolarHBondContact OG1-OG 3.28Å; F470-S472 PolarHBondContact O-N 3.03Å
473	D	95.4	Very high	96.6	Very high	35 Å²	35	26.5 Å²	26.5	19%	0.187	12%	0.119	C	C	.	.	S	Bend	trans	-83.1	-170.5	-173.8	69	42.2	0	0	0	114	W471 R475 N476	W471-D473 VanDerWaalsContact C-N 3.29Å; W471-D473 PolarHBondContact O-N 2.89Å; D473-R475 PolarHBondContact O-N 3.1Å; D473-R475 VanDerWaalsContact OD1-CB 3.22Å; D473-R475 WeakPolarHBondContact OD1-CB 3.22Å; D473-R475 WeakPolarHBondContact OD1-CG 3.47Å; D473-R475 IonicContact OD1-CZ 2.67Å; D473-R475 PolarHBondContact OD1-N 2.87Å; D473-R475 IonicContact OD1-NE 3.7Å; D473-R475 PolarHBondContact OD1-NE 3.37Å; D473-R475 IonicContact OD1-NH2 2.93Å; D473-R475 IonicContact OD2-CZ 3.51Å; D473-R475 VanDerWaalsContact OD2-CZ 3.23Å; D473-R475 IonicContact OD2-NE 3.59Å; D473-R475 PolarHBondContact OD2-NE 3.02Å; D473-R475 IonicContact OD2-NH2 3.8Å; D473-R475 PolarHBondContact OD2-NH2 2.88Å; D473-N476 PolarHBondContact O-N 2.95Å
474	R	95.1	Very high	95.9	Very high	164 Å²	164	32 Å²	32	62%	0.619	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-19.3	179	63.3	176.9	-76.7	165.3	-5.1	115.7	E452 N476 P477	E452-R474 IonicContact OE1-CZ 2.96Å; E452-R474 IonicContact OE1-NE 3.09Å; E452-R474 IonicContact OE1-NH2 2.88Å; E452-R474 PolarHBondContact OE1-NH2 3.33Å; E452-R474 IonicContact OE2-CZ 2.65Å; E452-R474 IonicContact OE2-NE 2.75Å; E452-R474 PolarHBondContact OE2-NE 3.17Å; E452-R474 IonicContact OE2-NH2 3.51Å; R474-N476 PolarHBondContact O-N 3.34Å; R474-P477 WeakPolarHBondContact O-CD 3.33Å
475	R	94.8	Very high	94.9	Very high	93 Å²	93	30.7 Å²	30.7	35%	0.351	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.1	174.6	-71.6	175.6	-76.5	172.9	-4.5	113.1	P451 E452 W471 D473	P451-R475 CarbonylContact C-O 3.55Å; P451-R475 WeakPolarHBondContact CA-O 3.46Å; E452-R475 PolarHBondContact N-O 3.1Å; W471-R475 HydrophobicContact CB-CB 4.46Å; W471-R475 VanDerWaalsContact CD2-CZ 3.48Å; W471-R475 VanDerWaalsContact CE2-NH1 3.32Å; W471-R475 VanDerWaalsContact CE3-NH2 3.28Å; W471-R475 VanDerWaalsContact CG-NH1 3.34Å; D473-R475 PolarHBondContact O-N 3.1Å; D473-R475 VanDerWaalsContact OD1-CB 3.22Å; D473-R475 WeakPolarHBondContact OD1-CB 3.22Å; D473-R475 WeakPolarHBondContact OD1-CG 3.47Å; D473-R475 IonicContact OD1-CZ 2.67Å; D473-R475 PolarHBondContact OD1-N 2.87Å; D473-R475 IonicContact OD1-NE 3.7Å; D473-R475 PolarHBondContact OD1-NE 3.37Å; D473-R475 IonicContact OD1-NH2 2.93Å; D473-R475 IonicContact OD2-CZ 3.51Å; D473-R475 VanDerWaalsContact OD2-CZ 3.23Å; D473-R475 IonicContact OD2-NE 3.59Å; D473-R475 PolarHBondContact OD2-NE 3.02Å; D473-R475 IonicContact OD2-NH2 3.8Å; D473-R475 PolarHBondContact OD2-NH2 2.88Å
476	N	96.5	Very high	94	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.011	17%	0.173	C	C	.	.			trans	-133	69.8	-176.9	-66.6	-57.3	0	0	0	113.8	G308 I449 F470 W471 D473 R474 H478	G308-N476 PolarHBondContact O-ND2 2.86Å; G308-N476 VanDerWaalsContact O-ND2 3.15Å; I449-N476 HydrophobicContact CG2-CB 3.69Å; F470-N476 HydrophobicContact CD2-CB 3.77Å; F470-N476 HydrophobicContact CE2-CB 4.42Å; W471-N476 PolarHBondContact N-ND2 2.63Å; W471-N476 VanDerWaalsContact N-ND2 3.19Å; W471-N476 WeakPolarHBondContact O-CB 3.19Å; W471-N476 PolarHBondContact O-ND2 3.32Å; D473-N476 PolarHBondContact O-N 2.95Å; R474-N476 PolarHBondContact O-N 3.34Å; N476-H478 PolarHBondContact O-N 2.89Å; N476-H478 PolarHBondContact O-ND1 2.89Å
477	P	97.2	Very high	93.3	Very high	21 Å²	21	43.1 Å²	43.1	14%	0.136	20%	0.196	C	C	.	.			trans	-62.4	131.9	164.7	-13	29.3	0	0	0	109.7	H417 V418 Y450 R474	H417-P477 CarbonylContact O-C 3.55Å; H417-P477 VanDerWaalsContact O-CA 3.3Å; H417-P477 WeakPolarHBondContact O-CA 3.2Å; V418-P477 HydrophobicContact CG2-CB 3.91Å; V418-P477 HydrophobicContact CG2-CG 3.9Å; Y450-P477 WeakPolarHBondContact CB-O 3.33Å; Y450-P477 PolarHBondContact N-O 3.21Å; Y450-P477 WeakPolarHBondContact O-CD 3.44Å; R474-P477 WeakPolarHBondContact O-CD 3.33Å
478	H	97.6	Very high	93	Very high	7 Å²	7	44.9 Å²	44.9	3%	0.032	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	154.6	-171.1	62	-88.7	0	0	0	113.6	R416 H417 D419 Q448 I449 F470 N476	R416-H478 CarbonylContact C-O 3.55Å; R416-H478 VanDerWaalsContact CA-O 3.3Å; R416-H478 WeakPolarHBondContact CA-O 3.37Å; H417-H478 AromaticContact CE1-CD2 3.82Å; H417-H478 AromaticContact CE1-NE2 3.59Å; H417-H478 PolarHBondContact N-O 2.92Å; H417-H478 PolarHBondContact ND1-O 3.43Å; H417-H478 AromaticContact NE2-CE1 3.97Å; H417-H478 AromaticContact NE2-NE2 3.37Å; H417-H478 PolarHBondContact NE2-NE2 3.46Å; H417-H478 PolarHBondContact O-N 3.26Å; D419-H478 IonicContact OD2-CE1 3.31Å; Q448-H478 CarbonylContact O-C 3.49Å; Q448-H478 WeakPolarHBondContact O-CA 3.22Å; Q448-H478 WeakPolarHBondContact O-CB 3.5Å; I449-H478 HydrophobicContact CB-CB 4.18Å; I449-H478 HydrophobicContact CG1-CB 3.85Å; I449-H478 HydrophobicContact CG2-CB 4.24Å; F470-H478 AromaticContact CE2-CE1 3.49Å; F470-H478 VanDerWaalsContact CE2-CE1 3.49Å; F470-H478 WeakPolarHBondContact CE2-CE1 3.46Å; F470-H478 AromaticContact CE2-ND1 3.58Å; F470-H478 AromaticContact CZ-CE1 3.6Å; F470-H478 AromaticContact CZ-ND1 3.89Å; F470-H478 AromaticContact CZ-NE2 3.84Å; N476-H478 PolarHBondContact O-N 2.89Å; N476-H478 PolarHBondContact O-ND1 2.89Å
479	E	96.9	Very high	92.9	Very high	17 Å²	17	45.1 Å²	45.1	8%	0.079	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.7	176.9	67.8	-177.1	113.1	0	0	112	T54 Y414 R416 L447 Q448 Y450 K481	T54-E479 VanDerWaalsContact CB-OE1 3.25Å; T54-E479 WeakPolarHBondContact CB-OE1 3.5Å; T54-E479 VanDerWaalsContact CG2-OE1 3.31Å; T54-E479 WeakPolarHBondContact CG2-OE1 3.4Å; T54-E479 PolarHBondContact OG1-OE1 3.15Å; Y414-E479 CarbonylContact O-C 3.1Å; Y414-E479 WeakPolarHBondContact O-CA 3.46Å; Y414-E479 WeakPolarHBondContact O-CB 3.46Å; R416-E479 HydrophobicContact CB-CB 3.86Å; R416-E479 HydrophobicContact CG-CB 4.48Å; L447-E479 CarbonylContact C-O 3.53Å; L447-E479 WeakPolarHBondContact CA-O 3.46Å; L447-E479 WeakPolarHBondContact CD1-O 3.46Å; Q448-E479 HydrophobicContact CB-CG 4.1Å; Q448-E479 PolarHBondContact N-O 2.74Å; Q448-E479 PolarHBondContact O-N 2.97Å; Y450-E479 HydrophobicContact CE2-CG 4.3Å; Y450-E479 PolarHBondContact OH-OE1 2.88Å; Y450-E479 VanDerWaalsContact OH-OE1 3.05Å; E479-K481 HydrophobicContact CG-CD 4.39Å; E479-K481 IonicContact OE1-NZ 3.61Å; E479-K481 PolarHBondContact OE1-NZ 3.17Å; E479-K481 WeakPolarHBondContact OE2-CD 3.24Å; E479-K481 WeakPolarHBondContact OE2-CE 3.5Å; E479-K481 IonicContact OE2-NZ 2.66Å; E479-K481 PolarHBondContact OE2-NZ 2.78Å
480	V	97.1	Very high	92.8	Very high	10 Å²	10	45.9 Å²	45.9	6%	0.061	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	112.5	165.6	179.1	0	0	0	0	107.6	Y407 G413 Y414 L447	Y407-V480 HydrophobicContact CD1-CG1 4.24Å; Y407-V480 HydrophobicContact CE1-CB 4.18Å; Y407-V480 HydrophobicContact CE1-CG1 3.82Å; G413-V480 CarbonylContact C-O 3.54Å; G413-V480 VanDerWaalsContact CA-O 3.28Å; G413-V480 WeakPolarHBondContact CA-O 3.36Å; Y414-V480 PolarHBondContact N-O 2.73Å; Y414-V480 PolarHBondContact O-N 3.24Å; L447-V480 HydrophobicContact CD1-CG2 3.7Å
481	K	95.6	Very high	92.8	Very high	46 Å²	46	46 Å²	46	20%	0.2	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	149.9	174.3	-65.4	-60.4	-179.2	-166.6	0	110.8	G445 L446 Q448 E479 S483	G445-K481 WeakPolarHBondContact CA-O 3.37Å; L446-K481 HydrophobicContact CB-CB 4.38Å; L446-K481 HydrophobicContact CB-CG 4.36Å; L446-K481 WeakPolarHBondContact O-CB 3.37Å; L446-K481 PolarHBondContact O-N 3.5Å; Q448-K481 VanDerWaalsContact CD-CE 3.47Å; E479-K481 HydrophobicContact CG-CD 4.39Å; E479-K481 IonicContact OE1-NZ 3.61Å; E479-K481 PolarHBondContact OE1-NZ 3.17Å; E479-K481 WeakPolarHBondContact OE2-CD 3.24Å; E479-K481 WeakPolarHBondContact OE2-CE 3.5Å; E479-K481 IonicContact OE2-NZ 2.66Å; E479-K481 PolarHBondContact OE2-NZ 2.78Å; K481-S483 PolarHBondContact O-N 2.89Å
482	P	92.9	Very high	92.9	Very high	42 Å²	42	45.2 Å²	45.2	27%	0.273	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-43.1	133.9	173.5	-34.4	39.1	0	0	0	114	G411 G445 Y484	G411-P482 WeakPolarHBondContact O-CB 3.33Å; G445-P482 PolarHBondContact N-O 2.8Å; P482-Y484 HydrophobicContact CB-CD2 4.38Å; P482-Y484 HydrophobicContact CB-CE1 3.87Å; P482-Y484 HydrophobicContact CB-CE2 3.7Å; P482-Y484 VanDerWaalsContact CB-CZ 3.41Å; P482-Y484 WeakPolarHBondContact CB-OH 3.48Å
483	S	87.9	Confident	93	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	117	167.8	-171.4	0	0	0	0	108.8	G409 N410 G411 A412 W438 K481	G409-S483 CarbonylContact C-O 3.53Å; G409-S483 WeakPolarHBondContact CA-O 3.48Å; N410-S483 PolarHBondContact N-O 2.88Å; G411-S483 WeakPolarHBondContact CA-O 3.36Å; G411-S483 PolarHBondContact N-O 2.65Å; A412-S483 PolarHBondContact O-N 3.12Å; W438-S483 WeakPolarHBondContact CH2-OG 3.11Å; K481-S483 PolarHBondContact O-N 2.89Å
484	Y	83.1	Confident	93.1	Very high	163 Å²	163	44.1 Å²	44.1	64%	0.639	20%	0.203	S	C	*	.			trans	-101.7	-9.8	-174.5	-64.5	-68.4	0	0	0	113.9	H443 P482	H443-Y484 PolarHBondContact O-N 2.79Å; P482-Y484 HydrophobicContact CB-CD2 4.38Å; P482-Y484 HydrophobicContact CB-CE1 3.87Å; P482-Y484 HydrophobicContact CB-CE2 3.7Å; P482-Y484 VanDerWaalsContact CB-CZ 3.41Å; P482-Y484 WeakPolarHBondContact CB-OH 3.48Å
485	T	76.9	Confident	93.3	Very high	16 Å²	16	37.3 Å²	37.3	10%	0.098	18%	0.177	C	C	.	.	S	Bend	trans	-72.4	159.1	178.4	180	0	0	0	0	113.1	G409 W438 H443 R487	G409-T485 WeakPolarHBondContact CA-O 3.36Å; W438-T485 HydrophobicContact CH2-CG2 3.3Å; W438-T485 HydrophobicContact CZ2-CG2 4.02Å; W438-T485 HydrophobicContact CZ3-CG2 3.87Å; H443-T485 HydrophobicContact CB-CG2 3.7Å; H443-T485 PolarHBondContact CD2-OG1 3.25Å; T485-R487 HydrophobicContact CG2-CB 4.05Å; T485-R487 VanDerWaalsContact CG2-O 3.24Å; T485-R487 WeakPolarHBondContact CG2-O 3.32Å; T485-R487 PolarHBondContact OG1-N 2.66Å
486	T	78.9	Confident	93.4	Very high	137 Å²	137	33 Å²	33	84%	0.84	16%	0.161	S	C	*	.	S	Bend	trans	-75.6	-8.8	165.6	53.2	0	0	0	0	113.3
487	R	85.1	Confident	93.5	Very high	129 Å²	129	34.1 Å²	34.1	49%	0.487	17%	0.166	S	C	.	.	S	Bend	trans	-82.6	130.8	174.8	-65	-178.7	177.7	171.1	1.5	111.1	W438 T485 R489	W438-R487 HydrophobicContact CZ3-CB 4.22Å; T485-R487 HydrophobicContact CG2-CB 4.05Å; T485-R487 VanDerWaalsContact CG2-O 3.24Å; T485-R487 WeakPolarHBondContact CG2-O 3.32Å; T485-R487 PolarHBondContact OG1-N 2.66Å; R487-R489 PolarHBondContact O-N 2.9Å
488	T	91.3	Very high	93.4	Very high	40 Å²	40	33.9 Å²	33.9	25%	0.245	16%	0.164	C	C	.	.			trans	-62.6	131.6	171.2	-50.8	0	0	0	0	111.1	C406 Y490	C406-T488 HydrophobicContact CB-CG2 4.29Å; C406-T488 WeakPolarHBondContact SG-CG2 3.43Å; T488-Y490 HydrophobicContact CG2-CD1 3.78Å; T488-Y490 HydrophobicContact CG2-CD2 4.5Å; T488-Y490 HydrophobicContact CG2-CE1 3.36Å; T488-Y490 HydrophobicContact CG2-CE2 4.16Å; T488-Y490 HydrophobicContact CG2-CG 4.33Å
489	R	96.3	Very high	93.3	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.015	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	115.4	167.9	169.9	-172.1	-177.9	-81.7	12.2	109.7	Y407 N435 W438 G445 R487	Y407-R489 PolarHBondContact N-O 3.28Å; Y407-R489 PolarHBondContact O-N 2.85Å; N435-R489 VanDerWaalsContact OD1-CA 3.32Å; N435-R489 WeakPolarHBondContact OD1-CA 3.39Å; W438-R489 HydrophobicContact CH2-CB 3.57Å; W438-R489 HydrophobicContact CH2-CG 4.37Å; W438-R489 HydrophobicContact CZ2-CB 4.1Å; W438-R489 HydrophobicContact CZ2-CG 4.47Å; W438-R489 HydrophobicContact CZ3-CB 3.96Å; G445-R489 VanDerWaalsContact O-CZ 3.31Å; G445-R489 PolarHBondContact O-NE 2.88Å; G445-R489 PolarHBondContact O-NH2 3.22Å; R487-R489 PolarHBondContact O-N 2.9Å
490	Y	97.8	Very high	93.2	Very high	19 Å²	19	40.6 Å²	40.6	8%	0.075	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	147.4	176.9	-61.3	-63	0	0	0	112.3	L325 V328 E329 N332 A405 C406 N435 T488	L325-Y490 HydrophobicContact CD1-CD2 4.1Å; L325-Y490 HydrophobicContact CD1-CE2 4.46Å; V328-Y490 HydrophobicContact CG1-CD1 3.49Å; V328-Y490 VanDerWaalsContact CG1-CD1 3.49Å; V328-Y490 HydrophobicContact CG1-CD2 4.32Å; V328-Y490 HydrophobicContact CG1-CE1 3.92Å; V328-Y490 HydrophobicContact CG1-CG 3.71Å; E329-Y490 HydrophobicContact CG-CE2 3.78Å; N332-Y490 HydrophobicContact CB-CE1 4.12Å; N332-Y490 PolarHBondContact ND2-OH 3.44Å; A405-Y490 WeakPolarHBondContact O-CA 3.36Å; C406-Y490 HydrophobicContact CB-CD1 4.3Å; C406-Y490 HydrophobicContact CB-CE1 4.27Å; N435-Y490 PolarHBondContact ND2-O 2.93Å; N435-Y490 PolarHBondContact OD1-N 3.13Å; N435-Y490 PolarHBondContact OD1-O 3.39Å; T488-Y490 HydrophobicContact CG2-CD1 3.78Å; T488-Y490 HydrophobicContact CG2-CD2 4.5Å; T488-Y490 HydrophobicContact CG2-CE1 3.36Å; T488-Y490 HydrophobicContact CG2-CE2 4.16Å; T488-Y490 HydrophobicContact CG2-CG 4.33Å
491	A	98.4	Very high	93.1	Very high	3 Å²	3	42.8 Å²	42.8	3%	0.025	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	155.5	167.7	0	0	0	0	0	110	A405 I431 Y432 Y433	A405-A491 PolarHBondContact N-O 3.49Å; A405-A491 PolarHBondContact O-N 3.35Å; A405-A491 VanDerWaalsContact O-N 3.12Å; I431-A491 HydrophobicContact CG2-CB 3.93Å; Y432-A491 CarbonylContact O-C 3.59Å; Y432-A491 WeakPolarHBondContact O-CA 3.22Å; Y433-A491 HydrophobicContact CD1-CB 3.83Å; Y433-A491 HydrophobicContact CE1-CB 3.95Å
492	I	98.7	Very high	93.1	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	119.9	170.1	-62.3	174	0	0	0	108.2	V324 V328 I371 L374 A402 V404 I431 Y432 L434	V324-I492 HydrophobicContact CG1-CD1 3.44Å; V324-I492 VanDerWaalsContact CG1-CD1 3.44Å; V328-I492 HydrophobicContact CG2-CD1 3.87Å; V328-I492 HydrophobicContact CG2-CG1 4.26Å; I371-I492 HydrophobicContact CG1-CD1 4.12Å; L374-I492 HydrophobicContact CD2-CB 4.38Å; L374-I492 HydrophobicContact CD2-CD1 3.64Å; L374-I492 HydrophobicContact CD2-CG2 4.39Å; A402-I492 HydrophobicContact CB-CG2 3.77Å; V404-I492 HydrophobicContact CG1-CG1 4.24Å; V404-I492 HydrophobicContact CG2-CG1 4.29Å; I431-I492 CarbonylContact C-O 3.51Å; I431-I492 WeakPolarHBondContact CA-O 3.23Å; Y432-I492 PolarHBondContact N-O 3.37Å; Y432-I492 PolarHBondContact O-N 3.09Å; L434-I492 HydrophobicContact CD1-CD1 4.07Å; L434-I492 HydrophobicContact CD1-CG1 4.11Å
493	T	98.7	Very high	93.2	Very high	10 Å²	10	45.1 Å²	45.1	6%	0.061	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	136.5	178.3	-53.2	0	0	0	0	111.5	M403 T429 C430 I431 W495	M403-T493 PolarHBondContact N-O 2.85Å; M403-T493 PolarHBondContact O-N 3.33Å; T429-T493 HydrophobicContact CG2-CG2 3.9Å; C430-T493 CarbonylContact O-C 3.55Å; C430-T493 WeakPolarHBondContact O-CA 3.49Å; I431-T493 HydrophobicContact CG1-CG2 4.12Å; T493-W495 HydrophobicContact CG2-CD2 3.94Å; T493-W495 HydrophobicContact CG2-CE3 4.04Å; T493-W495 HydrophobicContact CG2-CH2 3.6Å; T493-W495 HydrophobicContact CG2-CZ2 3.47Å; T493-W495 VanDerWaalsContact CG2-CZ2 3.47Å; T493-W495 HydrophobicContact CG2-CZ3 3.87Å
494	V	98.4	Very high	93.5	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	136	172.4	171.5	0	0	0	0	108.3	R399 A402 C430 Y496	R399-V494 HydrophobicContact CB-CG1 4.04Å; R399-V494 HydrophobicContact CG-CG1 4.33Å; A402-V494 HydrophobicContact CB-CG2 4.25Å; C430-V494 PolarHBondContact N-O 3.22Å; C430-V494 PolarHBondContact O-N 3.01Å; V494-Y496 HydrophobicContact CG1-CD2 4.37Å; V494-Y496 HydrophobicContact CG1-CE2 3.78Å
495	W	98.5	Very high	94	Very high	21 Å²	21	43.4 Å²	43.4	8%	0.08	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.6	173.3	-62.8	-90.8	0	0	0	111.1	W360 R399 T400 M403 D419 R426 L428 T429 T493	W360-W495 HydrophobicContact CH2-CE3 4.29Å; W360-W495 AromaticContact CH2-CZ3 3.64Å; W360-W495 HydrophobicContact CH2-CZ3 3.64Å; W360-W495 HydrophobicContact CZ3-CZ3 4.1Å; R399-W495 CarbonylContact C-O 3.49Å; R399-W495 WeakPolarHBondContact CA-O 2.96Å; R399-W495 VanDerWaalsContact CB-O 3.23Å; R399-W495 WeakPolarHBondContact CB-O 3.48Å; T400-W495 HydrophobicContact CG2-CB 3.99Å; T400-W495 HydrophobicContact CG2-CE3 4.05Å; T400-W495 PolarHBondContact N-O 2.88Å; T400-W495 PolarHBondContact OG1-N 3.23Å; M403-W495 HydrophobicContact CB-CH2 4.33Å; M403-W495 HydrophobicContact CB-CZ3 3.9Å; M403-W495 HydrophobicContact CE-CH2 3.72Å; M403-W495 HydrophobicContact CE-CZ3 4.46Å; M403-W495 HydrophobicContact SD-CH2 3.76Å; M403-W495 HydrophobicContact SD-CZ3 4.18Å; D419-W495 PolarHBondContact OD1-NE1 3.38Å; D419-W495 PolarHBondContact OD2-NE1 2.9Å; R426-W495 HydrophobicContact CB-CB 4.33Å; R426-W495 VanDerWaalsContact CD-CG 3.49Å; R426-W495 HydrophobicContact CG-CB 3.77Å; R426-W495 HydrophobicContact CG-CG 4.23Å; L428-W495 VanDerWaalsContact O-CA 3.32Å; L428-W495 WeakPolarHBondContact O-CA 3.49Å; T429-W495 PolarHBondContact OG1-NE1 2.82Å; T493-W495 HydrophobicContact CG2-CD2 3.94Å; T493-W495 HydrophobicContact CG2-CE3 4.04Å; T493-W495 HydrophobicContact CG2-CH2 3.6Å; T493-W495 HydrophobicContact CG2-CZ2 3.47Å; T493-W495 VanDerWaalsContact CG2-CZ2 3.47Å; T493-W495 HydrophobicContact CG2-CZ3 3.87Å
496	Y	98.1	Very high	94.7	Very high	3 Å²	3	47.5 Å²	47.5	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	147.3	172.6	-67.8	-91.4	0	0	0	110.7	I378 D379 I382 I396 R399 R426 C427 L428 C430 V494	I378-Y496 HydrophobicContact CG2-CE2 3.93Å; I378-Y496 WeakPolarHBondContact CG2-OH 3.36Å; D379-Y496 PolarHBondContact N-OH 2.73Å; D379-Y496 WeakPolarHBondContact OD1-CE1 3.39Å; D379-Y496 VanDerWaalsContact OD1-CZ 3.31Å; D379-Y496 PolarHBondContact OD1-OH 3.05Å; I382-Y496 HydrophobicContact CB-CE1 4.33Å; I382-Y496 HydrophobicContact CB-CE2 4.3Å; I382-Y496 HydrophobicContact CG1-CD2 4.39Å; I382-Y496 HydrophobicContact CG1-CE2 3.89Å; I382-Y496 HydrophobicContact CG2-CD1 3.89Å; I382-Y496 HydrophobicContact CG2-CD2 4.06Å; I382-Y496 HydrophobicContact CG2-CE1 3.99Å; I382-Y496 HydrophobicContact CG2-CE2 4.16Å; I382-Y496 HydrophobicContact CG2-CG 3.95Å; I396-Y496 HydrophobicContact CG2-CD1 3.68Å; I396-Y496 HydrophobicContact CG2-CG 4.28Å; R399-Y496 HydrophobicContact CB-CD1 3.69Å; R399-Y496 HydrophobicContact CB-CE1 3.79Å; R399-Y496 HydrophobicContact CB-CG 4.15Å; R399-Y496 HydrophobicContact CG-CD1 4.38Å; R399-Y496 HydrophobicContact CG-CE1 4.02Å; R426-Y496 WeakPolarHBondContact CA-O 3.35Å; C427-Y496 PolarHBondContact N-O 2.96Å; C427-Y496 PolarHBondContact SG-O 3.12Å; C427-Y496 VanDerWaalsContact SG-O 3.41Å; L428-Y496 PolarHBondContact O-N 3.45Å; C430-Y496 HydrophobicContact CB-CE2 4.36Å; V494-Y496 HydrophobicContact CG1-CD2 4.37Å; V494-Y496 HydrophobicContact CG1-CE2 3.78Å
497	F	97.2	Very high	95.4	Very high	25 Å²	25	44.8 Å²	44.8	11%	0.11	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	136.6	-179.2	-62.8	-63.3	0	0	0	111.6	I396 G398 R399 T400 G425 R426 R502	I396-F497 WeakPolarHBondContact CA-O 3.34Å; G398-F497 PolarHBondContact O-N 3.04Å; R399-F497 VanDerWaalsContact C-CE2 3.49Å; T400-F497 HydrophobicContact CG2-CE2 4.21Å; T400-F497 HydrophobicContact CG2-CZ 3.74Å; G425-F497 CarbonylContact O-C 3.59Å; G425-F497 WeakPolarHBondContact O-CA 3.49Å; R426-F497 HydrophobicContact CG-CD1 3.88Å; R426-F497 HydrophobicContact CG-CE1 3.55Å; F497-R502 HydrophobicContact CB-CB 4.05Å; F497-R502 HydrophobicContact CB-CG 3.98Å; F497-R502 HydrophobicContact CD1-CB 4.49Å; F497-R502 HydrophobicContact CD1-CG 3.94Å; F497-R502 VanDerWaalsContact CE1-CZ 3.45Å; F497-R502 VanDerWaalsContact CE1-NE 3.29Å; F497-R502 HydrophobicContact CG-CB 4.46Å; F497-R502 HydrophobicContact CG-CG 3.92Å
498	D	96.2	Very high	95.6	Very high	17 Å²	17	45.2 Å²	45.2	9%	0.091	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	131.4	159.7	176.9	-93	0	0	0	110	C394 V395 G425 C427 K500 E501 R502	C394-D498 WeakPolarHBondContact CA-OD2 3.32Å; V395-D498 PolarHBondContact N-OD2 3.08Å; G425-D498 PolarHBondContact O-N 3Å; C427-D498 HydrophobicContact CB-CB 4.08Å; C427-D498 PolarHBondContact SG-N 2.79Å; D498-K500 VanDerWaalsContact C-N 3.33Å; D498-K500 PolarHBondContact O-N 3.32Å; D498-K500 WeakPolarHBondContact OD1-CA 3.4Å; D498-K500 WeakPolarHBondContact OD1-CB 3.19Å; D498-K500 PolarHBondContact OD1-N 3.18Å; D498-E501 HydrophobicContact CB-CB 4.24Å; D498-E501 PolarHBondContact OD1-N 2.95Å; D498-R502 WeakPolarHBondContact O-CB 3.4Å; D498-R502 PolarHBondContact O-N 2.97Å
499	A	94.8	Very high	95.3	Very high	26 Å²	26	50.6 Å²	50.6	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-59.7	-39.2	-174.6	0	0	0	0	0	113.5	V395 N397 S503	V395-A499 HydrophobicContact CB-CB 4.16Å; V395-A499 HydrophobicContact CG1-CB 4.05Å; V395-A499 WeakPolarHBondContact O-CB 3.31Å; V395-A499 PolarHBondContact O-N 2.98Å; N397-A499 HydrophobicContact CB-CB 4.02Å; N397-A499 WeakPolarHBondContact ND2-CB 3.21Å; A499-S503 WeakPolarHBondContact O-CB 3.46Å; A499-S503 PolarHBondContact O-N 3.07Å
500	K	95	Very high	94.9	Very high	139 Å²	139	56.2 Å²	56.2	60%	0.604	26%	0.26	S	S	*	.	H	α-helix	trans	-76.6	-57	-177.6	179	-171.2	166.1	-175.2	0	110	D498 R502 S503 E504	D498-K500 VanDerWaalsContact C-N 3.33Å; D498-K500 PolarHBondContact O-N 3.32Å; D498-K500 WeakPolarHBondContact OD1-CA 3.4Å; D498-K500 WeakPolarHBondContact OD1-CB 3.19Å; D498-K500 PolarHBondContact OD1-N 3.18Å; K500-R502 PolarHBondContact O-N 3.06Å; K500-S503 WeakPolarHBondContact O-CA 3.46Å; K500-S503 WeakPolarHBondContact O-CB 3.27Å; K500-S503 PolarHBondContact O-N 2.84Å; K500-E504 WeakPolarHBondContact CE-OE1 3.18Å; K500-E504 IonicContact NZ-OE1 3.55Å; K500-E504 PolarHBondContact O-N 2.79Å
501	E	95.5	Very high	94.4	Very high	55 Å²	55	60.8 Å²	60.8	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-59.5	-39	-177.4	-168.1	-163.3	127.2	0	0	110.8	N420 G423 D424 G425 D498 S503 E504 A505	N420-E501 PolarHBondContact ND2-OE1 2.93Å; G423-E501 VanDerWaalsContact C-OE1 3.24Å; G423-E501 WeakPolarHBondContact CA-OE1 3.36Å; D424-E501 PolarHBondContact N-OE1 3.24Å; G425-E501 WeakPolarHBondContact CA-OE1 3.34Å; G425-E501 PolarHBondContact N-OE1 3.25Å; D498-E501 HydrophobicContact CB-CB 4.24Å; D498-E501 PolarHBondContact OD1-N 2.95Å; E501-S503 VanDerWaalsContact C-N 3.3Å; E501-S503 PolarHBondContact O-N 3.13Å; E501-E504 PolarHBondContact O-N 2.82Å; E501-A505 VanDerWaalsContact O-CB 3.28Å; E501-A505 WeakPolarHBondContact O-CB 3.46Å; E501-A505 PolarHBondContact O-N 3.01Å
502	R	95.4	Very high	93.5	Very high	76 Å²	76	63.1 Å²	63.1	29%	0.287	30%	0.304	S	S	.	.	H	α-helix	trans	-68.4	-26.9	176.6	-169.7	56	169.5	167.1	0.7	113.4	D424 F497 D498 K500 K506	D424-R502 WeakPolarHBondContact O-CD 3.42Å; D424-R502 PolarHBondContact O-NH1 3.09Å; F497-R502 HydrophobicContact CB-CB 4.05Å; F497-R502 HydrophobicContact CB-CG 3.98Å; F497-R502 HydrophobicContact CD1-CB 4.49Å; F497-R502 HydrophobicContact CD1-CG 3.94Å; F497-R502 VanDerWaalsContact CE1-CZ 3.45Å; F497-R502 VanDerWaalsContact CE1-NE 3.29Å; F497-R502 HydrophobicContact CG-CB 4.46Å; F497-R502 HydrophobicContact CG-CG 3.92Å; D498-R502 WeakPolarHBondContact O-CB 3.4Å; D498-R502 PolarHBondContact O-N 2.97Å; K500-R502 PolarHBondContact O-N 3.06Å; R502-K506 WeakPolarHBondContact O-CD 3.49Å; R502-K506 VanDerWaalsContact O-CG 3.23Å; R502-K506 WeakPolarHBondContact O-CG 3.49Å; R502-K506 PolarHBondContact O-N 2.94Å
503	S	95	Very high	92.3	Very high	62 Å²	62	66.3 Å²	66.3	43%	0.434	32%	0.324	S	S	.	.	H	α-helix	trans	-72.4	-50.2	172.3	-164.1	0	0	0	0	110.7	A499 K500 E501 A505 K506 E507	A499-S503 WeakPolarHBondContact O-CB 3.46Å; A499-S503 PolarHBondContact O-N 3.07Å; K500-S503 WeakPolarHBondContact O-CA 3.46Å; K500-S503 WeakPolarHBondContact O-CB 3.27Å; K500-S503 PolarHBondContact O-N 2.84Å; E501-S503 VanDerWaalsContact C-N 3.3Å; E501-S503 PolarHBondContact O-N 3.13Å; S503-A505 VanDerWaalsContact C-N 3.3Å; S503-A505 PolarHBondContact O-N 2.74Å; S503-K506 WeakPolarHBondContact O-CB 3.4Å; S503-K506 PolarHBondContact O-N 2.91Å; S503-E507 PolarHBondContact O-N 3.43Å
504	E	94.9	Very high	90.8	Very high	111 Å²	111	68.1 Å²	68.1	52%	0.519	34%	0.344	S	S	.	.	H	α-helix	trans	-58.2	-41.1	177.4	-66.9	174.3	168.6	0	0	111.6	K500 E501 E507 K508	K500-E504 WeakPolarHBondContact CE-OE1 3.18Å; K500-E504 IonicContact NZ-OE1 3.55Å; K500-E504 PolarHBondContact O-N 2.79Å; E501-E504 PolarHBondContact O-N 2.82Å; E504-E507 PolarHBondContact O-N 2.84Å; E504-K508 VanDerWaalsContact O-CB 3.31Å; E504-K508 WeakPolarHBondContact O-CB 3.47Å; E504-K508 PolarHBondContact O-N 3.49Å
505	A	92.8	Very high	88.9	Confident	15 Å²	15	74.5 Å²	74.5	12%	0.124	37%	0.374	C	S	.	.	H	α-helix	trans	-63	-40.2	173.8	0	0	0	0	0	113.4	G423 E501 S503 Y509	G423-A505 WeakPolarHBondContact O-CB 3.18Å; E501-A505 VanDerWaalsContact O-CB 3.28Å; E501-A505 WeakPolarHBondContact O-CB 3.46Å; E501-A505 PolarHBondContact O-N 3.01Å; S503-A505 VanDerWaalsContact C-N 3.3Å; S503-A505 PolarHBondContact O-N 2.74Å; A505-Y509 WeakPolarHBondContact O-CB 3.41Å; A505-Y509 PolarHBondContact O-N 3.41Å
506	K	91.9	Very high	86.7	Confident	102 Å²	102	82.8 Å²	82.8	44%	0.443	41%	0.411	S	S	.	.	H	α-helix	trans	-63.9	-45.1	175.9	-78.8	169	179.5	-179.7	0	111.2	R502 S503 Y509 K510	R502-K506 WeakPolarHBondContact O-CD 3.49Å; R502-K506 VanDerWaalsContact O-CG 3.23Å; R502-K506 WeakPolarHBondContact O-CG 3.49Å; R502-K506 PolarHBondContact O-N 2.94Å; S503-K506 WeakPolarHBondContact O-CB 3.4Å; S503-K506 PolarHBondContact O-N 2.91Å; K506-Y509 PolarHBondContact O-N 2.95Å; K506-K510 WeakPolarHBondContact O-CG 3.36Å; K506-K510 PolarHBondContact O-N 2.88Å
507	E	92.8	Very high	84.3	Confident	80 Å²	80	85.6 Å²	85.6	37%	0.374	44%	0.44	S	S	.	.	H	α-helix	trans	-68.1	-42.8	179	-59.8	-39.9	113	0	0	112	S503 E504 Y509 K510 L511	S503-E507 PolarHBondContact O-N 3.43Å; E504-E507 PolarHBondContact O-N 2.84Å; E507-Y509 VanDerWaalsContact C-N 3.27Å; E507-Y509 PolarHBondContact O-N 3.36Å; E507-K510 WeakPolarHBondContact O-CB 3.44Å; E507-K510 PolarHBondContact O-N 3.18Å; E507-K510 VanDerWaalsContact O-N 3.17Å; E507-K510 WeakPolarHBondContact OE1-CD 3.37Å; E507-K510 WeakPolarHBondContact OE1-CE 3.28Å; E507-K510 IonicContact OE1-NZ 2.75Å; E507-K510 PolarHBondContact OE1-NZ 3.01Å; E507-K510 WeakPolarHBondContact OE2-CD 3.3Å; E507-K510 IonicContact OE2-NZ 3.94Å; E507-K510 PolarHBondContact OE2-NZ 2.86Å; E507-L511 WeakPolarHBondContact O-CB 3.27Å; E507-L511 WeakPolarHBondContact O-CG 3.49Å; E507-L511 PolarHBondContact O-N 3.11Å
508	K	90	Very high	81.9	Confident	138 Å²	138	90.2 Å²	90.2	60%	0.6	47%	0.465	S	S	*	.	H	α-helix	trans	-55.5	-41.8	172.4	-173.7	177.5	178.8	-177.8	0	111.9	E504 A512	E504-K508 VanDerWaalsContact O-CB 3.31Å; E504-K508 WeakPolarHBondContact O-CB 3.47Å; E504-K508 PolarHBondContact O-N 3.49Å; K508-A512 WeakPolarHBondContact O-CB 3.41Å; K508-A512 PolarHBondContact O-N 3.01Å
509	Y	85.9	Confident	79.5	Confident	153 Å²	153	98 Å²	98	60%	0.6	50%	0.501	S	S	*	.	H	α-helix	trans	-69	-42	176.3	-172.7	-82.4	0	0	0	112.9	A505 K506 E507 T513	A505-Y509 WeakPolarHBondContact O-CB 3.41Å; A505-Y509 PolarHBondContact O-N 3.41Å; K506-Y509 PolarHBondContact O-N 2.95Å; E507-Y509 VanDerWaalsContact C-N 3.27Å; E507-Y509 PolarHBondContact O-N 3.36Å; Y509-T513 WeakPolarHBondContact CE1-OG1 3.41Å; Y509-T513 WeakPolarHBondContact O-CB 3.23Å; Y509-T513 PolarHBondContact O-N 2.74Å; Y509-T513 PolarHBondContact O-OG1 3.22Å
510	K	87.6	Confident	77.3	Confident	123 Å²	123	102.7 Å²	102.7	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-58.2	-50	174.4	-76.7	163.2	166.6	178.6	0	111	K506 E507 T513 G514	K506-K510 WeakPolarHBondContact O-CG 3.36Å; K506-K510 PolarHBondContact O-N 2.88Å; E507-K510 WeakPolarHBondContact O-CB 3.44Å; E507-K510 PolarHBondContact O-N 3.18Å; E507-K510 VanDerWaalsContact O-N 3.17Å; E507-K510 WeakPolarHBondContact OE1-CD 3.37Å; E507-K510 WeakPolarHBondContact OE1-CE 3.28Å; E507-K510 IonicContact OE1-NZ 2.75Å; E507-K510 PolarHBondContact OE1-NZ 3.01Å; E507-K510 WeakPolarHBondContact OE2-CD 3.3Å; E507-K510 IonicContact OE2-NZ 3.94Å; E507-K510 PolarHBondContact OE2-NZ 2.86Å; K510-T513 PolarHBondContact O-N 2.96Å; K510-G514 PolarHBondContact O-N 2.95Å
511	L	85.9	Confident	75	Confident	115 Å²	115	101.2 Å²	101.2	60%	0.602	53%	0.531	S	S	*	.	H	α-helix	trans	-60.3	-48.3	179.4	-70	170.1	0	0	0	111.7	E507 T513 G514 Q515	E507-L511 WeakPolarHBondContact O-CB 3.27Å; E507-L511 WeakPolarHBondContact O-CG 3.49Å; E507-L511 PolarHBondContact O-N 3.11Å; L511-T513 VanDerWaalsContact C-N 3.27Å; L511-T513 PolarHBondContact O-N 2.95Å; L511-G514 PolarHBondContact O-N 3.22Å; L511-Q515 WeakPolarHBondContact O-CB 3.31Å; L511-Q515 WeakPolarHBondContact O-CG 3.34Å; L511-Q515 PolarHBondContact O-N 2.76Å
512	A	79.4	Confident	72.4	Confident	51 Å²	51	104.9 Å²	104.9	42%	0.421	56%	0.557	S	S	.	*	H	α-helix	trans	-63	-31.3	176.9	0	0	0	0	0	113.2	K508	K508-A512 WeakPolarHBondContact O-CB 3.41Å; K508-A512 PolarHBondContact O-N 3.01Å
513	T	75	Confident	70.1	Confident	69 Å²	69	107.2 Å²	107.2	42%	0.423	58%	0.58	S	S	.	*	H	α-helix	trans	-73.5	-40.2	174.1	-54.7	0	0	0	0	111.5	Y509 K510 L511	Y509-T513 WeakPolarHBondContact CE1-OG1 3.41Å; Y509-T513 WeakPolarHBondContact O-CB 3.23Å; Y509-T513 PolarHBondContact O-N 2.74Å; Y509-T513 PolarHBondContact O-OG1 3.22Å; K510-T513 PolarHBondContact O-N 2.96Å; L511-T513 VanDerWaalsContact C-N 3.27Å; L511-T513 PolarHBondContact O-N 2.95Å
514	G	66.7	Low	67.5	Low	48 Å²	48	112.8 Å²	112.8	50%	0.495	60%	0.599	S	S	.	*	H	α-helix	trans	-68.3	-41.6	177.7	0	0	0	0	0	113.2	K510 L511 K516 G517	K510-G514 PolarHBondContact O-N 2.95Å; L511-G514 PolarHBondContact O-N 3.22Å; G514-K516 VanDerWaalsContact C-N 3.28Å; G514-K516 PolarHBondContact O-N 3.5Å; G514-G517 WeakPolarHBondContact O-CA 3.15Å; G514-G517 PolarHBondContact O-N 3.17Å
515	Q	57.8	Low	65	Low	135 Å²	135	114.5 Å²	114.5	63%	0.631	61%	0.612	S	S	*	*	H	α-helix	trans	-62.6	-32.7	178.1	-75.5	176.5	-21.5	0	0	112.8	L511 G517 I518	L511-Q515 WeakPolarHBondContact O-CB 3.31Å; L511-Q515 WeakPolarHBondContact O-CG 3.34Å; L511-Q515 PolarHBondContact O-N 2.76Å; Q515-G517 PolarHBondContact O-N 3.36Å; Q515-I518 HydrophobicContact CG-CD1 4.32Å; Q515-I518 PolarHBondContact O-N 3.48Å
516	K	51.9	Low	62.8	Low	196 Å²	196	119.5 Å²	119.5	85%	0.852	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-8.7	171.3	-74.6	-172.5	176.8	-170.9	0	114.3	G514	G514-K516 VanDerWaalsContact C-N 3.28Å; G514-K516 PolarHBondContact O-N 3.5Å
517	G	49.3	Very low	60.7	Low	61 Å²	61	125.9 Å²	125.9	63%	0.629	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-2.8	174.5	0	0	0	0	0	114.9	G514 Q515 Q519	G514-G517 WeakPolarHBondContact O-CA 3.15Å; G514-G517 PolarHBondContact O-N 3.17Å; Q515-G517 PolarHBondContact O-N 3.36Å; G517-Q519 PolarHBondContact O-N 3.41Å
518	I	46	Very low	58.4	Low	122 Å²	122	131 Å²	131	63%	0.626	71%	0.711	S	S	*	*			trans	-78.4	102.8	-179.2	-58.6	174.5	0	0	0	109.1	Q515 V520	Q515-I518 HydrophobicContact CG-CD1 4.32Å; Q515-I518 PolarHBondContact O-N 3.48Å; I518-V520 PolarHBondContact O-N 2.93Å
519	Q	45.5	Very low	56.8	Low	181 Å²	181	130.6 Å²	130.6	85%	0.846	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-65.2	121.1	163.3	-74.8	-174.4	-6.6	0	0	108.9	G517 P521	G517-Q519 PolarHBondContact O-N 3.41Å; Q519-P521 WeakPolarHBondContact O-CD 3.2Å
520	V	47.8	Very low	55.3	Low	124 Å²	124	129.4 Å²	129.4	75%	0.752	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-68.8	121.2	166.1	-179.9	0	0	0	0	107.3	I518 V522	I518-V520 PolarHBondContact O-N 2.93Å; V520-V522 PolarHBondContact O-N 3.4Å
521	P	47.1	Very low	53.5	Low	109 Å²	109	129.8 Å²	129.8	71%	0.708	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-62.6	125	176.5	-21.5	33.7	0	0	0	110	Q519 T523	Q519-P521 WeakPolarHBondContact O-CD 3.2Å; P521-T523 PolarHBondContact O-N 3.17Å; P521-T523 VanDerWaalsContact O-N 3.1Å
522	V	41.8	Very low	51.6	Low	132 Å²	132	130.6 Å²	130.6	80%	0.8	74%	0.741	S	S	*	*			trans	-71.6	105.8	171.3	177.9	0	0	0	0	107.7	V520 Q524	V520-V522 PolarHBondContact O-N 3.4Å; V522-Q524 PolarHBondContact O-N 2.89Å
523	T	46.5	Very low	49.8	Very low	124 Å²	124	135.6 Å²	135.6	76%	0.761	76%	0.761	S	S	*	*			trans	-63.1	100.8	169.2	30.8	0	0	0	0	109.3	P521 N525	P521-T523 PolarHBondContact O-N 3.17Å; P521-T523 VanDerWaalsContact O-N 3.1Å; T523-N525 PolarHBondContact O-N 3.36Å
524	Q	40.5	Very low	48.2	Very low	179 Å²	179	140.1 Å²	140.1	84%	0.836	78%	0.784	S	S	*	*			trans	-67.2	113.7	168.1	-68.8	-165.9	-3.1	0	0	108.6	V522 S526	V522-Q524 PolarHBondContact O-N 2.89Å; Q524-S526 PolarHBondContact O-N 2.62Å
525	N	41.9	Very low	46.8	Very low	148 Å²	148	146.6 Å²	146.6	79%	0.791	80%	0.804	S	S	*	*			trans	-63.9	108	170	-84.9	-16.3	0	0	0	109	T523 R527	T523-N525 PolarHBondContact O-N 3.36Å; N525-R527 PolarHBondContact O-N 2.92Å
526	S	48.1	Very low	46	Very low	119 Å²	119	147.5 Å²	147.5	83%	0.832	82%	0.818	S	S	*	*			trans	-63	97.3	164.6	53.8	0	0	0	0	109.1	Q524	Q524-S526 PolarHBondContact O-N 2.62Å
527	R	47.5	Very low	45.5	Very low	236 Å²	236	143.5 Å²	143.5	89%	0.891	82%	0.815	S	S	*	*			trans	-77.7	125.2	165.5	-81	-173.6	169.3	174.7	-3	108.9	N525	N525-R527 PolarHBondContact O-N 2.92Å
528	S	44.2	Very low	45.2	Very low	187 Å²	187	151 Å²	151	100%	1.308	83%	0.832	S	S	*	*			trans	-56.9	0	157.6	55.3	0	0	0	0	111.5

Retrieved 528 of 528 residues in 194.4 ms (Link to these results)

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