A0A077Z8C0_TRITR Loading...

Oxysterol-binding protein

AlphaFold DB , UniProt , Accession A0A077Z8C0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 534 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	31.2	Very low	240 Å²	240	174.9 Å²	174.9	100%	1.182	86%	0.862	S	S	*	*				0	133.5	0	-80.5	166.7	168.1	0	0	108.8
2	N	35.9	Very low	31.1	Very low	162 Å²	162	168.7 Å²	168.7	87%	0.866	86%	0.859	S	S	*	*			trans	56.8	88.1	165.7	-57.8	4	0	0	0	118.9
3	Q	29	Very low	30.7	Very low	176 Å²	176	168.8 Å²	168.8	82%	0.822	85%	0.854	S	S	*	*			trans	-96	157.3	140.2	-74.1	-179.9	-17.7	0	0	109.1
4	P	39.9	Very low	30.6	Very low	129 Å²	129	162.7 Å²	162.7	84%	0.838	85%	0.854	S	S	*	*			trans	-114.8	123.7	151.4	25.2	-9.5	0	0	0	111.7
5	D	32.1	Very low	30.3	Very low	157 Å²	157	159.3 Å²	159.3	84%	0.84	85%	0.85	S	S	*	*			trans	-70.1	164.5	168.7	-82.7	-60.6	0	0	0	113.1
6	G	29.3	Very low	30.1	Very low	71 Å²	71	160.3 Å²	160.3	73%	0.732	85%	0.852	S	S	*	*			trans	143.6	82.9	149	0	0	0	0	0	117.5
7	I	30.7	Very low	30	Very low	170 Å²	170	162.2 Å²	162.2	87%	0.872	86%	0.855	S	S	*	*			trans	-121.6	108.8	154.4	-62.7	-179	0	0	0	108.5
8	K	30.2	Very low	30	Very low	179 Å²	179	159.3 Å²	159.3	78%	0.778	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-73.4	130	177.2	-70.9	179.6	175.7	178.4	0	110.5
9	R	26.7	Very low	29.9	Very low	247 Å²	247	156.8 Å²	156.8	93%	0.932	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-86.8	133.2	163.8	-74.4	179.1	171.8	171.1	-3.4	109.5
10	Y	29.2	Very low	29.8	Very low	210 Å²	210	158.5 Å²	158.5	82%	0.824	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-98.7	125.4	162.6	-78.8	-92.5	0	0	0	109.2
11	K	26.1	Very low	29.8	Very low	183 Å²	183	156.5 Å²	156.5	80%	0.796	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-82.1	148.4	163.4	-93.7	-175	167.7	-169.2	0	108.8
12	A	29.5	Very low	29.4	Very low	100 Å²	100	155 Å²	155	83%	0.826	83%	0.831	S	S	*	*			trans	-135.3	125.1	157	0	0	0	0	0	107.9
13	E	26.4	Very low	29	Very low	171 Å²	171	153.8 Å²	153.8	80%	0.799	82%	0.823	S	S	*	*			trans	-87.9	155.8	-179.2	-66.7	168.9	163.7	0	0	110.1
14	G	28.8	Very low	29	Very low	83 Å²	83	152.9 Å²	152.9	86%	0.856	82%	0.824	S	S	*	*			trans	153.9	91.8	-179.6	0	0	0	0	0	112.7
15	S	25.8	Very low	28.4	Very low	112 Å²	112	155.9 Å²	155.9	78%	0.783	82%	0.824	S	S	*	*			trans	-94	130.4	177.8	50.5	0	0	0	0	112
16	I	28.5	Very low	28.4	Very low	174 Å²	174	154.3 Å²	154.3	89%	0.892	82%	0.822	S	S	*	*			trans	-138.8	125.2	154.2	-59.9	-177.4	0	0	0	106.7
17	E	27	Very low	28.4	Very low	193 Å²	193	160.7 Å²	160.7	90%	0.902	83%	0.83	S	S	*	*			trans	-87.8	145.6	178.5	-64.4	-178.4	141.1	0	0	111.4
18	S	29.9	Very low	28.3	Very low	111 Å²	111	161 Å²	161	78%	0.776	83%	0.832	S	S	*	*			trans	-142.1	134.7	156.6	-178.1	0	0	0	0	107.1
19	P	29.6	Very low	28.4	Very low	111 Å²	111	161.2 Å²	161.2	72%	0.721	84%	0.836	S	S	*	*			trans	-76	175.5	-176.9	33	-36.1	0	0	0	112.2
20	E	28.3	Very low	28.7	Very low	191 Å²	191	154.9 Å²	154.9	89%	0.893	83%	0.827	S	S	*	*			trans	82.5	62.8	169.1	-52.3	-172.1	-179.4	0	0	118.7
21	C	29	Very low	29	Very low	117 Å²	117	150.9 Å²	150.9	79%	0.791	83%	0.827	S	S	*	*				-161.5	118	123	-154.4	0	0	0	0	111.6
22	K	24.8	Very low	29.5	Very low	209 Å²	209	147.1 Å²	147.1	91%	0.909	82%	0.819	S	S	*	*			trans	-93.2	116.5	174.3	-75.1	178.4	178.3	172.5	0	110.1
23	I	29.4	Very low	29.7	Very low	135 Å²	135	147.4 Å²	147.4	69%	0.692	81%	0.812	S	S	*	*			trans	-123.5	117.1	166.8	-57.9	-178.3	0	0	0	109.2
24	N	27.3	Very low	30.2	Very low	158 Å²	158	146.5 Å²	146.5	85%	0.845	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-81.2	135.1	176.3	-82	-39.3	0	0	0	111
25	F	28.8	Very low	30.7	Very low	191 Å²	191	151.2 Å²	151.2	84%	0.838	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-94.7	127.8	166.7	-72.5	-83.5	0	0	0	110.7
26	P	31	Very low	31.2	Very low	124 Å²	124	151.3 Å²	151.3	81%	0.805	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68.5	149.9	173.2	-16.5	30.3	0	0	0	112.3
27	K	29.3	Very low	31.3	Very low	206 Å²	206	147.5 Å²	147.5	90%	0.896	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-70.5	141	179.8	-68.4	176.6	177.2	176.2	0	112.1
28	L	28.5	Very low	31.7	Very low	176 Å²	176	142.7 Å²	142.7	92%	0.921	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-66	148.2	172.3	-73.8	155.9	0	0	0	112.2
29	Q	32.1	Very low	31.9	Very low	184 Å²	184	144.5 Å²	144.5	86%	0.86	75%	0.748	S	S	*	*			trans	-121.2	163.2	170.7	-88.6	-165.4	-4.8	0	0	111.1
30	P	34	Very low	32	Very low	114 Å²	114	143.2 Å²	143.2	74%	0.74	73%	0.734	S	S	*	*			trans	-89.5	179.8	-150.8	38.7	-38.5	0	0	0	114.7
31	P	35	Very low	32.3	Very low	126 Å²	126	138.7 Å²	138.7	82%	0.818	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-87.1	159.6	-146.2	35.1	-37.5	0	0	0	116.7
32	V	36.9	Very low	32.7	Very low	104 Å²	104	142.1 Å²	142.1	63%	0.63	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-91.6	149.5	-179	-178.6	0	0	0	0	111.2	E36	V32-E36 WeakPolarHBondContact CG1-OE2 3.29Å
33	P	33.6	Very low	33.1	Very low	106 Å²	106	137.9 Å²	137.9	69%	0.688	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-71	157.5	-166.7	-21.3	34.9	0	0	0	117.2	H35 E36	P33-H35 PolarHBondContact O-N 3.47Å; P33-E36 PolarHBondContact O-N 3.36Å
34	H	35.9	Very low	33.3	Very low	152 Å²	152	135.7 Å²	135.7	70%	0.704	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.5	-7.2	-171.9	-90.4	-57.9	0	0	0	119.3	E37	H34-E37 IonicContact CE1-OE2 3.2Å; H34-E37 PolarHBondContact CE1-OE2 3.11Å; H34-E37 IonicContact CG-OE2 2.78Å; H34-E37 IonicContact ND1-OE2 3.87Å; H34-E37 PolarHBondContact ND1-OE2 3.49Å
35	H	40.3	Very low	33.6	Very low	182 Å²	182	137.3 Å²	137.3	84%	0.843	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-19.4	179.9	-119	-84.1	0	0	0	114.3	P33	P33-H35 PolarHBondContact O-N 3.47Å
36	E	35.9	Very low	33.9	Very low	113 Å²	113	136.2 Å²	136.2	53%	0.528	67%	0.672	S	S	.	*	S	Bend	trans	-81	-22.7	170.9	-70	-156.4	132.1	0	0	113	V32 P33 V38 Y39 L40	V32-E36 WeakPolarHBondContact CG1-OE2 3.29Å; P33-E36 PolarHBondContact O-N 3.36Å; E36-V38 VanDerWaalsContact C-N 3.28Å; E36-V38 PolarHBondContact O-N 3.47Å; E36-Y39 PolarHBondContact O-N 3.26Å; E36-Y39 VanDerWaalsContact O-N 3.07Å; E36-L40 HydrophobicContact CB-CD1 4.16Å; E36-L40 WeakPolarHBondContact O-CB 3.41Å; E36-L40 PolarHBondContact O-N 3.2Å
37	E	30	Very low	33.9	Very low	95 Å²	95	135.7 Å²	135.7	44%	0.444	66%	0.657	S	S	.	*	H	α-helix	trans	-56.6	-38.2	-178.2	-87.6	-168.5	137.3	0	0	112.9	H34 Y39 L40 L41	H34-E37 IonicContact CE1-OE2 3.2Å; H34-E37 PolarHBondContact CE1-OE2 3.11Å; H34-E37 IonicContact CG-OE2 2.78Å; H34-E37 IonicContact ND1-OE2 3.87Å; H34-E37 PolarHBondContact ND1-OE2 3.49Å; E37-Y39 VanDerWaalsContact C-N 3.34Å; E37-Y39 PolarHBondContact O-N 3.12Å; E37-L40 PolarHBondContact O-N 3.38Å; E37-L41 WeakPolarHBondContact O-CB 3.19Å; E37-L41 WeakPolarHBondContact O-CD1 3.11Å; E37-L41 WeakPolarHBondContact O-CG 3.39Å; E37-L41 PolarHBondContact O-N 3.46Å
38	V	36	Very low	34.2	Very low	92 Å²	92	127.2 Å²	127.2	56%	0.558	62%	0.624	S	S	*	*	H	α-helix	trans	-70.8	-32.3	-179.6	-177.2	0	0	0	0	111.8	E36 R42	E36-V38 VanDerWaalsContact C-N 3.28Å; E36-V38 PolarHBondContact O-N 3.47Å; V38-R42 PolarHBondContact O-N 3.22Å; V38-R42 VanDerWaalsContact O-N 3.15Å
39	Y	33.9	Very low	34.5	Very low	148 Å²	148	127.8 Å²	127.8	58%	0.58	61%	0.614	S	S	*	*	H	α-helix	trans	-75.5	-43.7	175.2	-173.8	-97.2	0	0	0	111.1	E36 E37 R42 K43	E36-Y39 PolarHBondContact O-N 3.26Å; E36-Y39 VanDerWaalsContact O-N 3.07Å; E37-Y39 VanDerWaalsContact C-N 3.34Å; E37-Y39 PolarHBondContact O-N 3.12Å; Y39-R42 PolarHBondContact O-N 3.48Å; Y39-K43 HydrophobicContact CD1-CD 4.47Å; Y39-K43 HydrophobicContact CE1-CD 3.9Å; Y39-K43 HydrophobicContact CE1-CG 4.43Å; Y39-K43 PolarHBondContact O-N 3.1Å
40	L	32	Very low	34.5	Very low	84 Å²	84	123.9 Å²	123.9	44%	0.44	59%	0.591	S	S	.	*	H	α-helix	trans	-62.6	-42.1	172.8	-77.6	164.3	0	0	0	111.7	E36 E37 R42 K43 L44	E36-L40 HydrophobicContact CB-CD1 4.16Å; E36-L40 WeakPolarHBondContact O-CB 3.41Å; E36-L40 PolarHBondContact O-N 3.2Å; E37-L40 PolarHBondContact O-N 3.38Å; L40-R42 VanDerWaalsContact C-N 3.34Å; L40-R42 PolarHBondContact O-N 3.04Å; L40-K43 CarbonylContact O-C 3.55Å; L40-K43 PolarHBondContact O-N 2.98Å; L40-L44 VanDerWaalsContact O-CB 3.22Å; L40-L44 WeakPolarHBondContact O-CB 3.45Å; L40-L44 WeakPolarHBondContact O-CG 3.32Å; L40-L44 PolarHBondContact O-N 3.27Å
41	L	33.5	Very low	34.5	Very low	96 Å²	96	122.8 Å²	122.8	50%	0.503	58%	0.577	S	S	.	*	H	α-helix	trans	-65.5	-33.4	175.5	-76.2	165.3	0	0	0	112.4	E37 R45	E37-L41 WeakPolarHBondContact O-CB 3.19Å; E37-L41 WeakPolarHBondContact O-CD1 3.11Å; E37-L41 WeakPolarHBondContact O-CG 3.39Å; E37-L41 PolarHBondContact O-N 3.46Å; L41-R45 WeakPolarHBondContact O-CB 3.4Å; L41-R45 WeakPolarHBondContact O-CG 3.46Å; L41-R45 PolarHBondContact O-N 3.41Å
42	R	37.6	Very low	34.5	Very low	189 Å²	189	124.7 Å²	124.7	71%	0.713	57%	0.567	S	S	*	*	H	α-helix	trans	-70.6	-41.4	171	-81.8	179.2	170.1	171.1	-1.7	112.1	V38 Y39 L40 R45 K46	V38-R42 PolarHBondContact O-N 3.22Å; V38-R42 VanDerWaalsContact O-N 3.15Å; Y39-R42 PolarHBondContact O-N 3.48Å; L40-R42 VanDerWaalsContact C-N 3.34Å; L40-R42 PolarHBondContact O-N 3.04Å; R42-R45 PolarHBondContact O-N 2.8Å; R42-K46 PolarHBondContact O-N 2.65Å
43	K	35	Very low	34.6	Very low	120 Å²	120	123.6 Å²	123.6	52%	0.522	55%	0.552	S	S	.	*	H	α-helix	trans	-62.1	-47	170.6	-87.8	-172.2	175.1	179.7	0	111.2	Y39 L40 R45 K46 F47	Y39-K43 HydrophobicContact CD1-CD 4.47Å; Y39-K43 HydrophobicContact CE1-CD 3.9Å; Y39-K43 HydrophobicContact CE1-CG 4.43Å; Y39-K43 PolarHBondContact O-N 3.1Å; L40-K43 CarbonylContact O-C 3.55Å; L40-K43 PolarHBondContact O-N 2.98Å; K43-R45 VanDerWaalsContact C-N 3.33Å; K43-R45 PolarHBondContact O-N 3.31Å; K43-K46 CarbonylContact O-C 3.54Å; K43-K46 WeakPolarHBondContact O-CA 3.25Å; K43-K46 WeakPolarHBondContact O-CB 3.24Å; K43-K46 PolarHBondContact O-N 2.81Å; K43-F47 WeakPolarHBondContact O-CB 3.41Å; K43-F47 PolarHBondContact O-N 2.88Å
44	L	32	Very low	34.8	Very low	90 Å²	90	122.7 Å²	122.7	47%	0.471	54%	0.536	S	S	.	.	H	α-helix	trans	-65.4	-27.6	177.6	-72.5	165.1	0	0	0	113.3	L40 S48	L40-L44 VanDerWaalsContact O-CB 3.22Å; L40-L44 WeakPolarHBondContact O-CB 3.45Å; L40-L44 WeakPolarHBondContact O-CG 3.32Å; L40-L44 PolarHBondContact O-N 3.27Å; L44-S48 WeakPolarHBondContact O-CB 3.44Å; L44-S48 PolarHBondContact O-N 3.37Å; L44-S48 PolarHBondContact O-OG 2.99Å
45	R	34.5	Very low	34.7	Very low	191 Å²	191	119.3 Å²	119.3	72%	0.721	53%	0.528	S	S	*	.	H	α-helix	trans	-70.1	-34.8	168.6	-82.1	180	177.2	-173.5	1	112.6	L41 R42 K43 R49	L41-R45 WeakPolarHBondContact O-CB 3.4Å; L41-R45 WeakPolarHBondContact O-CG 3.46Å; L41-R45 PolarHBondContact O-N 3.41Å; R42-R45 PolarHBondContact O-N 2.8Å; K43-R45 VanDerWaalsContact C-N 3.33Å; K43-R45 PolarHBondContact O-N 3.31Å; R45-R49 WeakPolarHBondContact O-CG 3.39Å; R45-R49 PolarHBondContact O-N 2.91Å
46	K	34.9	Very low	34.5	Very low	169 Å²	169	115.9 Å²	115.9	74%	0.735	52%	0.519	S	S	*	.	H	α-helix	trans	-71.6	-45.1	168.9	-69.8	-173.1	174.3	-172.7	0	111.2	R42 K43 S48 R49 W50	R42-K46 PolarHBondContact O-N 2.65Å; K43-K46 CarbonylContact O-C 3.54Å; K43-K46 WeakPolarHBondContact O-CA 3.25Å; K43-K46 WeakPolarHBondContact O-CB 3.24Å; K43-K46 PolarHBondContact O-N 2.81Å; K46-S48 PolarHBondContact O-N 3.44Å; K46-R49 WeakPolarHBondContact O-CB 3.43Å; K46-R49 PolarHBondContact O-N 3.24Å; K46-R49 VanDerWaalsContact O-N 3.12Å; K46-W50 PolarHBondContact O-N 3Å
47	F	32.1	Very low	34.5	Very low	112 Å²	112	115.4 Å²	115.4	49%	0.491	52%	0.519	S	S	.	.	H	α-helix	trans	-62.3	-39.1	179.4	-148.6	-99.2	0	0	0	112.4	K43 W50 Q51	K43-F47 WeakPolarHBondContact O-CB 3.41Å; K43-F47 PolarHBondContact O-N 2.88Å; F47-W50 WeakPolarHBondContact O-CB 3.47Å; F47-W50 PolarHBondContact O-N 3.49Å; F47-Q51 HydrophobicContact CD1-CG 4.2Å; F47-Q51 HydrophobicContact CE1-CG 4.38Å; F47-Q51 WeakPolarHBondContact O-CG 3.44Å; F47-Q51 PolarHBondContact O-N 3.27Å
48	S	34.2	Very low	34.7	Very low	28 Å²	28	114.7 Å²	114.7	20%	0.196	53%	0.525	C	S	.	.	H	α-helix	trans	-79.4	-13.5	175.8	68	0	0	0	0	113.9	L44 K46 R52	L44-S48 WeakPolarHBondContact O-CB 3.44Å; L44-S48 PolarHBondContact O-N 3.37Å; L44-S48 PolarHBondContact O-OG 2.99Å; K46-S48 PolarHBondContact O-N 3.44Å; S48-R52 VanDerWaalsContact O-CB 3.23Å; S48-R52 WeakPolarHBondContact O-CB 3.46Å; S48-R52 VanDerWaalsContact O-CG 3.26Å; S48-R52 WeakPolarHBondContact O-CG 3.33Å; S48-R52 PolarHBondContact O-N 2.74Å; S48-R52 PolarHBondContact O-NE 3.2Å; S48-R52 PolarHBondContact OG-NH2 3.06Å
49	R	35.5	Very low	34.4	Very low	189 Å²	189	114.2 Å²	114.2	71%	0.713	53%	0.531	S	S	*	.	H	α-helix	trans	-76.1	-41.4	162.2	-75.4	-178.7	-176.5	-172.2	0.8	110.2	R45 K46 R52 R53	R45-R49 WeakPolarHBondContact O-CG 3.39Å; R45-R49 PolarHBondContact O-N 2.91Å; K46-R49 WeakPolarHBondContact O-CB 3.43Å; K46-R49 PolarHBondContact O-N 3.24Å; K46-R49 VanDerWaalsContact O-N 3.12Å; R49-R52 PolarHBondContact O-N 2.87Å; R49-R53 WeakPolarHBondContact O-CG 3.39Å; R49-R53 PolarHBondContact O-N 3.49Å
50	W	32.7	Very low	34.3	Very low	101 Å²	101	109.6 Å²	109.6	38%	0.383	53%	0.528	S	S	.	.	H	α-helix	trans	-62.3	-51.3	176.1	-169.2	83.2	0	0	0	111.7	K46 F47 R52 R53 Y54 W532	K46-W50 PolarHBondContact O-N 3Å; F47-W50 WeakPolarHBondContact O-CB 3.47Å; F47-W50 PolarHBondContact O-N 3.49Å; W50-R52 VanDerWaalsContact C-N 3.33Å; W50-R52 PolarHBondContact O-N 3.38Å; W50-R53 PolarHBondContact O-N 3.1Å; W50-R53 VanDerWaalsContact O-N 3.14Å; W50-Y54 PolarHBondContact O-N 2.97Å; W50-Y54 VanDerWaalsContact O-N 3.14Å; W50-W532 AromaticContact CH2-CH2 3.9Å; W50-W532 HydrophobicContact CH2-CH2 3.9Å; W50-W532 HydrophobicContact CH2-CZ3 4.42Å; W50-W532 AromaticContact CZ2-CH2 3.88Å; W50-W532 HydrophobicContact CZ2-CH2 3.88Å
51	Q	32.2	Very low	34.4	Very low	92 Å²	92	108.9 Å²	108.9	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-58.9	-40.6	172.7	-72.3	-178.6	-61.8	0	0	112.5	F47 R53 C55	F47-Q51 HydrophobicContact CD1-CG 4.2Å; F47-Q51 HydrophobicContact CE1-CG 4.38Å; F47-Q51 WeakPolarHBondContact O-CG 3.44Å; F47-Q51 PolarHBondContact O-N 3.27Å; Q51-R53 VanDerWaalsContact C-N 3.32Å; Q51-R53 PolarHBondContact O-N 2.98Å; Q51-C55 VanDerWaalsContact O-CB 3.24Å; Q51-C55 WeakPolarHBondContact O-CB 3.31Å; Q51-C55 PolarHBondContact O-N 3.47Å
52	R	36.5	Very low	34.3	Very low	165 Å²	165	107.9 Å²	107.9	62%	0.623	53%	0.525	S	S	*	.	H	α-helix	trans	-63.7	-34.9	176.6	-87.6	178.5	-91.6	-144.2	-7.1	112.9	S48 R49 W50 H179	S48-R52 VanDerWaalsContact O-CB 3.23Å; S48-R52 WeakPolarHBondContact O-CB 3.46Å; S48-R52 VanDerWaalsContact O-CG 3.26Å; S48-R52 WeakPolarHBondContact O-CG 3.33Å; S48-R52 PolarHBondContact O-N 2.74Å; S48-R52 PolarHBondContact O-NE 3.2Å; S48-R52 PolarHBondContact OG-NH2 3.06Å; R49-R52 PolarHBondContact O-N 2.87Å; W50-R52 VanDerWaalsContact C-N 3.33Å; W50-R52 PolarHBondContact O-N 3.38Å; R52-H179 PolarHBondContact O-CD2 2.69Å; R52-H179 VanDerWaalsContact O-CD2 3.3Å; R52-H179 PolarHBondContact O-NE2 3.39Å
53	R	39	Very low	33.9	Very low	82 Å²	82	107.6 Å²	107.6	31%	0.309	53%	0.529	S	S	.	.	H	α-helix	trans	-79.5	-28.3	-179.5	-71.6	-154.8	161.8	-176	-8.4	114.9	R49 W50 Q51 H179 D181 R297	R49-R53 WeakPolarHBondContact O-CG 3.39Å; R49-R53 PolarHBondContact O-N 3.49Å; W50-R53 PolarHBondContact O-N 3.1Å; W50-R53 VanDerWaalsContact O-N 3.14Å; Q51-R53 VanDerWaalsContact C-N 3.32Å; Q51-R53 PolarHBondContact O-N 2.98Å; R53-H179 VanDerWaalsContact CA-CD2 3.49Å; R53-H179 WeakPolarHBondContact CA-CD2 3.3Å; R53-H179 HydrophobicContact CB-CB 3.9Å; R53-H179 HydrophobicContact CG-CB 3.7Å; R53-H179 VanDerWaalsContact CZ-O 3.24Å; R53-H179 PolarHBondContact NE-O 2.72Å; R53-H179 PolarHBondContact NH1-O 3.49Å; R53-H179 PolarHBondContact O-CD2 2.69Å; R53-D181 PolarHBondContact NH1-O 3.38Å; R53-D181 PolarHBondContact NH2-O 3.17Å; R53-R297 PolarHBondContact O-NH1 2.8Å
54	Y	37.2	Very low	33.9	Very low	87 Å²	87	108.1 Å²	108.1	34%	0.341	54%	0.536	S	S	.	.	H	α-helix	trans	-125.1	-19.2	-166.8	-67.8	-94.2	0	0	0	115.9	W50 V56 E288	W50-Y54 PolarHBondContact O-N 2.97Å; W50-Y54 VanDerWaalsContact O-N 3.14Å; Y54-V56 VanDerWaalsContact C-N 3.25Å; Y54-V56 PolarHBondContact O-N 2.86Å; Y54-E288 PolarHBondContact OH-OE2 3.05Å
55	C	34.3	Very low	34	Very low	81 Å²	81	107.4 Å²	107.4	55%	0.547	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	18.6	-176.7	-64.6	0	0	0	0	115.3	Q51	Q51-C55 VanDerWaalsContact O-CB 3.24Å; Q51-C55 WeakPolarHBondContact O-CB 3.31Å; Q51-C55 PolarHBondContact O-N 3.47Å
56	V	36.3	Very low	33.9	Very low	109 Å²	109	100.9 Å²	100.9	66%	0.661	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	13.3	179.2	-160.7	0	0	0	0	112.4	Y54 S58	Y54-V56 VanDerWaalsContact C-N 3.25Å; Y54-V56 PolarHBondContact O-N 2.86Å; V56-S58 VanDerWaalsContact C-N 3.28Å; V56-S58 PolarHBondContact O-N 3.04Å
57	I	34.7	Very low	33.9	Very low	103 Å²	103	102.2 Å²	102.2	53%	0.528	52%	0.521	S	S	.	.	S	Bend	trans	-73.8	90.7	158.7	-56.9	-180	0	0	0	106.6	V61	I57-V61 HydrophobicContact CG2-CG2 4.44Å
58	S	34	Very low	34.1	Very low	81 Å²	81	100.3 Å²	100.3	57%	0.566	52%	0.522	S	S	*	.			trans	-72.2	154.2	-165.4	73	0	0	0	0	113.4	V56 G60 V61	V56-S58 VanDerWaalsContact C-N 3.28Å; V56-S58 PolarHBondContact O-N 3.04Å; S58-G60 PolarHBondContact O-N 3.34Å; S58-V61 PolarHBondContact O-N 2.99Å
59	A	31.2	Very low	34.5	Very low	82 Å²	82	100.8 Å²	100.8	68%	0.678	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	2.4	-174.9	0	0	0	0	0	116.4
60	G	31.4	Very low	34.7	Very low	50 Å²	50	97 Å²	97	52%	0.515	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-27	170.5	0	0	0	0	0	113.9	S58	S58-G60 PolarHBondContact O-N 3.34Å
61	V	34.3	Very low	35.1	Very low	70 Å²	70	99 Å²	99	42%	0.424	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-46	179.6	-177.8	0	0	0	0	110.8	I57 S58 K63 L64 Y65	I57-V61 HydrophobicContact CG2-CG2 4.44Å; S58-V61 PolarHBondContact O-N 2.99Å; V61-K63 VanDerWaalsContact C-N 3.29Å; V61-K63 PolarHBondContact O-N 3.21Å; V61-L64 PolarHBondContact O-N 2.98Å; V61-Y65 HydrophobicContact CG1-CD2 4.02Å; V61-Y65 HydrophobicContact CG1-CE2 3.83Å; V61-Y65 WeakPolarHBondContact O-CD2 3.31Å
62	V	31.6	Very low	35.6	Very low	74 Å²	74	97.5 Å²	97.5	45%	0.448	53%	0.532	S	S	.	.	H	α-helix	trans	-52.4	-41.6	-177.4	176	0	0	0	0	112.9	L64 Y65	V62-L64 VanDerWaalsContact C-N 3.31Å; V62-L64 PolarHBondContact O-N 2.97Å; V62-Y65 PolarHBondContact O-N 3.38Å
63	K	29.3	Very low	36	Very low	183 Å²	183	95.9 Å²	95.9	80%	0.796	53%	0.526	S	S	*	.	H	α-helix	trans	-70.6	-16.8	-176.1	-85.1	-170.4	172.3	-173.9	0	115.7	V61	V61-K63 VanDerWaalsContact C-N 3.29Å; V61-K63 PolarHBondContact O-N 3.21Å
64	L	33.8	Very low	36.4	Very low	131 Å²	131	95.5 Å²	95.5	69%	0.686	53%	0.532	S	S	*	.	H	α-helix	trans	-94.1	-24.3	179.7	-78.1	166.1	0	0	0	113.2	V61 V62	V61-L64 PolarHBondContact O-N 2.98Å; V62-L64 VanDerWaalsContact C-N 3.31Å; V62-L64 PolarHBondContact O-N 2.97Å
65	Y	33.8	Very low	37	Very low	75 Å²	75	99.1 Å²	99.1	29%	0.294	55%	0.545	S	S	.	.	H	α-helix	trans	-81.7	-43.1	-174.9	-84.8	-105.6	0	0	0	113.1	V61 V62 K67 S68 T69 W322	V61-Y65 HydrophobicContact CG1-CD2 4.02Å; V61-Y65 HydrophobicContact CG1-CE2 3.83Å; V61-Y65 WeakPolarHBondContact O-CD2 3.31Å; V62-Y65 PolarHBondContact O-N 3.38Å; Y65-K67 PolarHBondContact O-N 3.2Å; Y65-S68 PolarHBondContact O-N 3.38Å; Y65-T69 PolarHBondContact O-N 3.3Å; Y65-T69 PolarHBondContact O-OG1 3.47Å; Y65-W322 VanDerWaalsContact OH-CD1 3.23Å; Y65-W322 VanDerWaalsContact OH-CE2 3.22Å; Y65-W322 PolarHBondContact OH-NE1 2.76Å
66	A	33.2	Very low	37.6	Very low	55 Å²	55	96.6 Å²	96.6	46%	0.455	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-16.3	-173	0	0	0	0	0	116.2
67	K	34.6	Very low	38.3	Very low	197 Å²	197	94.6 Å²	94.6	86%	0.857	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-14.5	173.2	-98	-172.9	175.1	-176.5	0	114.5	Y65	Y65-K67 PolarHBondContact O-N 3.2Å
68	S	36.4	Very low	38.9	Very low	72 Å²	72	95.7 Å²	95.7	50%	0.503	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-28.7	-179.4	-165.9	0	0	0	0	112.1	Y65 T72	Y65-S68 PolarHBondContact O-N 3.38Å; S68-T72 WeakPolarHBondContact O-CB 3.5Å; S68-T72 PolarHBondContact O-N 3.13Å; S68-T72 PolarHBondContact O-OG1 2.9Å
69	T	43.6	Very low	39.5	Very low	38 Å²	38	95.9 Å²	95.9	23%	0.233	51%	0.505	C	S	.	.	H	α-helix	trans	-72.3	-47.4	-171.5	44.5	0	0	0	0	112.9	Y65 L71 T72 R73	Y65-T69 PolarHBondContact O-N 3.3Å; Y65-T69 PolarHBondContact O-OG1 3.47Å; T69-L71 PolarHBondContact O-N 2.98Å; T69-T72 PolarHBondContact O-N 3.02Å; T69-R73 VanDerWaalsContact O-CB 3.26Å; T69-R73 WeakPolarHBondContact O-CB 3.01Å; T69-R73 PolarHBondContact O-N 2.95Å
70	D	38.3	Very low	40.2	Very low	108 Å²	108	92.5 Å²	92.5	58%	0.578	48%	0.476	S	S	*	.	H	α-helix	trans	-58.3	-51.8	-179.8	-70.5	-24.6	0	0	0	113	T72 R73 T74	D70-T72 VanDerWaalsContact C-N 3.26Å; D70-T72 PolarHBondContact O-N 3.46Å; D70-R73 WeakPolarHBondContact O-CB 3.2Å; D70-R73 PolarHBondContact O-N 3.27Å; D70-R73 VanDerWaalsContact O-N 3.16Å; D70-T74 PolarHBondContact O-N 3.36Å; D70-T74 PolarHBondContact O-OG1 2.78Å
71	L	41.2	Very low	40.8	Very low	144 Å²	144	94.6 Å²	94.6	75%	0.754	48%	0.475	S	S	*	.	H	α-helix	trans	-62.6	-34.1	-179.9	-126.6	101.8	0	0	0	112.6	T69 R75	T69-L71 PolarHBondContact O-N 2.98Å; L71-R75 WeakPolarHBondContact O-CB 3.35Å; L71-R75 PolarHBondContact O-N 3.02Å
72	T	43.9	Very low	41	Very low	60 Å²	60	93.9 Å²	93.9	37%	0.368	48%	0.477	S	S	.	.	H	α-helix	trans	-74.1	-39.6	177.1	-51.2	0	0	0	0	110.5	S68 T69 D70 R75 L76	S68-T72 WeakPolarHBondContact O-CB 3.5Å; S68-T72 PolarHBondContact O-N 3.13Å; S68-T72 PolarHBondContact O-OG1 2.9Å; T69-T72 PolarHBondContact O-N 3.02Å; D70-T72 VanDerWaalsContact C-N 3.26Å; D70-T72 PolarHBondContact O-N 3.46Å; T72-R75 PolarHBondContact O-N 2.98Å; T72-L76 HydrophobicContact CG2-CD1 3.93Å; T72-L76 HydrophobicContact CG2-CG 4.27Å; T72-L76 WeakPolarHBondContact O-CB 3.49Å; T72-L76 WeakPolarHBondContact O-CG 3.06Å; T72-L76 PolarHBondContact O-N 2.85Å
73	R	44	Very low	41.2	Very low	132 Å²	132	91.4 Å²	91.4	50%	0.498	46%	0.464	S	S	.	.	H	α-helix	trans	-62.3	-53.4	179.7	-177.2	179.3	-165.7	142.6	6.5	112.3	T69 D70 R75 L76 E77	T69-R73 VanDerWaalsContact O-CB 3.26Å; T69-R73 WeakPolarHBondContact O-CB 3.01Å; T69-R73 PolarHBondContact O-N 2.95Å; D70-R73 WeakPolarHBondContact O-CB 3.2Å; D70-R73 PolarHBondContact O-N 3.27Å; D70-R73 VanDerWaalsContact O-N 3.16Å; R73-R75 PolarHBondContact O-N 3.18Å; R73-L76 WeakPolarHBondContact O-CB 3.48Å; R73-L76 PolarHBondContact O-N 2.78Å; R73-L76 VanDerWaalsContact O-N 3.15Å; R73-E77 VanDerWaalsContact CG-OE1 3.23Å; R73-E77 WeakPolarHBondContact CG-OE1 3.48Å; R73-E77 IonicContact NE-OE1 3.86Å; R73-E77 PolarHBondContact NE-OE1 2.78Å; R73-E77 VanDerWaalsContact NE-OE1 3.09Å; R73-E77 WeakPolarHBondContact O-CG 3.28Å; R73-E77 PolarHBondContact O-N 2.83Å
74	T	47.7	Very low	41.5	Very low	73 Å²	73	87.6 Å²	87.6	45%	0.448	45%	0.449	S	S	.	.	H	α-helix	trans	-59.7	-38.3	179.3	-50.7	0	0	0	0	111.5	D70 Q78	D70-T74 PolarHBondContact O-N 3.36Å; D70-T74 PolarHBondContact O-OG1 2.78Å; T74-Q78 WeakPolarHBondContact O-CB 3.33Å; T74-Q78 VanDerWaalsContact O-CG 3.28Å; T74-Q78 WeakPolarHBondContact O-CG 3.35Å; T74-Q78 PolarHBondContact O-N 2.71Å
75	R	48.8	Very low	41.5	Very low	163 Å²	163	85.3 Å²	85.3	62%	0.615	44%	0.441	S	S	*	.	H	α-helix	trans	-68.1	-42	176.6	-174.6	175	177.2	158.8	4.4	112.6	L71 T72 R73 Q78 E79	L71-R75 WeakPolarHBondContact O-CB 3.35Å; L71-R75 PolarHBondContact O-N 3.02Å; T72-R75 PolarHBondContact O-N 2.98Å; R73-R75 PolarHBondContact O-N 3.18Å; R75-Q78 PolarHBondContact O-N 2.81Å; R75-E79 HydrophobicContact CG-CG 4.46Å; R75-E79 WeakPolarHBondContact CG-OE1 3.43Å; R75-E79 IonicContact CZ-OE1 3.76Å; R75-E79 IonicContact NE-OE1 2.8Å; R75-E79 PolarHBondContact NE-OE1 2.88Å; R75-E79 IonicContact NH2-OE1 3.13Å; R75-E79 PolarHBondContact NH2-OE1 2.87Å; R75-E79 WeakPolarHBondContact O-CB 3.5Å; R75-E79 WeakPolarHBondContact O-CG 3.31Å; R75-E79 PolarHBondContact O-N 3.22Å
76	L	47.4	Very low	41.4	Very low	29 Å²	29	86 Å²	86	15%	0.152	45%	0.452	C	S	.	.	H	α-helix	trans	-62	-43.8	174.6	-74.4	169.7	0	0	0	111.7	T72 R73 E79 V80 V341	T72-L76 HydrophobicContact CG2-CD1 3.93Å; T72-L76 HydrophobicContact CG2-CG 4.27Å; T72-L76 WeakPolarHBondContact O-CB 3.49Å; T72-L76 WeakPolarHBondContact O-CG 3.06Å; T72-L76 PolarHBondContact O-N 2.85Å; R73-L76 WeakPolarHBondContact O-CB 3.48Å; R73-L76 PolarHBondContact O-N 2.78Å; R73-L76 VanDerWaalsContact O-N 3.15Å; L76-E79 PolarHBondContact O-N 2.55Å; L76-V80 WeakPolarHBondContact O-CB 3.38Å; L76-V80 VanDerWaalsContact O-CG2 3.25Å; L76-V80 WeakPolarHBondContact O-CG2 3.34Å; L76-V80 PolarHBondContact O-N 3.2Å; L76-V341 HydrophobicContact CD2-CB 4.25Å; L76-V341 HydrophobicContact CD2-CG1 3.3Å
77	E	50.6	Low	41.4	Very low	66 Å²	66	85.3 Å²	85.3	31%	0.308	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-43.3	177.7	-72.5	163.4	177.9	0	0	110.8	R73 N81	R73-E77 VanDerWaalsContact CG-OE1 3.23Å; R73-E77 WeakPolarHBondContact CG-OE1 3.48Å; R73-E77 IonicContact NE-OE1 3.86Å; R73-E77 PolarHBondContact NE-OE1 2.78Å; R73-E77 VanDerWaalsContact NE-OE1 3.09Å; R73-E77 WeakPolarHBondContact O-CG 3.28Å; R73-E77 PolarHBondContact O-N 2.83Å; E77-N81 VanDerWaalsContact O-CB 3.31Å; E77-N81 WeakPolarHBondContact O-CB 3.25Å; E77-N81 PolarHBondContact O-N 3.32Å; E77-N81 PolarHBondContact O-ND2 3.27Å; E77-N81 PolarHBondContact O-OD1 3.33Å
78	Q	47.2	Very low	41.2	Very low	127 Å²	127	82 Å²	82	59%	0.593	43%	0.431	S	S	*	.	H	α-helix	trans	-63.3	-47.1	173.8	-74.1	174.4	-4.1	0	0	113.3	T74 R75 N81 A82	T74-Q78 WeakPolarHBondContact O-CB 3.33Å; T74-Q78 VanDerWaalsContact O-CG 3.28Å; T74-Q78 WeakPolarHBondContact O-CG 3.35Å; T74-Q78 PolarHBondContact O-N 2.71Å; R75-Q78 PolarHBondContact O-N 2.81Å; Q78-N81 PolarHBondContact O-N 2.86Å; Q78-A82 WeakPolarHBondContact O-CB 3.37Å; Q78-A82 PolarHBondContact O-N 3.12Å
79	E	48.2	Very low	40.9	Very low	84 Å²	84	83.6 Å²	83.6	39%	0.393	43%	0.434	S	S	.	.	H	α-helix	trans	-66	-37.9	-179.6	-73.4	177.3	-168.6	0	0	111.6	R75 L76 A83	R75-E79 HydrophobicContact CG-CG 4.46Å; R75-E79 WeakPolarHBondContact CG-OE1 3.43Å; R75-E79 IonicContact CZ-OE1 3.76Å; R75-E79 IonicContact NE-OE1 2.8Å; R75-E79 PolarHBondContact NE-OE1 2.88Å; R75-E79 IonicContact NH2-OE1 3.13Å; R75-E79 PolarHBondContact NH2-OE1 2.87Å; R75-E79 WeakPolarHBondContact O-CB 3.5Å; R75-E79 WeakPolarHBondContact O-CG 3.31Å; R75-E79 PolarHBondContact O-N 3.22Å; L76-E79 PolarHBondContact O-N 2.55Å; E79-A83 WeakPolarHBondContact O-CB 3.36Å; E79-A83 PolarHBondContact O-N 3.45Å; E79-A83 VanDerWaalsContact O-N 3.12Å
80	V	44.4	Very low	40.3	Very low	12 Å²	12	84.7 Å²	84.7	7%	0.073	44%	0.443	C	S	.	.	H	α-helix	trans	-68	-46.4	174.7	169.2	0	0	0	0	111.7	L76 A83 Q84 P307	L76-V80 WeakPolarHBondContact O-CB 3.38Å; L76-V80 VanDerWaalsContact O-CG2 3.25Å; L76-V80 WeakPolarHBondContact O-CG2 3.34Å; L76-V80 PolarHBondContact O-N 3.2Å; V80-A83 PolarHBondContact O-N 2.96Å; V80-Q84 WeakPolarHBondContact O-CG 3.46Å; V80-Q84 PolarHBondContact O-N 2.93Å; V80-P307 HydrophobicContact CG1-CB 4.35Å
81	N	45.3	Very low	40	Very low	94 Å²	94	85.1 Å²	85.1	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-63.5	-44.4	-179.9	-71.5	-6.4	0	0	0	111.1	E77 Q78 A83 Q84 T85	E77-N81 VanDerWaalsContact O-CB 3.31Å; E77-N81 WeakPolarHBondContact O-CB 3.25Å; E77-N81 PolarHBondContact O-N 3.32Å; E77-N81 PolarHBondContact O-ND2 3.27Å; E77-N81 PolarHBondContact O-OD1 3.33Å; Q78-N81 PolarHBondContact O-N 2.86Å; N81-A83 VanDerWaalsContact C-N 3.33Å; N81-A83 PolarHBondContact O-N 3.08Å; N81-Q84 PolarHBondContact O-N 3.26Å; N81-T85 PolarHBondContact O-N 3.39Å; N81-T85 PolarHBondContact O-OG1 2.84Å; N81-T85 VanDerWaalsContact O-OG1 3.04Å
82	A	38.7	Very low	39.5	Very low	55 Å²	55	82.2 Å²	82.2	46%	0.455	43%	0.431	S	S	.	.	H	α-helix	trans	-59.3	-42	175.1	0	0	0	0	0	112.3	Q78 T85 V86	Q78-A82 WeakPolarHBondContact O-CB 3.37Å; Q78-A82 PolarHBondContact O-N 3.12Å; A82-T85 PolarHBondContact O-N 2.99Å; A82-V86 WeakPolarHBondContact O-CG2 3.49Å; A82-V86 PolarHBondContact O-N 3.22Å
83	A	34.9	Very low	39.1	Very low	22 Å²	22	87.1 Å²	87.1	18%	0.182	45%	0.45	C	S	.	.	H	α-helix	trans	-67.8	-34.4	177.8	0	0	0	0	0	113.3	E79 V80 N81 T87 M328	E79-A83 WeakPolarHBondContact O-CB 3.36Å; E79-A83 PolarHBondContact O-N 3.45Å; E79-A83 VanDerWaalsContact O-N 3.12Å; V80-A83 PolarHBondContact O-N 2.96Å; N81-A83 VanDerWaalsContact C-N 3.33Å; N81-A83 PolarHBondContact O-N 3.08Å; A83-T87 WeakPolarHBondContact O-CB 3.42Å; A83-T87 PolarHBondContact O-N 2.95Å; A83-T87 PolarHBondContact O-OG1 3.42Å; A83-M328 HydrophobicContact CB-CG 4.48Å; A83-M328 HydrophobicContact CB-SD 3.3Å; A83-M328 WeakPolarHBondContact CB-SD 3.01Å
84	Q	36.7	Very low	38.7	Very low	103 Å²	103	87.8 Å²	87.8	48%	0.481	46%	0.464	S	S	.	.	H	α-helix	trans	-64.9	-45	171.9	-71	177.9	17.2	0	0	111.1	V80 N81 V86 T87 M88	V80-Q84 WeakPolarHBondContact O-CG 3.46Å; V80-Q84 PolarHBondContact O-N 2.93Å; N81-Q84 PolarHBondContact O-N 3.26Å; Q84-V86 PolarHBondContact O-N 3.49Å; Q84-T87 WeakPolarHBondContact O-CB 3.31Å; Q84-T87 PolarHBondContact O-N 3.44Å; Q84-M88 WeakPolarHBondContact O-CG 3.46Å; Q84-M88 PolarHBondContact O-N 3Å
85	T	32.9	Very low	38.2	Very low	83 Å²	83	88.5 Å²	88.5	51%	0.509	47%	0.472	S	S	.	.	H	α-helix	trans	-60.5	-45	176.1	-50.8	0	0	0	0	112.3	N81 A82 T87 M88 L89	N81-T85 PolarHBondContact O-N 3.39Å; N81-T85 PolarHBondContact O-OG1 2.84Å; N81-T85 VanDerWaalsContact O-OG1 3.04Å; A82-T85 PolarHBondContact O-N 2.99Å; T85-T87 VanDerWaalsContact C-N 3.3Å; T85-T87 PolarHBondContact O-N 3.37Å; T85-M88 PolarHBondContact O-N 3.48Å; T85-L89 HydrophobicContact CG2-CD1 4.16Å; T85-L89 WeakPolarHBondContact O-CG 3.44Å; T85-L89 PolarHBondContact O-N 2.85Å
86	V	31.8	Very low	37.3	Very low	89 Å²	89	88 Å²	88	54%	0.539	48%	0.481	S	S	.	.	H	α-helix	trans	-61.8	-39.3	176.1	171.1	0	0	0	0	111.5	A82 Q84 L89 S90	A82-V86 WeakPolarHBondContact O-CG2 3.49Å; A82-V86 PolarHBondContact O-N 3.22Å; Q84-V86 PolarHBondContact O-N 3.49Å; V86-L89 PolarHBondContact O-N 2.98Å; V86-S90 PolarHBondContact O-N 3.33Å; V86-S90 PolarHBondContact O-OG 3.49Å
87	T	32.9	Very low	36.6	Very low	40 Å²	40	91.2 Å²	91.2	25%	0.245	51%	0.506	C	S	.	.	H	α-helix	trans	-64	-42.3	177.4	-56.3	0	0	0	0	111.3	A83 Q84 T85 S90 F91	A83-T87 WeakPolarHBondContact O-CB 3.42Å; A83-T87 PolarHBondContact O-N 2.95Å; A83-T87 PolarHBondContact O-OG1 3.42Å; Q84-T87 WeakPolarHBondContact O-CB 3.31Å; Q84-T87 PolarHBondContact O-N 3.44Å; T85-T87 VanDerWaalsContact C-N 3.3Å; T85-T87 PolarHBondContact O-N 3.37Å; T87-S90 PolarHBondContact O-N 2.98Å; T87-S90 PolarHBondContact O-OG 2.91Å; T87-F91 HydrophobicContact CG2-CD2 4.42Å; T87-F91 HydrophobicContact CG2-CE2 3.87Å; T87-F91 WeakPolarHBondContact O-CD2 3.28Å; T87-F91 PolarHBondContact O-N 2.93Å
88	M	29.6	Very low	35.8	Very low	128 Å²	128	95.8 Å²	95.8	63%	0.631	53%	0.533	S	S	*	.	H	α-helix	trans	-62.5	-42.3	174.1	-69.8	-71	-72.7	0	0	112.3	Q84 T85 F91 S92	Q84-M88 WeakPolarHBondContact O-CG 3.46Å; Q84-M88 PolarHBondContact O-N 3Å; T85-M88 PolarHBondContact O-N 3.48Å; M88-F91 PolarHBondContact O-N 3.46Å; M88-S92 PolarHBondContact O-OG 3.06Å
89	L	31	Very low	35	Very low	106 Å²	106	95.8 Å²	95.8	56%	0.555	54%	0.542	S	S	*	.	H	α-helix	trans	-66.4	-36.4	179.4	-73.2	167.8	0	0	0	113	T85 V86 F91 S92	T85-L89 HydrophobicContact CG2-CD1 4.16Å; T85-L89 WeakPolarHBondContact O-CG 3.44Å; T85-L89 PolarHBondContact O-N 2.85Å; V86-L89 PolarHBondContact O-N 2.98Å; L89-F91 VanDerWaalsContact C-N 3.27Å; L89-F91 PolarHBondContact O-N 3.34Å; L89-S92 PolarHBondContact O-N 2.99Å; L89-S92 VanDerWaalsContact O-N 3.12Å
90	S	30.3	Very low	34.1	Very low	60 Å²	60	100.7 Å²	100.7	42%	0.42	56%	0.561	S	S	.	*	H	α-helix	trans	-63	-31.7	173.7	45.4	0	0	0	0	113.1	V86 T87 S92	V86-S90 PolarHBondContact O-N 3.33Å; V86-S90 PolarHBondContact O-OG 3.49Å; T87-S90 PolarHBondContact O-N 2.98Å; T87-S90 PolarHBondContact O-OG 2.91Å; S90-S92 VanDerWaalsContact C-N 3.25Å; S90-S92 PolarHBondContact O-N 3.13Å
91	F	32.7	Very low	33.5	Very low	117 Å²	117	107 Å²	107	51%	0.513	60%	0.601	S	S	.	*	H	α-helix	trans	-71	-17.6	174.9	-74.5	-62.8	0	0	0	114	T87 M88 L89	T87-F91 HydrophobicContact CG2-CD2 4.42Å; T87-F91 HydrophobicContact CG2-CE2 3.87Å; T87-F91 WeakPolarHBondContact O-CD2 3.28Å; T87-F91 PolarHBondContact O-N 2.93Å; M88-F91 PolarHBondContact O-N 3.46Å; L89-F91 VanDerWaalsContact C-N 3.27Å; L89-F91 PolarHBondContact O-N 3.34Å
92	S	31.4	Very low	32.8	Very low	83 Å²	83	109.9 Å²	109.9	58%	0.58	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-8.1	180	-56	0	0	0	0	114.4	M88 L89 S90	M88-S92 PolarHBondContact O-OG 3.06Å; L89-S92 PolarHBondContact O-N 2.99Å; L89-S92 VanDerWaalsContact O-N 3.12Å; S90-S92 VanDerWaalsContact C-N 3.25Å; S90-S92 PolarHBondContact O-N 3.13Å
93	Q	34.4	Very low	32.5	Very low	164 Å²	164	114.2 Å²	114.2	77%	0.766	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-26	-177.4	-66.6	-168.8	-29.2	0	0	114	S95	Q93-S95 PolarHBondContact O-N 3.4Å
94	D	36.9	Very low	32.1	Very low	146 Å²	146	118 Å²	118	78%	0.781	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	5.9	-177.9	-72.9	-16.8	0	0	0	114.7
95	S	35.3	Very low	32	Very low	87 Å²	87	119.3 Å²	119.3	61%	0.608	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	6	-177.4	54.6	0	0	0	0	115.1	Q93	Q93-S95 PolarHBondContact O-N 3.4Å
96	N	30.5	Very low	31.9	Very low	153 Å²	153	124.7 Å²	124.7	82%	0.818	70%	0.696	S	S	*	*			trans	-122	54.6	-175.6	-90.4	-34.1	0	0	0	113.7
97	S	32.6	Very low	31.9	Very low	96 Å²	96	123.5 Å²	123.5	67%	0.671	70%	0.702	S	S	*	*			trans	-148.9	137.5	158.3	58.8	0	0	0	0	112.1
98	D	33.3	Very low	32	Very low	162 Å²	162	129.3 Å²	129.3	87%	0.866	73%	0.731	S	S	*	*			trans	95.6	94.6	171.6	-57.4	-14.8	0	0	0	117
99	T	30.8	Very low	32.2	Very low	128 Å²	128	130 Å²	130	79%	0.785	74%	0.737	S	S	*	*			trans	-115.1	144.5	173.4	-29.5	0	0	0	0	110.6
100	K	30.4	Very low	32.2	Very low	186 Å²	186	134.2 Å²	134.2	81%	0.809	75%	0.751	S	S	*	*			trans	82.7	107.6	166.6	-50.3	173.7	-175.5	176.2	0	117.2
101	T	31.9	Very low	32.4	Very low	146 Å²	146	140.5 Å²	140.5	90%	0.896	77%	0.774	S	S	*	*				-158.2	140.8	103.5	24.1	0	0	0	0	110.7
102	N	28.9	Very low	32.2	Very low	154 Å²	154	137.8 Å²	137.8	82%	0.824	78%	0.779	S	S	*	*			trans	-90.9	143.2	-176.6	-64.6	-23.9	0	0	0	112.3
103	V	33.3	Very low	32.2	Very low	146 Å²	146	140.7 Å²	140.7	89%	0.885	79%	0.793	S	S	*	*			trans	-144.1	133	140.3	-177.9	0	0	0	0	108.6
104	S	27.2	Very low	31.8	Very low	102 Å²	102	138.5 Å²	138.5	71%	0.713	80%	0.795	S	S	*	*			trans	-110.6	144.1	171.7	-56.5	0	0	0	0	110.2
105	T	33.8	Very low	31.7	Very low	130 Å²	130	137.1 Å²	137.1	80%	0.798	80%	0.797	S	S	*	*				-179.3	119	117.2	30.3	0	0	0	0	113.3
106	Q	30.3	Very low	31.4	Very low	195 Å²	195	136.8 Å²	136.8	91%	0.911	81%	0.807	S	S	*	*			trans	27	135.2	138.5	-60.2	179.2	-10.6	0	0	122.5
107	G	32.1	Very low	31.3	Very low	65 Å²	65	137.1 Å²	137.1	67%	0.67	81%	0.809	S	S	*	*			trans	152	102.8	137.7	0	0	0	0	0	117.6
108	L	34.4	Very low	31.2	Very low	161 Å²	161	140.4 Å²	140.4	84%	0.843	82%	0.819	S	S	*	*			trans	63.4	145.4	146.7	-52	171.6	0	0	0	117.8
109	D	34.4	Very low	30.9	Very low	142 Å²	142	137.9 Å²	137.9	76%	0.759	81%	0.814	S	S	*	*			cis	-150.8	175	-3.1	-110.6	-35.3	0	0	0	110.9
110	K	31.8	Very low	31	Very low	196 Å²	196	136.7 Å²	136.7	85%	0.852	80%	0.803	S	S	*	*			trans	-79.2	144	-170.6	-62.2	171.5	179.3	173.3	0	115.5
111	E	33.3	Very low	31.1	Very low	192 Å²	192	135 Å²	135	90%	0.897	80%	0.803	S	S	*	*			trans	-172.6	156.1	139.5	-96	-88.9	70.1	0	0	107.8
112	G	28.3	Very low	31.3	Very low	60 Å²	60	134.5 Å²	134.5	62%	0.619	80%	0.795	S	S	*	*			cis	-175.3	-9.4	-2.7	0	0	0	0	0	117.6
113	V	31.6	Very low	31.4	Very low	144 Å²	144	134.8 Å²	134.8	87%	0.873	80%	0.796	S	S	*	*			trans	-117.3	124.9	-169.3	-178	0	0	0	0	113.5
114	S	27.1	Very low	31.5	Very low	117 Å²	117	134.9 Å²	134.9	82%	0.818	79%	0.792	S	S	*	*			trans	-98	139.3	168.9	57.5	0	0	0	0	111.9
115	S	33.6	Very low	31.8	Very low	117 Å²	117	139.6 Å²	139.6	82%	0.818	80%	0.802	S	S	*	*			trans	-140.9	134.9	157.1	49.1	0	0	0	0	110
116	G	29.7	Very low	31.8	Very low	80 Å²	80	142.2 Å²	142.2	83%	0.825	80%	0.803	S	S	*	*			trans	-61.2	151.9	-156.1	0	0	0	0	0	117.6
117	D	27.5	Very low	31.7	Very low	161 Å²	161	142.1 Å²	142.1	86%	0.861	80%	0.802	S	S	*	*			trans	-57.6	144.1	153.6	-63.2	-60.5	0	0	0	110.6
118	D	30.9	Very low	31.5	Very low	164 Å²	164	144.8 Å²	144.8	88%	0.877	81%	0.811	S	S	*	*			trans	-152.6	100.1	147.3	-105.8	-24	0	0	0	107.1
119	S	28.4	Very low	31.5	Very low	109 Å²	109	142 Å²	142	76%	0.762	81%	0.81	S	S	*	*			trans	-88.1	98.4	174.9	53.6	0	0	0	0	109.8
120	D	32.1	Very low	31.4	Very low	103 Å²	103	140.8 Å²	140.8	55%	0.551	81%	0.813	S	S	*	*			trans	-96.5	114.2	165.3	-88.6	-12.3	0	0	0	109	K519	D120-K519 IonicContact OD2-NZ 2.65Å; D120-K519 PolarHBondContact OD2-NZ 2.82Å
121	D	31.3	Very low	31.2	Very low	150 Å²	150	138.9 Å²	138.9	80%	0.802	81%	0.813	S	S	*	*			trans	-70.2	144.8	166.5	-64.8	-51.2	0	0	0	110.8
122	D	36.5	Very low	31.1	Very low	137 Å²	137	138.8 Å²	138.8	73%	0.733	81%	0.812	S	S	*	*			trans	-149.4	67	169.1	-88.9	-41	0	0	0	107.4
123	D	32.4	Very low	31.2	Very low	159 Å²	159	141.1 Å²	141.1	85%	0.85	82%	0.819	S	S	*	*			trans	-102.2	102.8	166.5	-93.4	-26.8	0	0	0	108.6
124	D	35.3	Very low	31.2	Very low	148 Å²	148	146 Å²	146	79%	0.791	82%	0.822	S	S	*	*			trans	-160.6	91.4	170.7	-118.9	-26.6	0	0	0	111.5
125	E	33.5	Very low	31.2	Very low	201 Å²	201	152.1 Å²	152.1	94%	0.939	83%	0.827	S	S	*	*			trans	-158.7	138.7	134.4	-118.4	179.6	-162.1	0	0	111.6
126	K	34.2	Very low	31.1	Very low	185 Å²	185	150 Å²	150	80%	0.804	82%	0.824	S	S	*	*			trans	-94	145.4	-160.3	-70.3	172.3	177.5	167.5	0	114.1
127	E	26.4	Very low	31.3	Very low	194 Å²	194	158.1 Å²	158.1	91%	0.907	83%	0.829	S	S	*	*			trans	-57.3	136.3	161.1	-72.3	-171.9	120.9	0	0	112.1
128	S	29	Very low	31.3	Very low	121 Å²	121	158.2 Å²	158.2	85%	0.846	83%	0.825	S	S	*	*			trans	-166.3	102.7	137.2	44.8	0	0	0	0	112.9
129	A	33.2	Very low	31.4	Very low	101 Å²	101	158.9 Å²	158.9	84%	0.835	83%	0.827	S	S	*	*			trans	-168.3	98.8	152.5	0	0	0	0	0	112.7
130	S	33.6	Very low	31.7	Very low	117 Å²	117	161.5 Å²	161.5	82%	0.818	83%	0.828	S	S	*	*			trans	-12.8	133.9	162.9	55.3	0	0	0	0	120.9
131	N	27.4	Very low	31.7	Very low	157 Å²	157	162.4 Å²	162.4	84%	0.84	84%	0.839	S	S	*	*			trans	-30	137.9	153.9	-77.1	-49.3	0	0	0	116.4
132	Q	32.1	Very low	31.8	Very low	190 Å²	190	163.4 Å²	163.4	89%	0.888	84%	0.843	S	S	*	*				-158.1	126.3	121.8	-114.1	175.3	51.1	0	0	113.5
133	S	29.6	Very low	31.8	Very low	109 Å²	109	162 Å²	162	76%	0.762	84%	0.842	S	S	*	*			trans	-78.4	132.4	176.2	159.1	0	0	0	0	111.8
134	R	31.9	Very low	32	Very low	245 Å²	245	159.7 Å²	159.7	93%	0.925	84%	0.838	S	S	*	*			trans	-136.7	108.8	156.1	-84.5	-168.7	170.1	-177.5	-2.6	111.9
135	R	27.2	Very low	32	Very low	247 Å²	247	157.5 Å²	157.5	93%	0.932	83%	0.834	S	S	*	*			trans	-62.4	143.5	160.2	-76.2	173.6	162.1	175.5	-6.5	110
136	G	31.9	Very low	32.1	Very low	73 Å²	73	152.7 Å²	152.7	75%	0.753	82%	0.823	S	S	*	*			trans	-161.9	65.6	-177.9	0	0	0	0	0	115.9
137	R	32.6	Very low	32	Very low	250 Å²	250	149.9 Å²	149.9	94%	0.943	82%	0.821	S	S	*	*			trans	44.4	129.2	157.6	-80.4	-178.3	171.4	167.1	-2.4	121.6
138	E	27.2	Very low	32.4	Very low	163 Å²	163	150.1 Å²	150.1	76%	0.762	82%	0.819	S	S	*	*			trans	-56.3	152.9	154.9	-60.3	158.6	97.8	0	0	113.1
139	L	34.1	Very low	32.7	Very low	178 Å²	178	153.9 Å²	153.9	93%	0.932	82%	0.821	S	S	*	*			trans	-137.8	131.4	147.3	-94.1	167.8	0	0	0	108.7
140	Q	34.8	Very low	32.9	Very low	164 Å²	164	154.3 Å²	154.3	77%	0.766	81%	0.814	S	S	*	*			trans	-84.5	155.8	-176.8	-67.3	175.1	-2.7	0	0	111.9
141	P	31.5	Very low	32.7	Very low	121 Å²	121	155.3 Å²	155.3	79%	0.786	81%	0.81	S	S	*	*			trans	-86.7	157.4	179.4	35.4	-35.2	0	0	0	113
142	L	33.3	Very low	33	Very low	171 Å²	171	156.8 Å²	156.8	90%	0.895	81%	0.809	S	S	*	*			trans	-129.3	154	167.1	-79.6	170.9	0	0	0	111.3
143	P	35.8	Very low	32.9	Very low	108 Å²	108	156.2 Å²	156.2	70%	0.701	81%	0.806	S	S	*	*			trans	-122.9	-163.4	-154.4	42.4	-27.6	0	0	0	113.9
144	S	36.5	Very low	33.1	Very low	110 Å²	110	155.9 Å²	155.9	77%	0.769	80%	0.801	S	S	*	*			trans	80.8	147.9	166.8	89.9	0	0	0	0	115.4
145	S	36.1	Very low	32.9	Very low	103 Å²	103	153.4 Å²	153.4	72%	0.72	80%	0.8	S	S	*	*			cis	-165.4	176.4	-14.9	51.2	0	0	0	0	111.8
146	S	36.3	Very low	33.2	Very low	99 Å²	99	145.5 Å²	145.5	69%	0.692	80%	0.796	S	S	*	*			trans	101.9	95.2	146.3	80.4	0	0	0	0	120.8
147	T	32.6	Very low	33	Very low	126 Å²	126	148.7 Å²	148.7	77%	0.773	80%	0.801	S	S	*	*				42.7	116.6	120.9	-2.4	0	0	0	0	120.9
148	K	34.3	Very low	33.1	Very low	200 Å²	200	144.3 Å²	144.3	87%	0.87	80%	0.801	S	S	*	*				-171.4	143.6	93.8	-96.1	161.6	-173.7	177.1	0	113.3
149	K	34.6	Very low	33.4	Very low	200 Å²	200	139.7 Å²	139.7	87%	0.87	80%	0.798	S	S	*	*			trans	-97.8	-163.9	172.9	-61.6	178.2	168.4	178.9	0	110
150	P	36.7	Very low	33.2	Very low	109 Å²	109	140.5 Å²	140.5	71%	0.708	80%	0.797	S	S	*	*				-124.6	-173.2	-90.4	39.8	-22.3	0	0	0	111.6
151	L	30.3	Very low	33.2	Very low	139 Å²	139	142.1 Å²	142.1	73%	0.728	80%	0.801	S	S	*	*			trans	-177.9	138.1	134.9	-120.8	63.6	0	0	0	115.6
152	K	32.8	Very low	33.1	Very low	187 Å²	187	142.3 Å²	142.3	81%	0.813	80%	0.8	S	S	*	*			trans	56.4	111.8	140.3	-77.5	172.6	-170.6	-177.3	0	123.4
153	Q	30.1	Very low	32.9	Very low	179 Å²	179	141.5 Å²	141.5	84%	0.836	80%	0.796	S	S	*	*			trans	-48.9	169.4	136.1	-80.7	-178.2	4.5	0	0	113.3
154	P	34.4	Very low	32.7	Very low	101 Å²	101	141.1 Å²	141.1	66%	0.656	80%	0.796	S	S	*	*			cis	-156.4	177.2	43.3	44.9	-22.7	0	0	0	121.5
155	Q	28.6	Very low	32.6	Very low	193 Å²	193	145.5 Å²	145.5	90%	0.902	80%	0.801	S	S	*	*			trans	56.8	123.7	144.1	-76.1	166.9	0.8	0	0	121.6
156	G	32.9	Very low	32.6	Very low	81 Å²	81	145.3 Å²	145.3	84%	0.835	81%	0.806	S	S	*	*			trans	-161.8	102	161.5	0	0	0	0	0	111.3
157	T	27.9	Very low	33	Very low	141 Å²	141	144 Å²	144	87%	0.865	79%	0.789	S	S	*	*			trans	-80.1	144.3	174.7	38.6	0	0	0	0	112.5
158	V	34.5	Very low	33.6	Very low	157 Å²	157	142.7 Å²	142.7	95%	0.952	78%	0.782	S	S	*	*			trans	154.1	138.9	155.1	157.6	0	0	0	0	106.3
159	G	33.3	Very low	34.6	Very low	66 Å²	66	138.2 Å²	138.2	68%	0.68	77%	0.772	S	S	*	*			cis	-174.2	149.5	-4.3	0	0	0	0	0	109.2
160	E	29.4	Very low	35.4	Very low	196 Å²	196	130 Å²	130	92%	0.916	74%	0.737	S	S	*	*			trans	-79.3	118.9	-165.3	-174.7	173.7	-151.6	0	0	113.6
161	K	35.2	Very low	36.4	Very low	198 Å²	198	132.4 Å²	132.4	86%	0.861	74%	0.737	S	S	*	*			trans	-143.9	90.6	169.4	-73.2	-166	176.8	176.6	0	114.2
162	T	29.9	Very low	37.6	Very low	124 Å²	124	132.4 Å²	132.4	76%	0.761	73%	0.73	S	S	*	*			trans	43.9	92.4	137.3	-33.3	0	0	0	0	119
163	L	29.6	Very low	38.6	Very low	154 Å²	154	126.6 Å²	126.6	81%	0.806	72%	0.718	S	S	*	*			trans	-94.5	87.8	165.1	-173.8	69.7	0	0	0	111.3
164	S	30.3	Very low	39.8	Very low	101 Å²	101	120.7 Å²	120.7	71%	0.706	69%	0.692	S	S	*	*			trans	-147.9	56.6	169	69.6	0	0	0	0	112.4
165	K	34.2	Very low	40.7	Very low	201 Å²	201	116.6 Å²	116.6	87%	0.874	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-96	116.2	159	-81.8	-175.1	174.7	179.1	0	108.3	Q167	K165-Q167 PolarHBondContact O-N 3.3Å
166	A	37.4	Very low	41.8	Very low	99 Å²	99	111.7 Å²	111.7	82%	0.818	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-55.2	136.4	170.8	0	0	0	0	0	109.5
167	Q	45	Very low	42.6	Very low	72 Å²	72	114.1 Å²	114.1	34%	0.336	63%	0.633	S	S	.	*	P	Polyproline II helix	trans	-62.7	145.7	173.5	-75	173.4	-63.2	0	0	109.6	K165 V169 N241	K165-Q167 PolarHBondContact O-N 3.3Å; Q167-V169 PolarHBondContact O-N 2.86Å; Q167-N241 PolarHBondContact NE2-O 2.87Å
168	P	45.1	Very low	43.9	Very low	98 Å²	98	109.8 Å²	109.8	64%	0.636	60%	0.601	S	S	*	*			trans	-66.5	110.8	178.8	27.5	-32.9	0	0	0	109.2	L170	P168-L170 PolarHBondContact O-N 3.31Å
169	V	53.4	Low	45.1	Very low	107 Å²	107	105.2 Å²	105.2	65%	0.648	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-53.9	129.6	166.7	-178.4	0	0	0	0	107.7	Q167	Q167-V169 PolarHBondContact O-N 2.86Å
170	L	52.8	Low	46.5	Very low	26 Å²	26	102.5 Å²	102.5	14%	0.136	54%	0.539	C	S	.	.	P	Polyproline II helix	trans	-53.2	141.7	178.6	-69.3	175.6	0	0	0	110.7	P168 D174 W175 G295 V317	P168-L170 PolarHBondContact O-N 3.31Å; L170-D174 HydrophobicContact CB-CB 4.25Å; L170-W175 HydrophobicContact CB-CD2 4.38Å; L170-W175 HydrophobicContact CB-CH2 4.26Å; L170-W175 HydrophobicContact CB-CZ2 3.75Å; L170-W175 HydrophobicContact CD1-CE3 4.25Å; L170-W175 HydrophobicContact CD1-CH2 3.85Å; L170-W175 HydrophobicContact CD1-CZ2 4.19Å; L170-W175 HydrophobicContact CD1-CZ3 3.84Å; L170-W175 HydrophobicContact CG-CH2 4.45Å; L170-W175 HydrophobicContact CG-CZ2 4.38Å; L170-W175 PolarHBondContact O-NE1 3.47Å; L170-W175 VanDerWaalsContact O-NE1 3.17Å; L170-G295 VanDerWaalsContact CD1-CA 3.49Å; L170-V317 HydrophobicContact CD1-CB 4.28Å; L170-V317 HydrophobicContact CD1-CG2 3.42Å; L170-V317 VanDerWaalsContact CD1-CG2 3.42Å; L170-V317 HydrophobicContact CD2-CB 4.06Å; L170-V317 HydrophobicContact CD2-CG1 4.38Å; L170-V317 HydrophobicContact CD2-CG2 3.81Å; L170-V317 HydrophobicContact CG-CG2 4.27Å
171	K	57.5	Low	47.9	Very low	161 Å²	161	95.3 Å²	95.3	70%	0.7	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-71.7	155.2	-177.9	-65.3	179.8	-179.9	176.4	0	109	A173 D174 W175	K171-A173 PolarHBondContact O-N 2.92Å; K171-A173 VanDerWaalsContact O-N 3.14Å; K171-D174 WeakPolarHBondContact CB-OD2 3.28Å; K171-D174 PolarHBondContact N-OD2 3.16Å; K171-D174 VanDerWaalsContact O-CB 3.32Å; K171-D174 WeakPolarHBondContact O-CB 3.4Å; K171-D174 PolarHBondContact O-N 3.33Å; K171-W175 PolarHBondContact O-N 3.15Å
172	K	54.3	Low	49.1	Very low	138 Å²	138	89 Å²	89	60%	0.6	50%	0.499	S	S	*	.	H	α-helix	trans	-54.4	-39.1	-175.8	-165	-173.4	173.1	-137.3	0	114	D174 W175 E176	K172-D174 PolarHBondContact O-N 2.76Å; K172-W175 WeakPolarHBondContact O-CB 3.49Å; K172-W175 PolarHBondContact O-N 3.23Å; K172-W175 VanDerWaalsContact O-N 3.14Å; K172-E176 WeakPolarHBondContact CE-OE1 3.33Å; K172-E176 IonicContact NZ-OE1 2.85Å; K172-E176 PolarHBondContact NZ-OE1 3.31Å; K172-E176 PolarHBondContact O-N 3.13Å; K172-E176 VanDerWaalsContact O-N 3.14Å
173	A	54	Low	50.9	Low	66 Å²	66	84.5 Å²	84.5	55%	0.545	47%	0.474	S	S	.	.	H	α-helix	trans	-60.8	-30.1	176.6	0	0	0	0	0	113.5	K171 L177	K171-A173 PolarHBondContact O-N 2.92Å; K171-A173 VanDerWaalsContact O-N 3.14Å; A173-L177 PolarHBondContact O-N 2.7Å
174	D	55.8	Low	52.8	Low	54 Å²	54	82.6 Å²	82.6	29%	0.289	46%	0.463	S	S	.	.	H	α-helix	trans	-71.5	-37.6	177.2	-51.1	-46	0	0	0	110.5	L170 K171 K172 L177 Y178 V317	L170-D174 HydrophobicContact CB-CB 4.25Å; K171-D174 WeakPolarHBondContact CB-OD2 3.28Å; K171-D174 PolarHBondContact N-OD2 3.16Å; K171-D174 VanDerWaalsContact O-CB 3.32Å; K171-D174 WeakPolarHBondContact O-CB 3.4Å; K171-D174 PolarHBondContact O-N 3.33Å; K172-D174 PolarHBondContact O-N 2.76Å; D174-L177 PolarHBondContact O-N 2.85Å; D174-Y178 WeakPolarHBondContact O-CD2 3.46Å; D174-Y178 PolarHBondContact O-N 3.11Å; D174-V317 HydrophobicContact CB-CG2 4.48Å
175	W	53.8	Low	55.2	Low	16 Å²	16	79.2 Å²	79.2	6%	0.061	44%	0.438	C	S	.	.	H	α-helix	trans	-66	-39	173.9	-58.5	127.1	0	0	0	113.1	L170 K171 K172 L177 Y178 H179 M180 Q292 G295	L170-W175 HydrophobicContact CB-CD2 4.38Å; L170-W175 HydrophobicContact CB-CH2 4.26Å; L170-W175 HydrophobicContact CB-CZ2 3.75Å; L170-W175 HydrophobicContact CD1-CE3 4.25Å; L170-W175 HydrophobicContact CD1-CH2 3.85Å; L170-W175 HydrophobicContact CD1-CZ2 4.19Å; L170-W175 HydrophobicContact CD1-CZ3 3.84Å; L170-W175 HydrophobicContact CG-CH2 4.45Å; L170-W175 HydrophobicContact CG-CZ2 4.38Å; L170-W175 PolarHBondContact O-NE1 3.47Å; L170-W175 VanDerWaalsContact O-NE1 3.17Å; K171-W175 PolarHBondContact O-N 3.15Å; K172-W175 WeakPolarHBondContact O-CB 3.49Å; K172-W175 PolarHBondContact O-N 3.23Å; K172-W175 VanDerWaalsContact O-N 3.14Å; W175-L177 VanDerWaalsContact C-N 3.31Å; W175-Y178 CarbonylContact O-C 3.51Å; W175-Y178 PolarHBondContact O-N 3.32Å; W175-H179 WeakPolarHBondContact O-CA 3.47Å; W175-H179 PolarHBondContact O-N 2.76Å; W175-M180 HydrophobicContact CE3-CB 3.88Å; W175-M180 HydrophobicContact CE3-CE 4.05Å; W175-M180 HydrophobicContact CE3-CG 4.35Å; W175-M180 HydrophobicContact CE3-SD 3.66Å; W175-M180 HydrophobicContact CH2-CE 4.44Å; W175-M180 HydrophobicContact CZ3-CB 4.48Å; W175-M180 HydrophobicContact CZ3-CE 3.47Å; W175-M180 VanDerWaalsContact CZ3-CE 3.47Å; W175-M180 HydrophobicContact CZ3-SD 3.56Å; W175-M180 VanDerWaalsContact CZ3-SD 3.56Å; W175-M180 PolarHBondContact O-N 3Å; W175-Q292 HydrophobicContact CD2-CG 3.68Å; W175-Q292 HydrophobicContact CE3-CG 3.64Å; W175-Q292 HydrophobicContact CG-CG 4.3Å; W175-Q292 HydrophobicContact CH2-CB 4.34Å; W175-Q292 HydrophobicContact CH2-CG 3.84Å; W175-Q292 WeakPolarHBondContact CH2-O 3.48Å; W175-Q292 HydrophobicContact CZ2-CG 3.95Å; W175-Q292 WeakPolarHBondContact CZ2-O 3.48Å; W175-Q292 HydrophobicContact CZ3-CB 4.38Å; W175-Q292 HydrophobicContact CZ3-CG 3.71Å; W175-G295 VanDerWaalsContact CH2-CA 3.41Å
176	E	51.1	Low	57.6	Low	89 Å²	89	70.4 Å²	70.4	42%	0.416	40%	0.402	S	S	.	.	H	α-helix	trans	-62.8	-40.5	177.6	-74.4	171.6	-171.3	0	0	110.5	K172 H179 D181	K172-E176 WeakPolarHBondContact CE-OE1 3.33Å; K172-E176 IonicContact NZ-OE1 2.85Å; K172-E176 PolarHBondContact NZ-OE1 3.31Å; K172-E176 PolarHBondContact O-N 3.13Å; K172-E176 VanDerWaalsContact O-N 3.14Å; E176-H179 PolarHBondContact O-N 3.41Å; E176-H179 PolarHBondContact O-ND1 2.87Å; E176-D181 VanDerWaalsContact CA-OD2 3.27Å; E176-D181 WeakPolarHBondContact CA-OD2 3.33Å; E176-D181 WeakPolarHBondContact CG-OD2 3.38Å
177	L	50.6	Low	59.9	Low	132 Å²	132	74.1 Å²	74.1	69%	0.691	40%	0.4	S	S	*	.	H	α-helix	trans	-69.2	-39.4	176.2	-160.9	80.1	0	0	0	113.3	A173 D174 W175 H179	A173-L177 PolarHBondContact O-N 2.7Å; D174-L177 PolarHBondContact O-N 2.85Å; W175-L177 VanDerWaalsContact C-N 3.31Å; L177-H179 VanDerWaalsContact C-N 3.28Å
178	Y	55.5	Low	62.2	Low	50 Å²	50	72.3 Å²	72.3	20%	0.196	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	3.7	176.2	-81.6	-94	0	0	0	113.8	D174 W175 M180 R297 V317 K349	D174-Y178 WeakPolarHBondContact O-CD2 3.46Å; D174-Y178 PolarHBondContact O-N 3.11Å; W175-Y178 CarbonylContact O-C 3.51Å; W175-Y178 PolarHBondContact O-N 3.32Å; Y178-M180 PolarHBondContact O-N 3.11Å; Y178-R297 PolarHBondContact O-NH1 2.67Å; Y178-R297 VanDerWaalsContact O-NH1 3.1Å; Y178-V317 HydrophobicContact CD2-CG2 3.88Å; Y178-V317 HydrophobicContact CE2-CB 4.36Å; Y178-V317 HydrophobicContact CE2-CG2 3.67Å; Y178-K349 PolarHBondContact OH-NZ 2.86Å; Y178-K349 VanDerWaalsContact OH-NZ 3.07Å
179	H	58.6	Low	64.4	Low	62 Å²	62	72.5 Å²	72.5	29%	0.287	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	24.1	175.4	-60.7	-41.5	0	0	0	115.8	R52 R53 W175 E176 L177	R52-H179 PolarHBondContact O-CD2 2.69Å; R52-H179 VanDerWaalsContact O-CD2 3.3Å; R52-H179 PolarHBondContact O-NE2 3.39Å; R53-H179 VanDerWaalsContact CA-CD2 3.49Å; R53-H179 WeakPolarHBondContact CA-CD2 3.3Å; R53-H179 HydrophobicContact CB-CB 3.9Å; R53-H179 HydrophobicContact CG-CB 3.7Å; R53-H179 VanDerWaalsContact CZ-O 3.24Å; R53-H179 PolarHBondContact NE-O 2.72Å; R53-H179 PolarHBondContact NH1-O 3.49Å; R53-H179 PolarHBondContact O-CD2 2.69Å; W175-H179 WeakPolarHBondContact O-CA 3.47Å; W175-H179 PolarHBondContact O-N 2.76Å; E176-H179 PolarHBondContact O-N 3.41Å; E176-H179 PolarHBondContact O-ND1 2.87Å; L177-H179 VanDerWaalsContact C-N 3.28Å
180	M	63.4	Low	66.4	Low	8 Å²	8	71 Å²	71	4%	0.039	37%	0.373	C	S	.	.			trans	-84.5	-5.3	-176.6	-66.4	173.3	71.1	0	0	113.6	W175 Y178 G182 A183 V290 Q292 W296	W175-M180 HydrophobicContact CE3-CB 3.88Å; W175-M180 HydrophobicContact CE3-CE 4.05Å; W175-M180 HydrophobicContact CE3-CG 4.35Å; W175-M180 HydrophobicContact CE3-SD 3.66Å; W175-M180 HydrophobicContact CH2-CE 4.44Å; W175-M180 HydrophobicContact CZ3-CB 4.48Å; W175-M180 HydrophobicContact CZ3-CE 3.47Å; W175-M180 VanDerWaalsContact CZ3-CE 3.47Å; W175-M180 HydrophobicContact CZ3-SD 3.56Å; W175-M180 VanDerWaalsContact CZ3-SD 3.56Å; W175-M180 PolarHBondContact O-N 3Å; Y178-M180 PolarHBondContact O-N 3.11Å; M180-G182 PolarHBondContact O-N 2.66Å; M180-A183 VanDerWaalsContact O-CB 3.28Å; M180-A183 WeakPolarHBondContact O-CB 3.48Å; M180-A183 PolarHBondContact O-N 2.89Å; M180-A183 VanDerWaalsContact O-N 3.14Å; M180-V290 HydrophobicContact CB-CG1 4.39Å; M180-V290 HydrophobicContact CE-CG1 3.42Å; M180-V290 VanDerWaalsContact CE-CG1 3.42Å; M180-V290 HydrophobicContact CG-CG1 4.15Å; M180-Q292 HydrophobicContact CB-CG 4.22Å; M180-Q292 HydrophobicContact CE-CB 4.47Å; M180-W296 VanDerWaalsContact CE-C 3.47Å; M180-W296 WeakPolarHBondContact CE-O 3.42Å
181	D	58	Low	68.4	Low	45 Å²	45	70 Å²	70	24%	0.241	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	131.2	-178.3	-62.9	-59.3	0	0	0	113.4	R53 E176 A183	R53-D181 PolarHBondContact NH1-O 3.38Å; R53-D181 PolarHBondContact NH2-O 3.17Å; E176-D181 VanDerWaalsContact CA-OD2 3.27Å; E176-D181 WeakPolarHBondContact CA-OD2 3.33Å; E176-D181 WeakPolarHBondContact CG-OD2 3.38Å; D181-A183 VanDerWaalsContact C-N 3.3Å
182	G	60.9	Low	70.1	Confident	67 Å²	67	65.8 Å²	65.8	69%	0.691	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-0.1	178.5	0	0	0	0	0	114.2	M180 I184	M180-G182 PolarHBondContact O-N 2.66Å; G182-I184 PolarHBondContact O-N 3.15Å; G182-I184 VanDerWaalsContact O-N 3.13Å
183	A	66.6	Low	72	Confident	28 Å²	28	61.9 Å²	61.9	23%	0.231	35%	0.345	C	S	.	.			trans	-72.4	101.4	169.5	0	0	0	0	0	109.8	M180 D181 V185 V290 Q292	M180-A183 VanDerWaalsContact O-CB 3.28Å; M180-A183 WeakPolarHBondContact O-CB 3.48Å; M180-A183 PolarHBondContact O-N 2.89Å; M180-A183 VanDerWaalsContact O-N 3.14Å; D181-A183 VanDerWaalsContact C-N 3.3Å; A183-V185 PolarHBondContact O-N 3.03Å; A183-V290 HydrophobicContact CB-CB 3.97Å; A183-V290 HydrophobicContact CB-CG1 3.56Å; A183-V290 HydrophobicContact CB-CG2 4.48Å; A183-Q292 PolarHBondContact O-OE1 2.79Å
184	I	71.4	Confident	73.8	Confident	114 Å²	114	61.6 Å²	61.6	59%	0.585	34%	0.339	S	S	*	.			trans	-72.6	112.5	176.9	-56.2	-176.8	0	0	0	108.5	G182 S186	G182-I184 PolarHBondContact O-N 3.15Å; G182-I184 VanDerWaalsContact O-N 3.13Å; I184-S186 PolarHBondContact O-N 3.07Å
185	V	80.2	Confident	75.5	Confident	30 Å²	30	61.7 Å²	61.7	18%	0.182	34%	0.338	C	S	.	.			trans	-62.9	120.6	167.6	-177.5	0	0	0	0	107.9	A183 K187 Q292 D293	A183-V185 PolarHBondContact O-N 3.03Å; V185-K187 PolarHBondContact O-N 3.29Å; V185-Q292 HydrophobicContact CG2-CB 4.06Å; V185-D293 HydrophobicContact CG2-CB 4.49Å; V185-D293 WeakPolarHBondContact CG2-OD1 3.36Å
186	S	85.3	Confident	76.9	Confident	16 Å²	16	62.9 Å²	62.9	11%	0.112	35%	0.349	C	S	.	.			trans	-58.8	137.8	176.5	172.8	0	0	0	0	110.1	I184 R188 T469 D472	I184-S186 PolarHBondContact O-N 3.07Å; S186-R188 WeakPolarHBondContact OG-CB 3.36Å; S186-R188 PolarHBondContact OG-N 3.18Å; S186-T469 WeakPolarHBondContact O-CG2 3.17Å; S186-D472 VanDerWaalsContact CB-OD2 3.28Å; S186-D472 WeakPolarHBondContact CB-OD2 3.43Å; S186-D472 WeakPolarHBondContact OG-CB 3.49Å; S186-D472 PolarHBondContact OG-OD2 2.92Å
187	K	85.1	Confident	78.1	Confident	178 Å²	178	63.2 Å²	63.2	77%	0.774	37%	0.367	S	S	*	.			trans	-110	19.2	175.9	-60	-171.8	178.3	-175.1	0	111.7	V185 Q189	V185-K187 PolarHBondContact O-N 3.29Å; K187-Q189 WeakPolarHBondContact O-CG 3.47Å; K187-Q189 PolarHBondContact O-N 3.19Å; K187-Q189 PolarHBondContact O-NE2 2.97Å
188	R	92.3	Very high	79.1	Confident	33 Å²	33	59.9 Å²	59.9	13%	0.125	35%	0.349	C	S	.	.			trans	-62	119.9	-174.1	-174.1	168.9	73.4	162	13.5	111.4	S186 V190 L468 D472 E496	S186-R188 WeakPolarHBondContact OG-CB 3.36Å; S186-R188 PolarHBondContact OG-N 3.18Å; R188-V190 WeakPolarHBondContact CD-O 3.37Å; R188-V190 WeakPolarHBondContact CG-O 3.49Å; R188-L468 PolarHBondContact NE-O 2.87Å; R188-L468 PolarHBondContact NH2-O 3.19Å; R188-D472 HydrophobicContact CB-CB 4.41Å; R188-D472 IonicContact NH1-OD1 3.15Å; R188-E496 IonicContact CZ-OE1 3.29Å; R188-E496 IonicContact NH1-OE1 3.8Å; R188-E496 PolarHBondContact NH1-OE1 3.31Å; R188-E496 IonicContact NH1-OE2 2.72Å; R188-E496 IonicContact NH2-OE1 2.73Å; R188-E496 PolarHBondContact NH2-OE1 3.45Å
189	Q	92.2	Very high	79.2	Confident	103 Å²	103	63 Å²	63	48%	0.481	38%	0.379	S	S	.	.			trans	-101.5	-11	-177.2	-59.9	-55.4	-54	0	0	114.1	K187 L468	K187-Q189 WeakPolarHBondContact O-CG 3.47Å; K187-Q189 PolarHBondContact O-N 3.19Å; K187-Q189 PolarHBondContact O-NE2 2.97Å; Q189-L468 WeakPolarHBondContact O-CD1 3.42Å
190	V	94.3	Very high	79.5	Confident	76 Å²	76	63.6 Å²	63.6	46%	0.461	38%	0.383	S	S	.	.	S	Bend	trans	-147.5	153.8	-179.1	-66.9	0	0	0	0	109.9	R188 Y460	R188-V190 WeakPolarHBondContact CD-O 3.37Å; R188-V190 WeakPolarHBondContact CG-O 3.49Å; V190-Y460 HydrophobicContact CB-CE1 4.4Å; V190-Y460 HydrophobicContact CB-CE2 4.04Å; V190-Y460 HydrophobicContact CG1-CE2 3.78Å
191	L	95.1	Very high	79.8	Confident	4 Å²	4	66.6 Å²	66.6	2%	0.021	41%	0.405	C	S	.	.			trans	-79.4	156.2	166.2	-55.5	-179.3	0	0	0	110.3	T193 P226 Y460 Y461 F463 L468 E496	L191-T193 PolarHBondContact O-N 2.86Å; L191-P226 HydrophobicContact CD1-CG 3.99Å; L191-Y460 HydrophobicContact CB-CD1 3.66Å; L191-Y460 HydrophobicContact CB-CE1 4.01Å; L191-Y460 HydrophobicContact CD1-CD1 4.13Å; L191-Y460 HydrophobicContact CG-CD1 3.87Å; L191-Y460 HydrophobicContact CG-CG 4.34Å; L191-Y461 HydrophobicContact CD1-CD2 3.58Å; L191-Y461 HydrophobicContact CD1-CE2 3.79Å; L191-F463 HydrophobicContact CD1-CD2 4.24Å; L191-F463 HydrophobicContact CD1-CE2 3.99Å; L191-F463 HydrophobicContact CD2-CE2 4.47Å; L191-L468 HydrophobicContact CD2-CD2 3.77Å; L191-L468 HydrophobicContact CG-CD2 3.76Å; L191-E496 HydrophobicContact CD2-CG 4.34Å
192	P	93.7	Very high	80.3	Confident	73 Å²	73	66.3 Å²	66.3	47%	0.474	40%	0.403	S	S	.	.	S	Bend	trans	-56.1	-32.5	176.8	-25.5	35.5	0	0	0	114	Y497	P192-Y497 HydrophobicContact CB-CD1 3.65Å; P192-Y497 HydrophobicContact CB-CE1 3.93Å; P192-Y497 HydrophobicContact CG-CD1 3.78Å; P192-Y497 HydrophobicContact CG-CE1 3.66Å
193	T	94.3	Very high	80.6	Confident	55 Å²	55	67.1 Å²	67.1	34%	0.337	39%	0.386	S	S	.	.	S	Bend	trans	-137.4	143.7	-179.5	-49.7	0	0	0	0	109.8	L191 Y497	L191-T193 PolarHBondContact O-N 2.86Å; T193-Y497 VanDerWaalsContact OG1-C 3.32Å; T193-Y497 PolarHBondContact OG1-O 2.87Å
194	S	92.7	Very high	80.8	Confident	61 Å²	61	68.1 Å²	68.1	43%	0.427	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-70.3	147.6	172.1	53.6	0	0	0	0	111.1	S196 K459	S194-S196 PolarHBondContact O-N 3.39Å; S194-K459 WeakPolarHBondContact CA-O 3.41Å
195	M	90.9	Very high	80.8	Confident	55 Å²	55	63 Å²	63	27%	0.271	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-52.3	123.2	174.4	177.9	-178.1	69.3	0	0	112.1	R276 E458 K459 Y461	M195-R276 HydrophobicContact SD-CG 4.14Å; M195-R276 VanDerWaalsContact SD-CZ 3.53Å; M195-R276 PolarHBondContact SD-NE 3.16Å; M195-R276 PolarHBondContact SD-NH2 3.07Å; M195-E458 WeakPolarHBondContact CE-O 3.28Å; M195-K459 WeakPolarHBondContact CB-O 3.39Å; M195-K459 PolarHBondContact N-O 3.36Å; M195-Y461 HydrophobicContact CB-CD1 4.26Å; M195-Y461 HydrophobicContact CB-CD2 3.98Å; M195-Y461 HydrophobicContact CB-CE1 4Å; M195-Y461 HydrophobicContact CB-CE2 3.71Å; M195-Y461 HydrophobicContact CB-CG 4.24Å; M195-Y461 HydrophobicContact CG-CD1 3.86Å; M195-Y461 HydrophobicContact CG-CD2 4.47Å; M195-Y461 HydrophobicContact CG-CE1 3.56Å; M195-Y461 HydrophobicContact CG-CE2 4.23Å; M195-Y461 HydrophobicContact CG-CG 4.29Å; M195-Y461 HydrophobicContact SD-CD1 3.73Å; M195-Y461 HydrophobicContact SD-CE1 4.04Å; M195-Y461 HydrophobicContact SD-CG 4.1Å
196	S	82.7	Confident	80.2	Confident	41 Å²	41	62.7 Å²	62.7	29%	0.287	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-64.8	141.4	175.5	-51.4	0	0	0	0	111.8	S194 R276	S194-S196 PolarHBondContact O-N 3.39Å; S196-R276 PolarHBondContact O-NH2 3.39Å
197	A	75.8	Confident	79.5	Confident	97 Å²	97	67.4 Å²	67.4	80%	0.802	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-60.5	142.1	174.5	0	0	0	0	0	111.3	S199	A197-S199 PolarHBondContact O-N 3.12Å
198	I	72.1	Confident	78.5	Confident	61 Å²	61	65 Å²	65	31%	0.313	37%	0.372	S	S	.	.			trans	-83.1	108.9	171.5	-57.6	-179.9	0	0	0	107.7	I200 F222 R276	I198-I200 WeakPolarHBondContact CG2-O 3.4Å; I198-F222 HydrophobicContact CG1-CD2 4.42Å; I198-F222 HydrophobicContact CG2-CD2 4.1Å; I198-F222 HydrophobicContact CG2-CE2 3.87Å; I198-R276 VanDerWaalsContact CG1-CZ 3.44Å
199	S	58.3	Low	77.1	Confident	116 Å²	116	64 Å²	64	81%	0.811	37%	0.37	S	S	*	.			trans	-83.2	-19.2	173.6	53.2	0	0	0	0	113.5	A197	A197-S199 PolarHBondContact O-N 3.12Å
200	I	64.9	Low	75.6	Confident	74 Å²	74	63.2 Å²	63.2	38%	0.379	37%	0.365	S	S	.	.	S	Bend	trans	-103.9	124.4	-174.2	-61.5	171.9	0	0	0	109.7	I198 L202 S204 V205 F222	I198-I200 WeakPolarHBondContact CG2-O 3.4Å; I200-L202 PolarHBondContact O-N 3.2Å; I200-S204 VanDerWaalsContact CG2-OG 3.25Å; I200-S204 WeakPolarHBondContact CG2-OG 3.28Å; I200-V205 HydrophobicContact CG2-CG2 4.14Å; I200-F222 HydrophobicContact CB-CE2 4.36Å; I200-F222 HydrophobicContact CB-CZ 3.88Å; I200-F222 HydrophobicContact CD1-CE1 3.84Å; I200-F222 HydrophobicContact CD1-CZ 3.99Å; I200-F222 HydrophobicContact CG1-CZ 4.46Å; I200-F222 HydrophobicContact CG2-CZ 4.17Å
201	S	68.7	Low	73.7	Confident	72 Å²	72	64 Å²	64	50%	0.503	39%	0.388	S	S	.	.			trans	-55.7	129.7	176.8	-174.6	0	0	0	0	111.2	W203 S204	S201-W203 PolarHBondContact O-N 2.9Å; S201-W203 WeakPolarHBondContact OG-CB 3.09Å; S201-W203 PolarHBondContact OG-N 2.94Å; S201-S204 PolarHBondContact O-N 3.33Å; S201-S204 PolarHBondContact O-OG 3.28Å
202	L	68.5	Low	71.8	Confident	38 Å²	38	70.2 Å²	70.2	20%	0.199	42%	0.415	C	S	.	.	H	α-helix	trans	-55.1	-27.4	173.7	-174.5	63.1	0	0	0	111.3	I200 V205 L206 I223	I200-L202 PolarHBondContact O-N 3.2Å; L202-V205 PolarHBondContact O-N 2.98Å; L202-L206 HydrophobicContact CD2-CD1 4.27Å; L202-L206 HydrophobicContact CG-CD1 3.85Å; L202-L206 HydrophobicContact CG-CG 4.21Å; L202-L206 WeakPolarHBondContact O-CB 3.33Å; L202-L206 VanDerWaalsContact O-CG 3.28Å; L202-L206 WeakPolarHBondContact O-CG 3.32Å; L202-L206 PolarHBondContact O-N 2.66Å; L202-I223 HydrophobicContact CD1-CD1 3.86Å; L202-I223 HydrophobicContact CD1-CG1 4.45Å
203	W	67.6	Low	69.9	Low	85 Å²	85	70.7 Å²	70.7	32%	0.322	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-36.2	173.7	-176.1	-137.3	0	0	0	114.2	S201 V205 L206 K207 F210 L368	S201-W203 PolarHBondContact O-N 2.9Å; S201-W203 WeakPolarHBondContact OG-CB 3.09Å; S201-W203 PolarHBondContact OG-N 2.94Å; W203-V205 VanDerWaalsContact C-N 3.34Å; W203-L206 HydrophobicContact CE3-CB 4.34Å; W203-K207 HydrophobicContact CD2-CD 4.2Å; W203-K207 HydrophobicContact CD2-CG 3.97Å; W203-K207 VanDerWaalsContact CE2-CE 3.48Å; W203-K207 HydrophobicContact CE3-CG 4.27Å; W203-K207 HydrophobicContact CG-CD 4.37Å; W203-K207 HydrophobicContact CH2-CG 4.42Å; W203-K207 HydrophobicContact CZ2-CD 4.32Å; W203-K207 HydrophobicContact CZ2-CG 4.09Å; W203-K207 VanDerWaalsContact NE1-CE 3.31Å; W203-K207 WeakPolarHBondContact O-CB 3.3Å; W203-K207 VanDerWaalsContact O-CG 3.29Å; W203-K207 WeakPolarHBondContact O-CG 3.39Å; W203-K207 PolarHBondContact O-N 3.14Å; W203-F210 HydrophobicContact CE3-CE2 4.33Å; W203-F210 AromaticContact CH2-CE2 3.52Å; W203-F210 HydrophobicContact CH2-CE2 3.52Å; W203-F210 AromaticContact CH2-CZ 3.86Å; W203-F210 HydrophobicContact CH2-CZ 3.86Å; W203-F210 AromaticContact CZ3-CE2 3.41Å; W203-F210 HydrophobicContact CZ3-CE2 3.41Å; W203-F210 VanDerWaalsContact CZ3-CE2 3.41Å; W203-F210 AromaticContact CZ3-CZ 3.63Å; W203-F210 HydrophobicContact CZ3-CZ 3.63Å; W203-L368 HydrophobicContact CB-CD2 3.93Å; W203-L368 HydrophobicContact CD2-CD1 4.46Å; W203-L368 HydrophobicContact CD2-CD2 3.71Å; W203-L368 HydrophobicContact CE3-CD1 4.23Å; W203-L368 HydrophobicContact CE3-CD2 3.25Å; W203-L368 HydrophobicContact CE3-CG 4.4Å; W203-L368 HydrophobicContact CG-CD2 4.03Å; W203-L368 HydrophobicContact CZ3-CD1 4.25Å; W203-L368 HydrophobicContact CZ3-CD2 3.9Å
204	S	71.6	Confident	67.6	Low	49 Å²	49	72.7 Å²	72.7	34%	0.343	42%	0.422	S	S	.	.	H	α-helix	trans	-71.4	-32.4	178	57.3	0	0	0	0	111.8	I200 S201 Q208	I200-S204 VanDerWaalsContact CG2-OG 3.25Å; I200-S204 WeakPolarHBondContact CG2-OG 3.28Å; S201-S204 PolarHBondContact O-N 3.33Å; S201-S204 PolarHBondContact O-OG 3.28Å; S204-Q208 WeakPolarHBondContact O-CG 3.43Å; S204-Q208 PolarHBondContact O-N 2.93Å
205	V	71.5	Confident	65.5	Low	7 Å²	7	74.5 Å²	74.5	4%	0.042	43%	0.431	C	S	.	.	H	α-helix	trans	-71.5	-49.4	172.7	-174.3	0	0	0	0	110.6	I200 L202 W203 K207 Q208 C209 L219 P220 F222 I223	I200-V205 HydrophobicContact CG2-CG2 4.14Å; L202-V205 PolarHBondContact O-N 2.98Å; W203-V205 VanDerWaalsContact C-N 3.34Å; V205-K207 PolarHBondContact O-N 3.24Å; V205-Q208 WeakPolarHBondContact O-CB 3.46Å; V205-Q208 PolarHBondContact O-N 3.42Å; V205-Q208 VanDerWaalsContact O-N 3.1Å; V205-C209 PolarHBondContact O-SG 2.82Å; V205-C209 VanDerWaalsContact O-SG 3.38Å; V205-L219 HydrophobicContact CG1-CD2 3.77Å; V205-P220 HydrophobicContact CG1-CG 4.48Å; V205-P220 HydrophobicContact CG2-CG 4.47Å; V205-F222 HydrophobicContact CG2-CZ 4.1Å; V205-I223 HydrophobicContact CB-CD1 4.15Å; V205-I223 HydrophobicContact CG1-CD1 3.76Å; V205-I223 HydrophobicContact CG2-CD1 4.16Å
206	L	67.3	Low	63.7	Low	23 Å²	23	80.6 Å²	80.6	12%	0.12	45%	0.451	C	S	.	.	H	α-helix	trans	-60	-31.6	175.6	-70.9	169	0	0	0	112.6	L202 W203 Q208 C209 F210 F331 I336 I367	L202-L206 HydrophobicContact CD2-CD1 4.27Å; L202-L206 HydrophobicContact CG-CD1 3.85Å; L202-L206 HydrophobicContact CG-CG 4.21Å; L202-L206 WeakPolarHBondContact O-CB 3.33Å; L202-L206 VanDerWaalsContact O-CG 3.28Å; L202-L206 WeakPolarHBondContact O-CG 3.32Å; L202-L206 PolarHBondContact O-N 2.66Å; W203-L206 HydrophobicContact CE3-CB 4.34Å; L206-Q208 VanDerWaalsContact C-N 3.34Å; L206-Q208 PolarHBondContact O-N 3.37Å; L206-C209 WeakPolarHBondContact O-CA 3.31Å; L206-C209 VanDerWaalsContact O-CB 3.24Å; L206-C209 WeakPolarHBondContact O-CB 3.17Å; L206-C209 PolarHBondContact O-N 3.3Å; L206-F210 PolarHBondContact O-N 2.89Å; L206-F331 HydrophobicContact CD1-CE2 4.14Å; L206-F331 HydrophobicContact CD2-CE2 4.25Å; L206-I336 HydrophobicContact CD2-CD1 4.41Å; L206-I367 HydrophobicContact CD1-CD1 4.01Å; L206-I367 HydrophobicContact CD1-CG1 4.33Å
207	K	69.9	Low	62.9	Low	115 Å²	115	80.6 Å²	80.6	50%	0.5	45%	0.447	S	S	.	.	H	α-helix	trans	-62.6	-39	174.9	-93.6	177	155.2	-178.1	0	113.2	W203 V205 C209 F210	W203-K207 HydrophobicContact CD2-CD 4.2Å; W203-K207 HydrophobicContact CD2-CG 3.97Å; W203-K207 VanDerWaalsContact CE2-CE 3.48Å; W203-K207 HydrophobicContact CE3-CG 4.27Å; W203-K207 HydrophobicContact CG-CD 4.37Å; W203-K207 HydrophobicContact CH2-CG 4.42Å; W203-K207 HydrophobicContact CZ2-CD 4.32Å; W203-K207 HydrophobicContact CZ2-CG 4.09Å; W203-K207 VanDerWaalsContact NE1-CE 3.31Å; W203-K207 WeakPolarHBondContact O-CB 3.3Å; W203-K207 VanDerWaalsContact O-CG 3.29Å; W203-K207 WeakPolarHBondContact O-CG 3.39Å; W203-K207 PolarHBondContact O-N 3.14Å; V205-K207 PolarHBondContact O-N 3.24Å; K207-C209 PolarHBondContact O-N 2.96Å; K207-F210 HydrophobicContact CG-CD2 4.37Å; K207-F210 HydrophobicContact CG-CE2 4.32Å; K207-F210 PolarHBondContact O-N 2.89Å
208	Q	65.2	Low	63	Low	128 Å²	128	78.5 Å²	78.5	60%	0.598	43%	0.426	S	S	*	.	H	α-helix	trans	-65.4	-15.6	174.1	-64.4	168.1	2	0	0	112.1	S204 V205 L206 I217	S204-Q208 WeakPolarHBondContact O-CG 3.43Å; S204-Q208 PolarHBondContact O-N 2.93Å; V205-Q208 WeakPolarHBondContact O-CB 3.46Å; V205-Q208 PolarHBondContact O-N 3.42Å; V205-Q208 VanDerWaalsContact O-N 3.1Å; L206-Q208 VanDerWaalsContact C-N 3.34Å; L206-Q208 PolarHBondContact O-N 3.37Å; Q208-I217 WeakPolarHBondContact O-CD1 3.37Å
209	C	62.4	Low	63.5	Low	12 Å²	12	77.3 Å²	77.3	8%	0.081	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-12.6	177.3	-52.6	0	0	0	0	115.5	V205 L206 K207 L214 I217	V205-C209 PolarHBondContact O-SG 2.82Å; V205-C209 VanDerWaalsContact O-SG 3.38Å; L206-C209 WeakPolarHBondContact O-CA 3.31Å; L206-C209 VanDerWaalsContact O-CB 3.24Å; L206-C209 WeakPolarHBondContact O-CB 3.17Å; L206-C209 PolarHBondContact O-N 3.3Å; K207-C209 PolarHBondContact O-N 2.96Å; C209-L214 HydrophobicContact CB-CD2 3.63Å; C209-I217 HydrophobicContact CB-CD1 3.8Å
210	F	60.2	Low	64.9	Low	85 Å²	85	73.4 Å²	73.4	37%	0.373	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	141.9	174	-69.1	-62.9	0	0	0	111.7	W203 L206 K207 K212 F331	W203-F210 HydrophobicContact CE3-CE2 4.33Å; W203-F210 AromaticContact CH2-CE2 3.52Å; W203-F210 HydrophobicContact CH2-CE2 3.52Å; W203-F210 AromaticContact CH2-CZ 3.86Å; W203-F210 HydrophobicContact CH2-CZ 3.86Å; W203-F210 AromaticContact CZ3-CE2 3.41Å; W203-F210 HydrophobicContact CZ3-CE2 3.41Å; W203-F210 VanDerWaalsContact CZ3-CE2 3.41Å; W203-F210 AromaticContact CZ3-CZ 3.63Å; W203-F210 HydrophobicContact CZ3-CZ 3.63Å; L206-F210 PolarHBondContact O-N 2.89Å; K207-F210 HydrophobicContact CG-CD2 4.37Å; K207-F210 HydrophobicContact CG-CE2 4.32Å; K207-F210 PolarHBondContact O-N 2.89Å; F210-K212 PolarHBondContact O-N 3.15Å; F210-K212 VanDerWaalsContact O-N 3.11Å; F210-F331 HydrophobicContact CE1-CD1 4.01Å; F210-F331 AromaticContact CE1-CE1 3.43Å; F210-F331 HydrophobicContact CE1-CE1 3.43Å; F210-F331 VanDerWaalsContact CE1-CE1 3.43Å; F210-F331 HydrophobicContact CE1-CZ 4.08Å; F210-F331 HydrophobicContact CZ-CD1 4.43Å; F210-F331 AromaticContact CZ-CE1 3.46Å; F210-F331 HydrophobicContact CZ-CE1 3.46Å; F210-F331 VanDerWaalsContact CZ-CE1 3.46Å; F210-F331 AromaticContact CZ-CZ 3.67Å; F210-F331 HydrophobicContact CZ-CZ 3.67Å
211	G	53.8	Low	66.2	Low	92 Å²	92	70.1 Å²	70.1	95%	0.948	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	-6.4	-179	0	0	0	0	0	115.1
212	K	56.2	Low	67.1	Low	136 Å²	136	68.4 Å²	68.4	59%	0.591	36%	0.359	S	S	*	.	S	Bend	trans	-107.2	144.9	175.3	-67.4	-176.1	-178.4	179.7	0	109.7	F210 L214 I217	F210-K212 PolarHBondContact O-N 3.15Å; F210-K212 VanDerWaalsContact O-N 3.11Å; K212-L214 PolarHBondContact O-N 3.07Å; K212-L214 VanDerWaalsContact O-N 3.1Å; K212-I217 HydrophobicContact CB-CD1 3.8Å; K212-I217 HydrophobicContact CB-CG1 4.46Å; K212-I217 HydrophobicContact CD-CD1 3.92Å; K212-I217 HydrophobicContact CD-CG1 4.39Å; K212-I217 HydrophobicContact CG-CD1 4.46Å
213	N	52.7	Low	68	Low	82 Å²	82	67.2 Å²	67.2	44%	0.439	35%	0.353	S	S	.	.			trans	-61	117.1	171	-175.7	-28.9	0	0	0	108.6	T215 R216	N213-T215 VanDerWaalsContact CG-OG1 3.29Å; N213-T215 PolarHBondContact O-N 3.28Å; N213-T215 PolarHBondContact OD1-N 3.43Å; N213-T215 PolarHBondContact OD1-OG1 3.49Å; N213-R216 HydrophobicContact CB-CG 4.29Å; N213-R216 WeakPolarHBondContact O-CB 3.4Å; N213-R216 PolarHBondContact O-N 3.4Å
214	L	46.7	Very low	69.2	Low	98 Å²	98	63.8 Å²	63.8	51%	0.513	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-55.3	-23.8	-173.8	-64.6	179.6	0	0	0	113.6	C209 K212 R216	C209-L214 HydrophobicContact CB-CD2 3.63Å; K212-L214 PolarHBondContact O-N 3.07Å; K212-L214 VanDerWaalsContact O-N 3.1Å; L214-R216 VanDerWaalsContact C-N 3.29Å; L214-R216 PolarHBondContact O-N 3.05Å
215	T	47.7	Very low	70.3	Confident	99 Å²	99	61.6 Å²	61.6	61%	0.607	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-71.3	-19.2	176.2	63.4	0	0	0	0	114.1	N213	N213-T215 VanDerWaalsContact CG-OG1 3.29Å; N213-T215 PolarHBondContact O-N 3.28Å; N213-T215 PolarHBondContact OD1-N 3.43Å; N213-T215 PolarHBondContact OD1-OG1 3.49Å
216	R	54.5	Low	71.5	Confident	183 Å²	183	61.2 Å²	61.2	69%	0.691	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-89.8	-5.8	-178.3	-64.2	-173	177.9	-166	-1.9	113.7	N213 L214	N213-R216 HydrophobicContact CB-CG 4.29Å; N213-R216 WeakPolarHBondContact O-CB 3.4Å; N213-R216 PolarHBondContact O-N 3.4Å; L214-R216 VanDerWaalsContact C-N 3.29Å; L214-R216 PolarHBondContact O-N 3.05Å
217	I	66	Low	73	Confident	40 Å²	40	60.2 Å²	60.2	21%	0.205	32%	0.317	C	S	.	.			trans	-103.6	116.1	-175.7	-64.3	172	0	0	0	111.4	Q208 C209 K212 L219	Q208-I217 WeakPolarHBondContact O-CD1 3.37Å; C209-I217 HydrophobicContact CB-CD1 3.8Å; K212-I217 HydrophobicContact CB-CD1 3.8Å; K212-I217 HydrophobicContact CB-CG1 4.46Å; K212-I217 HydrophobicContact CD-CD1 3.92Å; K212-I217 HydrophobicContact CD-CG1 4.39Å; K212-I217 HydrophobicContact CG-CD1 4.46Å; I217-L219 PolarHBondContact O-N 3.09Å
218	S	76.6	Confident	74.3	Confident	53 Å²	53	54.7 Å²	54.7	37%	0.371	29%	0.293	S	S	.	.			trans	-71.5	112.8	166.9	-161.4	0	0	0	0	109.2	K507 E511	S218-K507 PolarHBondContact OG-NZ 3.24Å; S218-E511 WeakPolarHBondContact CB-OE2 3.25Å; S218-E511 VanDerWaalsContact OG-CD 3.27Å; S218-E511 PolarHBondContact OG-OE1 3.27Å; S218-E511 PolarHBondContact OG-OE2 3.28Å
219	L	84.2	Confident	75.8	Confident	36 Å²	36	51.1 Å²	51.1	19%	0.188	28%	0.277	C	S	.	.			trans	-74.4	143.4	172.9	-65.7	175.3	0	0	0	109.5	V205 I217 I223 F224 K277 K507	V205-L219 HydrophobicContact CG1-CD2 3.77Å; I217-L219 PolarHBondContact O-N 3.09Å; L219-I223 HydrophobicContact CB-CD1 4.49Å; L219-I223 HydrophobicContact CD2-CD1 4.35Å; L219-F224 HydrophobicContact CB-CE2 3.85Å; L219-F224 HydrophobicContact CB-CZ 4.05Å; L219-F224 WeakPolarHBondContact O-CE2 3.43Å; L219-K277 HydrophobicContact CD1-CD 4.06Å; L219-K507 WeakPolarHBondContact O-CE 3.47Å; L219-K507 PolarHBondContact O-NZ 3.05Å
220	P	87.5	Confident	77.5	Confident	34 Å²	34	50.6 Å²	50.6	22%	0.221	27%	0.273	C	S	.	.			trans	-68.2	147.6	178.6	28	-36.2	0	0	0	112.5	V205 F222 I223 F224 E504	V205-P220 HydrophobicContact CG1-CG 4.48Å; V205-P220 HydrophobicContact CG2-CG 4.47Å; P220-F222 HydrophobicContact CB-CD1 3.74Å; P220-F222 HydrophobicContact CB-CE1 3.56Å; P220-F222 HydrophobicContact CB-CZ 4.42Å; P220-F222 HydrophobicContact CG-CD1 3.86Å; P220-F222 HydrophobicContact CG-CE1 3.27Å; P220-F222 HydrophobicContact CG-CZ 3.65Å; P220-F222 PolarHBondContact O-N 2.87Å; P220-F222 VanDerWaalsContact O-N 3.07Å; P220-I223 HydrophobicContact CG-CD1 4.07Å; P220-I223 HydrophobicContact CG-CG1 4.3Å; P220-I223 PolarHBondContact O-N 2.91Å; P220-F224 WeakPolarHBondContact O-CD2 3.46Å; P220-E504 WeakPolarHBondContact CA-OE2 3.34Å
221	V	91.8	Very high	79.3	Confident	5 Å²	5	46.5 Å²	46.5	3%	0.03	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-54.1	-31.1	-174.5	-74	0	0	0	0	114.7	I223 F224 V495 L500 A503 E504 K507	V221-I223 PolarHBondContact O-N 3.08Å; V221-I223 VanDerWaalsContact O-N 3.15Å; V221-F224 WeakPolarHBondContact O-CB 3.38Å; V221-F224 PolarHBondContact O-N 3.44Å; V221-V495 HydrophobicContact CB-CG2 4.06Å; V221-L500 HydrophobicContact CG2-CB 4.34Å; V221-L500 WeakPolarHBondContact CG2-O 3.43Å; V221-A503 HydrophobicContact CB-CB 4.24Å; V221-A503 HydrophobicContact CG1-CB 3.97Å; V221-A503 HydrophobicContact CG2-CB 4.18Å; V221-E504 HydrophobicContact CG1-CB 4.27Å; V221-E504 WeakPolarHBondContact CG1-OE2 3.37Å; V221-E504 HydrophobicContact CG2-CB 3.88Å; V221-E504 WeakPolarHBondContact CG2-OE2 3.47Å; V221-E504 PolarHBondContact N-OE2 3.35Å; V221-K507 HydrophobicContact CG1-CB 3.96Å; V221-K507 HydrophobicContact CG1-CD 3.47Å; V221-K507 VanDerWaalsContact CG1-CD 3.47Å; V221-K507 HydrophobicContact CG1-CG 4.39Å
222	F	87.7	Confident	81.4	Confident	37 Å²	37	43.2 Å²	43.2	16%	0.162	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-63.5	-21.5	-179.9	73.1	-101.6	0	0	0	112.8	I198 I200 V205 P220 F224 R276 L500	I198-F222 HydrophobicContact CG1-CD2 4.42Å; I198-F222 HydrophobicContact CG2-CD2 4.1Å; I198-F222 HydrophobicContact CG2-CE2 3.87Å; I200-F222 HydrophobicContact CB-CE2 4.36Å; I200-F222 HydrophobicContact CB-CZ 3.88Å; I200-F222 HydrophobicContact CD1-CE1 3.84Å; I200-F222 HydrophobicContact CD1-CZ 3.99Å; I200-F222 HydrophobicContact CG1-CZ 4.46Å; I200-F222 HydrophobicContact CG2-CZ 4.17Å; V205-F222 HydrophobicContact CG2-CZ 4.1Å; P220-F222 HydrophobicContact CB-CD1 3.74Å; P220-F222 HydrophobicContact CB-CE1 3.56Å; P220-F222 HydrophobicContact CB-CZ 4.42Å; P220-F222 HydrophobicContact CG-CD1 3.86Å; P220-F222 HydrophobicContact CG-CE1 3.27Å; P220-F222 HydrophobicContact CG-CZ 3.65Å; P220-F222 PolarHBondContact O-N 2.87Å; P220-F222 VanDerWaalsContact O-N 3.07Å; F222-F224 PolarHBondContact O-N 2.91Å; F222-R276 PolarHBondContact O-NH1 2.88Å; F222-L500 HydrophobicContact CB-CD1 4.28Å
223	I	87.8	Confident	83.4	Confident	13 Å²	13	36.8 Å²	36.8	7%	0.067	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-71.7	-18.5	174.7	-66.3	-179.1	0	0	0	111.2	L202 V205 L219 P220 V221 R276 K277	L202-I223 HydrophobicContact CD1-CD1 3.86Å; L202-I223 HydrophobicContact CD1-CG1 4.45Å; V205-I223 HydrophobicContact CB-CD1 4.15Å; V205-I223 HydrophobicContact CG1-CD1 3.76Å; V205-I223 HydrophobicContact CG2-CD1 4.16Å; L219-I223 HydrophobicContact CB-CD1 4.49Å; L219-I223 HydrophobicContact CD2-CD1 4.35Å; P220-I223 HydrophobicContact CG-CD1 4.07Å; P220-I223 HydrophobicContact CG-CG1 4.3Å; P220-I223 PolarHBondContact O-N 2.91Å; V221-I223 PolarHBondContact O-N 3.08Å; V221-I223 VanDerWaalsContact O-N 3.15Å; I223-R276 CarbonylContact O-C 3.59Å; I223-R276 WeakPolarHBondContact O-CA 3.16Å; I223-K277 HydrophobicContact CG2-CB 4.21Å; I223-K277 PolarHBondContact O-N 3.18Å
224	F	92.6	Very high	85.6	Confident	12 Å²	12	32.9 Å²	32.9	5%	0.053	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	152.3	-174.2	-62.2	-94.5	0	0	0	113.1	L219 P220 V221 F222 K277 P278 F279	L219-F224 HydrophobicContact CB-CE2 3.85Å; L219-F224 HydrophobicContact CB-CZ 4.05Å; L219-F224 WeakPolarHBondContact O-CE2 3.43Å; P220-F224 WeakPolarHBondContact O-CD2 3.46Å; V221-F224 WeakPolarHBondContact O-CB 3.38Å; V221-F224 PolarHBondContact O-N 3.44Å; F222-F224 PolarHBondContact O-N 2.91Å; F224-K277 WeakPolarHBondContact CA-O 3.37Å; F224-K277 HydrophobicContact CD1-CB 4.28Å; F224-K277 VanDerWaalsContact CD1-O 3.32Å; F224-K277 WeakPolarHBondContact CD1-O 3.46Å; F224-K277 HydrophobicContact CE1-CB 4.46Å; F224-K277 HydrophobicContact CE1-CD 4.02Å; F224-K277 HydrophobicContact CE1-CG 4.38Å; F224-P278 WeakPolarHBondContact CD1-O 3.49Å; F224-F279 HydrophobicContact CB-CD2 3.85Å; F224-F279 HydrophobicContact CB-CE1 4.41Å; F224-F279 HydrophobicContact CB-CE2 3.46Å; F224-F279 VanDerWaalsContact CB-CE2 3.46Å; F224-F279 HydrophobicContact CB-CG 4.47Å; F224-F279 HydrophobicContact CB-CZ 3.79Å; F224-F279 HydrophobicContact CD1-CD1 4.28Å; F224-F279 HydrophobicContact CD1-CD2 4.21Å; F224-F279 HydrophobicContact CD1-CG 4.08Å; F224-F279 HydrophobicContact CG-CD1 4.46Å; F224-F279 HydrophobicContact CG-CD2 4.3Å; F224-F279 HydrophobicContact CG-CE1 4.35Å; F224-F279 HydrophobicContact CG-CE2 4.18Å; F224-F279 HydrophobicContact CG-CG 4.45Å; F224-F279 HydrophobicContact CG-CZ 4.2Å
225	E	94.8	Very high	88	Confident	3 Å²	3	28.4 Å²	28.4	1%	0.014	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	156.1	162.7	65.2	-164.1	175.8	0	0	109.3	L227 R273 R276 K277 P278 F279 Y461 F463	E225-L227 HydrophobicContact CG-CB 4.49Å; E225-L227 PolarHBondContact O-N 3.22Å; E225-R273 IonicContact OE1-CZ 3.5Å; E225-R273 IonicContact OE1-NE 3.93Å; E225-R273 PolarHBondContact OE1-NE 3.21Å; E225-R273 IonicContact OE1-NH2 3.77Å; E225-R273 PolarHBondContact OE1-NH2 3.07Å; E225-R273 IonicContact OE2-CZ 3.82Å; E225-R273 IonicContact OE2-NE 3.25Å; E225-R273 PolarHBondContact OE2-NE 2.92Å; E225-R273 IonicContact OE2-NH2 2.79Å; E225-R273 PolarHBondContact OE2-NH2 2.81Å; E225-R273 VanDerWaalsContact OE2-NH2 3.15Å; E225-R276 HydrophobicContact CB-CB 3.89Å; E225-K277 PolarHBondContact N-O 2.89Å; E225-P278 WeakPolarHBondContact OE1-CD 3.5Å; E225-P278 VanDerWaalsContact OE1-CG 3.3Å; E225-P278 WeakPolarHBondContact OE1-CG 3.4Å; E225-F279 WeakPolarHBondContact O-CD2 3.48Å; E225-F279 VanDerWaalsContact O-CE2 3.32Å; E225-F279 WeakPolarHBondContact O-CE2 3.43Å; E225-Y461 HydrophobicContact CB-CD1 3.52Å; E225-Y461 HydrophobicContact CB-CE1 4.22Å; E225-Y461 HydrophobicContact CB-CG 4.05Å; E225-F463 HydrophobicContact CB-CE1 4.2Å; E225-F463 HydrophobicContact CB-CZ 4.11Å; E225-F463 HydrophobicContact CG-CE1 4.35Å; E225-F463 HydrophobicContact CG-CZ 4.41Å
226	P	97	Very high	90.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	37.1	-175.2	30.9	-36.4	0	0	0	114.3	L191 Y461 F463 Q492 V495 E496	L191-P226 HydrophobicContact CD1-CG 3.99Å; P226-Y461 HydrophobicContact CG-CD2 4.05Å; P226-Y461 HydrophobicContact CG-CE2 3.85Å; P226-F463 HydrophobicContact CG-CE2 4.09Å; P226-F463 HydrophobicContact CG-CZ 4.15Å; P226-Q492 PolarHBondContact O-NE2 3.37Å; P226-V495 HydrophobicContact CB-CG1 4.37Å; P226-E496 HydrophobicContact CB-CB 3.58Å; P226-E496 HydrophobicContact CB-CG 3.82Å; P226-E496 HydrophobicContact CG-CB 4.24Å; P226-E496 HydrophobicContact CG-CG 4.07Å
227	L	97.9	Very high	92.5	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.005	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	147.7	172.8	-65.7	176.9	0	0	0	110.4	E225 Q231 I232 P278 F279 F463 L470 N471	E225-L227 HydrophobicContact CG-CB 4.49Å; E225-L227 PolarHBondContact O-N 3.22Å; L227-Q231 VanDerWaalsContact CA-OE1 3.28Å; L227-Q231 HydrophobicContact CB-CB 4.32Å; L227-Q231 HydrophobicContact CD2-CB 4.03Å; L227-Q231 HydrophobicContact CD2-CG 4.28Å; L227-I232 HydrophobicContact CB-CD1 4.34Å; L227-P278 CarbonylContact O-C 3.57Å; L227-P278 VanDerWaalsContact O-CA 3.23Å; L227-P278 WeakPolarHBondContact O-CA 3.38Å; L227-F279 PolarHBondContact O-N 3.24Å; L227-F463 HydrophobicContact CD1-CD1 4.35Å; L227-F463 HydrophobicContact CD1-CD2 4.45Å; L227-F463 HydrophobicContact CD1-CE1 3.78Å; L227-F463 HydrophobicContact CD1-CE2 3.89Å; L227-F463 HydrophobicContact CD1-CZ 3.52Å; L227-F463 HydrophobicContact CG-CE1 4.38Å; L227-F463 HydrophobicContact CG-CE2 4.07Å; L227-F463 HydrophobicContact CG-CZ 3.7Å; L227-L470 HydrophobicContact CD1-CD1 4.03Å; L227-L470 HydrophobicContact CD2-CB 3.67Å; L227-L470 HydrophobicContact CD2-CD1 4.35Å; L227-N471 HydrophobicContact CD2-CB 3.97Å
228	N	97.5	Very high	94	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	172.9	173.2	79.5	-3.8	0	0	0	112.3	L230 Q231 I232 F279 P281 E285 T486	N228-L230 PolarHBondContact O-N 3Å; N228-L230 WeakPolarHBondContact OD1-CA 3.39Å; N228-L230 WeakPolarHBondContact OD1-CB 3.43Å; N228-L230 PolarHBondContact OD1-N 3.06Å; N228-Q231 WeakPolarHBondContact O-CB 3.26Å; N228-Q231 PolarHBondContact O-N 2.74Å; N228-Q231 PolarHBondContact OD1-N 3.39Å; N228-Q231 PolarHBondContact OD1-OE1 3.18Å; N228-I232 WeakPolarHBondContact O-CG1 3.26Å; N228-I232 PolarHBondContact O-N 2.91Å; N228-F279 VanDerWaalsContact CA-O 3.27Å; N228-F279 WeakPolarHBondContact CA-O 3.48Å; N228-F279 HydrophobicContact CB-CB 3.82Å; N228-F279 WeakPolarHBondContact CB-O 3.5Å; N228-P281 HydrophobicContact CB-CG 4.16Å; N228-E285 PolarHBondContact ND2-OE1 2.87Å; N228-T486 HydrophobicContact CB-CG2 4.3Å; N228-T486 VanDerWaalsContact ND2-CG2 3.29Å; N228-T486 WeakPolarHBondContact ND2-CG2 3.45Å; N228-T486 PolarHBondContact ND2-OG1 3.28Å
229	M	96.2	Very high	95.1	Very high	53 Å²	53	12.4 Å²	12.4	26%	0.261	6%	0.063	S	C	.	.	H	α-helix	trans	-58.4	-30.2	178.2	-69.6	-57.9	-52.2	0	0	114.7	Q231 I232 L233 P278 F279 P281 L325	M229-Q231 VanDerWaalsContact C-N 3.31Å; M229-Q231 PolarHBondContact O-N 3.24Å; M229-I232 HydrophobicContact CE-CB 4.4Å; M229-I232 PolarHBondContact O-N 3.3Å; M229-I232 HydrophobicContact SD-CG1 4.31Å; M229-L233 WeakPolarHBondContact O-CG 3.43Å; M229-L233 PolarHBondContact O-N 3.19Å; M229-P278 HydrophobicContact CG-CB 4.46Å; M229-P278 HydrophobicContact SD-CB 3.89Å; M229-P278 HydrophobicContact SD-CG 3.89Å; M229-F279 PolarHBondContact N-O 3.47Å; M229-F279 VanDerWaalsContact N-O 3.11Å; M229-P281 HydrophobicContact CB-CG 3.88Å; M229-L325 HydrophobicContact CE-CD2 4.32Å
230	L	98.5	Very high	95.7	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-66.3	-36.5	176.5	-53.7	-173.3	0	0	0	111.6	N228 C234 P281 E285 Y287 Y298 Q302	N228-L230 PolarHBondContact O-N 3Å; N228-L230 WeakPolarHBondContact OD1-CA 3.39Å; N228-L230 WeakPolarHBondContact OD1-CB 3.43Å; N228-L230 PolarHBondContact OD1-N 3.06Å; L230-C234 PolarHBondContact O-N 3.04Å; L230-P281 HydrophobicContact CD1-CB 4.26Å; L230-P281 HydrophobicContact CD2-CB 4.37Å; L230-P281 HydrophobicContact CD2-CG 4.04Å; L230-P281 HydrophobicContact CG-CB 3.97Å; L230-P281 HydrophobicContact CG-CG 3.71Å; L230-E285 HydrophobicContact CD1-CB 4.39Å; L230-E285 HydrophobicContact CD1-CG 4.38Å; L230-E285 WeakPolarHBondContact CD1-O 3.23Å; L230-Y287 HydrophobicContact CB-CD1 4.49Å; L230-Y298 PolarHBondContact O-OH 2.81Å; L230-Q302 HydrophobicContact CD2-CB 4.45Å
231	Q	98.6	Very high	96.2	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-71.7	-38.8	172.8	-75.4	162.3	-31.4	0	0	111.9	L227 N228 M229 L233 C234 E235 Y287 L470 N471	L227-Q231 VanDerWaalsContact CA-OE1 3.28Å; L227-Q231 HydrophobicContact CB-CB 4.32Å; L227-Q231 HydrophobicContact CD2-CB 4.03Å; L227-Q231 HydrophobicContact CD2-CG 4.28Å; N228-Q231 WeakPolarHBondContact O-CB 3.26Å; N228-Q231 PolarHBondContact O-N 2.74Å; N228-Q231 PolarHBondContact OD1-N 3.39Å; N228-Q231 PolarHBondContact OD1-OE1 3.18Å; M229-Q231 VanDerWaalsContact C-N 3.31Å; M229-Q231 PolarHBondContact O-N 3.24Å; Q231-L233 VanDerWaalsContact C-N 3.31Å; Q231-L233 PolarHBondContact O-N 2.8Å; Q231-C234 WeakPolarHBondContact O-CB 3.29Å; Q231-C234 PolarHBondContact O-N 2.89Å; Q231-C234 VanDerWaalsContact O-N 3.09Å; Q231-E235 PolarHBondContact O-N 2.97Å; Q231-Y287 HydrophobicContact CB-CE1 4.29Å; Q231-Y287 HydrophobicContact CG-CD1 3.8Å; Q231-Y287 HydrophobicContact CG-CD2 3.89Å; Q231-Y287 HydrophobicContact CG-CE1 3.55Å; Q231-Y287 HydrophobicContact CG-CE2 3.59Å; Q231-Y287 HydrophobicContact CG-CG 3.97Å; Q231-Y287 VanDerWaalsContact CG-CZ 3.41Å; Q231-L470 HydrophobicContact CB-CB 4.41Å; Q231-L470 HydrophobicContact CB-CD1 4.29Å; Q231-L470 HydrophobicContact CG-CB 4.35Å; Q231-N471 PolarHBondContact NE2-OD1 3.1Å
232	I	97.3	Very high	96.5	Very high	23 Å²	23	11.2 Å²	11.2	12%	0.118	5%	0.054	C	C	.	.	H	α-helix	trans	-60.2	-40.7	173	-54.7	-50.3	0	0	0	111.5	L227 N228 M229 C234 E235 P278	L227-I232 HydrophobicContact CB-CD1 4.34Å; N228-I232 WeakPolarHBondContact O-CG1 3.26Å; N228-I232 PolarHBondContact O-N 2.91Å; M229-I232 HydrophobicContact CE-CB 4.4Å; M229-I232 PolarHBondContact O-N 3.3Å; M229-I232 HydrophobicContact SD-CG1 4.31Å; I232-C234 VanDerWaalsContact C-N 3.28Å; I232-C234 PolarHBondContact O-N 3.46Å; I232-E235 WeakPolarHBondContact O-CB 3.14Å; I232-E235 PolarHBondContact O-N 3.31Å; I232-E235 VanDerWaalsContact O-N 3.14Å; I232-P278 HydrophobicContact CD1-CB 4.23Å; I232-P278 HydrophobicContact CD1-CG 3.94Å; I232-P278 HydrophobicContact CG1-CB 3.8Å; I232-P278 HydrophobicContact CG1-CG 3.63Å
233	L	97.8	Very high	97	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-63.7	-33.3	174.6	-72.9	-169.3	0	0	0	112.9	M229 Q231 Y298 C312 L325	M229-L233 WeakPolarHBondContact O-CG 3.43Å; M229-L233 PolarHBondContact O-N 3.19Å; Q231-L233 VanDerWaalsContact C-N 3.31Å; Q231-L233 PolarHBondContact O-N 2.8Å; L233-Y298 WeakPolarHBondContact CB-OH 3.5Å; L233-C312 HydrophobicContact CD1-CB 4.3Å; L233-L325 HydrophobicContact CD2-CB 4Å; L233-L325 HydrophobicContact CD2-CD2 3.51Å; L233-L325 HydrophobicContact CD2-CG 4.38Å
234	C	98.5	Very high	97.5	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-71.8	-31.1	173	-170.4	0	0	0	0	112.3	L230 Q231 I232 E236 L237 Y287 Y298 F466 L470	L230-C234 PolarHBondContact O-N 3.04Å; Q231-C234 WeakPolarHBondContact O-CB 3.29Å; Q231-C234 PolarHBondContact O-N 2.89Å; Q231-C234 VanDerWaalsContact O-N 3.09Å; I232-C234 VanDerWaalsContact C-N 3.28Å; I232-C234 PolarHBondContact O-N 3.46Å; C234-E236 PolarHBondContact O-N 3.25Å; C234-L237 WeakPolarHBondContact O-CB 3.16Å; C234-L237 PolarHBondContact O-N 2.83Å; C234-Y287 HydrophobicContact CB-CD1 4.34Å; C234-Y287 HydrophobicContact CB-CE1 3.7Å; C234-Y298 HydrophobicContact CB-CD1 4Å; C234-Y298 HydrophobicContact CB-CD2 4.24Å; C234-Y298 HydrophobicContact CB-CE1 3.66Å; C234-Y298 HydrophobicContact CB-CE2 3.91Å; C234-Y298 HydrophobicContact CB-CG 4.3Å; C234-Y298 PolarHBondContact N-OH 3.09Å; C234-F466 WeakPolarHBondContact O-CE1 3.35Å; C234-L470 HydrophobicContact CB-CD2 4.24Å
235	E	97.9	Very high	97.7	Very high	5 Å²	5	11.6 Å²	11.6	2%	0.023	6%	0.056	C	C	.	.	H	α-helix	trans	-62.9	-25.7	178.7	-159	177.3	-112.1	0	0	112.5	Q231 I232 L237 E238 S269 R273 F466 L470	Q231-E235 PolarHBondContact O-N 2.97Å; I232-E235 WeakPolarHBondContact O-CB 3.14Å; I232-E235 PolarHBondContact O-N 3.31Å; I232-E235 VanDerWaalsContact O-N 3.14Å; E235-L237 PolarHBondContact O-N 2.86Å; E235-E238 WeakPolarHBondContact O-CB 3.47Å; E235-E238 PolarHBondContact O-N 3.5Å; E235-S269 WeakPolarHBondContact OE2-CB 3.18Å; E235-S269 PolarHBondContact OE2-OG 2.88Å; E235-R273 IonicContact OE1-CZ 3.72Å; E235-R273 IonicContact OE1-NH1 3.91Å; E235-R273 PolarHBondContact OE1-NH1 3.48Å; E235-R273 IonicContact OE2-NH1 3.15Å; E235-R273 PolarHBondContact OE2-NH1 3.01Å; E235-F466 HydrophobicContact CG-CD1 4.38Å; E235-L470 HydrophobicContact CB-CD1 4.05Å; E235-L470 HydrophobicContact CG-CD1 4.25Å
236	E	98.2	Very high	97.8	Very high	13 Å²	13	11.5 Å²	11.5	6%	0.061	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.2	173.6	-50.9	-161.7	142.2	0	0	113.2	C234 F262 R266 Q323 K359	C234-E236 PolarHBondContact O-N 3.25Å; E236-F262 VanDerWaalsContact O-CE2 3.27Å; E236-F262 WeakPolarHBondContact O-CE2 3.5Å; E236-R266 HydrophobicContact CB-CB 3.95Å; E236-R266 HydrophobicContact CG-CB 3.91Å; E236-R266 HydrophobicContact CG-CG 4.27Å; E236-R266 VanDerWaalsContact OE1-CD 3.27Å; E236-R266 WeakPolarHBondContact OE1-CD 3.27Å; E236-R266 IonicContact OE1-CZ 3.31Å; E236-R266 IonicContact OE1-NE 2.77Å; E236-R266 PolarHBondContact OE1-NE 2.84Å; E236-Q323 PolarHBondContact OE2-NE2 2.97Å; E236-Q323 PolarHBondContact OE2-OE1 2.98Å; E236-K359 IonicContact OE1-NZ 3.42Å; E236-K359 PolarHBondContact OE1-NZ 3.19Å; E236-K359 IonicContact OE2-NZ 3.49Å; E236-K359 PolarHBondContact OE2-NZ 2.95Å
237	L	98.4	Very high	97.8	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	8.9	173.6	-63.4	171	0	0	0	114.2	C234 E235 Y239 S240 F262 W296 Y298 A314 W319 F321	C234-L237 WeakPolarHBondContact O-CB 3.16Å; C234-L237 PolarHBondContact O-N 2.83Å; E235-L237 PolarHBondContact O-N 2.86Å; L237-Y239 PolarHBondContact O-N 3.21Å; L237-S240 WeakPolarHBondContact O-CB 3.49Å; L237-S240 PolarHBondContact O-N 3.27Å; L237-F262 HydrophobicContact CD2-CE2 4.29Å; L237-F262 HydrophobicContact CD2-CZ 4.01Å; L237-W296 HydrophobicContact CB-CH2 3.77Å; L237-W296 HydrophobicContact CB-CZ2 3.48Å; L237-W296 VanDerWaalsContact CB-CZ2 3.48Å; L237-W296 HydrophobicContact CD1-CD2 4.36Å; L237-W296 HydrophobicContact CD1-CE3 4.04Å; L237-W296 HydrophobicContact CD1-CH2 3.82Å; L237-W296 HydrophobicContact CD1-CZ2 4.13Å; L237-W296 HydrophobicContact CD1-CZ3 3.8Å; L237-W296 HydrophobicContact CG-CH2 4.47Å; L237-W296 HydrophobicContact CG-CZ2 4.43Å; L237-Y298 HydrophobicContact CD1-CD2 3.68Å; L237-Y298 HydrophobicContact CD1-CE2 4.47Å; L237-Y298 HydrophobicContact CD1-CG 4.44Å; L237-A314 HydrophobicContact CD1-CB 3.68Å; L237-W319 HydrophobicContact CD2-CH2 4.02Å; L237-W319 HydrophobicContact CD2-CZ3 4.27Å; L237-F321 HydrophobicContact CD1-CD1 4.46Å; L237-F321 HydrophobicContact CD2-CD1 3.91Å; L237-F321 HydrophobicContact CD2-CE1 4.28Å; L237-F321 HydrophobicContact CD2-CG 4.32Å; L237-F321 HydrophobicContact CG-CD1 4.37Å; L237-F321 HydrophobicContact CG-CE1 4.46Å
238	E	97.8	Very high	97.8	Very high	16 Å²	16	16.3 Å²	16.3	8%	0.075	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-40.3	176.2	-170.5	174.5	131	0	0	112.1	E235 N451 T464 F466	E235-E238 WeakPolarHBondContact O-CB 3.47Å; E235-E238 PolarHBondContact O-N 3.5Å; E238-N451 PolarHBondContact OE1-ND2 3.39Å; E238-T464 VanDerWaalsContact OE2-CB 3.29Å; E238-T464 WeakPolarHBondContact OE2-CB 3.25Å; E238-T464 WeakPolarHBondContact OE2-CG2 3.32Å; E238-T464 PolarHBondContact OE2-OG1 2.72Å; E238-F466 HydrophobicContact CB-CD1 3.64Å; E238-F466 HydrophobicContact CB-CE1 4.29Å; E238-F466 HydrophobicContact CB-CG 4.47Å; E238-F466 HydrophobicContact CG-CB 3.91Å; E238-F466 HydrophobicContact CG-CD1 3.95Å; E238-F466 HydrophobicContact CG-CG 4.31Å
239	Y	98.2	Very high	97.7	Very high	10 Å²	10	18.8 Å²	18.8	4%	0.039	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	36.7	179.6	-54	-85.5	0	0	0	112	L237 N241 L242 S265 W448 N451	L237-Y239 PolarHBondContact O-N 3.21Å; Y239-N241 VanDerWaalsContact C-OD1 3.24Å; Y239-N241 WeakPolarHBondContact CA-OD1 3.46Å; Y239-N241 PolarHBondContact O-N 2.79Å; Y239-N241 PolarHBondContact O-OD1 2.77Å; Y239-N241 VanDerWaalsContact O-OD1 3.11Å; Y239-L242 WeakPolarHBondContact O-CB 3.26Å; Y239-L242 PolarHBondContact O-N 2.91Å; Y239-S265 WeakPolarHBondContact CD2-OG 3.45Å; Y239-W448 AromaticContact CD1-CD1 3.69Å; Y239-W448 AromaticContact CD1-NE1 3.07Å; Y239-W448 AromaticContact CD2-NE1 3.77Å; Y239-W448 HydrophobicContact CE1-CZ2 4.42Å; Y239-W448 AromaticContact CE1-NE1 3.24Å; Y239-W448 HydrophobicContact CE2-CZ2 4.14Å; Y239-W448 AromaticContact CE2-NE1 3.95Å; Y239-W448 AromaticContact CG-NE1 3.36Å; Y239-W448 AromaticContact CZ-NE1 3.72Å; Y239-N451 VanDerWaalsContact CE1-ND2 3.31Å; Y239-N451 WeakPolarHBondContact CE1-ND2 3.47Å; Y239-N451 PolarHBondContact OH-N 3.35Å; Y239-N451 PolarHBondContact OH-ND2 2.89Å
240	S	98.1	Very high	97.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-24.2	177	72.1	0	0	0	0	113.3	L237 L242 L243 D244 W296	L237-S240 WeakPolarHBondContact O-CB 3.49Å; L237-S240 PolarHBondContact O-N 3.27Å; S240-L242 PolarHBondContact O-N 2.99Å; S240-L242 VanDerWaalsContact O-N 3.1Å; S240-L243 WeakPolarHBondContact O-CA 3.33Å; S240-L243 VanDerWaalsContact O-CB 3.25Å; S240-L243 WeakPolarHBondContact O-CB 3.37Å; S240-L243 PolarHBondContact O-N 2.66Å; S240-D244 PolarHBondContact O-N 2.88Å; S240-W296 PolarHBondContact OG-NE1 3.11Å
241	N	97.2	Very high	97.5	Very high	47 Å²	47	24.6 Å²	24.6	25%	0.251	12%	0.119	S	C	.	.	H	α-helix	trans	-57.1	-22	175	65.1	-22.9	0	0	0	114	Q167 Y239 D244 K245	Q167-N241 PolarHBondContact NE2-O 2.87Å; Y239-N241 VanDerWaalsContact C-OD1 3.24Å; Y239-N241 WeakPolarHBondContact CA-OD1 3.46Å; Y239-N241 PolarHBondContact O-N 2.79Å; Y239-N241 PolarHBondContact O-OD1 2.77Å; Y239-N241 VanDerWaalsContact O-OD1 3.11Å; N241-D244 WeakPolarHBondContact CA-OD2 3.2Å; N241-D244 PolarHBondContact O-N 2.83Å; N241-K245 WeakPolarHBondContact O-CG 3.18Å; N241-K245 PolarHBondContact O-N 3.31Å
242	L	98.6	Very high	97.3	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-68.1	-33.4	170.3	-67.6	167.2	0	0	0	112.2	Y239 S240 K245 A246 Y258 I261 F262 W448	Y239-L242 WeakPolarHBondContact O-CB 3.26Å; Y239-L242 PolarHBondContact O-N 2.91Å; S240-L242 PolarHBondContact O-N 2.99Å; S240-L242 VanDerWaalsContact O-N 3.1Å; L242-K245 HydrophobicContact CD2-CD 4.44Å; L242-K245 PolarHBondContact O-N 2.89Å; L242-A246 WeakPolarHBondContact O-CB 3.17Å; L242-A246 PolarHBondContact O-N 3.01Å; L242-Y258 HydrophobicContact CD2-CD1 4.27Å; L242-I261 HydrophobicContact CD1-CG2 3.96Å; L242-I261 HydrophobicContact CD2-CG2 4.24Å; L242-F262 HydrophobicContact CB-CB 3.91Å; L242-F262 HydrophobicContact CD1-CB 4.11Å; L242-W448 HydrophobicContact CD1-CG 4.37Å; L242-W448 HydrophobicContact CD2-CB 4.46Å
243	L	98.6	Very high	97.3	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-70	-36.2	173	-56.9	-177.2	0	0	0	111.4	S240 A246 A247 I259 F262 W319 V346	S240-L243 WeakPolarHBondContact O-CA 3.33Å; S240-L243 VanDerWaalsContact O-CB 3.25Å; S240-L243 WeakPolarHBondContact O-CB 3.37Å; S240-L243 PolarHBondContact O-N 2.66Å; L243-A246 PolarHBondContact O-N 3.19Å; L243-A247 WeakPolarHBondContact O-CB 3.35Å; L243-A247 PolarHBondContact O-N 2.97Å; L243-I259 HydrophobicContact CD2-CG1 4.32Å; L243-F262 HydrophobicContact CD1-CD1 4.45Å; L243-F262 HydrophobicContact CD1-CD2 4.37Å; L243-F262 HydrophobicContact CD1-CE1 4.09Å; L243-F262 HydrophobicContact CD1-CE2 4Å; L243-F262 HydrophobicContact CD1-CZ 3.86Å; L243-F262 HydrophobicContact CD2-CB 4.08Å; L243-F262 HydrophobicContact CD2-CD1 3.57Å; L243-F262 HydrophobicContact CD2-CD2 4.07Å; L243-F262 HydrophobicContact CD2-CE1 4Å; L243-F262 HydrophobicContact CD2-CE2 4.46Å; L243-F262 HydrophobicContact CD2-CG 3.61Å; L243-F262 HydrophobicContact CD2-CZ 4.44Å; L243-F262 HydrophobicContact CG-CD1 4.19Å; L243-F262 HydrophobicContact CG-CD2 3.89Å; L243-F262 HydrophobicContact CG-CE1 4.32Å; L243-F262 HydrophobicContact CG-CE2 4.04Å; L243-F262 HydrophobicContact CG-CG 3.98Å; L243-F262 HydrophobicContact CG-CZ 4.25Å; L243-W319 HydrophobicContact CB-CD2 3.94Å; L243-W319 HydrophobicContact CB-CG 3.83Å; L243-W319 HydrophobicContact CD1-CD2 3.72Å; L243-W319 HydrophobicContact CD1-CE3 3.78Å; L243-W319 HydrophobicContact CD1-CG 4.31Å; L243-W319 HydrophobicContact CD1-CH2 4.26Å; L243-W319 HydrophobicContact CD1-CZ2 4.19Å; L243-W319 HydrophobicContact CD1-CZ3 4.06Å; L243-V346 HydrophobicContact CD1-CG2 4.29Å; L243-V346 HydrophobicContact CD2-CG1 4.13Å; L243-V346 HydrophobicContact CD2-CG2 3.95Å
244	D	97.2	Very high	97.3	Very high	13 Å²	13	29 Å²	29	7%	0.07	14%	0.137	C	C	.	.	H	α-helix	trans	-67	-39.3	174	-58	-55.5	0	0	0	111.7	S240 N241 A247 Q248 H318 W319	S240-D244 PolarHBondContact O-N 2.88Å; N241-D244 WeakPolarHBondContact CA-OD2 3.2Å; N241-D244 PolarHBondContact O-N 2.83Å; D244-A247 PolarHBondContact O-N 3.12Å; D244-Q248 WeakPolarHBondContact O-CG 3.32Å; D244-Q248 PolarHBondContact O-N 3.24Å; D244-H318 IonicContact OD1-CD2 2.82Å; D244-W319 PolarHBondContact OD1-NE1 2.82Å
245	K	97.4	Very high	97.2	Very high	58 Å²	58	29.5 Å²	29.5	25%	0.252	14%	0.139	S	C	.	.	H	α-helix	trans	-59.6	-48.6	169.5	-71.4	178.1	-174	178.4	0	111.1	N241 L242 A247 Q248 E249 Y258	N241-K245 WeakPolarHBondContact O-CG 3.18Å; N241-K245 PolarHBondContact O-N 3.31Å; L242-K245 HydrophobicContact CD2-CD 4.44Å; L242-K245 PolarHBondContact O-N 2.89Å; K245-A247 VanDerWaalsContact C-N 3.31Å; K245-A247 PolarHBondContact O-N 2.89Å; K245-Q248 PolarHBondContact O-N 3.24Å; K245-E249 WeakPolarHBondContact O-CB 3.37Å; K245-E249 PolarHBondContact O-N 3.2Å; K245-Y258 HydrophobicContact CB-CD1 4.25Å; K245-Y258 HydrophobicContact CB-CD2 4.27Å; K245-Y258 HydrophobicContact CB-CE1 4.3Å; K245-Y258 HydrophobicContact CB-CE2 4.32Å; K245-Y258 HydrophobicContact CB-CG 4.25Å; K245-Y258 HydrophobicContact CD-CD1 4.2Å; K245-Y258 HydrophobicContact CD-CE1 3.82Å
246	A	97.9	Very high	97.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.1	-38.2	177.9	0	0	0	0	0	112.7	L242 L243 Q248 R255 I259 L348	L242-A246 WeakPolarHBondContact O-CB 3.17Å; L242-A246 PolarHBondContact O-N 3.01Å; L243-A246 PolarHBondContact O-N 3.19Å; A246-Q248 VanDerWaalsContact C-N 3.33Å; A246-Q248 PolarHBondContact O-N 3.02Å; A246-R255 WeakPolarHBondContact O-CD 3.2Å; A246-R255 VanDerWaalsContact O-CG 3.22Å; A246-R255 WeakPolarHBondContact O-CG 3.36Å; A246-I259 HydrophobicContact CB-CD1 4.19Å; A246-I259 HydrophobicContact CB-CG1 3.85Å; A246-L348 HydrophobicContact CB-CD1 4.44Å; A246-L348 HydrophobicContact CB-CD2 4.46Å
247	A	96.9	Very high	97.2	Very high	6 Å²	6	28.6 Å²	28.6	5%	0.05	14%	0.135	C	C	.	.	H	α-helix	trans	-69.1	-29.1	178.2	0	0	0	0	0	113.7	L243 D244 K245 H318 L348	L243-A247 WeakPolarHBondContact O-CB 3.35Å; L243-A247 PolarHBondContact O-N 2.97Å; D244-A247 PolarHBondContact O-N 3.12Å; K245-A247 VanDerWaalsContact C-N 3.31Å; K245-A247 PolarHBondContact O-N 2.89Å; A247-H318 HydrophobicContact CB-CB 3.69Å; A247-L348 HydrophobicContact CB-CD2 4.15Å
248	Q	96.2	Very high	97.2	Very high	96 Å²	96	30.6 Å²	30.6	45%	0.449	14%	0.143	S	C	.	.	H	α-helix	trans	-87.1	-25.4	179.2	-67.9	175.1	25.4	0	0	113	D244 K245 A246	D244-Q248 WeakPolarHBondContact O-CG 3.32Å; D244-Q248 PolarHBondContact O-N 3.24Å; K245-Q248 PolarHBondContact O-N 3.24Å; A246-Q248 VanDerWaalsContact C-N 3.33Å; A246-Q248 PolarHBondContact O-N 3.02Å
249	E	96.7	Very high	97.3	Very high	52 Å²	52	29.8 Å²	29.8	24%	0.243	14%	0.139	C	C	.	.			trans	-67.6	135.9	-177.5	176.8	61.2	-95.5	0	0	112.9	K245 D251 M254 R255 Y258 R351	K245-E249 WeakPolarHBondContact O-CB 3.37Å; K245-E249 PolarHBondContact O-N 3.2Å; E249-D251 WeakPolarHBondContact CG-O 2.94Å; E249-D251 PolarHBondContact OE1-N 2.68Å; E249-M254 HydrophobicContact CG-CB 3.59Å; E249-R255 HydrophobicContact CB-CG 3.82Å; E249-R255 HydrophobicContact CG-CG 3.86Å; E249-R255 WeakPolarHBondContact O-CD 3.31Å; E249-R255 PolarHBondContact O-NH1 3.32Å; E249-Y258 HydrophobicContact CB-CD2 4.46Å; E249-Y258 HydrophobicContact CB-CE2 4.37Å; E249-Y258 HydrophobicContact CG-CE2 4.3Å; E249-R351 PolarHBondContact O-NH2 2.86Å
250	E	94.9	Very high	97.3	Very high	116 Å²	116	29.3 Å²	29.3	54%	0.542	14%	0.137	S	C	.	.			trans	-92.9	-30.7	-179	-65.5	-60.6	148.8	0	0	111.9	R252 R255 K350 R351	E250-R252 PolarHBondContact O-N 3.35Å; E250-R255 PolarHBondContact O-NH1 2.83Å; E250-K350 IonicContact OE1-NZ 3.84Å; E250-K350 PolarHBondContact OE1-NZ 2.99Å; E250-R351 IonicContact OE1-CZ 3.44Å; E250-R351 IonicContact OE1-NH1 3.8Å; E250-R351 IonicContact OE1-NH2 2.64Å; E250-R351 PolarHBondContact OE1-NH2 2.9Å; E250-R351 IonicContact OE2-CZ 2.88Å; E250-R351 IonicContact OE2-NH1 3.81Å; E250-R351 PolarHBondContact OE2-NH1 2.82Å; E250-R351 IonicContact OE2-NH2 2.68Å; E250-R351 PolarHBondContact OE2-NH2 3.16Å
251	D	95.1	Very high	97.3	Very high	59 Å²	59	29.3 Å²	29.3	32%	0.316	14%	0.137	S	C	.	.			trans	-75.7	119.9	171.9	175.4	25.6	0	0	0	112	E249 F253 M254 R255	E249-D251 WeakPolarHBondContact CG-O 2.94Å; E249-D251 PolarHBondContact OE1-N 2.68Å; D251-F253 PolarHBondContact O-N 3.48Å; D251-F253 VanDerWaalsContact OD1-CD2 3.29Å; D251-F253 WeakPolarHBondContact OD1-CD2 3.5Å; D251-F253 PolarHBondContact OD1-N 3.48Å; D251-M254 HydrophobicContact CB-CB 4.15Å; D251-M254 HydrophobicContact CB-CG 4.26Å; D251-M254 PolarHBondContact O-N 2.8Å; D251-M254 WeakPolarHBondContact OD2-CG 3.32Å; D251-M254 PolarHBondContact OD2-N 3.25Å; D251-R255 WeakPolarHBondContact O-CG 3.46Å; D251-R255 PolarHBondContact O-N 3.05Å
252	R	95	Very high	97.4	Very high	49 Å²	49	27.3 Å²	27.3	19%	0.185	13%	0.126	C	C	.	.	H	α-helix	trans	-58.8	-30.3	176.7	65.7	-177.9	176	140.8	-3.7	113.6	E250 M256 L390 V392 E424	E250-R252 PolarHBondContact O-N 3.35Å; R252-M256 PolarHBondContact O-N 3.47Å; R252-M256 VanDerWaalsContact O-N 3.12Å; R252-L390 PolarHBondContact NH1-O 3.29Å; R252-V392 HydrophobicContact CB-CG2 4.09Å; R252-V392 HydrophobicContact CG-CG2 3.82Å; R252-E424 IonicContact CZ-OE2 3.69Å; R252-E424 VanDerWaalsContact CZ-OE2 3.29Å; R252-E424 IonicContact NH1-OE2 3.33Å; R252-E424 PolarHBondContact NH1-OE2 3.17Å; R252-E424 IonicContact NH2-OE1 3.71Å; R252-E424 IonicContact NH2-OE2 3.36Å; R252-E424 PolarHBondContact NH2-OE2 2.79Å
253	F	96.5	Very high	97.4	Very high	25 Å²	25	27.5 Å²	27.5	11%	0.11	13%	0.128	C	C	.	.	H	α-helix	trans	-75.1	-45.5	179.3	-57	-62.1	0	0	0	110.8	D251 R255 M256 A257 V392 V421 N423 V429 L430	D251-F253 PolarHBondContact O-N 3.48Å; D251-F253 VanDerWaalsContact OD1-CD2 3.29Å; D251-F253 WeakPolarHBondContact OD1-CD2 3.5Å; D251-F253 PolarHBondContact OD1-N 3.48Å; F253-R255 VanDerWaalsContact C-N 3.34Å; F253-R255 PolarHBondContact O-N 3.33Å; F253-M256 PolarHBondContact O-N 2.94Å; F253-A257 PolarHBondContact O-N 3.17Å; F253-V392 HydrophobicContact CD1-CG1 3.87Å; F253-V392 HydrophobicContact CD1-CG2 4.26Å; F253-V392 HydrophobicContact CE1-CG1 4.28Å; F253-V392 HydrophobicContact CE1-CG2 4.15Å; F253-V421 HydrophobicContact CB-CG1 4.13Å; F253-V421 HydrophobicContact CD1-CG1 3.9Å; F253-N423 HydrophobicContact CE1-CB 3.84Å; F253-N423 HydrophobicContact CZ-CB 3.78Å; F253-V429 HydrophobicContact CB-CG1 4.37Å; F253-V429 HydrophobicContact CD1-CB 4.32Å; F253-V429 HydrophobicContact CD1-CG1 4.46Å; F253-V429 HydrophobicContact CD1-CG2 4.31Å; F253-V429 HydrophobicContact CD2-CB 4.45Å; F253-V429 HydrophobicContact CD2-CG1 3.75Å; F253-V429 HydrophobicContact CE1-CG2 4.01Å; F253-V429 HydrophobicContact CE2-CG1 4.05Å; F253-V429 HydrophobicContact CE2-CG2 4.28Å; F253-V429 HydrophobicContact CG-CB 4.28Å; F253-V429 HydrophobicContact CG-CG1 3.95Å; F253-V429 HydrophobicContact CZ-CG2 3.96Å; F253-L430 VanDerWaalsContact C-CD1 3.48Å; F253-L430 HydrophobicContact CB-CD1 3.75Å; F253-L430 HydrophobicContact CB-CG 4.17Å
254	M	97.6	Very high	97.4	Very high	41 Å²	41	27.5 Å²	27.5	20%	0.202	13%	0.128	C	C	.	.	H	α-helix	trans	-61.3	-38.1	170.8	-71.2	-62.3	-63.6	0	0	112.7	E249 D251 M256 A257 Y258 L430 I442	E249-M254 HydrophobicContact CG-CB 3.59Å; D251-M254 HydrophobicContact CB-CB 4.15Å; D251-M254 HydrophobicContact CB-CG 4.26Å; D251-M254 PolarHBondContact O-N 2.8Å; D251-M254 WeakPolarHBondContact OD2-CG 3.32Å; D251-M254 PolarHBondContact OD2-N 3.25Å; M254-M256 PolarHBondContact O-N 2.93Å; M254-A257 PolarHBondContact O-N 3.46Å; M254-Y258 HydrophobicContact CB-CE2 4.45Å; M254-Y258 HydrophobicContact CE-CE2 4.05Å; M254-Y258 WeakPolarHBondContact O-CD2 3.23Å; M254-Y258 PolarHBondContact O-N 3.37Å; M254-L430 HydrophobicContact CG-CD1 4.26Å; M254-L430 HydrophobicContact SD-CD1 3.73Å; M254-L430 HydrophobicContact SD-CD2 4.36Å; M254-I442 HydrophobicContact CE-CD1 3.77Å; M254-I442 HydrophobicContact SD-CD1 4.28Å; M254-I442 HydrophobicContact SD-CG2 3.95Å
255	R	97.3	Very high	97.4	Very high	11 Å²	11	26.9 Å²	26.9	4%	0.042	13%	0.125	C	C	.	.	H	α-helix	trans	-56.2	-50.4	171.4	-73.3	-156.6	-67.7	-70.9	2.6	112.3	A246 E249 E250 D251 F253 A257 Y258 I259 E353 Y355	A246-R255 WeakPolarHBondContact O-CD 3.2Å; A246-R255 VanDerWaalsContact O-CG 3.22Å; A246-R255 WeakPolarHBondContact O-CG 3.36Å; E249-R255 HydrophobicContact CB-CG 3.82Å; E249-R255 HydrophobicContact CG-CG 3.86Å; E249-R255 WeakPolarHBondContact O-CD 3.31Å; E249-R255 PolarHBondContact O-NH1 3.32Å; E250-R255 PolarHBondContact O-NH1 2.83Å; D251-R255 WeakPolarHBondContact O-CG 3.46Å; D251-R255 PolarHBondContact O-N 3.05Å; F253-R255 VanDerWaalsContact C-N 3.34Å; F253-R255 PolarHBondContact O-N 3.33Å; R255-A257 VanDerWaalsContact C-N 3.3Å; R255-A257 PolarHBondContact O-N 2.97Å; R255-Y258 PolarHBondContact O-N 2.97Å; R255-I259 WeakPolarHBondContact O-CG1 3.39Å; R255-I259 PolarHBondContact O-N 2.86Å; R255-I259 VanDerWaalsContact O-N 3.12Å; R255-E353 IonicContact CZ-OE1 2.81Å; R255-E353 IonicContact CZ-OE2 2.73Å; R255-E353 IonicContact NE-OE1 4Å; R255-E353 IonicContact NE-OE2 2.7Å; R255-E353 PolarHBondContact NE-OE2 2.74Å; R255-E353 IonicContact NH2-OE1 3.12Å; R255-E353 PolarHBondContact NH2-OE1 3.02Å; R255-E353 IonicContact NH2-OE2 2.71Å; R255-E353 PolarHBondContact NH2-OE2 3.28Å; R255-E353 VanDerWaalsContact NH2-OE2 3.15Å; R255-Y355 WeakPolarHBondContact CB-OH 3.24Å; R255-Y355 PolarHBondContact NE-OH 3.42Å
256	M	97.8	Very high	97.4	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60	-41.4	176.4	179.1	60.9	80.6	0	0	111.5	R252 F253 M254 I259 A260 Y355 F382 C384 V392 C394 V421	R252-M256 PolarHBondContact O-N 3.47Å; R252-M256 VanDerWaalsContact O-N 3.12Å; F253-M256 PolarHBondContact O-N 2.94Å; M254-M256 PolarHBondContact O-N 2.93Å; M256-I259 PolarHBondContact O-N 2.96Å; M256-A260 WeakPolarHBondContact O-CB 3.27Å; M256-A260 PolarHBondContact O-N 2.87Å; M256-Y355 HydrophobicContact CB-CE1 4.45Å; M256-Y355 HydrophobicContact CE-CD1 3.81Å; M256-Y355 HydrophobicContact CE-CE1 4.01Å; M256-Y355 HydrophobicContact SD-CD1 4.05Å; M256-Y355 HydrophobicContact SD-CE1 4.34Å; M256-F382 HydrophobicContact CE-CB 4.22Å; M256-F382 HydrophobicContact SD-CB 3.54Å; M256-F382 VanDerWaalsContact SD-CB 3.54Å; M256-F382 HydrophobicContact SD-CG 4.34Å; M256-C384 HydrophobicContact CE-CB 3.72Å; M256-V392 HydrophobicContact CB-CG1 3.75Å; M256-V392 HydrophobicContact CE-CB 4.2Å; M256-V392 HydrophobicContact CE-CG1 4.13Å; M256-V392 VanDerWaalsContact CE-O 3.23Å; M256-V392 WeakPolarHBondContact CE-O 3.35Å; M256-V392 HydrophobicContact CG-CG1 3.92Å; M256-C394 HydrophobicContact CG-CB 3.52Å; M256-C394 HydrophobicContact SD-CB 3.89Å; M256-V421 HydrophobicContact CB-CG1 4.02Å; M256-V421 HydrophobicContact CG-CG1 3.94Å; M256-V421 HydrophobicContact CG-CG2 4.33Å
257	A	98.5	Very high	97.4	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.9	-44.3	178	0	0	0	0	0	112.7	F253 M254 R255 I259 A260 I261 V421 L430 I432 I442	F253-A257 PolarHBondContact O-N 3.17Å; M254-A257 PolarHBondContact O-N 3.46Å; R255-A257 VanDerWaalsContact C-N 3.3Å; R255-A257 PolarHBondContact O-N 2.97Å; A257-I259 VanDerWaalsContact C-N 3.35Å; A257-I259 PolarHBondContact O-N 3.32Å; A257-A260 PolarHBondContact O-N 2.81Å; A257-I261 WeakPolarHBondContact O-CB 3.48Å; A257-I261 VanDerWaalsContact O-CG1 3.28Å; A257-I261 WeakPolarHBondContact O-CG1 3.42Å; A257-I261 PolarHBondContact O-N 2.73Å; A257-V421 HydrophobicContact CB-CG2 4.08Å; A257-L430 HydrophobicContact CB-CD1 4.07Å; A257-I432 HydrophobicContact CB-CD1 3.9Å; A257-I442 HydrophobicContact CB-CD1 3.59Å; A257-I442 HydrophobicContact CB-CG1 4.08Å
258	Y	98.6	Very high	97.4	Very high	41 Å²	41	26.6 Å²	26.6	16%	0.161	12%	0.121	C	C	.	.	H	α-helix	trans	-62.6	-39.1	175.8	-74	-56.5	0	0	0	112.7	L242 K245 E249 M254 R255 I261 F262	L242-Y258 HydrophobicContact CD2-CD1 4.27Å; K245-Y258 HydrophobicContact CB-CD1 4.25Å; K245-Y258 HydrophobicContact CB-CD2 4.27Å; K245-Y258 HydrophobicContact CB-CE1 4.3Å; K245-Y258 HydrophobicContact CB-CE2 4.32Å; K245-Y258 HydrophobicContact CB-CG 4.25Å; K245-Y258 HydrophobicContact CD-CD1 4.2Å; K245-Y258 HydrophobicContact CD-CE1 3.82Å; E249-Y258 HydrophobicContact CB-CD2 4.46Å; E249-Y258 HydrophobicContact CB-CE2 4.37Å; E249-Y258 HydrophobicContact CG-CE2 4.3Å; M254-Y258 HydrophobicContact CB-CE2 4.45Å; M254-Y258 HydrophobicContact CE-CE2 4.05Å; M254-Y258 WeakPolarHBondContact O-CD2 3.23Å; M254-Y258 PolarHBondContact O-N 3.37Å; R255-Y258 PolarHBondContact O-N 2.97Å; Y258-I261 PolarHBondContact O-N 3.18Å; Y258-F262 WeakPolarHBondContact O-CB 3.15Å; Y258-F262 PolarHBondContact O-N 3.25Å
259	I	98.6	Very high	97.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-69.6	-39.4	177.3	-69.9	171.1	0	0	0	111.3	L243 A246 R255 M256 A257 F262 A263 V346 L348 Y355 W357	L243-I259 HydrophobicContact CD2-CG1 4.32Å; A246-I259 HydrophobicContact CB-CD1 4.19Å; A246-I259 HydrophobicContact CB-CG1 3.85Å; R255-I259 WeakPolarHBondContact O-CG1 3.39Å; R255-I259 PolarHBondContact O-N 2.86Å; R255-I259 VanDerWaalsContact O-N 3.12Å; M256-I259 PolarHBondContact O-N 2.96Å; A257-I259 VanDerWaalsContact C-N 3.35Å; A257-I259 PolarHBondContact O-N 3.32Å; I259-F262 WeakPolarHBondContact O-CB 3.38Å; I259-F262 PolarHBondContact O-N 3.41Å; I259-A263 PolarHBondContact O-N 3.06Å; I259-V346 HydrophobicContact CD1-CG1 4.29Å; I259-L348 HydrophobicContact CD1-CD1 4.25Å; I259-L348 HydrophobicContact CD1-CD2 4.45Å; I259-L348 HydrophobicContact CD1-CG 4.49Å; I259-Y355 HydrophobicContact CD1-CD1 3.52Å; I259-Y355 HydrophobicContact CD1-CD2 3.43Å; I259-Y355 VanDerWaalsContact CD1-CD2 3.43Å; I259-Y355 HydrophobicContact CD1-CE1 3.69Å; I259-Y355 HydrophobicContact CD1-CE2 3.62Å; I259-Y355 HydrophobicContact CD1-CG 3.39Å; I259-Y355 HydrophobicContact CG2-CD1 4.43Å; I259-Y355 HydrophobicContact CG2-CG 4.43Å; I259-W357 HydrophobicContact CG2-CE3 4.27Å; I259-W357 HydrophobicContact CG2-CH2 4.49Å; I259-W357 HydrophobicContact CG2-CZ3 3.88Å
260	A	98.7	Very high	97.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.1	-39.7	175.5	0	0	0	0	0	112	M256 A257 A263 V264 F382 L396 I432	M256-A260 WeakPolarHBondContact O-CB 3.27Å; M256-A260 PolarHBondContact O-N 2.87Å; A257-A260 PolarHBondContact O-N 2.81Å; A260-A263 PolarHBondContact O-N 3.49Å; A260-V264 WeakPolarHBondContact O-CG2 3.18Å; A260-V264 PolarHBondContact O-N 3.15Å; A260-F382 HydrophobicContact CB-CD1 4.22Å; A260-F382 HydrophobicContact CB-CD2 4.09Å; A260-F382 HydrophobicContact CB-CE1 4.02Å; A260-F382 HydrophobicContact CB-CE2 3.85Å; A260-F382 HydrophobicContact CB-CG 4.28Å; A260-F382 HydrophobicContact CB-CZ 3.81Å; A260-L396 HydrophobicContact CB-CD1 3.79Å; A260-L396 HydrophobicContact CB-CG 4.25Å; A260-I432 HydrophobicContact CB-CD1 4.29Å
261	I	98.7	Very high	97.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-68.5	-39.1	174.5	-71	177.2	0	0	0	111.6	L242 A257 Y258 V264 S265 I432 L440 I442 A447 W448	L242-I261 HydrophobicContact CD1-CG2 3.96Å; L242-I261 HydrophobicContact CD2-CG2 4.24Å; A257-I261 WeakPolarHBondContact O-CB 3.48Å; A257-I261 VanDerWaalsContact O-CG1 3.28Å; A257-I261 WeakPolarHBondContact O-CG1 3.42Å; A257-I261 PolarHBondContact O-N 2.73Å; Y258-I261 PolarHBondContact O-N 3.18Å; I261-V264 PolarHBondContact O-N 3.42Å; I261-S265 WeakPolarHBondContact O-CB 3.48Å; I261-S265 PolarHBondContact O-N 2.74Å; I261-I432 HydrophobicContact CD1-CG2 4.42Å; I261-I432 HydrophobicContact CG1-CG2 4.23Å; I261-L440 HydrophobicContact CB-CD1 4.41Å; I261-L440 HydrophobicContact CD1-CB 4.19Å; I261-L440 HydrophobicContact CG1-CB 4.22Å; I261-L440 HydrophobicContact CG1-CD1 4.17Å; I261-L440 HydrophobicContact CG2-CB 4.35Å; I261-L440 HydrophobicContact CG2-CD1 4.06Å; I261-I442 HydrophobicContact CD1-CD1 3.91Å; I261-I442 HydrophobicContact CD1-CG1 3.68Å; I261-A447 HydrophobicContact CD1-CB 3.6Å; I261-W448 HydrophobicContact CG2-CB 3.37Å; I261-W448 HydrophobicContact CG2-CG 4.05Å
262	F	98.7	Very high	97.2	Very high	4 Å²	4	18.5 Å²	18.5	2%	0.018	8%	0.084	C	C	.	.	H	α-helix	trans	-56.3	-51.3	171.9	165.4	-100.4	0	0	0	111.2	E236 L237 L242 L243 Y258 I259 V264 S265 F321 W357	E236-F262 VanDerWaalsContact O-CE2 3.27Å; E236-F262 WeakPolarHBondContact O-CE2 3.5Å; L237-F262 HydrophobicContact CD2-CE2 4.29Å; L237-F262 HydrophobicContact CD2-CZ 4.01Å; L242-F262 HydrophobicContact CB-CB 3.91Å; L242-F262 HydrophobicContact CD1-CB 4.11Å; L243-F262 HydrophobicContact CD1-CD1 4.45Å; L243-F262 HydrophobicContact CD1-CD2 4.37Å; L243-F262 HydrophobicContact CD1-CE1 4.09Å; L243-F262 HydrophobicContact CD1-CE2 4Å; L243-F262 HydrophobicContact CD1-CZ 3.86Å; L243-F262 HydrophobicContact CD2-CB 4.08Å; L243-F262 HydrophobicContact CD2-CD1 3.57Å; L243-F262 HydrophobicContact CD2-CD2 4.07Å; L243-F262 HydrophobicContact CD2-CE1 4Å; L243-F262 HydrophobicContact CD2-CE2 4.46Å; L243-F262 HydrophobicContact CD2-CG 3.61Å; L243-F262 HydrophobicContact CD2-CZ 4.44Å; L243-F262 HydrophobicContact CG-CD1 4.19Å; L243-F262 HydrophobicContact CG-CD2 3.89Å; L243-F262 HydrophobicContact CG-CE1 4.32Å; L243-F262 HydrophobicContact CG-CE2 4.04Å; L243-F262 HydrophobicContact CG-CG 3.98Å; L243-F262 HydrophobicContact CG-CZ 4.25Å; Y258-F262 WeakPolarHBondContact O-CB 3.15Å; Y258-F262 PolarHBondContact O-N 3.25Å; I259-F262 WeakPolarHBondContact O-CB 3.38Å; I259-F262 PolarHBondContact O-N 3.41Å; F262-V264 PolarHBondContact O-N 3.08Å; F262-S265 WeakPolarHBondContact O-CB 3.23Å; F262-S265 PolarHBondContact O-N 2.8Å; F262-S265 PolarHBondContact O-OG 2.93Å; F262-F321 HydrophobicContact CE1-CD2 4.28Å; F262-F321 HydrophobicContact CE1-CE2 4.04Å; F262-F321 HydrophobicContact CZ-CE2 4.35Å; F262-W357 HydrophobicContact CD1-CH2 4.06Å; F262-W357 HydrophobicContact CD1-CZ2 4.24Å; F262-W357 AromaticContact CE1-CH2 3.96Å; F262-W357 HydrophobicContact CE1-CH2 3.96Å; F262-W357 HydrophobicContact CE1-CZ2 4.11Å
263	A	98.5	Very high	97.1	Very high	6 Å²	6	16.8 Å²	16.8	5%	0.05	8%	0.078	C	C	.	.	H	α-helix	trans	-60.2	-30.3	-179.6	0	0	0	0	0	113.8	I259 A260 R266 W357 M380 F382	I259-A263 PolarHBondContact O-N 3.06Å; A260-A263 PolarHBondContact O-N 3.49Å; A263-R266 WeakPolarHBondContact O-CG 3.26Å; A263-W357 HydrophobicContact CB-CD2 4.16Å; A263-W357 VanDerWaalsContact CB-CE2 3.47Å; A263-W357 HydrophobicContact CB-CG 4.41Å; A263-W357 HydrophobicContact CB-CZ2 3.7Å; A263-M380 HydrophobicContact CB-CE 3.85Å; A263-F382 HydrophobicContact CB-CE1 3.52Å; A263-F382 HydrophobicContact CB-CZ 3.78Å
264	V	98.4	Very high	96.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-82.5	-33.4	174.7	174.1	0	0	0	0	112.5	A260 I261 F262 R266 Y267 M380 L396 L398 I417 W436 L440	A260-V264 WeakPolarHBondContact O-CG2 3.18Å; A260-V264 PolarHBondContact O-N 3.15Å; I261-V264 PolarHBondContact O-N 3.42Å; F262-V264 PolarHBondContact O-N 3.08Å; V264-R266 PolarHBondContact O-N 3.21Å; V264-Y267 HydrophobicContact CG1-CD2 4.28Å; V264-Y267 WeakPolarHBondContact O-CD2 3.4Å; V264-Y267 PolarHBondContact O-N 3.12Å; V264-M380 HydrophobicContact CG2-SD 4.19Å; V264-L396 HydrophobicContact CG2-CD1 3.61Å; V264-L398 HydrophobicContact CG2-CD1 4.36Å; V264-I417 HydrophobicContact CG1-CD1 3.31Å; V264-I417 HydrophobicContact CG2-CD1 4.43Å; V264-W436 HydrophobicContact CG1-CB 4.1Å; V264-L440 HydrophobicContact CB-CD1 3.95Å; V264-L440 HydrophobicContact CG1-CD1 3.64Å
265	S	98.2	Very high	95.6	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-55.3	-29.5	-176.8	72.9	0	0	0	0	113.2	Y239 I261 F262 Y267 K268	Y239-S265 WeakPolarHBondContact CD2-OG 3.45Å; I261-S265 WeakPolarHBondContact O-CB 3.48Å; I261-S265 PolarHBondContact O-N 2.74Å; F262-S265 WeakPolarHBondContact O-CB 3.23Å; F262-S265 PolarHBondContact O-N 2.8Å; F262-S265 PolarHBondContact O-OG 2.93Å; S265-Y267 PolarHBondContact O-N 3.37Å; S265-K268 VanDerWaalsContact O-CB 3.28Å; S265-K268 WeakPolarHBondContact O-CB 3.11Å; S265-K268 PolarHBondContact O-N 2.8Å; S265-K268 VanDerWaalsContact O-N 3.11Å
266	R	96.8	Very high	95	Very high	39 Å²	39	16.9 Å²	16.9	15%	0.147	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-58.5	-28.8	176.5	87.3	86.2	175.9	178.8	-2.9	114.2	E236 A263 V264 K268 S269	E236-R266 HydrophobicContact CB-CB 3.95Å; E236-R266 HydrophobicContact CG-CB 3.91Å; E236-R266 HydrophobicContact CG-CG 4.27Å; E236-R266 VanDerWaalsContact OE1-CD 3.27Å; E236-R266 WeakPolarHBondContact OE1-CD 3.27Å; E236-R266 IonicContact OE1-CZ 3.31Å; E236-R266 IonicContact OE1-NE 2.77Å; E236-R266 PolarHBondContact OE1-NE 2.84Å; A263-R266 WeakPolarHBondContact O-CG 3.26Å; V264-R266 PolarHBondContact O-N 3.21Å; R266-K268 PolarHBondContact O-N 3.23Å; R266-S269 PolarHBondContact O-OG 3.45Å
267	Y	97.3	Very high	94.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-68.3	-20.6	-179.8	-63.1	-75.5	0	0	0	111.8	V264 S265 S269 T270 A360 H376 M380 L398 W436	V264-Y267 HydrophobicContact CG1-CD2 4.28Å; V264-Y267 WeakPolarHBondContact O-CD2 3.4Å; V264-Y267 PolarHBondContact O-N 3.12Å; S265-Y267 PolarHBondContact O-N 3.37Å; Y267-S269 VanDerWaalsContact C-N 3.31Å; Y267-S269 PolarHBondContact O-N 2.84Å; Y267-T270 PolarHBondContact O-N 2.75Å; Y267-T270 PolarHBondContact O-OG1 2.71Å; Y267-A360 HydrophobicContact CE1-CB 4.37Å; Y267-A360 PolarHBondContact OH-N 2.9Å; Y267-H376 HydrophobicContact CD1-CB 4.04Å; Y267-H376 AromaticContact CD1-CD2 3.75Å; Y267-H376 AromaticContact CD1-CE1 3.75Å; Y267-H376 AromaticContact CD1-CG 3.48Å; Y267-H376 VanDerWaalsContact CD1-CG 3.48Å; Y267-H376 AromaticContact CD1-ND1 3.48Å; Y267-H376 WeakPolarHBondContact CD1-ND1 3.45Å; Y267-H376 AromaticContact CD1-NE2 3.9Å; Y267-H376 HydrophobicContact CE1-CB 4.41Å; Y267-H376 AromaticContact CE1-ND1 3.95Å; Y267-H376 HydrophobicContact CG-CB 4.46Å; Y267-M380 HydrophobicContact CE2-CE 4.39Å; Y267-M380 HydrophobicContact CE2-SD 3.84Å; Y267-L398 HydrophobicContact CD2-CD2 4Å; Y267-L398 HydrophobicContact CE2-CD2 3.98Å; Y267-L398 HydrophobicContact CG-CD2 4.49Å; Y267-W436 VanDerWaalsContact O-CZ3 3.24Å; Y267-W436 WeakPolarHBondContact O-CZ3 3.26Å
268	K	97.1	Very high	94.3	Very high	20 Å²	20	22.8 Å²	22.8	9%	0.087	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-57.2	-40.3	-179	176.2	61	-170.2	-177.3	0	113.4	S265 R266 T270 Q271 T437 W448 P450	S265-K268 VanDerWaalsContact O-CB 3.28Å; S265-K268 WeakPolarHBondContact O-CB 3.11Å; S265-K268 PolarHBondContact O-N 2.8Å; S265-K268 VanDerWaalsContact O-N 3.11Å; R266-K268 PolarHBondContact O-N 3.23Å; K268-T270 PolarHBondContact O-N 2.88Å; K268-Q271 WeakPolarHBondContact O-CB 3.37Å; K268-Q271 PolarHBondContact O-N 2.98Å; K268-T437 PolarHBondContact NZ-O 3.1Å; K268-W448 HydrophobicContact CB-CH2 4.05Å; K268-W448 HydrophobicContact CB-CZ2 4.06Å; K268-W448 HydrophobicContact CG-CH2 4.47Å; K268-W448 HydrophobicContact CG-CZ2 4.42Å; K268-P450 HydrophobicContact CD-CB 3.64Å; K268-P450 HydrophobicContact CD-CG 4.3Å; K268-P450 HydrophobicContact CG-CB 3.72Å
269	S	95.5	Very high	94.2	Very high	14 Å²	14	21 Å²	21	10%	0.098	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-67	-20.5	-174.9	69.9	0	0	0	0	113.1	E235 R266 Y267 Q271 R273	E235-S269 WeakPolarHBondContact OE2-CB 3.18Å; E235-S269 PolarHBondContact OE2-OG 2.88Å; R266-S269 PolarHBondContact O-OG 3.45Å; Y267-S269 VanDerWaalsContact C-N 3.31Å; Y267-S269 PolarHBondContact O-N 2.84Å; S269-Q271 VanDerWaalsContact C-N 3.32Å; S269-Q271 PolarHBondContact O-N 3.3Å; S269-R273 WeakPolarHBondContact O-CD 3.47Å; S269-R273 WeakPolarHBondContact O-CG 3.39Å
270	T	95.8	Very high	93.9	Very high	19 Å²	19	23.9 Å²	23.9	12%	0.117	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-72.8	-24.6	179.7	74.9	0	0	0	0	112.8	Y267 K268 H272 R273 F374 H376	Y267-T270 PolarHBondContact O-N 2.75Å; Y267-T270 PolarHBondContact O-OG1 2.71Å; K268-T270 PolarHBondContact O-N 2.88Å; T270-H272 PolarHBondContact O-N 3.49Å; T270-R273 PolarHBondContact O-N 3.03Å; T270-F374 VanDerWaalsContact O-CD2 3.26Å; T270-F374 WeakPolarHBondContact O-CD2 3.44Å; T270-H376 PolarHBondContact OG1-NE2 3.03Å
271	Q	95	Very high	93.8	Very high	54 Å²	54	23.9 Å²	23.9	25%	0.252	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-37	-162.1	-174.6	176.2	-12.2	0	0	113.9	K268 S269 W436 T437	K268-Q271 WeakPolarHBondContact O-CB 3.37Å; K268-Q271 PolarHBondContact O-N 2.98Å; S269-Q271 VanDerWaalsContact C-N 3.32Å; S269-Q271 PolarHBondContact O-N 3.3Å; Q271-W436 HydrophobicContact CB-CH2 4.15Å; Q271-W436 HydrophobicContact CB-CZ3 3.84Å; Q271-W436 HydrophobicContact CG-CH2 4.33Å; Q271-W436 HydrophobicContact CG-CZ3 4.35Å; Q271-T437 HydrophobicContact CG-CG2 4.33Å
272	H	93.6	Very high	93.6	Very high	66 Å²	66	25.5 Å²	25.5	31%	0.306	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	6.5	-175.2	-59	-81.2	0	0	0	113.8	T270 T274 L453 Y457	T270-H272 PolarHBondContact O-N 3.49Å; H272-T274 VanDerWaalsContact C-N 3.3Å; H272-T274 PolarHBondContact O-N 2.78Å; H272-L453 VanDerWaalsContact CD2-CD1 3.46Å; H272-L453 WeakPolarHBondContact CD2-CD1 3.4Å; H272-Y457 HydrophobicContact CB-CD2 4.01Å; H272-Y457 HydrophobicContact CB-CE2 3.7Å; H272-Y457 AromaticContact CD2-CE2 3.87Å; H272-Y457 AromaticContact CE1-CE2 3.95Å; H272-Y457 AromaticContact CG-CE2 3.4Å; H272-Y457 VanDerWaalsContact CG-CE2 3.4Å; H272-Y457 AromaticContact ND1-CE2 3.48Å; H272-Y457 WeakPolarHBondContact ND1-CE2 3.31Å
273	R	91.9	Very high	93.5	Very high	12 Å²	12	27.8 Å²	27.8	5%	0.045	14%	0.144	C	C	.	.			trans	-95.5	30.6	-178	-61.3	174.8	73.9	160.1	3.5	112.4	E225 E235 S269 T270 G275 Y461	E225-R273 IonicContact OE1-CZ 3.5Å; E225-R273 IonicContact OE1-NE 3.93Å; E225-R273 PolarHBondContact OE1-NE 3.21Å; E225-R273 IonicContact OE1-NH2 3.77Å; E225-R273 PolarHBondContact OE1-NH2 3.07Å; E225-R273 IonicContact OE2-CZ 3.82Å; E225-R273 IonicContact OE2-NE 3.25Å; E225-R273 PolarHBondContact OE2-NE 2.92Å; E225-R273 IonicContact OE2-NH2 2.79Å; E225-R273 PolarHBondContact OE2-NH2 2.81Å; E225-R273 VanDerWaalsContact OE2-NH2 3.15Å; E235-R273 IonicContact OE1-CZ 3.72Å; E235-R273 IonicContact OE1-NH1 3.91Å; E235-R273 PolarHBondContact OE1-NH1 3.48Å; E235-R273 IonicContact OE2-NH1 3.15Å; E235-R273 PolarHBondContact OE2-NH1 3.01Å; S269-R273 WeakPolarHBondContact O-CD 3.47Å; S269-R273 WeakPolarHBondContact O-CG 3.39Å; T270-R273 PolarHBondContact O-N 3.03Å; R273-G275 VanDerWaalsContact C-N 3.29Å; R273-G275 PolarHBondContact O-N 2.91Å; R273-Y461 WeakPolarHBondContact CG-O 3.28Å
274	T	85.3	Confident	93.4	Very high	26 Å²	26	28.3 Å²	28.3	16%	0.16	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-4.9	-164.2	63.5	0	0	0	0	114.6	H272 L364 R372 F374	H272-T274 VanDerWaalsContact C-N 3.3Å; H272-T274 PolarHBondContact O-N 2.78Å; T274-L364 HydrophobicContact CG2-CD1 4.4Å; T274-R372 WeakPolarHBondContact CB-O 3.42Å; T274-R372 WeakPolarHBondContact O-CD 3.28Å; T274-R372 PolarHBondContact OG1-O 3.24Å; T274-F374 HydrophobicContact CG2-CD2 3.83Å; T274-F374 HydrophobicContact CG2-CE2 4.31Å
275	G	76.9	Confident	93.4	Very high	24 Å²	24	28.8 Å²	28.8	25%	0.247	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-0.7	-177.9	0	0	0	0	0	115.2	R273	R273-G275 VanDerWaalsContact C-N 3.29Å; R273-G275 PolarHBondContact O-N 2.91Å
276	R	85.7	Confident	93.4	Very high	30 Å²	30	29 Å²	29	11%	0.113	15%	0.154	C	C	.	.			trans	-139.9	158.4	-169.9	-53.9	-73.7	174.9	166.8	1.6	111.7	M195 S196 I198 F222 I223 E225 Y461	M195-R276 HydrophobicContact SD-CG 4.14Å; M195-R276 VanDerWaalsContact SD-CZ 3.53Å; M195-R276 PolarHBondContact SD-NE 3.16Å; M195-R276 PolarHBondContact SD-NH2 3.07Å; S196-R276 PolarHBondContact O-NH2 3.39Å; I198-R276 VanDerWaalsContact CG1-CZ 3.44Å; F222-R276 PolarHBondContact O-NH1 2.88Å; I223-R276 CarbonylContact O-C 3.59Å; I223-R276 WeakPolarHBondContact O-CA 3.16Å; E225-R276 HydrophobicContact CB-CB 3.89Å; R276-Y461 HydrophobicContact CG-CD1 3.94Å; R276-Y461 HydrophobicContact CG-CE1 4.47Å
277	K	88.2	Confident	93.5	Very high	98 Å²	98	27.1 Å²	27.1	43%	0.426	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	139.3	-179	-170.8	-172.8	170.2	178.1	0	110.4	L219 I223 F224 E225	L219-K277 HydrophobicContact CD1-CD 4.06Å; I223-K277 HydrophobicContact CG2-CB 4.21Å; I223-K277 PolarHBondContact O-N 3.18Å; F224-K277 WeakPolarHBondContact CA-O 3.37Å; F224-K277 HydrophobicContact CD1-CB 4.28Å; F224-K277 VanDerWaalsContact CD1-O 3.32Å; F224-K277 WeakPolarHBondContact CD1-O 3.46Å; F224-K277 HydrophobicContact CE1-CB 4.46Å; F224-K277 HydrophobicContact CE1-CD 4.02Å; F224-K277 HydrophobicContact CE1-CG 4.38Å; E225-K277 PolarHBondContact N-O 2.89Å
278	P	93.8	Very high	93.4	Very high	26 Å²	26	28.7 Å²	28.7	17%	0.169	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	146.3	167	-16	25.4	0	0	0	111.5	F224 E225 L227 M229 I232 N280	F224-P278 WeakPolarHBondContact CD1-O 3.49Å; E225-P278 WeakPolarHBondContact OE1-CD 3.5Å; E225-P278 VanDerWaalsContact OE1-CG 3.3Å; E225-P278 WeakPolarHBondContact OE1-CG 3.4Å; L227-P278 CarbonylContact O-C 3.57Å; L227-P278 VanDerWaalsContact O-CA 3.23Å; L227-P278 WeakPolarHBondContact O-CA 3.38Å; M229-P278 HydrophobicContact CG-CB 4.46Å; M229-P278 HydrophobicContact SD-CB 3.89Å; M229-P278 HydrophobicContact SD-CG 3.89Å; I232-P278 HydrophobicContact CD1-CB 4.23Å; I232-P278 HydrophobicContact CD1-CG 3.94Å; I232-P278 HydrophobicContact CG1-CB 3.8Å; I232-P278 HydrophobicContact CG1-CG 3.63Å; P278-N280 PolarHBondContact O-N 2.65Å
279	F	95	Very high	93.3	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.009	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	139.3	169.1	-81.4	-96.2	0	0	0	110.5	F224 E225 L227 N228 M229 P281 D491 Q492 V495 K507	F224-F279 HydrophobicContact CB-CD2 3.85Å; F224-F279 HydrophobicContact CB-CE1 4.41Å; F224-F279 HydrophobicContact CB-CE2 3.46Å; F224-F279 VanDerWaalsContact CB-CE2 3.46Å; F224-F279 HydrophobicContact CB-CG 4.47Å; F224-F279 HydrophobicContact CB-CZ 3.79Å; F224-F279 HydrophobicContact CD1-CD1 4.28Å; F224-F279 HydrophobicContact CD1-CD2 4.21Å; F224-F279 HydrophobicContact CD1-CG 4.08Å; F224-F279 HydrophobicContact CG-CD1 4.46Å; F224-F279 HydrophobicContact CG-CD2 4.3Å; F224-F279 HydrophobicContact CG-CE1 4.35Å; F224-F279 HydrophobicContact CG-CE2 4.18Å; F224-F279 HydrophobicContact CG-CG 4.45Å; F224-F279 HydrophobicContact CG-CZ 4.2Å; E225-F279 WeakPolarHBondContact O-CD2 3.48Å; E225-F279 VanDerWaalsContact O-CE2 3.32Å; E225-F279 WeakPolarHBondContact O-CE2 3.43Å; L227-F279 PolarHBondContact O-N 3.24Å; N228-F279 VanDerWaalsContact CA-O 3.27Å; N228-F279 WeakPolarHBondContact CA-O 3.48Å; N228-F279 HydrophobicContact CB-CB 3.82Å; N228-F279 WeakPolarHBondContact CB-O 3.5Å; M229-F279 PolarHBondContact N-O 3.47Å; M229-F279 VanDerWaalsContact N-O 3.11Å; F279-P281 WeakPolarHBondContact O-CD 3.3Å; F279-D491 HydrophobicContact CE1-CB 4.29Å; F279-D491 WeakPolarHBondContact CE1-OD2 3.02Å; F279-Q492 HydrophobicContact CD2-CB 4Å; F279-Q492 HydrophobicContact CD2-CG 3.77Å; F279-Q492 HydrophobicContact CE1-CB 4.5Å; F279-Q492 HydrophobicContact CE2-CB 3.94Å; F279-Q492 HydrophobicContact CE2-CG 3.91Å; F279-Q492 HydrophobicContact CG-CB 4.31Å; F279-Q492 HydrophobicContact CG-CG 4.42Å; F279-Q492 HydrophobicContact CZ-CB 4.21Å; F279-V495 HydrophobicContact CE2-CB 4.47Å; F279-V495 HydrophobicContact CE2-CG2 4.26Å; F279-V495 HydrophobicContact CZ-CB 4.46Å; F279-V495 HydrophobicContact CZ-CG2 3.82Å; F279-K507 HydrophobicContact CE1-CD 4.33Å
280	N	92.7	Very high	93.1	Very high	62 Å²	62	28.8 Å²	28.8	33%	0.332	16%	0.155	S	C	.	.	P	Polyproline II helix	trans	-76.3	120.2	168.4	-168.4	20.9	0	0	0	107.9	P278 H305 R489	P278-N280 PolarHBondContact O-N 2.65Å; N280-H305 PolarHBondContact ND2-CE1 2.96Å; N280-H305 VanDerWaalsContact ND2-CE1 3.33Å; N280-R489 PolarHBondContact O-NH1 3.48Å
281	P	96.3	Very high	92.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-64.4	147.6	178.7	-18.5	32.2	0	0	0	111.1	N228 M229 L230 F279 E285 Q302	N228-P281 HydrophobicContact CB-CG 4.16Å; M229-P281 HydrophobicContact CB-CG 3.88Å; L230-P281 HydrophobicContact CD1-CB 4.26Å; L230-P281 HydrophobicContact CD2-CB 4.37Å; L230-P281 HydrophobicContact CD2-CG 4.04Å; L230-P281 HydrophobicContact CG-CB 3.97Å; L230-P281 HydrophobicContact CG-CG 3.71Å; F279-P281 WeakPolarHBondContact O-CD 3.3Å; P281-E285 VanDerWaalsContact CA-OE2 3.27Å; P281-E285 WeakPolarHBondContact CA-OE2 3.46Å; P281-E285 HydrophobicContact CB-CB 4.21Å; P281-Q302 HydrophobicContact CB-CB 3.84Å; P281-Q302 HydrophobicContact CB-CG 3.9Å
282	V	95.6	Very high	92.4	Very high	34 Å²	34	29.3 Å²	29.3	21%	0.206	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-78.8	155.6	173.8	-56.1	0	0	0	0	111	G284 E285 Q302 I510 Q514	V282-G284 PolarHBondContact O-N 2.87Å; V282-E285 HydrophobicContact CG2-CB 3.8Å; V282-E285 HydrophobicContact CG2-CG 4.37Å; V282-E285 PolarHBondContact N-OE2 2.95Å; V282-E285 WeakPolarHBondContact O-CB 3.4Å; V282-E285 PolarHBondContact O-N 2.78Å; V282-Q302 VanDerWaalsContact O-CB 3.23Å; V282-Q302 WeakPolarHBondContact O-CB 3.15Å; V282-I510 HydrophobicContact CG1-CG2 3.42Å; V282-I510 VanDerWaalsContact CG1-CG2 3.42Å; V282-Q514 VanDerWaalsContact CB-OE1 3.28Å
283	L	96.1	Very high	92.1	Very high	51 Å²	51	29.4 Å²	29.4	27%	0.267	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	122.5	-179.4	-174.4	63	0	0	0	111.8	E285 H305 H528	L283-E285 VanDerWaalsContact C-N 3.32Å; L283-H305 HydrophobicContact CB-CB 4.3Å; L283-H305 HydrophobicContact CD1-CB 4.45Å; L283-H528 HydrophobicContact CD2-CB 3.65Å; L283-H528 HydrophobicContact CG-CB 4.24Å
284	G	96.3	Very high	92	Very high	18 Å²	18	30.9 Å²	30.9	19%	0.186	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	8.9	-173.1	0	0	0	0	0	115	V282 Q302	V282-G284 PolarHBondContact O-N 2.87Å; G284-Q302 PolarHBondContact N-O 2.66Å
285	E	98.2	Very high	92.2	Very high	9 Å²	9	29.8 Å²	29.8	4%	0.042	16%	0.16	C	C	.	.			trans	-64.3	143.5	162.9	-162.5	178.4	149.5	0	0	109.3	N228 L230 P281 V282 L283 E301 Q302 T486 R489	N228-E285 PolarHBondContact ND2-OE1 2.87Å; L230-E285 HydrophobicContact CD1-CB 4.39Å; L230-E285 HydrophobicContact CD1-CG 4.38Å; L230-E285 WeakPolarHBondContact CD1-O 3.23Å; P281-E285 VanDerWaalsContact CA-OE2 3.27Å; P281-E285 WeakPolarHBondContact CA-OE2 3.46Å; P281-E285 HydrophobicContact CB-CB 4.21Å; V282-E285 HydrophobicContact CG2-CB 3.8Å; V282-E285 HydrophobicContact CG2-CG 4.37Å; V282-E285 PolarHBondContact N-OE2 2.95Å; V282-E285 WeakPolarHBondContact O-CB 3.4Å; V282-E285 PolarHBondContact O-N 2.78Å; L283-E285 VanDerWaalsContact C-N 3.32Å; E285-E301 CarbonylContact O-C 3.57Å; E285-E301 WeakPolarHBondContact O-CA 3.49Å; E285-Q302 PolarHBondContact O-N 2.88Å; E285-T486 WeakPolarHBondContact OE1-CB 3.4Å; E285-T486 WeakPolarHBondContact OE1-CG2 3.24Å; E285-T486 PolarHBondContact OE1-OG1 3.28Å; E285-R489 WeakPolarHBondContact OE1-CD 3.46Å; E285-R489 IonicContact OE2-CZ 2.72Å; E285-R489 IonicContact OE2-NH1 2.82Å; E285-R489 PolarHBondContact OE2-NH1 2.85Å
286	T	98.6	Very high	93	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.025	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	160.3	-177.8	57.1	0	0	0	0	110.6	S300 E301 S484 D485 T486	T286-S300 CarbonylContact C-O 3.57Å; T286-S300 WeakPolarHBondContact CA-O 3.43Å; T286-S300 WeakPolarHBondContact CB-O 3.14Å; T286-E301 HydrophobicContact CG2-CB 4.3Å; T286-E301 HydrophobicContact CG2-CG 4.13Å; T286-S484 PolarHBondContact N-O 3.37Å; T286-S484 VanDerWaalsContact OG1-CB 3.32Å; T286-S484 WeakPolarHBondContact OG1-CB 3.49Å; T286-S484 PolarHBondContact OG1-O 3.25Å; T286-S484 PolarHBondContact OG1-OG 3Å; T286-D485 CarbonylContact O-C 3.54Å; T286-D485 WeakPolarHBondContact O-CA 3.48Å; T286-D485 PolarHBondContact OG1-N 2.97Å; T286-T486 PolarHBondContact O-N 3.12Å; T286-T486 PolarHBondContact O-OG1 2.83Å
287	Y	98.6	Very high	93.4	Very high	1 Å²	1	29.2 Å²	29.2	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	126.5	169.4	172	-109.4	0	0	0	110.8	L230 Q231 C234 Y289 Y298 V299 S300 L470 D485 R487	L230-Y287 HydrophobicContact CB-CD1 4.49Å; Q231-Y287 HydrophobicContact CB-CE1 4.29Å; Q231-Y287 HydrophobicContact CG-CD1 3.8Å; Q231-Y287 HydrophobicContact CG-CD2 3.89Å; Q231-Y287 HydrophobicContact CG-CE1 3.55Å; Q231-Y287 HydrophobicContact CG-CE2 3.59Å; Q231-Y287 HydrophobicContact CG-CG 3.97Å; Q231-Y287 VanDerWaalsContact CG-CZ 3.41Å; C234-Y287 HydrophobicContact CB-CD1 4.34Å; C234-Y287 HydrophobicContact CB-CE1 3.7Å; Y287-Y289 AromaticContact CZ-CD2 3.96Å; Y287-Y289 WeakPolarHBondContact OH-CD2 3.4Å; Y287-Y298 HydrophobicContact CD1-CD1 4.32Å; Y287-Y298 AromaticContact CD1-CE1 3.8Å; Y287-Y298 HydrophobicContact CD1-CE1 3.8Å; Y287-Y298 HydrophobicContact CE1-CE1 4.23Å; Y287-V299 CarbonylContact O-C 3.59Å; Y287-S300 WeakPolarHBondContact CB-OG 3.13Å; Y287-S300 PolarHBondContact N-O 2.91Å; Y287-S300 PolarHBondContact O-N 2.87Å; Y287-S300 PolarHBondContact O-OG 3.36Å; Y287-L470 WeakPolarHBondContact CE2-O 3.48Å; Y287-L470 VanDerWaalsContact OH-C 3.29Å; Y287-L470 VanDerWaalsContact OH-CA 3.28Å; Y287-L470 WeakPolarHBondContact OH-CA 3.47Å; Y287-L470 WeakPolarHBondContact OH-CB 3.12Å; Y287-L470 WeakPolarHBondContact OH-CD2 3.38Å; Y287-L470 PolarHBondContact OH-O 2.73Å; Y287-D485 WeakPolarHBondContact CA-OD2 3.2Å; Y287-R487 VanDerWaalsContact CE2-CZ 3.41Å
288	E	95.8	Very high	93.8	Very high	33 Å²	33	24.9 Å²	24.9	15%	0.154	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	151.8	171	65.9	158.3	-136	0	0	113	Y54 Y298 L481 D485 R487	Y54-E288 PolarHBondContact OH-OE2 3.05Å; E288-Y298 CarbonylContact C-O 3.59Å; E288-Y298 VanDerWaalsContact CA-O 3.26Å; E288-Y298 WeakPolarHBondContact CA-O 3.38Å; E288-Y298 WeakPolarHBondContact CB-O 3.07Å; E288-L481 HydrophobicContact CG-CD2 3.58Å; E288-L481 WeakPolarHBondContact OE1-CD2 3.44Å; E288-D485 PolarHBondContact N-OD2 2.76Å; E288-R487 VanDerWaalsContact O-CZ 3.27Å; E288-R487 PolarHBondContact O-NH1 2.91Å; E288-R487 PolarHBondContact O-NH2 3.45Å
289	Y	95	Very high	93.9	Very high	8 Å²	8	25.7 Å²	25.7	3%	0.031	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	146	171.9	-159.1	-82.7	0	0	0	111.5	Y287 R291 W296 R297 Y298 F466 T469 L470	Y287-Y289 AromaticContact CZ-CD2 3.96Å; Y287-Y289 WeakPolarHBondContact OH-CD2 3.4Å; Y289-R291 HydrophobicContact CD1-CG 4.06Å; Y289-R291 VanDerWaalsContact CE1-CD 3.49Å; Y289-R291 HydrophobicContact CE1-CG 3.75Å; Y289-W296 HydrophobicContact CD1-CH2 4.08Å; Y289-W296 HydrophobicContact CD1-CZ3 4.06Å; Y289-R297 CarbonylContact O-C 3.49Å; Y289-R297 WeakPolarHBondContact O-CA 3.29Å; Y289-Y298 PolarHBondContact N-O 2.92Å; Y289-Y298 PolarHBondContact O-N 3.05Å; Y289-F466 HydrophobicContact CD1-CE2 4.41Å; Y289-F466 AromaticContact CE1-CE2 3.93Å; Y289-F466 HydrophobicContact CE1-CE2 3.93Å; Y289-T469 WeakPolarHBondContact OH-CB 3.47Å; Y289-T469 PolarHBondContact OH-OG1 2.86Å; Y289-L470 HydrophobicContact CD2-CD2 4.28Å; Y289-L470 HydrophobicContact CE2-CD2 4.33Å
290	V	91.5	Very high	94.1	Very high	28 Å²	28	25.6 Å²	25.6	17%	0.17	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	115.4	-176.9	-170.5	0	0	0	0	109.7	M180 A183 R297	M180-V290 HydrophobicContact CB-CG1 4.39Å; M180-V290 HydrophobicContact CE-CG1 3.42Å; M180-V290 VanDerWaalsContact CE-CG1 3.42Å; M180-V290 HydrophobicContact CG-CG1 4.15Å; A183-V290 HydrophobicContact CB-CB 3.97Å; A183-V290 HydrophobicContact CB-CG1 3.56Å; A183-V290 HydrophobicContact CB-CG2 4.48Å; V290-R297 HydrophobicContact CG1-CB 4.47Å; V290-R297 HydrophobicContact CG2-CB 4.38Å
291	R	89.9	Confident	94.4	Very high	36 Å²	36	22.8 Å²	22.8	14%	0.136	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	84	171.2	-72.6	-66.2	-71.8	-92.4	7.3	109.6	Y289 D293 L294 G295 W296 F466	Y289-R291 HydrophobicContact CD1-CG 4.06Å; Y289-R291 VanDerWaalsContact CE1-CD 3.49Å; Y289-R291 HydrophobicContact CE1-CG 3.75Å; R291-D293 WeakPolarHBondContact CA-OD1 3.28Å; R291-D293 WeakPolarHBondContact CB-OD1 3.41Å; R291-D293 WeakPolarHBondContact CD-OD1 3.21Å; R291-D293 IonicContact CZ-OD1 2.75Å; R291-D293 IonicContact CZ-OD2 2.88Å; R291-D293 VanDerWaalsContact CZ-OD2 3.29Å; R291-D293 VanDerWaalsContact NE-CG 3.29Å; R291-D293 IonicContact NE-OD1 2.66Å; R291-D293 PolarHBondContact NE-OD1 2.85Å; R291-D293 IonicContact NE-OD2 3.55Å; R291-D293 PolarHBondContact NE-OD2 2.83Å; R291-D293 IonicContact NH2-OD1 2.79Å; R291-D293 IonicContact NH2-OD2 2.71Å; R291-D293 PolarHBondContact NH2-OD2 3.17Å; R291-D293 PolarHBondContact O-N 2.85Å; R291-D293 VanDerWaalsContact O-N 3.16Å; R291-L294 HydrophobicContact CB-CB 3.96Å; R291-L294 HydrophobicContact CB-CG 4.45Å; R291-L294 VanDerWaalsContact CZ-CD1 3.43Å; R291-L294 PolarHBondContact O-N 2.94Å; R291-L294 VanDerWaalsContact O-N 3.14Å; R291-G295 PolarHBondContact O-N 3.32Å; R291-W296 HydrophobicContact CB-CD2 3.9Å; R291-W296 HydrophobicContact CB-CE3 4.31Å; R291-W296 HydrophobicContact CB-CG 4.39Å; R291-W296 HydrophobicContact CB-CH2 4.37Å; R291-W296 HydrophobicContact CB-CZ2 3.97Å; R291-W296 HydrophobicContact CG-CD2 4.14Å; R291-W296 HydrophobicContact CG-CE3 4.36Å; R291-W296 HydrophobicContact CG-CH2 3.57Å; R291-W296 HydrophobicContact CG-CZ2 3.28Å; R291-W296 HydrophobicContact CG-CZ3 4.08Å; R291-W296 PolarHBondContact N-O 2.67Å; R291-W296 PolarHBondContact O-N 3.19Å; R291-F466 VanDerWaalsContact NH1-CD2 3.29Å
292	Q	85.4	Confident	94.5	Very high	47 Å²	47	22.8 Å²	22.8	22%	0.22	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	0.1	172.3	-150.7	-167.2	-7.6	0	0	113.1	W175 M180 A183 V185	W175-Q292 HydrophobicContact CD2-CG 3.68Å; W175-Q292 HydrophobicContact CE3-CG 3.64Å; W175-Q292 HydrophobicContact CG-CG 4.3Å; W175-Q292 HydrophobicContact CH2-CB 4.34Å; W175-Q292 HydrophobicContact CH2-CG 3.84Å; W175-Q292 WeakPolarHBondContact CH2-O 3.48Å; W175-Q292 HydrophobicContact CZ2-CG 3.95Å; W175-Q292 WeakPolarHBondContact CZ2-O 3.48Å; W175-Q292 HydrophobicContact CZ3-CB 4.38Å; W175-Q292 HydrophobicContact CZ3-CG 3.71Å; M180-Q292 HydrophobicContact CB-CG 4.22Å; M180-Q292 HydrophobicContact CE-CB 4.47Å; A183-Q292 PolarHBondContact O-OE1 2.79Å; V185-Q292 HydrophobicContact CG2-CB 4.06Å
293	D	87.2	Confident	94.5	Very high	68 Å²	68	22.6 Å²	22.6	36%	0.364	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-30.6	168.4	60.6	-44.5	0	0	0	112.6	V185 R291	V185-D293 HydrophobicContact CG2-CB 4.49Å; V185-D293 WeakPolarHBondContact CG2-OD1 3.36Å; R291-D293 WeakPolarHBondContact CA-OD1 3.28Å; R291-D293 WeakPolarHBondContact CB-OD1 3.41Å; R291-D293 WeakPolarHBondContact CD-OD1 3.21Å; R291-D293 IonicContact CZ-OD1 2.75Å; R291-D293 IonicContact CZ-OD2 2.88Å; R291-D293 VanDerWaalsContact CZ-OD2 3.29Å; R291-D293 VanDerWaalsContact NE-CG 3.29Å; R291-D293 IonicContact NE-OD1 2.66Å; R291-D293 PolarHBondContact NE-OD1 2.85Å; R291-D293 IonicContact NE-OD2 3.55Å; R291-D293 PolarHBondContact NE-OD2 2.83Å; R291-D293 IonicContact NH2-OD1 2.79Å; R291-D293 IonicContact NH2-OD2 2.71Å; R291-D293 PolarHBondContact NH2-OD2 3.17Å; R291-D293 PolarHBondContact O-N 2.85Å; R291-D293 VanDerWaalsContact O-N 3.16Å
294	L	90.1	Very high	94.4	Very high	43 Å²	43	20.9 Å²	20.9	23%	0.225	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-1.6	-177.9	-61.6	-173.7	0	0	0	115.3	R291	R291-L294 HydrophobicContact CB-CB 3.96Å; R291-L294 HydrophobicContact CB-CG 4.45Å; R291-L294 VanDerWaalsContact CZ-CD1 3.43Å; R291-L294 PolarHBondContact O-N 2.94Å; R291-L294 VanDerWaalsContact O-N 3.14Å
295	G	89.4	Confident	94	Very high	4 Å²	4	22 Å²	22	4%	0.041	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.2	17	169.2	0	0	0	0	0	116.3	L170 W175 R291 S316	L170-G295 VanDerWaalsContact CD1-CA 3.49Å; W175-G295 VanDerWaalsContact CH2-CA 3.41Å; R291-G295 PolarHBondContact O-N 3.32Å; G295-S316 VanDerWaalsContact O-CA 3.29Å; G295-S316 WeakPolarHBondContact O-CA 3.41Å
296	W	93.6	Very high	93.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	155.1	-174.3	60.2	-101.4	0	0	0	115.6	M180 L237 S240 Y289 R291 E315 W319 F466	M180-W296 VanDerWaalsContact CE-C 3.47Å; M180-W296 WeakPolarHBondContact CE-O 3.42Å; L237-W296 HydrophobicContact CB-CH2 3.77Å; L237-W296 HydrophobicContact CB-CZ2 3.48Å; L237-W296 VanDerWaalsContact CB-CZ2 3.48Å; L237-W296 HydrophobicContact CD1-CD2 4.36Å; L237-W296 HydrophobicContact CD1-CE3 4.04Å; L237-W296 HydrophobicContact CD1-CH2 3.82Å; L237-W296 HydrophobicContact CD1-CZ2 4.13Å; L237-W296 HydrophobicContact CD1-CZ3 3.8Å; L237-W296 HydrophobicContact CG-CH2 4.47Å; L237-W296 HydrophobicContact CG-CZ2 4.43Å; S240-W296 PolarHBondContact OG-NE1 3.11Å; Y289-W296 HydrophobicContact CD1-CH2 4.08Å; Y289-W296 HydrophobicContact CD1-CZ3 4.06Å; R291-W296 HydrophobicContact CB-CD2 3.9Å; R291-W296 HydrophobicContact CB-CE3 4.31Å; R291-W296 HydrophobicContact CB-CG 4.39Å; R291-W296 HydrophobicContact CB-CH2 4.37Å; R291-W296 HydrophobicContact CB-CZ2 3.97Å; R291-W296 HydrophobicContact CG-CD2 4.14Å; R291-W296 HydrophobicContact CG-CE3 4.36Å; R291-W296 HydrophobicContact CG-CH2 3.57Å; R291-W296 HydrophobicContact CG-CZ2 3.28Å; R291-W296 HydrophobicContact CG-CZ3 4.08Å; R291-W296 PolarHBondContact N-O 2.67Å; R291-W296 PolarHBondContact O-N 3.19Å; W296-E315 WeakPolarHBondContact CA-O 3.44Å; W296-E315 WeakPolarHBondContact CB-O 3.44Å; W296-W319 HydrophobicContact CB-CH2 3.62Å; W296-W319 HydrophobicContact CB-CZ2 3.9Å; W296-W319 AromaticContact CD1-CH2 3.9Å; W296-W319 AromaticContact CD1-CZ2 3.74Å; W296-W319 HydrophobicContact CD2-CH2 4.45Å; W296-W319 AromaticContact CG-CH2 3.73Å; W296-W319 HydrophobicContact CG-CH2 3.73Å; W296-W319 AromaticContact CG-CZ2 3.98Å; W296-W319 HydrophobicContact CG-CZ2 3.98Å; W296-F466 AromaticContact CH2-CZ 3.89Å; W296-F466 HydrophobicContact CH2-CZ 3.89Å; W296-F466 HydrophobicContact CZ2-CZ 4.19Å
297	R	93.3	Very high	92.9	Very high	42 Å²	42	27 Å²	27	16%	0.158	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	150.4	169.7	66	-174.4	-172.8	-179.6	7.6	110.7	R53 Y178 Y289 V290 A314 E315	R53-R297 PolarHBondContact O-NH1 2.8Å; Y178-R297 PolarHBondContact O-NH1 2.67Å; Y178-R297 VanDerWaalsContact O-NH1 3.1Å; Y289-R297 CarbonylContact O-C 3.49Å; Y289-R297 WeakPolarHBondContact O-CA 3.29Å; V290-R297 HydrophobicContact CG1-CB 4.47Å; V290-R297 HydrophobicContact CG2-CB 4.38Å; R297-A314 CarbonylContact O-C 3.53Å; R297-A314 WeakPolarHBondContact O-CA 3.44Å; R297-A314 WeakPolarHBondContact O-CB 3.35Å; R297-E315 HydrophobicContact CG-CG 3.72Å; R297-E315 IonicContact CZ-OE1 2.76Å; R297-E315 PolarHBondContact N-O 3.29Å; R297-E315 IonicContact NE-OE1 2.75Å; R297-E315 PolarHBondContact NE-OE1 3.11Å; R297-E315 IonicContact NH2-OE1 3.15Å; R297-E315 PolarHBondContact NH2-OE1 3.22Å; R297-E315 PolarHBondContact O-N 2.79Å
298	Y	96.8	Very high	92.5	Very high	6 Å²	6	29.5 Å²	29.5	2%	0.024	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	141.8	-173.4	171.2	-81.1	0	0	0	109.9	L230 L233 C234 L237 Y287 E288 Y289 S300 C312 H313 A314	L230-Y298 PolarHBondContact O-OH 2.81Å; L233-Y298 WeakPolarHBondContact CB-OH 3.5Å; C234-Y298 HydrophobicContact CB-CD1 4Å; C234-Y298 HydrophobicContact CB-CD2 4.24Å; C234-Y298 HydrophobicContact CB-CE1 3.66Å; C234-Y298 HydrophobicContact CB-CE2 3.91Å; C234-Y298 HydrophobicContact CB-CG 4.3Å; C234-Y298 PolarHBondContact N-OH 3.09Å; L237-Y298 HydrophobicContact CD1-CD2 3.68Å; L237-Y298 HydrophobicContact CD1-CE2 4.47Å; L237-Y298 HydrophobicContact CD1-CG 4.44Å; Y287-Y298 HydrophobicContact CD1-CD1 4.32Å; Y287-Y298 AromaticContact CD1-CE1 3.8Å; Y287-Y298 HydrophobicContact CD1-CE1 3.8Å; Y287-Y298 HydrophobicContact CE1-CE1 4.23Å; E288-Y298 CarbonylContact C-O 3.59Å; E288-Y298 VanDerWaalsContact CA-O 3.26Å; E288-Y298 WeakPolarHBondContact CA-O 3.38Å; E288-Y298 WeakPolarHBondContact CB-O 3.07Å; Y289-Y298 PolarHBondContact N-O 2.92Å; Y289-Y298 PolarHBondContact O-N 3.05Å; Y298-S300 VanDerWaalsContact CE1-OG 3.32Å; Y298-S300 WeakPolarHBondContact CE1-OG 3.47Å; Y298-S300 WeakPolarHBondContact OH-CB 3.18Å; Y298-C312 HydrophobicContact CE1-CB 4.45Å; Y298-C312 HydrophobicContact CE2-CB 3.53Å; Y298-C312 VanDerWaalsContact CZ-CB 3.5Å; Y298-C312 VanDerWaalsContact OH-CB 3.24Å; Y298-C312 WeakPolarHBondContact OH-CB 3.48Å; Y298-H313 CarbonylContact C-O 3.59Å; Y298-H313 WeakPolarHBondContact CA-O 3.48Å; Y298-A314 HydrophobicContact CD2-CB 4.01Å
299	V	97.6	Very high	92.5	Very high	43 Å²	43	29.2 Å²	29.2	26%	0.261	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	148.7	170.8	65.4	0	0	0	0	109.9	Y287 C312 H313 F533	Y287-V299 CarbonylContact O-C 3.59Å; V299-C312 CarbonylContact O-C 3.56Å; V299-C312 VanDerWaalsContact O-CA 3.28Å; V299-C312 WeakPolarHBondContact O-CA 3.5Å; V299-C312 WeakPolarHBondContact O-CB 3.46Å; V299-H313 HydrophobicContact CG1-CB 4.19Å; V299-H313 PolarHBondContact N-O 3.04Å; V299-H313 PolarHBondContact O-N 3.28Å; V299-F533 HydrophobicContact CG1-CZ 4.39Å
300	S	98.6	Very high	92.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	156	178.6	56.6	0	0	0	0	112.2	T286 Y287 Y298 A311	T286-S300 CarbonylContact C-O 3.57Å; T286-S300 WeakPolarHBondContact CA-O 3.43Å; T286-S300 WeakPolarHBondContact CB-O 3.14Å; Y287-S300 WeakPolarHBondContact CB-OG 3.13Å; Y287-S300 PolarHBondContact N-O 2.91Å; Y287-S300 PolarHBondContact O-N 2.87Å; Y287-S300 PolarHBondContact O-OG 3.36Å; Y298-S300 VanDerWaalsContact CE1-OG 3.32Å; Y298-S300 WeakPolarHBondContact CE1-OG 3.47Å; Y298-S300 WeakPolarHBondContact OH-CB 3.18Å; S300-A311 CarbonylContact C-O 3.38Å; S300-A311 WeakPolarHBondContact CA-O 3.4Å; S300-A311 WeakPolarHBondContact CB-O 3.06Å
301	E	98.6	Very high	93	Very high	3 Å²	3	28.2 Å²	28.2	1%	0.014	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	142.8	178.5	-173.4	171.3	-169.8	0	0	110	E285 T286 V303 A311 K531 W532 F533	E285-E301 CarbonylContact O-C 3.57Å; E285-E301 WeakPolarHBondContact O-CA 3.49Å; T286-E301 HydrophobicContact CG2-CB 4.3Å; T286-E301 HydrophobicContact CG2-CG 4.13Å; E301-V303 HydrophobicContact CB-CG1 4.16Å; E301-V303 HydrophobicContact CG-CG1 4.24Å; E301-V303 PolarHBondContact O-N 2.98Å; E301-A311 PolarHBondContact N-O 3.23Å; E301-A311 PolarHBondContact O-N 2.98Å; E301-K531 PolarHBondContact OE1-N 3.28Å; E301-K531 PolarHBondContact OE2-N 3.19Å; E301-W532 PolarHBondContact OE2-N 3.08Å; E301-F533 HydrophobicContact CB-CD2 3.57Å; E301-F533 HydrophobicContact CB-CE2 3.7Å
302	Q	97.9	Very high	93.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	92.1	167.5	-169.9	67.4	21.7	0	0	109.3	L230 P281 V282 G284 E285 S304 I309 S310	L230-Q302 HydrophobicContact CD2-CB 4.45Å; P281-Q302 HydrophobicContact CB-CB 3.84Å; P281-Q302 HydrophobicContact CB-CG 3.9Å; V282-Q302 VanDerWaalsContact O-CB 3.23Å; V282-Q302 WeakPolarHBondContact O-CB 3.15Å; G284-Q302 PolarHBondContact N-O 2.66Å; E285-Q302 PolarHBondContact O-N 2.88Å; Q302-S304 PolarHBondContact NE2-O 3.05Å; Q302-I309 PolarHBondContact NE2-O 2.87Å; Q302-S310 PolarHBondContact OE1-OG 3.01Å
303	V	96.5	Very high	94	Very high	31 Å²	31	26.4 Å²	26.4	19%	0.188	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-22.7	-171.5	-63.6	0	0	0	0	114.1	E301 I309 A311 T530 F533	E301-V303 HydrophobicContact CB-CG1 4.16Å; E301-V303 HydrophobicContact CG-CG1 4.24Å; E301-V303 PolarHBondContact O-N 2.98Å; V303-I309 HydrophobicContact CG2-CB 3.91Å; V303-I309 HydrophobicContact CG2-CG2 3.6Å; V303-I309 WeakPolarHBondContact CG2-O 3.18Å; V303-I309 PolarHBondContact N-O 2.81Å; V303-A311 HydrophobicContact CG1-CB 3.72Å; V303-A311 HydrophobicContact CG2-CB 4Å; V303-T530 HydrophobicContact CB-CG2 3.67Å; V303-T530 HydrophobicContact CG1-CG2 3.75Å; V303-F533 HydrophobicContact CG1-CB 3.9Å; V303-F533 HydrophobicContact CG1-CD2 4.33Å; V303-F533 HydrophobicContact CG1-CG 4.29Å
304	S	93.6	Very high	94.5	Very high	15 Å²	15	23.2 Å²	23.2	11%	0.105	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	158.2	169.9	-169	0	0	0	0	111.6	Q302 P307 P308 I309	Q302-S304 PolarHBondContact NE2-O 3.05Å; S304-P307 CarbonylContact C-O 3.41Å; S304-P307 VanDerWaalsContact CB-O 3.26Å; S304-P307 WeakPolarHBondContact CB-O 3.41Å; S304-P307 PolarHBondContact OG-O 3.22Å; S304-P307 VanDerWaalsContact OG-O 3.07Å; S304-P308 WeakPolarHBondContact O-CA 3.35Å; S304-I309 PolarHBondContact N-O 3.19Å; S304-I309 PolarHBondContact O-N 3.21Å
305	H	88.4	Confident	94.8	Very high	40 Å²	40	22.4 Å²	22.4	19%	0.185	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	-23	176.7	-167.8	75	0	0	0	113.3	N280 L283 P307 Q514	N280-H305 PolarHBondContact ND2-CE1 2.96Å; N280-H305 VanDerWaalsContact ND2-CE1 3.33Å; L283-H305 HydrophobicContact CB-CB 4.3Å; L283-H305 HydrophobicContact CD1-CB 4.45Å; H305-P307 CarbonylContact C-O 3.57Å; H305-P307 VanDerWaalsContact C-O 3.31Å; H305-P307 PolarHBondContact N-O 3.05Å; H305-P307 CarbonylContact O-C 3.54Å; H305-Q514 PolarHBondContact CD2-NE2 3.33Å; H305-Q514 PolarHBondContact CE1-NE2 2.89Å; H305-Q514 VanDerWaalsContact CE1-NE2 3.3Å; H305-Q514 PolarHBondContact ND1-NE2 3.33Å; H305-Q514 VanDerWaalsContact ND1-NE2 3.14Å; H305-Q514 PolarHBondContact NE2-NE2 3.09Å
306	H	85.2	Confident	95	Very high	99 Å²	99	22.3 Å²	22.3	46%	0.458	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133	99.2	171.9	-59.4	-55.9	0	0	0	109.3	R518	H306-R518 PolarHBondContact NE2-NH1 3.03Å
307	P	87.6	Confident	94.8	Very high	21 Å²	21	24 Å²	24	14%	0.136	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	cis	-65	159.6	-12.2	29.2	-34.8	0	0	0	112.5	V80 S304 H305 I309	V80-P307 HydrophobicContact CG1-CB 4.35Å; S304-P307 CarbonylContact C-O 3.41Å; S304-P307 VanDerWaalsContact CB-O 3.26Å; S304-P307 WeakPolarHBondContact CB-O 3.41Å; S304-P307 PolarHBondContact OG-O 3.22Å; S304-P307 VanDerWaalsContact OG-O 3.07Å; H305-P307 CarbonylContact C-O 3.57Å; H305-P307 VanDerWaalsContact C-O 3.31Å; H305-P307 PolarHBondContact N-O 3.05Å; H305-P307 CarbonylContact O-C 3.54Å; P307-I309 HydrophobicContact CG-CD1 4.17Å; P307-I309 HydrophobicContact CG-CG1 4.2Å; P307-I309 PolarHBondContact O-N 2.85Å; P307-I309 VanDerWaalsContact O-N 3.12Å
308	P	91.4	Very high	94.8	Very high	52 Å²	52	24.8 Å²	24.8	34%	0.338	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	107.4	176	28.4	-33.3	0	0	0	110.1	S304 T326	S304-P308 WeakPolarHBondContact O-CA 3.35Å; P308-T326 WeakPolarHBondContact O-CB 3.43Å; P308-T326 PolarHBondContact O-OG1 3.27Å
309	I	95.8	Very high	94.8	Very high	28 Å²	28	24.5 Å²	24.5	14%	0.144	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.2	177.5	-55.9	169.9	0	0	0	108.5	Q302 V303 S304 P307 L325	Q302-I309 PolarHBondContact NE2-O 2.87Å; V303-I309 HydrophobicContact CG2-CB 3.91Å; V303-I309 HydrophobicContact CG2-CG2 3.6Å; V303-I309 WeakPolarHBondContact CG2-O 3.18Å; V303-I309 PolarHBondContact N-O 2.81Å; S304-I309 PolarHBondContact N-O 3.19Å; S304-I309 PolarHBondContact O-N 3.21Å; P307-I309 HydrophobicContact CG-CD1 4.17Å; P307-I309 HydrophobicContact CG-CG1 4.2Å; P307-I309 PolarHBondContact O-N 2.85Å; P307-I309 VanDerWaalsContact O-N 3.12Å; I309-L325 WeakPolarHBondContact CA-O 3.28Å
310	S	97.7	Very high	94.8	Very high	7 Å²	7	23.9 Å²	23.9	5%	0.049	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.9	169.2	-53.4	0	0	0	0	109	Q302 S324 L325	Q302-S310 PolarHBondContact OE1-OG 3.01Å; S310-S324 WeakPolarHBondContact O-CA 3.32Å; S310-L325 PolarHBondContact N-O 2.93Å; S310-L325 PolarHBondContact O-N 2.94Å
311	A	98.3	Very high	94.8	Very high	8 Å²	8	23.9 Å²	23.9	7%	0.066	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	144	173.2	0	0	0	0	0	110.2	S300 E301 V303 Q323 F533	S300-A311 CarbonylContact C-O 3.38Å; S300-A311 WeakPolarHBondContact CA-O 3.4Å; S300-A311 WeakPolarHBondContact CB-O 3.06Å; E301-A311 PolarHBondContact N-O 3.23Å; E301-A311 PolarHBondContact O-N 2.98Å; V303-A311 HydrophobicContact CG1-CB 3.72Å; V303-A311 HydrophobicContact CG2-CB 4Å; A311-Q323 WeakPolarHBondContact CA-O 3.25Å; A311-F533 HydrophobicContact CB-CB 4.46Å; A311-F533 HydrophobicContact CB-CD1 3.73Å; A311-F533 HydrophobicContact CB-CD2 4.28Å; A311-F533 HydrophobicContact CB-CE1 3.99Å; A311-F533 HydrophobicContact CB-CG 3.9Å; A311-F533 HydrophobicContact CB-CZ 4.39Å
312	C	98.6	Very high	94.8	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.007	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	153.9	172.8	76.1	0	0	0	0	113.5	L233 Y298 V299 W322 Q323	L233-C312 HydrophobicContact CD1-CB 4.3Å; Y298-C312 HydrophobicContact CE1-CB 4.45Å; Y298-C312 HydrophobicContact CE2-CB 3.53Å; Y298-C312 VanDerWaalsContact CZ-CB 3.5Å; Y298-C312 VanDerWaalsContact OH-CB 3.24Å; Y298-C312 WeakPolarHBondContact OH-CB 3.48Å; V299-C312 CarbonylContact O-C 3.56Å; V299-C312 VanDerWaalsContact O-CA 3.28Å; V299-C312 WeakPolarHBondContact O-CA 3.5Å; V299-C312 WeakPolarHBondContact O-CB 3.46Å; C312-W322 VanDerWaalsContact O-CA 3.26Å; C312-W322 WeakPolarHBondContact O-CA 3.41Å; C312-W322 WeakPolarHBondContact O-CB 3.24Å; C312-Q323 PolarHBondContact N-O 2.7Å; C312-Q323 PolarHBondContact O-N 2.71Å; C312-Q323 WeakPolarHBondContact SG-CG 3.47Å
313	H	98.4	Very high	94.9	Very high	43 Å²	43	25 Å²	25	20%	0.199	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	136.2	174.3	-175.5	89.4	0	0	0	109.4	Y298 V299 F321 W322 F533	Y298-H313 CarbonylContact C-O 3.59Å; Y298-H313 WeakPolarHBondContact CA-O 3.48Å; V299-H313 HydrophobicContact CG1-CB 4.19Å; V299-H313 PolarHBondContact N-O 3.04Å; V299-H313 PolarHBondContact O-N 3.28Å; H313-F321 CarbonylContact C-O 3.49Å; H313-F321 WeakPolarHBondContact CA-O 3.3Å; H313-W322 HydrophobicContact CB-CB 4.47Å; H313-F533 HydrophobicContact CB-CE1 4.04Å; H313-F533 HydrophobicContact CB-CZ 4.26Å
314	A	97.5	Very high	94.9	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.008	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.6	171.8	0	0	0	0	0	111	L237 R297 Y298 W319 F321	L237-A314 HydrophobicContact CD1-CB 3.68Å; R297-A314 CarbonylContact O-C 3.53Å; R297-A314 WeakPolarHBondContact O-CA 3.44Å; R297-A314 WeakPolarHBondContact O-CB 3.35Å; Y298-A314 HydrophobicContact CD2-CB 4.01Å; A314-W319 HydrophobicContact CB-CZ3 4.2Å; A314-F321 HydrophobicContact CB-CB 4.4Å; A314-F321 HydrophobicContact CB-CD1 4.29Å; A314-F321 PolarHBondContact N-O 3.41Å; A314-F321 PolarHBondContact O-N 3.33Å; A314-F321 VanDerWaalsContact O-O 3.13Å
315	E	95.1	Very high	95	Very high	27 Å²	27	25.6 Å²	25.6	13%	0.126	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	138.4	179.8	63.6	179.9	141	0	0	112	W296 R297 L320	W296-E315 WeakPolarHBondContact CA-O 3.44Å; W296-E315 WeakPolarHBondContact CB-O 3.44Å; R297-E315 HydrophobicContact CG-CG 3.72Å; R297-E315 IonicContact CZ-OE1 2.76Å; R297-E315 PolarHBondContact N-O 3.29Å; R297-E315 IonicContact NE-OE1 2.75Å; R297-E315 PolarHBondContact NE-OE1 3.11Å; R297-E315 IonicContact NH2-OE1 3.15Å; R297-E315 PolarHBondContact NH2-OE1 3.22Å; R297-E315 PolarHBondContact O-N 2.79Å; E315-L320 HydrophobicContact CB-CD2 3.45Å; E315-L320 VanDerWaalsContact CB-CD2 3.45Å
316	S	93.7	Very high	95.3	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.007	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	168.6	170.9	156.9	0	0	0	0	109.2	G295 H318 W319 K349	G295-S316 VanDerWaalsContact O-CA 3.29Å; G295-S316 WeakPolarHBondContact O-CA 3.41Å; S316-H318 PolarHBondContact O-N 2.81Å; S316-H318 PolarHBondContact OG-N 2.73Å; S316-W319 VanDerWaalsContact CB-CD2 3.48Å; S316-W319 PolarHBondContact N-O 3.42Å; S316-W319 PolarHBondContact OG-NE1 2.59Å; S316-K349 WeakPolarHBondContact O-CE 3.26Å; S316-K349 PolarHBondContact O-NZ 2.7Å
317	V	89.5	Confident	95.5	Very high	35 Å²	35	21.7 Å²	21.7	21%	0.212	13%	0.126	C	C	.	.	S	Bend	trans	-54.9	-31.3	164.7	177.7	0	0	0	0	111.8	L170 D174 Y178 K349	L170-V317 HydrophobicContact CD1-CB 4.28Å; L170-V317 HydrophobicContact CD1-CG2 3.42Å; L170-V317 VanDerWaalsContact CD1-CG2 3.42Å; L170-V317 HydrophobicContact CD2-CB 4.06Å; L170-V317 HydrophobicContact CD2-CG1 4.38Å; L170-V317 HydrophobicContact CD2-CG2 3.81Å; L170-V317 HydrophobicContact CG-CG2 4.27Å; D174-V317 HydrophobicContact CB-CG2 4.48Å; Y178-V317 HydrophobicContact CD2-CG2 3.88Å; Y178-V317 HydrophobicContact CE2-CB 4.36Å; Y178-V317 HydrophobicContact CE2-CG2 3.67Å; V317-K349 WeakPolarHBondContact O-CD 3.2Å
318	H	94.2	Very high	95.5	Very high	60 Å²	60	22.7 Å²	22.7	28%	0.278	13%	0.129	S	C	.	.	S	Bend	trans	-104.5	-26.5	-170	-61.3	-41.5	0	0	0	115	D244 A247 S316 K349	D244-H318 IonicContact OD1-CD2 2.82Å; A247-H318 HydrophobicContact CB-CB 3.69Å; S316-H318 PolarHBondContact O-N 2.81Å; S316-H318 PolarHBondContact OG-N 2.73Å; H318-K349 WeakPolarHBondContact O-CB 3.38Å; H318-K349 PolarHBondContact O-N 2.95Å
319	W	97.2	Very high	95.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	163.2	-173.8	49.7	-96.6	0	0	0	112.6	L237 L243 D244 W296 A314 S316 F321 R347 L348	L237-W319 HydrophobicContact CD2-CH2 4.02Å; L237-W319 HydrophobicContact CD2-CZ3 4.27Å; L243-W319 HydrophobicContact CB-CD2 3.94Å; L243-W319 HydrophobicContact CB-CG 3.83Å; L243-W319 HydrophobicContact CD1-CD2 3.72Å; L243-W319 HydrophobicContact CD1-CE3 3.78Å; L243-W319 HydrophobicContact CD1-CG 4.31Å; L243-W319 HydrophobicContact CD1-CH2 4.26Å; L243-W319 HydrophobicContact CD1-CZ2 4.19Å; L243-W319 HydrophobicContact CD1-CZ3 4.06Å; D244-W319 PolarHBondContact OD1-NE1 2.82Å; W296-W319 HydrophobicContact CB-CH2 3.62Å; W296-W319 HydrophobicContact CB-CZ2 3.9Å; W296-W319 AromaticContact CD1-CH2 3.9Å; W296-W319 AromaticContact CD1-CZ2 3.74Å; W296-W319 HydrophobicContact CD2-CH2 4.45Å; W296-W319 AromaticContact CG-CH2 3.73Å; W296-W319 HydrophobicContact CG-CH2 3.73Å; W296-W319 AromaticContact CG-CZ2 3.98Å; W296-W319 HydrophobicContact CG-CZ2 3.98Å; A314-W319 HydrophobicContact CB-CZ3 4.2Å; S316-W319 VanDerWaalsContact CB-CD2 3.48Å; S316-W319 PolarHBondContact N-O 3.42Å; S316-W319 PolarHBondContact OG-NE1 2.59Å; W319-F321 HydrophobicContact CE3-CB 4.03Å; W319-F321 HydrophobicContact CZ3-CB 3.88Å; W319-R347 CarbonylContact C-O 3.55Å; W319-R347 WeakPolarHBondContact CA-O 3.38Å; W319-L348 HydrophobicContact CB-CD2 4.14Å
320	L	97.9	Very high	94.7	Very high	30 Å²	30	26 Å²	26	16%	0.157	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	144.4	163.4	-61	176.3	0	0	0	107.9	E315 W322 V346 R347 K349	E315-L320 HydrophobicContact CB-CD2 3.45Å; E315-L320 VanDerWaalsContact CB-CD2 3.45Å; L320-W322 HydrophobicContact CB-CE3 4.06Å; L320-W322 HydrophobicContact CB-CZ3 3.86Å; L320-V346 CarbonylContact O-C 3.57Å; L320-V346 VanDerWaalsContact O-CA 3.27Å; L320-V346 WeakPolarHBondContact O-CA 3.19Å; L320-R347 HydrophobicContact CB-CB 4.34Å; L320-R347 PolarHBondContact N-O 2.89Å; L320-R347 PolarHBondContact O-N 2.86Å; L320-K349 HydrophobicContact CG-CG 4.47Å
321	F	98.6	Very high	93.9	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133	172.7	169.4	-108.4	0	0	0	108.3	L237 F262 H313 A314 W319 Q323 V344 H345 V346 W357	L237-F321 HydrophobicContact CD1-CD1 4.46Å; L237-F321 HydrophobicContact CD2-CD1 3.91Å; L237-F321 HydrophobicContact CD2-CE1 4.28Å; L237-F321 HydrophobicContact CD2-CG 4.32Å; L237-F321 HydrophobicContact CG-CD1 4.37Å; L237-F321 HydrophobicContact CG-CE1 4.46Å; F262-F321 HydrophobicContact CE1-CD2 4.28Å; F262-F321 HydrophobicContact CE1-CE2 4.04Å; F262-F321 HydrophobicContact CZ-CE2 4.35Å; H313-F321 CarbonylContact C-O 3.49Å; H313-F321 WeakPolarHBondContact CA-O 3.3Å; A314-F321 HydrophobicContact CB-CB 4.4Å; A314-F321 HydrophobicContact CB-CD1 4.29Å; A314-F321 PolarHBondContact N-O 3.41Å; A314-F321 PolarHBondContact O-N 3.33Å; A314-F321 VanDerWaalsContact O-O 3.13Å; W319-F321 HydrophobicContact CE3-CB 4.03Å; W319-F321 HydrophobicContact CZ3-CB 3.88Å; F321-Q323 HydrophobicContact CE1-CG 4.42Å; F321-Q323 HydrophobicContact CZ-CG 4.23Å; F321-Q323 VanDerWaalsContact CZ-NE2 3.27Å; F321-V344 HydrophobicContact CE2-CG1 3.8Å; F321-V344 HydrophobicContact CZ-CG1 4.42Å; F321-H345 WeakPolarHBondContact CA-O 3.28Å; F321-H345 WeakPolarHBondContact CD2-O 3.45Å; F321-V346 HydrophobicContact CB-CG2 4.48Å; F321-V346 HydrophobicContact CD2-CG2 3.77Å; F321-W357 HydrophobicContact CE2-CH2 4.18Å; F321-W357 HydrophobicContact CE2-CZ2 4.32Å
322	W	98.5	Very high	93.3	Very high	20 Å²	20	34.3 Å²	34.3	8%	0.076	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	153.9	172.9	67.1	92.1	0	0	0	111.2	Y65 C312 H313 L320 H345 R347 E354	Y65-W322 VanDerWaalsContact OH-CD1 3.23Å; Y65-W322 VanDerWaalsContact OH-CE2 3.22Å; Y65-W322 PolarHBondContact OH-NE1 2.76Å; C312-W322 VanDerWaalsContact O-CA 3.26Å; C312-W322 WeakPolarHBondContact O-CA 3.41Å; C312-W322 WeakPolarHBondContact O-CB 3.24Å; H313-W322 HydrophobicContact CB-CB 4.47Å; L320-W322 HydrophobicContact CB-CE3 4.06Å; L320-W322 HydrophobicContact CB-CZ3 3.86Å; W322-H345 AromaticContact CD1-CD2 3.68Å; W322-H345 AromaticContact CD1-CG 3.98Å; W322-H345 HydrophobicContact CD2-CB 3.64Å; W322-H345 AromaticContact CE2-CD2 3.88Å; W322-H345 AromaticContact CE2-CG 3.4Å; W322-H345 VanDerWaalsContact CE2-CG 3.4Å; W322-H345 AromaticContact CE2-ND1 3.81Å; W322-H345 HydrophobicContact CE3-CB 4.09Å; W322-H345 HydrophobicContact CG-CB 4.18Å; W322-H345 HydrophobicContact CH2-CB 3.84Å; W322-H345 HydrophobicContact CZ2-CB 3.36Å; W322-H345 AromaticContact CZ2-CG 3.57Å; W322-H345 AromaticContact CZ2-ND1 3.58Å; W322-H345 HydrophobicContact CZ3-CB 4.17Å; W322-H345 PolarHBondContact N-O 3.09Å; W322-H345 AromaticContact NE1-CD2 3.19Å; W322-H345 PolarHBondContact NE1-CD2 3.27Å; W322-H345 AromaticContact NE1-CE1 3.93Å; W322-H345 AromaticContact NE1-CG 3.21Å; W322-H345 AromaticContact NE1-ND1 3.67Å; W322-H345 AromaticContact NE1-NE2 3.69Å; W322-H345 PolarHBondContact O-N 3.25Å; W322-R347 HydrophobicContact CH2-CB 3.99Å; W322-R347 HydrophobicContact CZ3-CB 3.82Å; W322-E354 HydrophobicContact CH2-CG 4.19Å; W322-E354 WeakPolarHBondContact CH2-OE2 3.36Å
323	Q	98.3	Very high	92.4	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.028	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	157.9	175.8	55.3	177.8	-31.2	0	0	113.2	E236 A311 C312 F321 S343 V344 K359	E236-Q323 PolarHBondContact OE2-NE2 2.97Å; E236-Q323 PolarHBondContact OE2-OE1 2.98Å; A311-Q323 WeakPolarHBondContact CA-O 3.25Å; C312-Q323 PolarHBondContact N-O 2.7Å; C312-Q323 PolarHBondContact O-N 2.71Å; C312-Q323 WeakPolarHBondContact SG-CG 3.47Å; F321-Q323 HydrophobicContact CE1-CG 4.42Å; F321-Q323 HydrophobicContact CZ-CG 4.23Å; F321-Q323 VanDerWaalsContact CZ-NE2 3.27Å; Q323-S343 CarbonylContact C-O 3.31Å; Q323-S343 WeakPolarHBondContact CA-O 3.42Å; Q323-S343 WeakPolarHBondContact CB-O 3.39Å; Q323-V344 HydrophobicContact CB-CB 4.36Å; Q323-V344 HydrophobicContact CB-CG1 4.23Å; Q323-V344 HydrophobicContact CB-CG2 4.16Å; Q323-K359 VanDerWaalsContact OE1-CE 3.28Å
324	S	97.1	Very high	91.8	Very high	37 Å²	37	42.7 Å²	42.7	26%	0.259	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	139.3	155.2	57.2	0	0	0	0	108.9	S310 C342 S343	S310-S324 WeakPolarHBondContact O-CA 3.32Å; S324-C342 WeakPolarHBondContact O-CA 3.27Å; S324-C342 WeakPolarHBondContact O-CB 3.33Å; S324-S343 PolarHBondContact N-O 2.93Å; S324-S343 VanDerWaalsContact N-O 3.07Å; S324-S343 PolarHBondContact O-N 3.14Å
325	L	96.3	Very high	91.4	Very high	22 Å²	22	43.2 Å²	43.2	12%	0.115	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.4	177	-178.7	67.5	0	0	0	110.9	M229 L233 I309 S310 P340 C342 K359	M229-L325 HydrophobicContact CE-CD2 4.32Å; L233-L325 HydrophobicContact CD2-CB 4Å; L233-L325 HydrophobicContact CD2-CD2 3.51Å; L233-L325 HydrophobicContact CD2-CG 4.38Å; I309-L325 WeakPolarHBondContact CA-O 3.28Å; S310-L325 PolarHBondContact N-O 2.93Å; S310-L325 PolarHBondContact O-N 2.94Å; L325-P340 HydrophobicContact CD1-CB 3.96Å; L325-C342 HydrophobicContact CD1-CB 3.76Å; L325-K359 HydrophobicContact CD1-CD 4.45Å
326	T	94.3	Very high	91.1	Very high	12 Å²	12	44 Å²	44	7%	0.074	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	175.6	152.7	-165.3	0	0	0	0	109.2	P308 V341	P308-T326 WeakPolarHBondContact O-CB 3.43Å; P308-T326 PolarHBondContact O-OG1 3.27Å; T326-V341 HydrophobicContact CG2-CB 3.9Å; T326-V341 HydrophobicContact CG2-CG2 4.48Å; T326-V341 PolarHBondContact N-O 2.77Å; T326-V341 PolarHBondContact O-N 3.4Å; T326-V341 VanDerWaalsContact O-O 3.06Å
327	A	89.8	Confident	90.9	Very high	44 Å²	44	44.8 Å²	44.8	36%	0.364	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	134.7	175.7	0	0	0	0	0	111.1	I339	A327-I339 CarbonylContact C-O 3.52Å; A327-I339 VanDerWaalsContact CA-O 3.31Å; A327-I339 WeakPolarHBondContact CA-O 3.46Å
328	M	87.7	Confident	91	Very high	43 Å²	43	44.8 Å²	44.8	21%	0.212	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	127.2	166.5	-61.9	-177.6	-75.6	0	0	108.2	A83 I339 V341	A83-M328 HydrophobicContact CB-CG 4.48Å; A83-M328 HydrophobicContact CB-SD 3.3Å; A83-M328 WeakPolarHBondContact CB-SD 3.01Å; M328-I339 HydrophobicContact CB-CB 4.41Å; M328-I339 HydrophobicContact CE-CB 4.43Å; M328-I339 HydrophobicContact CE-CG2 4.04Å; M328-I339 PolarHBondContact N-O 2.83Å; M328-I339 PolarHBondContact O-N 2.84Å; M328-V341 HydrophobicContact CE-CG2 3.78Å; M328-V341 HydrophobicContact CG-CG2 4.11Å
329	V	85.8	Confident	91	Very high	86 Å²	86	43.6 Å²	43.6	52%	0.521	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	121.7	-180	-178.7	0	0	0	0	109.6	I336 E337	V329-I336 HydrophobicContact CG1-CG2 3.72Å; V329-E337 CarbonylContact C-O 3.56Å; V329-E337 WeakPolarHBondContact CA-O 3.45Å
330	K	84.7	Confident	91	Very high	62 Å²	62	44.8 Å²	44.8	27%	0.27	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	144.1	174	-65.2	-176	178.7	-178.3	0	110.6	W332 E337 I339	K330-W332 HydrophobicContact CD-CZ2 4.03Å; K330-E337 HydrophobicContact CB-CB 4.35Å; K330-E337 PolarHBondContact N-O 3.37Å; K330-E337 PolarHBondContact O-N 2.64Å; K330-I339 HydrophobicContact CD-CD1 4.04Å
331	F	81.1	Confident	90.8	Very high	39 Å²	39	44.6 Å²	44.6	17%	0.171	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.9	178.1	178.3	-89.1	0	0	0	109.6	L206 F210 G333 I336 I367	L206-F331 HydrophobicContact CD1-CE2 4.14Å; L206-F331 HydrophobicContact CD2-CE2 4.25Å; F210-F331 HydrophobicContact CE1-CD1 4.01Å; F210-F331 AromaticContact CE1-CE1 3.43Å; F210-F331 HydrophobicContact CE1-CE1 3.43Å; F210-F331 VanDerWaalsContact CE1-CE1 3.43Å; F210-F331 HydrophobicContact CE1-CZ 4.08Å; F210-F331 HydrophobicContact CZ-CD1 4.43Å; F210-F331 AromaticContact CZ-CE1 3.46Å; F210-F331 HydrophobicContact CZ-CE1 3.46Å; F210-F331 VanDerWaalsContact CZ-CE1 3.46Å; F210-F331 AromaticContact CZ-CZ 3.67Å; F210-F331 HydrophobicContact CZ-CZ 3.67Å; F331-G333 VanDerWaalsContact CE1-N 3.27Å; F331-G333 WeakPolarHBondContact CZ-O 3.4Å; F331-I336 HydrophobicContact CD2-CD1 4.49Å; F331-I336 HydrophobicContact CD2-CG1 3.87Å; F331-I336 HydrophobicContact CE2-CG1 4.4Å; F331-I367 HydrophobicContact CD2-CD1 4.15Å; F331-I367 HydrophobicContact CE2-CD1 3.39Å; F331-I367 HydrophobicContact CZ-CD1 4.04Å
332	W	84.1	Confident	90.6	Very high	152 Å²	152	46.2 Å²	46.2	58%	0.576	24%	0.243	S	C	*	.			trans	-112.3	36.2	-174.1	-63.1	113.1	0	0	0	112.3	K330 R334 S335 E337	K330-W332 HydrophobicContact CD-CZ2 4.03Å; W332-R334 PolarHBondContact O-N 3.43Å; W332-S335 PolarHBondContact N-O 2.82Å; W332-E337 PolarHBondContact NE1-OE1 2.79Å; W332-E337 PolarHBondContact NE1-OE2 3.42Å
333	G	81	Confident	90.4	Very high	33 Å²	33	47.6 Å²	47.6	34%	0.34	26%	0.256	S	S	.	.	S	Bend	trans	75.1	-58.6	-179.9	0	0	0	0	0	114.4	F331	F331-G333 VanDerWaalsContact CE1-N 3.27Å; F331-G333 WeakPolarHBondContact CZ-O 3.4Å
334	R	85.5	Confident	90.4	Very high	186 Å²	186	47.4 Å²	47.4	70%	0.702	26%	0.255	S	S	*	.	S	Bend	trans	-112.6	-3	-179.5	-64.7	-174.6	179.2	-173.2	1	114.1	W332 N366 I367 L368	W332-R334 PolarHBondContact O-N 3.43Å; R334-N366 PolarHBondContact O-N 2.93Å; R334-N366 VanDerWaalsContact O-N 3.11Å; R334-I367 PolarHBondContact O-N 2.82Å; R334-I367 VanDerWaalsContact O-N 3.11Å; R334-L368 HydrophobicContact CG-CD1 4.18Å
335	S	88.7	Confident	90.5	Very high	12 Å²	12	47 Å²	47	8%	0.084	25%	0.249	C	C	.	.			trans	-138.3	150.1	178.7	-50	0	0	0	0	111.5	W332 L364 R365	W332-S335 PolarHBondContact N-O 2.82Å; S335-L364 CarbonylContact C-O 3.58Å; S335-L364 WeakPolarHBondContact CA-O 3.5Å; S335-L364 WeakPolarHBondContact CB-O 3.19Å; S335-R365 WeakPolarHBondContact OG-CD 3.21Å
336	I	88.7	Confident	90.6	Very high	44 Å²	44	46 Å²	46	23%	0.226	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.6	170.2	-66.5	167.1	0	0	0	107.9	L206 V329 F331 C363 L364 I367	L206-I336 HydrophobicContact CD2-CD1 4.41Å; V329-I336 HydrophobicContact CG1-CG2 3.72Å; F331-I336 HydrophobicContact CD2-CD1 4.49Å; F331-I336 HydrophobicContact CD2-CG1 3.87Å; F331-I336 HydrophobicContact CE2-CG1 4.4Å; I336-C363 CarbonylContact O-C 3.58Å; I336-C363 WeakPolarHBondContact O-CA 3.08Å; I336-L364 PolarHBondContact N-O 3.27Å; I336-L364 PolarHBondContact O-N 3.48Å; I336-I367 HydrophobicContact CD1-CD1 4.2Å; I336-I367 HydrophobicContact CD1-CG2 4.23Å; I336-I367 HydrophobicContact CG1-CD1 3.91Å; I336-I367 HydrophobicContact CG1-CG2 4.2Å
337	E	90.8	Very high	90.7	Very high	18 Å²	18	48.7 Å²	48.7	8%	0.084	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118.8	-173	-176.8	177.8	-71.7	0	0	110.2	V329 K330 W332 I339 T361 Y377	V329-E337 CarbonylContact C-O 3.56Å; V329-E337 WeakPolarHBondContact CA-O 3.45Å; K330-E337 HydrophobicContact CB-CB 4.35Å; K330-E337 PolarHBondContact N-O 3.37Å; K330-E337 PolarHBondContact O-N 2.64Å; W332-E337 PolarHBondContact NE1-OE1 2.79Å; W332-E337 PolarHBondContact NE1-OE2 3.42Å; E337-I339 HydrophobicContact CG-CG1 4.19Å; E337-T361 HydrophobicContact CG-CG2 3.49Å; E337-T361 VanDerWaalsContact CG-CG2 3.49Å; E337-Y377 VanDerWaalsContact CD-OH 3.27Å; E337-Y377 PolarHBondContact OE1-OH 2.93Å
338	A	91.6	Very high	91	Very high	34 Å²	34	46.6 Å²	46.6	28%	0.281	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	108.5	174.6	0	0	0	0	0	109.2	P340 S362	A338-P340 WeakPolarHBondContact O-CD 3.45Å; A338-S362 PolarHBondContact N-O 2.84Å; A338-S362 PolarHBondContact O-N 3Å
339	I	94.2	Very high	91.4	Very high	36 Å²	36	47.9 Å²	47.9	19%	0.185	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	109.3	175.3	-57	168.4	0	0	0	106.9	A327 M328 K330 E337 T361	A327-I339 CarbonylContact C-O 3.52Å; A327-I339 VanDerWaalsContact CA-O 3.31Å; A327-I339 WeakPolarHBondContact CA-O 3.46Å; M328-I339 HydrophobicContact CB-CB 4.41Å; M328-I339 HydrophobicContact CE-CB 4.43Å; M328-I339 HydrophobicContact CE-CG2 4.04Å; M328-I339 PolarHBondContact N-O 2.83Å; M328-I339 PolarHBondContact O-N 2.84Å; K330-I339 HydrophobicContact CD-CD1 4.04Å; E337-I339 HydrophobicContact CG-CG1 4.19Å; I339-T361 HydrophobicContact CG1-CG2 4.01Å
340	P	95.3	Very high	91.7	Very high	25 Å²	25	50.2 Å²	50.2	16%	0.162	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	139.4	-178	29.9	-34.6	0	0	0	110.8	L325 A338 K359 A360	L325-P340 HydrophobicContact CD1-CB 3.96Å; A338-P340 WeakPolarHBondContact O-CD 3.45Å; P340-K359 HydrophobicContact CB-CB 3.9Å; P340-K359 HydrophobicContact CG-CB 3.53Å; P340-A360 WeakPolarHBondContact CG-O 3.32Å
341	V	94.8	Very high	92	Very high	25 Å²	25	50.1 Å²	50.1	15%	0.152	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	113.7	168.7	-160.6	0	0	0	0	106.9	L76 T326 M328	L76-V341 HydrophobicContact CD2-CB 4.25Å; L76-V341 HydrophobicContact CD2-CG1 3.3Å; T326-V341 HydrophobicContact CG2-CB 3.9Å; T326-V341 HydrophobicContact CG2-CG2 4.48Å; T326-V341 PolarHBondContact N-O 2.77Å; T326-V341 PolarHBondContact O-N 3.4Å; T326-V341 VanDerWaalsContact O-O 3.06Å; M328-V341 HydrophobicContact CE-CG2 3.78Å; M328-V341 HydrophobicContact CG-CG2 4.11Å
342	C	95.2	Very high	92.6	Very high	34 Å²	34	51.9 Å²	51.9	23%	0.23	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	152.7	-164.6	57.5	0	0	0	0	113	S324 L325 V344	S324-C342 WeakPolarHBondContact O-CA 3.27Å; S324-C342 WeakPolarHBondContact O-CB 3.33Å; L325-C342 HydrophobicContact CD1-CB 3.76Å; C342-V344 HydrophobicContact CB-CG2 3.99Å
343	S	94	Very high	93.1	Very high	49 Å²	49	44.8 Å²	44.8	34%	0.343	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	121.8	158.6	-154.4	0	0	0	0	107.4	Q323 S324 H345	Q323-S343 CarbonylContact C-O 3.31Å; Q323-S343 WeakPolarHBondContact CA-O 3.42Å; Q323-S343 WeakPolarHBondContact CB-O 3.39Å; S324-S343 PolarHBondContact N-O 2.93Å; S324-S343 VanDerWaalsContact N-O 3.07Å; S324-S343 PolarHBondContact O-N 3.14Å; S343-H345 PolarHBondContact OG-NE2 3.42Å
344	V	98.2	Very high	93.9	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.8	-177.2	-167.8	0	0	0	0	109.5	F321 Q323 C342 T356 W357 K359	F321-V344 HydrophobicContact CE2-CG1 3.8Å; F321-V344 HydrophobicContact CZ-CG1 4.42Å; Q323-V344 HydrophobicContact CB-CB 4.36Å; Q323-V344 HydrophobicContact CB-CG1 4.23Å; Q323-V344 HydrophobicContact CB-CG2 4.16Å; C342-V344 HydrophobicContact CB-CG2 3.99Å; V344-T356 VanDerWaalsContact O-CA 3.29Å; V344-T356 WeakPolarHBondContact O-CA 3.47Å; V344-W357 HydrophobicContact CB-CD2 4.27Å; V344-W357 HydrophobicContact CB-CZ2 4.35Å; V344-W357 HydrophobicContact CG1-CD2 4.1Å; V344-W357 VanDerWaalsContact CG1-CE2 3.48Å; V344-W357 HydrophobicContact CG1-CE3 4.43Å; V344-W357 HydrophobicContact CG1-CH2 3.76Å; V344-W357 HydrophobicContact CG1-CZ2 3.32Å; V344-W357 HydrophobicContact CG1-CZ3 4.28Å; V344-W357 PolarHBondContact O-N 2.8Å; V344-K359 HydrophobicContact CG2-CG 4.37Å
345	H	98.3	Very high	94.4	Very high	29 Å²	29	36.7 Å²	36.7	13%	0.134	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	142.3	-172.1	-55.4	-116	0	0	0	111.8	F321 W322 S343 E354 Y355 T356	F321-H345 WeakPolarHBondContact CA-O 3.28Å; F321-H345 WeakPolarHBondContact CD2-O 3.45Å; W322-H345 AromaticContact CD1-CD2 3.68Å; W322-H345 AromaticContact CD1-CG 3.98Å; W322-H345 HydrophobicContact CD2-CB 3.64Å; W322-H345 AromaticContact CE2-CD2 3.88Å; W322-H345 AromaticContact CE2-CG 3.4Å; W322-H345 VanDerWaalsContact CE2-CG 3.4Å; W322-H345 AromaticContact CE2-ND1 3.81Å; W322-H345 HydrophobicContact CE3-CB 4.09Å; W322-H345 HydrophobicContact CG-CB 4.18Å; W322-H345 HydrophobicContact CH2-CB 3.84Å; W322-H345 HydrophobicContact CZ2-CB 3.36Å; W322-H345 AromaticContact CZ2-CG 3.57Å; W322-H345 AromaticContact CZ2-ND1 3.58Å; W322-H345 HydrophobicContact CZ3-CB 4.17Å; W322-H345 PolarHBondContact N-O 3.09Å; W322-H345 AromaticContact NE1-CD2 3.19Å; W322-H345 PolarHBondContact NE1-CD2 3.27Å; W322-H345 AromaticContact NE1-CE1 3.93Å; W322-H345 AromaticContact NE1-CG 3.21Å; W322-H345 AromaticContact NE1-ND1 3.67Å; W322-H345 AromaticContact NE1-NE2 3.69Å; W322-H345 PolarHBondContact O-N 3.25Å; S343-H345 PolarHBondContact OG-NE2 3.42Å; H345-E354 IonicContact CE1-OE1 3.64Å; H345-E354 IonicContact CG-OE1 3.92Å; H345-E354 IonicContact ND1-OE1 2.74Å; H345-E354 PolarHBondContact ND1-OE1 3.42Å; H345-Y355 CarbonylContact C-O 3.27Å; H345-Y355 VanDerWaalsContact CA-O 3.31Å; H345-Y355 WeakPolarHBondContact CA-O 3.3Å; H345-T356 WeakPolarHBondContact ND1-CG2 3.39Å
346	V	98.4	Very high	94.9	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	131.7	163	166.4	0	0	0	0	108.6	L243 I259 L320 F321 L348 E354 Y355 W357	L243-V346 HydrophobicContact CD1-CG2 4.29Å; L243-V346 HydrophobicContact CD2-CG1 4.13Å; L243-V346 HydrophobicContact CD2-CG2 3.95Å; I259-V346 HydrophobicContact CD1-CG1 4.29Å; L320-V346 CarbonylContact O-C 3.57Å; L320-V346 VanDerWaalsContact O-CA 3.27Å; L320-V346 WeakPolarHBondContact O-CA 3.19Å; F321-V346 HydrophobicContact CB-CG2 4.48Å; F321-V346 HydrophobicContact CD2-CG2 3.77Å; V346-L348 HydrophobicContact CG1-CD2 3.91Å; V346-E354 CarbonylContact O-C 3.54Å; V346-E354 WeakPolarHBondContact O-CA 3.29Å; V346-Y355 PolarHBondContact N-O 2.96Å; V346-Y355 PolarHBondContact O-N 2.84Å; V346-W357 HydrophobicContact CB-CZ3 4.18Å; V346-W357 HydrophobicContact CG2-CH2 3.6Å; V346-W357 HydrophobicContact CG2-CZ3 3.73Å
347	R	97.4	Very high	95.3	Very high	69 Å²	69	36.7 Å²	36.7	26%	0.26	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.9	169.6	-167.8	-179.8	-63.7	156.6	0.5	111.2	W319 L320 W322 K349 E353 E354	W319-R347 CarbonylContact C-O 3.55Å; W319-R347 WeakPolarHBondContact CA-O 3.38Å; L320-R347 HydrophobicContact CB-CB 4.34Å; L320-R347 PolarHBondContact N-O 2.89Å; L320-R347 PolarHBondContact O-N 2.86Å; W322-R347 HydrophobicContact CH2-CB 3.99Å; W322-R347 HydrophobicContact CZ3-CB 3.82Å; R347-K349 PolarHBondContact O-N 2.8Å; R347-E353 CarbonylContact C-O 3.45Å; R347-E353 VanDerWaalsContact CA-O 3.26Å; R347-E353 WeakPolarHBondContact CA-O 3.44Å; R347-E353 WeakPolarHBondContact CG-O 3.38Å; R347-E354 HydrophobicContact CG-CB 4.49Å; R347-E354 IonicContact CZ-OE2 2.7Å; R347-E354 IonicContact NE-OE2 2.77Å; R347-E354 PolarHBondContact NE-OE2 3.08Å; R347-E354 IonicContact NH2-OE2 3.87Å; R347-E354 PolarHBondContact NH2-OE2 2.99Å
348	L	96.5	Very high	95.6	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	108.1	176.3	-56.5	-176.2	0	0	0	109.8	A246 A247 I259 W319 V346 K350 R351 N352 E353 Y355	A246-L348 HydrophobicContact CB-CD1 4.44Å; A246-L348 HydrophobicContact CB-CD2 4.46Å; A247-L348 HydrophobicContact CB-CD2 4.15Å; I259-L348 HydrophobicContact CD1-CD1 4.25Å; I259-L348 HydrophobicContact CD1-CD2 4.45Å; I259-L348 HydrophobicContact CD1-CG 4.49Å; W319-L348 HydrophobicContact CB-CD2 4.14Å; V346-L348 HydrophobicContact CG1-CD2 3.91Å; L348-K350 PolarHBondContact O-N 2.92Å; L348-R351 PolarHBondContact O-N 3.43Å; L348-R351 VanDerWaalsContact O-N 3.16Å; L348-N352 PolarHBondContact O-N 3.06Å; L348-E353 PolarHBondContact N-O 3.06Å; L348-Y355 HydrophobicContact CD1-CD2 4.45Å; L348-Y355 HydrophobicContact CD1-CE2 3.57Å; L348-Y355 HydrophobicContact CG-CD2 4.3Å; L348-Y355 HydrophobicContact CG-CE2 3.83Å
349	K	94.3	Very high	95.9	Very high	70 Å²	70	37.8 Å²	37.8	30%	0.304	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-41.5	-167.9	-71	179.2	169.9	-179.9	0	113.2	Y178 S316 V317 H318 L320 R347 R351	Y178-K349 PolarHBondContact OH-NZ 2.86Å; Y178-K349 VanDerWaalsContact OH-NZ 3.07Å; S316-K349 WeakPolarHBondContact O-CE 3.26Å; S316-K349 PolarHBondContact O-NZ 2.7Å; V317-K349 WeakPolarHBondContact O-CD 3.2Å; H318-K349 WeakPolarHBondContact O-CB 3.38Å; H318-K349 PolarHBondContact O-N 2.95Å; L320-K349 HydrophobicContact CG-CG 4.47Å; R347-K349 PolarHBondContact O-N 2.8Å; K349-R351 PolarHBondContact O-N 2.93Å
350	K	92.7	Very high	96.1	Very high	134 Å²	134	36.2 Å²	36.2	58%	0.583	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-30.4	-179.5	178.3	-177.3	167.1	-167.6	0	113.6	E250 L348	E250-K350 IonicContact OE1-NZ 3.84Å; E250-K350 PolarHBondContact OE1-NZ 2.99Å; L348-K350 PolarHBondContact O-N 2.92Å
351	R	91.7	Very high	96.2	Very high	60 Å²	60	36.1 Å²	36.1	23%	0.226	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-8.6	-171	-55.8	-173.1	-166.5	-74.2	-5.3	114.2	E249 E250 L348 K349 E353	E249-R351 PolarHBondContact O-NH2 2.86Å; E250-R351 IonicContact OE1-CZ 3.44Å; E250-R351 IonicContact OE1-NH1 3.8Å; E250-R351 IonicContact OE1-NH2 2.64Å; E250-R351 PolarHBondContact OE1-NH2 2.9Å; E250-R351 IonicContact OE2-CZ 2.88Å; E250-R351 IonicContact OE2-NH1 3.81Å; E250-R351 PolarHBondContact OE2-NH1 2.82Å; E250-R351 IonicContact OE2-NH2 2.68Å; E250-R351 PolarHBondContact OE2-NH2 3.16Å; L348-R351 PolarHBondContact O-N 3.43Å; L348-R351 VanDerWaalsContact O-N 3.16Å; K349-R351 PolarHBondContact O-N 2.93Å; R351-E353 HydrophobicContact CB-CB 4.35Å; R351-E353 HydrophobicContact CB-CG 3.76Å; R351-E353 WeakPolarHBondContact CD-OE2 3.34Å; R351-E353 PolarHBondContact O-N 2.87Å
352	N	93.6	Very high	96.3	Very high	77 Å²	77	35.6 Å²	35.6	41%	0.412	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	36.4	-169.3	-159.9	34.9	0	0	0	112.9	L348	L348-N352 PolarHBondContact O-N 3.06Å
353	E	94.9	Very high	96.2	Very high	2 Å²	2	34 Å²	34	1%	0.009	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	128.3	176.1	-71	174.2	158.6	0	0	109.6	R255 R347 L348 R351 Y355 K385 T389	R255-E353 IonicContact CZ-OE1 2.81Å; R255-E353 IonicContact CZ-OE2 2.73Å; R255-E353 IonicContact NE-OE1 4Å; R255-E353 IonicContact NE-OE2 2.7Å; R255-E353 PolarHBondContact NE-OE2 2.74Å; R255-E353 IonicContact NH2-OE1 3.12Å; R255-E353 PolarHBondContact NH2-OE1 3.02Å; R255-E353 IonicContact NH2-OE2 2.71Å; R255-E353 PolarHBondContact NH2-OE2 3.28Å; R255-E353 VanDerWaalsContact NH2-OE2 3.15Å; R347-E353 CarbonylContact C-O 3.45Å; R347-E353 VanDerWaalsContact CA-O 3.26Å; R347-E353 WeakPolarHBondContact CA-O 3.44Å; R347-E353 WeakPolarHBondContact CG-O 3.38Å; L348-E353 PolarHBondContact N-O 3.06Å; R351-E353 HydrophobicContact CB-CB 4.35Å; R351-E353 HydrophobicContact CB-CG 3.76Å; R351-E353 WeakPolarHBondContact CD-OE2 3.34Å; R351-E353 PolarHBondContact O-N 2.87Å; E353-Y355 HydrophobicContact CB-CD2 4.42Å; E353-Y355 HydrophobicContact CB-CE2 3.66Å; E353-Y355 PolarHBondContact OE2-OH 3.03Å; E353-Y355 VanDerWaalsContact OE2-OH 3.09Å; E353-K385 WeakPolarHBondContact CA-O 3.13Å; E353-T389 WeakPolarHBondContact OE1-CB 3.4Å; E353-T389 WeakPolarHBondContact OE1-CG2 3.27Å; E353-T389 PolarHBondContact OE1-OG1 2.93Å
354	E	96.1	Very high	96.2	Very high	47 Å²	47	32.8 Å²	32.8	22%	0.22	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.2	175.7	-172.4	171.6	140.1	0	0	111.3	W322 H345 V346 R347 T356 C384 K385	W322-E354 HydrophobicContact CH2-CG 4.19Å; W322-E354 WeakPolarHBondContact CH2-OE2 3.36Å; H345-E354 IonicContact CE1-OE1 3.64Å; H345-E354 IonicContact CG-OE1 3.92Å; H345-E354 IonicContact ND1-OE1 2.74Å; H345-E354 PolarHBondContact ND1-OE1 3.42Å; V346-E354 CarbonylContact O-C 3.54Å; V346-E354 WeakPolarHBondContact O-CA 3.29Å; R347-E354 HydrophobicContact CG-CB 4.49Å; R347-E354 IonicContact CZ-OE2 2.7Å; R347-E354 IonicContact NE-OE2 2.77Å; R347-E354 PolarHBondContact NE-OE2 3.08Å; R347-E354 IonicContact NH2-OE2 3.87Å; R347-E354 PolarHBondContact NH2-OE2 2.99Å; E354-T356 HydrophobicContact CG-CG2 4.46Å; E354-C384 CarbonylContact O-C 3.49Å; E354-C384 WeakPolarHBondContact O-CA 3.49Å; E354-K385 PolarHBondContact N-O 3.34Å; E354-K385 PolarHBondContact O-N 2.87Å
355	Y	97.7	Very high	95.9	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.008	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132.4	-177.8	-63.8	-104.7	0	0	0	109.3	R255 M256 I259 H345 V346 L348 E353 S383 C384	R255-Y355 WeakPolarHBondContact CB-OH 3.24Å; R255-Y355 PolarHBondContact NE-OH 3.42Å; M256-Y355 HydrophobicContact CB-CE1 4.45Å; M256-Y355 HydrophobicContact CE-CD1 3.81Å; M256-Y355 HydrophobicContact CE-CE1 4.01Å; M256-Y355 HydrophobicContact SD-CD1 4.05Å; M256-Y355 HydrophobicContact SD-CE1 4.34Å; I259-Y355 HydrophobicContact CD1-CD1 3.52Å; I259-Y355 HydrophobicContact CD1-CD2 3.43Å; I259-Y355 VanDerWaalsContact CD1-CD2 3.43Å; I259-Y355 HydrophobicContact CD1-CE1 3.69Å; I259-Y355 HydrophobicContact CD1-CE2 3.62Å; I259-Y355 HydrophobicContact CD1-CG 3.39Å; I259-Y355 HydrophobicContact CG2-CD1 4.43Å; I259-Y355 HydrophobicContact CG2-CG 4.43Å; H345-Y355 CarbonylContact C-O 3.27Å; H345-Y355 VanDerWaalsContact CA-O 3.31Å; H345-Y355 WeakPolarHBondContact CA-O 3.3Å; V346-Y355 PolarHBondContact N-O 2.96Å; V346-Y355 PolarHBondContact O-N 2.84Å; L348-Y355 HydrophobicContact CD1-CD2 4.45Å; L348-Y355 HydrophobicContact CD1-CE2 3.57Å; L348-Y355 HydrophobicContact CG-CD2 4.3Å; L348-Y355 HydrophobicContact CG-CE2 3.83Å; E353-Y355 HydrophobicContact CB-CD2 4.42Å; E353-Y355 HydrophobicContact CB-CE2 3.66Å; E353-Y355 PolarHBondContact OE2-OH 3.03Å; E353-Y355 VanDerWaalsContact OE2-OH 3.09Å; Y355-S383 WeakPolarHBondContact CA-O 3.45Å; Y355-C384 HydrophobicContact CD1-CB 3.68Å; Y355-C384 HydrophobicContact CE1-CB 3.57Å; Y355-C384 VanDerWaalsContact CE1-SG 3.6Å; Y355-C384 HydrophobicContact CG-CB 4.33Å
356	T	97.8	Very high	95.5	Very high	39 Å²	39	37.3 Å²	37.3	24%	0.239	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	147.8	-179.2	61.1	0	0	0	0	111.6	V344 H345 E354 F382 S383	V344-T356 VanDerWaalsContact O-CA 3.29Å; V344-T356 WeakPolarHBondContact O-CA 3.47Å; H345-T356 WeakPolarHBondContact ND1-CG2 3.39Å; E354-T356 HydrophobicContact CG-CG2 4.46Å; T356-F382 WeakPolarHBondContact O-CA 3.34Å; T356-S383 PolarHBondContact N-O 3.29Å; T356-S383 PolarHBondContact O-N 3.2Å; T356-S383 PolarHBondContact OG1-OG 3Å
357	W	98.2	Very high	94.8	Very high	17 Å²	17	37.4 Å²	37.4	6%	0.064	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	159.9	178	67.1	94.7	0	0	0	114	I259 F262 A263 F321 V344 V346 V381 F382	I259-W357 HydrophobicContact CG2-CE3 4.27Å; I259-W357 HydrophobicContact CG2-CH2 4.49Å; I259-W357 HydrophobicContact CG2-CZ3 3.88Å; F262-W357 HydrophobicContact CD1-CH2 4.06Å; F262-W357 HydrophobicContact CD1-CZ2 4.24Å; F262-W357 AromaticContact CE1-CH2 3.96Å; F262-W357 HydrophobicContact CE1-CH2 3.96Å; F262-W357 HydrophobicContact CE1-CZ2 4.11Å; A263-W357 HydrophobicContact CB-CD2 4.16Å; A263-W357 VanDerWaalsContact CB-CE2 3.47Å; A263-W357 HydrophobicContact CB-CG 4.41Å; A263-W357 HydrophobicContact CB-CZ2 3.7Å; F321-W357 HydrophobicContact CE2-CH2 4.18Å; F321-W357 HydrophobicContact CE2-CZ2 4.32Å; V344-W357 HydrophobicContact CB-CD2 4.27Å; V344-W357 HydrophobicContact CB-CZ2 4.35Å; V344-W357 HydrophobicContact CG1-CD2 4.1Å; V344-W357 VanDerWaalsContact CG1-CE2 3.48Å; V344-W357 HydrophobicContact CG1-CE3 4.43Å; V344-W357 HydrophobicContact CG1-CH2 3.76Å; V344-W357 HydrophobicContact CG1-CZ2 3.32Å; V344-W357 HydrophobicContact CG1-CZ3 4.28Å; V344-W357 PolarHBondContact O-N 2.8Å; V346-W357 HydrophobicContact CB-CZ3 4.18Å; V346-W357 HydrophobicContact CG2-CH2 3.6Å; V346-W357 HydrophobicContact CG2-CZ3 3.73Å; W357-V381 VanDerWaalsContact CA-O 3.28Å; W357-V381 WeakPolarHBondContact CA-O 3.28Å; W357-V381 WeakPolarHBondContact CB-O 3.47Å; W357-F382 HydrophobicContact CB-CB 4.47Å; W357-F382 HydrophobicContact CB-CD1 3.37Å; W357-F382 HydrophobicContact CB-CE1 3.56Å; W357-F382 HydrophobicContact CB-CG 3.93Å; W357-F382 HydrophobicContact CB-CZ 4.29Å; W357-F382 AromaticContact CD1-CE1 3.88Å; W357-F382 HydrophobicContact CD2-CD1 4.04Å; W357-F382 AromaticContact CD2-CE1 3.81Å; W357-F382 HydrophobicContact CD2-CE1 3.81Å; W357-F382 HydrophobicContact CE3-CD1 4.2Å; W357-F382 HydrophobicContact CE3-CE1 4.31Å; W357-F382 AromaticContact CG-CD1 3.73Å; W357-F382 HydrophobicContact CG-CD1 3.73Å; W357-F382 AromaticContact CG-CE1 3.46Å; W357-F382 HydrophobicContact CG-CE1 3.46Å; W357-F382 VanDerWaalsContact CG-CE1 3.46Å; W357-F382 HydrophobicContact CG-CZ 4.29Å
358	N	97.6	Very high	94	Very high	64 Å²	64	37.5 Å²	37.5	34%	0.342	18%	0.181	S	C	.	.	P	Polyproline II helix	trans	-91.3	153.3	167	70.6	-73.3	0	0	0	111.3	E379 M380 V381	N358-E379 PolarHBondContact ND2-O 3.46Å; N358-M380 WeakPolarHBondContact O-CE 3.31Å; N358-M380 WeakPolarHBondContact O-CG 3.41Å; N358-V381 PolarHBondContact OD1-N 2.87Å
359	K	98	Very high	93.3	Very high	12 Å²	12	40 Å²	40	5%	0.052	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-88.2	158.1	173.1	-65.1	-176.5	-171.3	-171.7	0	111.5	E236 Q323 L325 P340 V344	E236-K359 IonicContact OE1-NZ 3.42Å; E236-K359 PolarHBondContact OE1-NZ 3.19Å; E236-K359 IonicContact OE2-NZ 3.49Å; E236-K359 PolarHBondContact OE2-NZ 2.95Å; Q323-K359 VanDerWaalsContact OE1-CE 3.28Å; L325-K359 HydrophobicContact CD1-CD 4.45Å; P340-K359 HydrophobicContact CB-CB 3.9Å; P340-K359 HydrophobicContact CG-CB 3.53Å; V344-K359 HydrophobicContact CG2-CG 4.37Å
360	A	97.9	Very high	92.6	Very high	2 Å²	2	43.1 Å²	43.1	2%	0.017	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-84.2	152.4	175.5	0	0	0	0	0	111.5	Y267 P340 M380 L398	Y267-A360 HydrophobicContact CE1-CB 4.37Å; Y267-A360 PolarHBondContact OH-N 2.9Å; P340-A360 WeakPolarHBondContact CG-O 3.32Å; A360-M380 HydrophobicContact CB-CG 4.01Å; A360-M380 HydrophobicContact CB-SD 4.04Å; A360-L398 HydrophobicContact CB-CD1 4.23Å; A360-L398 HydrophobicContact CB-CD2 3.84Å; A360-L398 HydrophobicContact CB-CG 4.43Å
361	T	97.1	Very high	92.3	Very high	23 Å²	23	39.9 Å²	39.9	14%	0.141	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	142	175.2	-61.3	0	0	0	0	110.1	E337 I339 H376 Y377	E337-T361 HydrophobicContact CG-CG2 3.49Å; E337-T361 VanDerWaalsContact CG-CG2 3.49Å; I339-T361 HydrophobicContact CG1-CG2 4.01Å; T361-H376 WeakPolarHBondContact O-CA 3.49Å; T361-Y377 HydrophobicContact CG2-CE1 4.02Å; T361-Y377 HydrophobicContact CG2-CE2 4.24Å; T361-Y377 PolarHBondContact N-O 3.47Å; T361-Y377 PolarHBondContact O-N 3.43Å
362	S	96.2	Very high	92.2	Very high	15 Å²	15	39.5 Å²	39.5	11%	0.105	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.3	178.6	-56.5	0	0	0	0	109.8	A338 H376	A338-S362 PolarHBondContact N-O 2.84Å; A338-S362 PolarHBondContact O-N 3Å; S362-H376 WeakPolarHBondContact CB-ND1 3.21Å; S362-H376 PolarHBondContact OG-CE1 2.89Å; S362-H376 PolarHBondContact OG-ND1 2.76Å
363	C	94.5	Very high	92.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.2	-176.7	-163.8	0	0	0	0	110.2	I336 R365 F374 E375 Y377	I336-C363 CarbonylContact O-C 3.58Å; I336-C363 WeakPolarHBondContact O-CA 3.08Å; C363-R365 PolarHBondContact O-N 3.17Å; C363-F374 WeakPolarHBondContact O-CA 3.44Å; C363-E375 HydrophobicContact CB-CB 4.49Å; C363-E375 PolarHBondContact N-O 2.93Å; C363-E375 PolarHBondContact O-N 3.21Å; C363-Y377 HydrophobicContact CB-CE1 4.03Å
364	L	92.9	Very high	92.2	Very high	24 Å²	24	39.8 Å²	39.8	13%	0.126	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	107.6	167.7	-176	64.9	0	0	0	108.2	T274 S335 I336 I367 R372 F374	T274-L364 HydrophobicContact CG2-CD1 4.4Å; S335-L364 CarbonylContact C-O 3.58Å; S335-L364 WeakPolarHBondContact CA-O 3.5Å; S335-L364 WeakPolarHBondContact CB-O 3.19Å; I336-L364 PolarHBondContact N-O 3.27Å; I336-L364 PolarHBondContact O-N 3.48Å; L364-I367 HydrophobicContact CB-CG2 4.38Å; L364-I367 HydrophobicContact CD2-CG2 3.95Å; L364-I367 HydrophobicContact CG-CG2 3.92Å; L364-I367 WeakPolarHBondContact O-CG2 3.44Å; L364-R372 HydrophobicContact CD1-CB 4.34Å; L364-F374 HydrophobicContact CB-CD1 4.15Å; L364-F374 HydrophobicContact CB-CE1 3.78Å; L364-F374 HydrophobicContact CB-CZ 4.35Å; L364-F374 HydrophobicContact CD1-CD1 4.23Å; L364-F374 HydrophobicContact CD1-CD2 4.22Å; L364-F374 HydrophobicContact CD1-CE1 4.07Å; L364-F374 HydrophobicContact CD1-CE2 4.07Å; L364-F374 HydrophobicContact CD1-CG 4.31Å; L364-F374 HydrophobicContact CD1-CZ 3.99Å; L364-F374 HydrophobicContact CG-CE1 4.45Å
365	R	92.4	Very high	92.2	Very high	66 Å²	66	37.8 Å²	37.8	25%	0.249	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	159.1	178.4	-63.8	-65.3	-164.8	-164.9	-2.2	111.1	S335 C363 I367 Y373 E375	S335-R365 WeakPolarHBondContact OG-CD 3.21Å; C363-R365 PolarHBondContact O-N 3.17Å; R365-I367 VanDerWaalsContact C-N 3.34Å; R365-I367 PolarHBondContact O-N 2.82Å; R365-Y373 HydrophobicContact CB-CD1 3.97Å; R365-Y373 HydrophobicContact CB-CD2 4.25Å; R365-Y373 HydrophobicContact CB-CE1 3.54Å; R365-Y373 HydrophobicContact CB-CE2 3.86Å; R365-Y373 HydrophobicContact CB-CG 4.3Å; R365-Y373 VanDerWaalsContact CB-CZ 3.49Å; R365-Y373 HydrophobicContact CG-CD2 4.32Å; R365-Y373 HydrophobicContact CG-CE1 4.23Å; R365-Y373 HydrophobicContact CG-CE2 3.68Å; R365-Y373 PolarHBondContact N-O 3.21Å; R365-E375 HydrophobicContact CG-CB 4.27Å; R365-E375 IonicContact CZ-OE2 2.7Å; R365-E375 IonicContact NE-OE2 3.47Å; R365-E375 PolarHBondContact NE-OE2 3.32Å; R365-E375 IonicContact NH2-OE1 3.89Å; R365-E375 PolarHBondContact NH2-OE1 2.82Å; R365-E375 IonicContact NH2-OE2 3.66Å; R365-E375 PolarHBondContact NH2-OE2 2.88Å
366	N	90.2	Very high	92.3	Very high	60 Å²	60	37.7 Å²	37.7	32%	0.321	20%	0.199	S	C	.	.			trans	57.4	36.1	171.1	-67.3	-2.9	0	0	0	115	R334 L368 S369 S371 R372	R334-N366 PolarHBondContact O-N 2.93Å; R334-N366 VanDerWaalsContact O-N 3.11Å; N366-L368 PolarHBondContact O-N 2.8Å; N366-S369 PolarHBondContact O-N 3Å; N366-S369 VanDerWaalsContact O-O 3.12Å; N366-S371 WeakPolarHBondContact CB-O 3.46Å; N366-S371 PolarHBondContact ND2-O 3.14Å; N366-S371 PolarHBondContact ND2-OG 2.86Å; N366-S371 VanDerWaalsContact ND2-OG 3.16Å; N366-R372 WeakPolarHBondContact O-CG 3.4Å
367	I	83.5	Confident	92.3	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.5	-174.7	69.1	-168.8	0	0	0	114.8	L206 F331 R334 I336 L364 R365	L206-I367 HydrophobicContact CD1-CD1 4.01Å; L206-I367 HydrophobicContact CD1-CG1 4.33Å; F331-I367 HydrophobicContact CD2-CD1 4.15Å; F331-I367 HydrophobicContact CE2-CD1 3.39Å; F331-I367 HydrophobicContact CZ-CD1 4.04Å; R334-I367 PolarHBondContact O-N 2.82Å; R334-I367 VanDerWaalsContact O-N 3.11Å; I336-I367 HydrophobicContact CD1-CD1 4.2Å; I336-I367 HydrophobicContact CD1-CG2 4.23Å; I336-I367 HydrophobicContact CG1-CD1 3.91Å; I336-I367 HydrophobicContact CG1-CG2 4.2Å; L364-I367 HydrophobicContact CB-CG2 4.38Å; L364-I367 HydrophobicContact CD2-CG2 3.95Å; L364-I367 HydrophobicContact CG-CG2 3.92Å; L364-I367 WeakPolarHBondContact O-CG2 3.44Å; R365-I367 VanDerWaalsContact C-N 3.34Å; R365-I367 PolarHBondContact O-N 2.82Å
368	L	79.6	Confident	92.2	Very high	71 Å²	71	38.4 Å²	38.4	37%	0.372	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	2.2	179.4	-49.5	-175.4	0	0	0	113.8	W203 R334 N366	W203-L368 HydrophobicContact CB-CD2 3.93Å; W203-L368 HydrophobicContact CD2-CD1 4.46Å; W203-L368 HydrophobicContact CD2-CD2 3.71Å; W203-L368 HydrophobicContact CE3-CD1 4.23Å; W203-L368 HydrophobicContact CE3-CD2 3.25Å; W203-L368 HydrophobicContact CE3-CG 4.4Å; W203-L368 HydrophobicContact CG-CD2 4.03Å; W203-L368 HydrophobicContact CZ3-CD1 4.25Å; W203-L368 HydrophobicContact CZ3-CD2 3.9Å; R334-L368 HydrophobicContact CG-CD1 4.18Å; N366-L368 PolarHBondContact O-N 2.8Å
369	S	82.2	Confident	92.2	Very high	53 Å²	53	39.2 Å²	39.2	37%	0.371	21%	0.205	S	C	.	.	S	Bend	trans	-121.6	167.1	176.9	178.8	0	0	0	0	108.7	N366 S371 R372	N366-S369 PolarHBondContact O-N 3Å; N366-S369 VanDerWaalsContact O-O 3.12Å; S369-S371 VanDerWaalsContact C-N 3.3Å; S369-S371 PolarHBondContact OG-N 3.27Å; S369-S371 PolarHBondContact OG-OG 2.97Å; S369-R372 VanDerWaalsContact O-CG 3.3Å; S369-R372 WeakPolarHBondContact O-CG 3.26Å; S369-R372 PolarHBondContact O-NH1 3.21Å
370	D	79.1	Confident	92.3	Very high	137 Å²	137	38.6 Å²	38.6	73%	0.733	20%	0.202	S	C	*	.	S	Bend	trans	-82	-11.7	168.6	-63.2	-49.2	0	0	0	113.2	R372	D370-R372 PolarHBondContact O-N 2.65Å; D370-R372 IonicContact OD1-CZ 2.84Å; D370-R372 IonicContact OD1-NH1 3.63Å; D370-R372 PolarHBondContact OD1-NH1 3.03Å; D370-R372 VanDerWaalsContact OD1-NH1 3.13Å; D370-R372 IonicContact OD1-NH2 3.08Å; D370-R372 PolarHBondContact OD1-NH2 3.35Å
371	S	87.3	Confident	92.2	Very high	65 Å²	65	41.3 Å²	41.3	46%	0.455	22%	0.218	S	C	.	.			trans	-75.4	38	172.5	65.4	0	0	0	0	113.8	N366 S369 Y373	N366-S371 WeakPolarHBondContact CB-O 3.46Å; N366-S371 PolarHBondContact ND2-O 3.14Å; N366-S371 PolarHBondContact ND2-OG 2.86Å; N366-S371 VanDerWaalsContact ND2-OG 3.16Å; S369-S371 VanDerWaalsContact C-N 3.3Å; S369-S371 PolarHBondContact OG-N 3.27Å; S369-S371 PolarHBondContact OG-OG 2.97Å; S371-Y373 WeakPolarHBondContact O-CD1 3.44Å
372	R	90.5	Very high	92.3	Very high	52 Å²	52	40.3 Å²	40.3	20%	0.196	21%	0.212	C	C	.	.			trans	-68.9	132.2	-179.8	-70.3	175.9	-64.3	-90.9	1.1	110.9	T274 L364 N366 S369 D370	T274-R372 WeakPolarHBondContact CB-O 3.42Å; T274-R372 WeakPolarHBondContact O-CD 3.28Å; T274-R372 PolarHBondContact OG1-O 3.24Å; L364-R372 HydrophobicContact CD1-CB 4.34Å; N366-R372 WeakPolarHBondContact O-CG 3.4Å; S369-R372 VanDerWaalsContact O-CG 3.3Å; S369-R372 WeakPolarHBondContact O-CG 3.26Å; S369-R372 PolarHBondContact O-NH1 3.21Å; D370-R372 PolarHBondContact O-N 2.65Å; D370-R372 IonicContact OD1-CZ 2.84Å; D370-R372 IonicContact OD1-NH1 3.63Å; D370-R372 PolarHBondContact OD1-NH1 3.03Å; D370-R372 VanDerWaalsContact OD1-NH1 3.13Å; D370-R372 IonicContact OD1-NH2 3.08Å; D370-R372 PolarHBondContact OD1-NH2 3.35Å
373	Y	93.1	Very high	92.3	Very high	41 Å²	41	41.6 Å²	41.6	16%	0.161	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	152.6	174.2	66.1	-82.8	0	0	0	111	R365 S371 E375 D401 R414	R365-Y373 HydrophobicContact CB-CD1 3.97Å; R365-Y373 HydrophobicContact CB-CD2 4.25Å; R365-Y373 HydrophobicContact CB-CE1 3.54Å; R365-Y373 HydrophobicContact CB-CE2 3.86Å; R365-Y373 HydrophobicContact CB-CG 4.3Å; R365-Y373 VanDerWaalsContact CB-CZ 3.49Å; R365-Y373 HydrophobicContact CG-CD2 4.32Å; R365-Y373 HydrophobicContact CG-CE1 4.23Å; R365-Y373 HydrophobicContact CG-CE2 3.68Å; R365-Y373 PolarHBondContact N-O 3.21Å; S371-Y373 WeakPolarHBondContact O-CD1 3.44Å; Y373-E375 HydrophobicContact CE2-CB 4.44Å; Y373-D401 VanDerWaalsContact CE2-OD2 3.29Å; Y373-D401 WeakPolarHBondContact CE2-OD2 3.42Å; Y373-R414 VanDerWaalsContact CG-NH1 3.3Å
374	F	94.9	Very high	92.3	Very high	45 Å²	45	42 Å²	42	20%	0.197	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	134.7	168.4	-80.8	-72.9	0	0	0	110.7	T270 T274 C363 L364	T270-F374 VanDerWaalsContact O-CD2 3.26Å; T270-F374 WeakPolarHBondContact O-CD2 3.44Å; T274-F374 HydrophobicContact CG2-CD2 3.83Å; T274-F374 HydrophobicContact CG2-CE2 4.31Å; C363-F374 WeakPolarHBondContact O-CA 3.44Å; L364-F374 HydrophobicContact CB-CD1 4.15Å; L364-F374 HydrophobicContact CB-CE1 3.78Å; L364-F374 HydrophobicContact CB-CZ 4.35Å; L364-F374 HydrophobicContact CD1-CD1 4.23Å; L364-F374 HydrophobicContact CD1-CD2 4.22Å; L364-F374 HydrophobicContact CD1-CE1 4.07Å; L364-F374 HydrophobicContact CD1-CE2 4.07Å; L364-F374 HydrophobicContact CD1-CG 4.31Å; L364-F374 HydrophobicContact CD1-CZ 3.99Å; L364-F374 HydrophobicContact CG-CE1 4.45Å
375	E	96.6	Very high	92	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.019	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	139.7	163.1	-178.5	-176.5	163.1	0	0	108	C363 R365 Y373 Y377 P400 D401	C363-E375 HydrophobicContact CB-CB 4.49Å; C363-E375 PolarHBondContact N-O 2.93Å; C363-E375 PolarHBondContact O-N 3.21Å; R365-E375 HydrophobicContact CG-CB 4.27Å; R365-E375 IonicContact CZ-OE2 2.7Å; R365-E375 IonicContact NE-OE2 3.47Å; R365-E375 PolarHBondContact NE-OE2 3.32Å; R365-E375 IonicContact NH2-OE1 3.89Å; R365-E375 PolarHBondContact NH2-OE1 2.82Å; R365-E375 IonicContact NH2-OE2 3.66Å; R365-E375 PolarHBondContact NH2-OE2 2.88Å; Y373-E375 HydrophobicContact CE2-CB 4.44Å; E375-Y377 HydrophobicContact CG-CD1 4.26Å; E375-P400 WeakPolarHBondContact OE1-CA 3.48Å; E375-P400 WeakPolarHBondContact OE1-CB 3.42Å; E375-D401 HydrophobicContact CG-CB 4.23Å; E375-D401 PolarHBondContact OE1-N 2.84Å
376	H	97.9	Very high	91.6	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.4	174.6	-60.7	-63.6	0	0	0	108.5	Y267 T270 T361 S362 L398 W436	Y267-H376 HydrophobicContact CD1-CB 4.04Å; Y267-H376 AromaticContact CD1-CD2 3.75Å; Y267-H376 AromaticContact CD1-CE1 3.75Å; Y267-H376 AromaticContact CD1-CG 3.48Å; Y267-H376 VanDerWaalsContact CD1-CG 3.48Å; Y267-H376 AromaticContact CD1-ND1 3.48Å; Y267-H376 WeakPolarHBondContact CD1-ND1 3.45Å; Y267-H376 AromaticContact CD1-NE2 3.9Å; Y267-H376 HydrophobicContact CE1-CB 4.41Å; Y267-H376 AromaticContact CE1-ND1 3.95Å; Y267-H376 HydrophobicContact CG-CB 4.46Å; T270-H376 PolarHBondContact OG1-NE2 3.03Å; T361-H376 WeakPolarHBondContact O-CA 3.49Å; S362-H376 WeakPolarHBondContact CB-ND1 3.21Å; S362-H376 PolarHBondContact OG-CE1 2.89Å; S362-H376 PolarHBondContact OG-ND1 2.76Å; H376-L398 HydrophobicContact CB-CD2 3.71Å; H376-L398 WeakPolarHBondContact O-CB 3.36Å; H376-W436 AromaticContact CD2-CE2 3.71Å; H376-W436 AromaticContact CD2-CH2 3.85Å; H376-W436 AromaticContact CD2-CZ2 3.65Å
377	Y	97.9	Very high	90.8	Very high	51 Å²	51	51.2 Å²	51.2	20%	0.2	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	158	-174.6	70.4	-96.7	0	0	0	113.1	E337 T361 C363 E375 L398 P400	E337-Y377 VanDerWaalsContact CD-OH 3.27Å; E337-Y377 PolarHBondContact OE1-OH 2.93Å; T361-Y377 HydrophobicContact CG2-CE1 4.02Å; T361-Y377 HydrophobicContact CG2-CE2 4.24Å; T361-Y377 PolarHBondContact N-O 3.47Å; T361-Y377 PolarHBondContact O-N 3.43Å; C363-Y377 HydrophobicContact CB-CE1 4.03Å; E375-Y377 HydrophobicContact CG-CD1 4.26Å; Y377-L398 WeakPolarHBondContact CA-O 3.48Å; Y377-P400 HydrophobicContact CG-CG 4.39Å
378	G	97.5	Very high	90.3	Very high	20 Å²	20	58.6 Å²	58.6	21%	0.206	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.9	168.1	178.4	0	0	0	0	0	113.2	Q397 L398	G378-Q397 VanDerWaalsContact C-NE2 3.29Å; G378-Q397 PolarHBondContact O-NE2 3.36Å; G378-L398 PolarHBondContact N-O 3.22Å; G378-L398 PolarHBondContact O-N 3.16Å
379	E	97.9	Very high	90.1	Very high	80 Å²	80	56.8 Å²	56.8	37%	0.374	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	124.4	172.7	-169.6	178.8	70.5	0	0	109.6	N358 V381 K395 L396	N358-E379 PolarHBondContact ND2-O 3.46Å; E379-V381 HydrophobicContact CG-CG2 3.83Å; E379-V381 WeakPolarHBondContact OE1-CG2 3.33Å; E379-K395 IonicContact OE1-NZ 2.87Å; E379-K395 PolarHBondContact OE1-NZ 2.84Å; E379-K395 WeakPolarHBondContact OE2-CD 3.45Å; E379-K395 IonicContact OE2-NZ 3.21Å; E379-K395 PolarHBondContact OE2-NZ 2.67Å; E379-L396 WeakPolarHBondContact CA-O 3.21Å
380	M	98.3	Very high	90.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	116	164.7	-66	179.4	65.4	0	0	108.3	A263 V264 Y267 N358 A360 F382 L396 L398	A263-M380 HydrophobicContact CB-CE 3.85Å; V264-M380 HydrophobicContact CG2-SD 4.19Å; Y267-M380 HydrophobicContact CE2-CE 4.39Å; Y267-M380 HydrophobicContact CE2-SD 3.84Å; N358-M380 WeakPolarHBondContact O-CE 3.31Å; N358-M380 WeakPolarHBondContact O-CG 3.41Å; A360-M380 HydrophobicContact CB-CG 4.01Å; A360-M380 HydrophobicContact CB-SD 4.04Å; M380-F382 HydrophobicContact CB-CE2 3.69Å; M380-F382 HydrophobicContact CB-CZ 4.04Å; M380-F382 HydrophobicContact CE-CZ 3.84Å; M380-L396 HydrophobicContact CB-CB 4.46Å; M380-L396 PolarHBondContact N-O 3.07Å; M380-L396 PolarHBondContact O-N 3.1Å; M380-L398 HydrophobicContact CG-CD1 4.05Å; M380-L398 HydrophobicContact SD-CD1 3.62Å
381	V	97.8	Very high	90.4	Very high	58 Å²	58	56.4 Å²	56.4	35%	0.352	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.6	179.9	-175.1	0	0	0	0	109	W357 N358 E379 K395	W357-V381 VanDerWaalsContact CA-O 3.28Å; W357-V381 WeakPolarHBondContact CA-O 3.28Å; W357-V381 WeakPolarHBondContact CB-O 3.47Å; N358-V381 PolarHBondContact OD1-N 2.87Å; E379-V381 HydrophobicContact CG-CG2 3.83Å; E379-V381 WeakPolarHBondContact OE1-CG2 3.33Å; V381-K395 HydrophobicContact CG2-CG 4.49Å
382	F	97.9	Very high	90.6	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.009	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	138.4	179.8	-57.2	-100.4	0	0	0	110.1	M256 A260 A263 T356 W357 M380 K393 C394 L396	M256-F382 HydrophobicContact CE-CB 4.22Å; M256-F382 HydrophobicContact SD-CB 3.54Å; M256-F382 VanDerWaalsContact SD-CB 3.54Å; M256-F382 HydrophobicContact SD-CG 4.34Å; A260-F382 HydrophobicContact CB-CD1 4.22Å; A260-F382 HydrophobicContact CB-CD2 4.09Å; A260-F382 HydrophobicContact CB-CE1 4.02Å; A260-F382 HydrophobicContact CB-CE2 3.85Å; A260-F382 HydrophobicContact CB-CG 4.28Å; A260-F382 HydrophobicContact CB-CZ 3.81Å; A263-F382 HydrophobicContact CB-CE1 3.52Å; A263-F382 HydrophobicContact CB-CZ 3.78Å; T356-F382 WeakPolarHBondContact O-CA 3.34Å; W357-F382 HydrophobicContact CB-CB 4.47Å; W357-F382 HydrophobicContact CB-CD1 3.37Å; W357-F382 HydrophobicContact CB-CE1 3.56Å; W357-F382 HydrophobicContact CB-CG 3.93Å; W357-F382 HydrophobicContact CB-CZ 4.29Å; W357-F382 AromaticContact CD1-CE1 3.88Å; W357-F382 HydrophobicContact CD2-CD1 4.04Å; W357-F382 AromaticContact CD2-CE1 3.81Å; W357-F382 HydrophobicContact CD2-CE1 3.81Å; W357-F382 HydrophobicContact CE3-CD1 4.2Å; W357-F382 HydrophobicContact CE3-CE1 4.31Å; W357-F382 AromaticContact CG-CD1 3.73Å; W357-F382 HydrophobicContact CG-CD1 3.73Å; W357-F382 AromaticContact CG-CE1 3.46Å; W357-F382 HydrophobicContact CG-CE1 3.46Å; W357-F382 VanDerWaalsContact CG-CE1 3.46Å; W357-F382 HydrophobicContact CG-CZ 4.29Å; M380-F382 HydrophobicContact CB-CE2 3.69Å; M380-F382 HydrophobicContact CB-CZ 4.04Å; M380-F382 HydrophobicContact CE-CZ 3.84Å; F382-K393 WeakPolarHBondContact O-CA 3.29Å; F382-C394 HydrophobicContact CB-CB 3.98Å; F382-C394 HydrophobicContact CD2-CB 4.02Å; F382-C394 HydrophobicContact CG-CB 4.28Å; F382-C394 PolarHBondContact N-O 3.21Å; F382-C394 PolarHBondContact O-N 3.18Å; F382-L396 HydrophobicContact CE2-CB 4.21Å; F382-L396 HydrophobicContact CE2-CD1 4Å; F382-L396 HydrophobicContact CE2-CG 3.87Å; F382-L396 HydrophobicContact CZ-CD1 4.31Å
383	S	95.5	Very high	90.8	Very high	42 Å²	42	54.9 Å²	54.9	29%	0.294	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	141.8	171.8	69.7	0	0	0	0	111.4	Y355 T356	Y355-S383 WeakPolarHBondContact CA-O 3.45Å; T356-S383 PolarHBondContact N-O 3.29Å; T356-S383 PolarHBondContact O-N 3.2Å; T356-S383 PolarHBondContact OG1-OG 3Å
384	C	94.7	Very high	91.1	Very high	8 Å²	8	52.9 Å²	52.9	5%	0.054	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	136.8	171.9	178.7	0	0	0	0	110.5	M256 E354 Y355 V392	M256-C384 HydrophobicContact CE-CB 3.72Å; E354-C384 CarbonylContact O-C 3.49Å; E354-C384 WeakPolarHBondContact O-CA 3.49Å; Y355-C384 HydrophobicContact CD1-CB 3.68Å; Y355-C384 HydrophobicContact CE1-CB 3.57Å; Y355-C384 VanDerWaalsContact CE1-SG 3.6Å; Y355-C384 HydrophobicContact CG-CB 4.33Å; C384-V392 HydrophobicContact CB-CB 4.5Å; C384-V392 PolarHBondContact N-O 3.45Å; C384-V392 VanDerWaalsContact N-O 3.15Å
385	K	86.6	Confident	91.2	Very high	156 Å²	156	54.8 Å²	54.8	68%	0.678	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.3	137	170.7	-63.6	178	-176.5	173.8	0	109.3	E353 E354	E353-K385 WeakPolarHBondContact CA-O 3.13Å; E354-K385 PolarHBondContact N-O 3.34Å; E354-K385 PolarHBondContact O-N 2.87Å
386	G	83.8	Confident	91.3	Very high	24 Å²	24	54.6 Å²	54.6	25%	0.247	29%	0.286	C	S	.	.			trans	-163.5	148.4	173.7	0	0	0	0	0	109.4	N388 T389	G386-N388 PolarHBondContact O-N 2.96Å; G386-N388 VanDerWaalsContact O-N 3.12Å; G386-T389 PolarHBondContact O-N 3.05Å
387	E	74.1	Confident	91.3	Very high	164 Å²	164	57.7 Å²	57.7	77%	0.766	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-29.5	-171.8	-67.7	171.6	175.5	0	0	113.5
388	N	72.9	Confident	91.3	Very high	157 Å²	157	55.3 Å²	55.3	84%	0.84	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	18.3	-176.2	-62.5	-68.1	0	0	0	113.3	G386	G386-N388 PolarHBondContact O-N 2.96Å; G386-N388 VanDerWaalsContact O-N 3.12Å
389	T	74.6	Confident	91.3	Very high	32 Å²	32	57.4 Å²	57.4	20%	0.196	30%	0.295	C	S	.	.			trans	-119.2	117.4	-176.3	-52.7	0	0	0	0	110	E353 G386	E353-T389 WeakPolarHBondContact OE1-CB 3.4Å; E353-T389 WeakPolarHBondContact OE1-CG2 3.27Å; E353-T389 PolarHBondContact OE1-OG1 2.93Å; G386-T389 PolarHBondContact O-N 3.05Å
390	L	85	Confident	91.2	Very high	107 Å²	107	56.7 Å²	56.7	56%	0.56	30%	0.297	S	S	*	.			trans	-58.9	140.5	172.7	-56.8	172.9	0	0	0	109.6	R252 V392	R252-L390 PolarHBondContact NH1-O 3.29Å; L390-V392 PolarHBondContact O-N 2.96Å
391	P	83.8	Confident	91	Very high	76 Å²	76	58.2 Å²	58.2	49%	0.494	31%	0.305	S	S	.	.			trans	-52.3	132.7	-175.5	-28.1	35	0	0	0	113.3
392	V	91.2	Very high	90.9	Very high	2 Å²	2	60 Å²	60	1%	0.012	31%	0.306	C	S	.	.			trans	-116.7	136.4	167.8	-177.1	0	0	0	0	107.2	R252 F253 M256 C384 L390 V421	R252-V392 HydrophobicContact CB-CG2 4.09Å; R252-V392 HydrophobicContact CG-CG2 3.82Å; F253-V392 HydrophobicContact CD1-CG1 3.87Å; F253-V392 HydrophobicContact CD1-CG2 4.26Å; F253-V392 HydrophobicContact CE1-CG1 4.28Å; F253-V392 HydrophobicContact CE1-CG2 4.15Å; M256-V392 HydrophobicContact CB-CG1 3.75Å; M256-V392 HydrophobicContact CE-CB 4.2Å; M256-V392 HydrophobicContact CE-CG1 4.13Å; M256-V392 VanDerWaalsContact CE-O 3.23Å; M256-V392 WeakPolarHBondContact CE-O 3.35Å; M256-V392 HydrophobicContact CG-CG1 3.92Å; C384-V392 HydrophobicContact CB-CB 4.5Å; C384-V392 PolarHBondContact N-O 3.45Å; C384-V392 VanDerWaalsContact N-O 3.15Å; L390-V392 PolarHBondContact O-N 2.96Å; V392-V421 HydrophobicContact CG1-CG1 3.65Å
393	K	95.3	Very high	90.7	Very high	82 Å²	82	67.3 Å²	67.3	36%	0.357	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	153.7	173.3	-55.9	175.8	-162.4	160.3	0	109.3	F382 L422 D426	F382-K393 WeakPolarHBondContact O-CA 3.29Å; K393-L422 HydrophobicContact CB-CB 4.38Å; K393-L422 PolarHBondContact N-O 2.84Å; K393-L422 PolarHBondContact O-N 2.76Å; K393-D426 WeakPolarHBondContact CD-OD1 3.43Å; K393-D426 WeakPolarHBondContact CE-OD1 3.29Å; K393-D426 IonicContact NZ-OD1 2.92Å; K393-D426 PolarHBondContact NZ-OD1 2.9Å; K393-D426 IonicContact NZ-OD2 3.29Å; K393-D426 PolarHBondContact NZ-OD2 2.93Å
394	C	98.1	Very high	90.5	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.8	161.7	177.5	0	0	0	0	109	M256 F382 Q420 V421	M256-C394 HydrophobicContact CG-CB 3.52Å; M256-C394 HydrophobicContact SD-CB 3.89Å; F382-C394 HydrophobicContact CB-CB 3.98Å; F382-C394 HydrophobicContact CD2-CB 4.02Å; F382-C394 HydrophobicContact CG-CB 4.28Å; F382-C394 PolarHBondContact N-O 3.21Å; F382-C394 PolarHBondContact O-N 3.18Å; C394-Q420 WeakPolarHBondContact CA-O 3.18Å; C394-Q420 PolarHBondContact SG-O 2.83Å; C394-V421 HydrophobicContact CB-CG2 4.2Å
395	K	98.1	Very high	90.3	Very high	85 Å²	85	78.8 Å²	78.8	37%	0.37	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	116.4	172	-76.9	171.2	160.1	-96.2	0	107.5	E379 V381 G419 Q420 L422	E379-K395 IonicContact OE1-NZ 2.87Å; E379-K395 PolarHBondContact OE1-NZ 2.84Å; E379-K395 WeakPolarHBondContact OE2-CD 3.45Å; E379-K395 IonicContact OE2-NZ 3.21Å; E379-K395 PolarHBondContact OE2-NZ 2.67Å; V381-K395 HydrophobicContact CG2-CG 4.49Å; K395-G419 CarbonylContact O-C 3.46Å; K395-G419 WeakPolarHBondContact O-CA 3.19Å; K395-Q420 PolarHBondContact N-O 2.78Å; K395-Q420 PolarHBondContact O-N 3.02Å; K395-L422 HydrophobicContact CD-CD1 4.41Å
396	L	98.1	Very high	90.3	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.5	171.1	-63.7	-170.2	0	0	0	109.5	A260 V264 E379 M380 F382 I432	A260-L396 HydrophobicContact CB-CD1 3.79Å; A260-L396 HydrophobicContact CB-CG 4.25Å; V264-L396 HydrophobicContact CG2-CD1 3.61Å; E379-L396 WeakPolarHBondContact CA-O 3.21Å; M380-L396 HydrophobicContact CB-CB 4.46Å; M380-L396 PolarHBondContact N-O 3.07Å; M380-L396 PolarHBondContact O-N 3.1Å; F382-L396 HydrophobicContact CE2-CB 4.21Å; F382-L396 HydrophobicContact CE2-CD1 4Å; F382-L396 HydrophobicContact CE2-CG 3.87Å; F382-L396 HydrophobicContact CZ-CD1 4.31Å; L396-I432 HydrophobicContact CD2-CB 3.77Å; L396-I432 HydrophobicContact CD2-CD1 3.92Å; L396-I432 HydrophobicContact CD2-CG1 4.41Å; L396-I432 HydrophobicContact CD2-CG2 3.86Å
397	Q	98.4	Very high	90.6	Very high	65 Å²	65	77.9 Å²	77.9	30%	0.304	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	115	168.2	-176.7	64.8	51	0	0	108.8	G378 K399 I417 W418	G378-Q397 VanDerWaalsContact C-NE2 3.29Å; G378-Q397 PolarHBondContact O-NE2 3.36Å; Q397-K399 HydrophobicContact CG-CG 4.08Å; Q397-K399 PolarHBondContact O-N 2.88Å; Q397-I417 WeakPolarHBondContact O-CA 3.46Å; Q397-W418 PolarHBondContact N-O 2.97Å; Q397-W418 PolarHBondContact O-N 3.38Å
398	L	98.2	Very high	91.3	Very high	1 Å²	1	75.5 Å²	75.5	1%	0.005	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	112.3	158	-74.6	74.6	0	0	0	106	V264 Y267 A360 H376 Y377 G378 M380 I417	V264-L398 HydrophobicContact CG2-CD1 4.36Å; Y267-L398 HydrophobicContact CD2-CD2 4Å; Y267-L398 HydrophobicContact CE2-CD2 3.98Å; Y267-L398 HydrophobicContact CG-CD2 4.49Å; A360-L398 HydrophobicContact CB-CD1 4.23Å; A360-L398 HydrophobicContact CB-CD2 3.84Å; A360-L398 HydrophobicContact CB-CG 4.43Å; H376-L398 HydrophobicContact CB-CD2 3.71Å; H376-L398 WeakPolarHBondContact O-CB 3.36Å; Y377-L398 WeakPolarHBondContact CA-O 3.48Å; G378-L398 PolarHBondContact N-O 3.22Å; G378-L398 PolarHBondContact O-N 3.16Å; M380-L398 HydrophobicContact CG-CD1 4.05Å; M380-L398 HydrophobicContact SD-CD1 3.62Å; L398-I417 HydrophobicContact CD1-CD1 4.32Å; L398-I417 HydrophobicContact CD2-CD1 4.33Å; L398-I417 HydrophobicContact CG-CD1 3.8Å; L398-I417 HydrophobicContact CG-CG1 4.04Å
399	K	97.1	Very high	92.1	Very high	64 Å²	64	73.2 Å²	73.2	28%	0.278	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-76.9	136.8	-175.3	-66.5	-178.6	-179.5	177.3	0	109.5	Q397 E416	Q397-K399 HydrophobicContact CG-CG 4.08Å; Q397-K399 PolarHBondContact O-N 2.88Å; K399-E416 HydrophobicContact CB-CB 4.44Å; K399-E416 WeakPolarHBondContact CB-O 3.48Å; K399-E416 HydrophobicContact CD-CB 4.23Å; K399-E416 HydrophobicContact CD-CG 4.18Å; K399-E416 WeakPolarHBondContact CD-OE2 3.38Å; K399-E416 PolarHBondContact N-O 2.93Å; K399-E416 VanDerWaalsContact NZ-CD 3.34Å; K399-E416 IonicContact NZ-OE1 3.47Å; K399-E416 PolarHBondContact NZ-OE1 3.3Å; K399-E416 IonicContact NZ-OE2 2.68Å
400	P	96.2	Very high	92.8	Very high	66 Å²	66	77 Å²	77	43%	0.429	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-54.4	149.1	165.9	-22.2	32.6	0	0	0	111	E375 Y377	E375-P400 WeakPolarHBondContact OE1-CA 3.48Å; E375-P400 WeakPolarHBondContact OE1-CB 3.42Å; Y377-P400 HydrophobicContact CG-CG 4.39Å
401	D	94.6	Very high	93.1	Very high	32 Å²	32	75.8 Å²	75.8	17%	0.171	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-64.8	136.4	177.5	-76.9	2.5	0	0	0	109.9	Y373 E375 R414 G415	Y373-D401 VanDerWaalsContact CE2-OD2 3.29Å; Y373-D401 WeakPolarHBondContact CE2-OD2 3.42Å; E375-D401 HydrophobicContact CG-CB 4.23Å; E375-D401 PolarHBondContact OE1-N 2.84Å; D401-R414 HydrophobicContact CB-CG 4.26Å; D401-R414 WeakPolarHBondContact OD1-CA 3.33Å; D401-R414 WeakPolarHBondContact OD1-CB 3.44Å; D401-R414 WeakPolarHBondContact OD2-CB 3.39Å; D401-R414 WeakPolarHBondContact OD2-CD 3.42Å; D401-R414 WeakPolarHBondContact OD2-CG 3.28Å; D401-R414 IonicContact OD2-NE 3.12Å; D401-G415 PolarHBondContact OD1-N 3.06Å
402	Y	94.2	Very high	93.5	Very high	95 Å²	95	74.2 Å²	74.2	37%	0.373	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	163.5	-176.2	70.9	-84.1	0	0	0	112	K404 V413 E416	Y402-K404 HydrophobicContact CE2-CB 4.11Å; Y402-V413 HydrophobicContact CD1-CB 4.14Å; Y402-V413 HydrophobicContact CD1-CG1 4.4Å; Y402-V413 HydrophobicContact CD2-CB 4.45Å; Y402-V413 HydrophobicContact CE1-CB 3.73Å; Y402-V413 HydrophobicContact CE1-CG1 3.62Å; Y402-V413 HydrophobicContact CE1-CG2 4.49Å; Y402-V413 HydrophobicContact CE2-CB 4.08Å; Y402-V413 HydrophobicContact CE2-CG2 4.03Å; Y402-V413 HydrophobicContact CG-CB 4.48Å; Y402-V413 PolarHBondContact N-O 3.05Å; Y402-V413 VanDerWaalsContact N-O 3.08Å; Y402-V413 PolarHBondContact O-N 3.36Å; Y402-E416 WeakPolarHBondContact CE1-OE2 3.42Å; Y402-E416 PolarHBondContact OH-OE2 2.9Å; Y402-E416 VanDerWaalsContact OH-OE2 3.05Å
403	Y	93.8	Very high	93.6	Very high	156 Å²	156	75.8 Å²	75.8	61%	0.612	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.9	174.6	-67.4	-88.7	0	0	0	110.1	N410 I411 A412	Y403-N410 HydrophobicContact CD1-CB 4.29Å; Y403-I411 WeakPolarHBondContact CA-O 3.4Å; Y403-A412 HydrophobicContact CD1-CB 4.14Å; Y403-A412 HydrophobicContact CE1-CB 3.78Å
404	K	92.4	Very high	93.6	Very high	100 Å²	100	76.6 Å²	76.6	44%	0.435	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130.7	172	-177	-171.6	167	-138.8	0	108.4	Y402 E406 I411 V413	Y402-K404 HydrophobicContact CE2-CB 4.11Å; K404-E406 IonicContact NZ-OE2 3.36Å; K404-E406 PolarHBondContact NZ-OE2 2.77Å; K404-E406 PolarHBondContact O-N 2.67Å; K404-I411 PolarHBondContact N-O 3.07Å; K404-I411 PolarHBondContact O-N 3.08Å; K404-V413 HydrophobicContact CB-CG2 3.74Å; K404-V413 HydrophobicContact CD-CG2 4.43Å
405	R	91.2	Very high	93.5	Very high	191 Å²	191	76.6 Å²	76.6	72%	0.721	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	126.4	172.5	-172.2	177.2	-177.7	170.7	5.1	109.9	G407	R405-G407 PolarHBondContact NE-O 3.06Å
406	E	86.7	Confident	93.5	Very high	104 Å²	104	75 Å²	75	49%	0.486	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	95.5	176.9	-162.2	147.9	144.8	0	0	108.5	K404 D409 I411	K404-E406 IonicContact NZ-OE2 3.36Å; K404-E406 PolarHBondContact NZ-OE2 2.77Å; K404-E406 PolarHBondContact O-N 2.67Å; E406-D409 PolarHBondContact N-O 2.95Å; E406-D409 PolarHBondContact O-N 2.9Å; E406-I411 HydrophobicContact CB-CD1 3.67Å; E406-I411 HydrophobicContact CB-CG1 4.12Å; E406-I411 HydrophobicContact CG-CD1 4.11Å
407	G	88.8	Confident	93.5	Very high	56 Å²	56	75 Å²	75	58%	0.577	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	-129.3	-170.4	0	0	0	0	0	112.6	R405 D409	R405-G407 PolarHBondContact NE-O 3.06Å; G407-D409 VanDerWaalsContact C-N 3.34Å
408	P	89.6	Confident	93.5	Very high	114 Å²	114	76.5 Å²	76.5	74%	0.74	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-23.8	176.1	32.6	-33.5	0	0	0	112.7
409	D	89	Confident	93.5	Very high	110 Å²	110	76.4 Å²	76.4	59%	0.588	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	158.6	-169.2	-62.8	-50	0	0	0	113.3	E406 G407	E406-D409 PolarHBondContact N-O 2.95Å; E406-D409 PolarHBondContact O-N 2.9Å; G407-D409 VanDerWaalsContact C-N 3.34Å
410	N	89.2	Confident	93.6	Very high	111 Å²	111	76.1 Å²	76.1	59%	0.594	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	110.3	171.4	-75.3	-43.2	0	0	0	109.2	Y403	Y403-N410 HydrophobicContact CD1-CB 4.29Å
411	I	91.9	Very high	93.7	Very high	82 Å²	82	73 Å²	73	42%	0.421	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.5	-179.9	-57.9	-177.2	0	0	0	109.2	Y403 K404 E406 V413	Y403-I411 WeakPolarHBondContact CA-O 3.4Å; K404-I411 PolarHBondContact N-O 3.07Å; K404-I411 PolarHBondContact O-N 3.08Å; E406-I411 HydrophobicContact CB-CD1 3.67Å; E406-I411 HydrophobicContact CB-CG1 4.12Å; E406-I411 HydrophobicContact CG-CD1 4.11Å; I411-V413 PolarHBondContact O-N 3.15Å
412	A	91.9	Very high	93.8	Very high	42 Å²	42	72.3 Å²	72.3	35%	0.347	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	115.3	173.4	0	0	0	0	0	110.3	Y403 R414	Y403-A412 HydrophobicContact CD1-CB 4.14Å; Y403-A412 HydrophobicContact CE1-CB 3.78Å; A412-R414 HydrophobicContact CB-CG 4.39Å
413	V	93.6	Very high	93.7	Very high	35 Å²	35	68.7 Å²	68.7	21%	0.212	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	120.5	169	-176.6	0	0	0	0	107.4	Y402 K404 I411 E416	Y402-V413 HydrophobicContact CD1-CB 4.14Å; Y402-V413 HydrophobicContact CD1-CG1 4.4Å; Y402-V413 HydrophobicContact CD2-CB 4.45Å; Y402-V413 HydrophobicContact CE1-CB 3.73Å; Y402-V413 HydrophobicContact CE1-CG1 3.62Å; Y402-V413 HydrophobicContact CE1-CG2 4.49Å; Y402-V413 HydrophobicContact CE2-CB 4.08Å; Y402-V413 HydrophobicContact CE2-CG2 4.03Å; Y402-V413 HydrophobicContact CG-CB 4.48Å; Y402-V413 PolarHBondContact N-O 3.05Å; Y402-V413 VanDerWaalsContact N-O 3.08Å; Y402-V413 PolarHBondContact O-N 3.36Å; K404-V413 HydrophobicContact CB-CG2 3.74Å; K404-V413 HydrophobicContact CD-CG2 4.43Å; I411-V413 PolarHBondContact O-N 3.15Å; V413-E416 HydrophobicContact CG1-CB 4.4Å
414	R	94.8	Very high	93.4	Very high	99 Å²	99	65.3 Å²	65.3	37%	0.374	33%	0.332	S	S	.	.			trans	-126.5	141.1	-174.3	-58.4	-163.5	173.2	168.8	1.5	113	Y373 D401 A412 E416 N435	Y373-R414 VanDerWaalsContact CG-NH1 3.3Å; D401-R414 HydrophobicContact CB-CG 4.26Å; D401-R414 WeakPolarHBondContact OD1-CA 3.33Å; D401-R414 WeakPolarHBondContact OD1-CB 3.44Å; D401-R414 WeakPolarHBondContact OD2-CB 3.39Å; D401-R414 WeakPolarHBondContact OD2-CD 3.42Å; D401-R414 WeakPolarHBondContact OD2-CG 3.28Å; D401-R414 IonicContact OD2-NE 3.12Å; A412-R414 HydrophobicContact CB-CG 4.39Å; R414-E416 VanDerWaalsContact C-N 3.28Å; R414-E416 PolarHBondContact O-N 2.95Å; R414-N435 PolarHBondContact O-ND2 2.88Å
415	G	96.3	Very high	93.4	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.01	34%	0.34	C	S	.	.	S	Bend	trans	66.1	22.3	171.6	0	0	0	0	0	116.4	D401 N435 W436	D401-G415 PolarHBondContact OD1-N 3.06Å; G415-N435 VanDerWaalsContact O-CA 3.3Å; G415-N435 WeakPolarHBondContact O-CA 3.17Å; G415-N435 VanDerWaalsContact O-CG 3.26Å; G415-N435 PolarHBondContact O-OD1 2.83Å; G415-W436 VanDerWaalsContact CA-CD1 3.43Å; G415-W436 VanDerWaalsContact O-CD1 3.26Å; G415-W436 PolarHBondContact O-N 2.93Å
416	E	97.8	Very high	93.4	Very high	50 Å²	50	60.2 Å²	60.2	23%	0.234	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	138.4	176.5	-165.9	-163.2	153.4	0	0	111.4	K399 Y402 V413 R414	K399-E416 HydrophobicContact CB-CB 4.44Å; K399-E416 WeakPolarHBondContact CB-O 3.48Å; K399-E416 HydrophobicContact CD-CB 4.23Å; K399-E416 HydrophobicContact CD-CG 4.18Å; K399-E416 WeakPolarHBondContact CD-OE2 3.38Å; K399-E416 PolarHBondContact N-O 2.93Å; K399-E416 VanDerWaalsContact NZ-CD 3.34Å; K399-E416 IonicContact NZ-OE1 3.47Å; K399-E416 PolarHBondContact NZ-OE1 3.3Å; K399-E416 IonicContact NZ-OE2 2.68Å; Y402-E416 WeakPolarHBondContact CE1-OE2 3.42Å; Y402-E416 PolarHBondContact OH-OE2 2.9Å; Y402-E416 VanDerWaalsContact OH-OE2 3.05Å; V413-E416 HydrophobicContact CG1-CB 4.4Å; R414-E416 VanDerWaalsContact C-N 3.28Å; R414-E416 PolarHBondContact O-N 2.95Å
417	I	98.3	Very high	93.8	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.4	178.1	-62.9	-174.5	0	0	0	109.7	V264 Q397 L398 T433 G434 W436 L440	V264-I417 HydrophobicContact CG1-CD1 3.31Å; V264-I417 HydrophobicContact CG2-CD1 4.43Å; Q397-I417 WeakPolarHBondContact O-CA 3.46Å; L398-I417 HydrophobicContact CD1-CD1 4.32Å; L398-I417 HydrophobicContact CD2-CD1 4.33Å; L398-I417 HydrophobicContact CG-CD1 3.8Å; L398-I417 HydrophobicContact CG-CG1 4.04Å; I417-T433 CarbonylContact O-C 3.49Å; I417-T433 WeakPolarHBondContact O-CA 3.27Å; I417-G434 PolarHBondContact N-O 2.78Å; I417-G434 PolarHBondContact O-N 2.84Å; I417-W436 HydrophobicContact CD1-CB 3.85Å; I417-L440 HydrophobicContact CB-CD2 4.06Å; I417-L440 HydrophobicContact CD1-CD2 4.28Å; I417-L440 HydrophobicContact CG2-CD2 4.12Å
418	W	98.4	Very high	94.2	Very high	96 Å²	96	61.6 Å²	61.6	36%	0.364	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	142.6	170.1	179.9	91.4	0	0	0	109.6	Q397 Q420 E431 I432	Q397-W418 PolarHBondContact N-O 2.97Å; Q397-W418 PolarHBondContact O-N 3.38Å; W418-Q420 VanDerWaalsContact CH2-CD 3.48Å; W418-Q420 HydrophobicContact CH2-CG 3.73Å; W418-Q420 HydrophobicContact CZ2-CG 3.72Å; W418-Q420 HydrophobicContact CZ3-CG 4.46Å; W418-E431 PolarHBondContact NE1-OE1 3.47Å; W418-I432 CarbonylContact C-O 3.59Å; W418-I432 WeakPolarHBondContact CA-O 3.42Å
419	G	98.3	Very high	94.6	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.6	178.7	175.8	0	0	0	0	0	113.3	K395 I432	K395-G419 CarbonylContact O-C 3.46Å; K395-G419 WeakPolarHBondContact O-CA 3.19Å; G419-I432 PolarHBondContact N-O 3.18Å; G419-I432 PolarHBondContact O-N 2.87Å
420	Q	98.4	Very high	95	Very high	58 Å²	58	54.5 Å²	54.5	27%	0.271	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	141.8	-173.3	-66.2	-178.7	-32.1	0	0	111.9	C394 K395 W418 L422 A428 L430	C394-Q420 WeakPolarHBondContact CA-O 3.18Å; C394-Q420 PolarHBondContact SG-O 2.83Å; K395-Q420 PolarHBondContact N-O 2.78Å; K395-Q420 PolarHBondContact O-N 3.02Å; W418-Q420 VanDerWaalsContact CH2-CD 3.48Å; W418-Q420 HydrophobicContact CH2-CG 3.73Å; W418-Q420 HydrophobicContact CZ2-CG 3.72Å; W418-Q420 HydrophobicContact CZ3-CG 4.46Å; Q420-L422 HydrophobicContact CB-CD2 3.99Å; Q420-A428 HydrophobicContact CB-CB 4.18Å; Q420-A428 HydrophobicContact CG-CB 4.23Å; Q420-L430 CarbonylContact C-O 3.57Å; Q420-L430 VanDerWaalsContact CA-O 3.27Å; Q420-L430 WeakPolarHBondContact CA-O 3.27Å
421	V	98.3	Very high	95.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	127.8	164.9	-174.2	0	0	0	0	108.3	F253 M256 A257 V392 C394 V429 L430 I432	F253-V421 HydrophobicContact CB-CG1 4.13Å; F253-V421 HydrophobicContact CD1-CG1 3.9Å; M256-V421 HydrophobicContact CB-CG1 4.02Å; M256-V421 HydrophobicContact CG-CG1 3.94Å; M256-V421 HydrophobicContact CG-CG2 4.33Å; A257-V421 HydrophobicContact CB-CG2 4.08Å; V392-V421 HydrophobicContact CG1-CG1 3.65Å; C394-V421 HydrophobicContact CB-CG2 4.2Å; V421-V429 PolarHBondContact O-N 2.87Å; V421-L430 HydrophobicContact CB-CB 4.04Å; V421-L430 HydrophobicContact CB-CD1 4.44Å; V421-L430 HydrophobicContact CB-CG 4.47Å; V421-L430 HydrophobicContact CG2-CB 4.11Å; V421-L430 HydrophobicContact CG2-CD1 4.27Å; V421-L430 PolarHBondContact N-O 3.22Å; V421-L430 PolarHBondContact O-N 3.27Å; V421-I432 HydrophobicContact CG2-CD1 3.96Å
422	L	96.1	Very high	95.8	Very high	17 Å²	17	48.9 Å²	48.9	9%	0.089	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	144.8	-174.3	-48	178.9	0	0	0	110.8	K393 K395 Q420 K427 A428	K393-L422 HydrophobicContact CB-CB 4.38Å; K393-L422 PolarHBondContact N-O 2.84Å; K393-L422 PolarHBondContact O-N 2.76Å; K395-L422 HydrophobicContact CD-CD1 4.41Å; Q420-L422 HydrophobicContact CB-CD2 3.99Å; L422-K427 WeakPolarHBondContact CA-O 3.31Å; L422-A428 HydrophobicContact CD2-CB 4.1Å
423	N	92.3	Very high	96.1	Very high	19 Å²	19	48.6 Å²	48.6	10%	0.102	24%	0.244	C	C	.	.			trans	-81.9	-178.4	170.8	79.2	-27.6	0	0	0	113	F253 T425 D426 K427 V429	F253-N423 HydrophobicContact CE1-CB 3.84Å; F253-N423 HydrophobicContact CZ-CB 3.78Å; N423-T425 VanDerWaalsContact CG-OG1 3.3Å; N423-T425 PolarHBondContact ND2-OG1 2.79Å; N423-T425 PolarHBondContact O-N 3.32Å; N423-T425 VanDerWaalsContact O-N 3.08Å; N423-T425 PolarHBondContact OD1-N 3.42Å; N423-T425 VanDerWaalsContact OD1-N 3.16Å; N423-T425 PolarHBondContact OD1-OG1 3.21Å; N423-D426 PolarHBondContact O-N 3.13Å; N423-D426 PolarHBondContact OD1-N 2.68Å; N423-K427 PolarHBondContact N-O 2.84Å; N423-K427 WeakPolarHBondContact OD1-CA 3.23Å; N423-K427 WeakPolarHBondContact OD1-CB 3.32Å; N423-K427 PolarHBondContact OD1-N 2.82Å; N423-K427 PolarHBondContact OD1-O 3.15Å; N423-V429 HydrophobicContact CB-CG2 3.92Å
424	E	88.6	Confident	96.3	Very high	86 Å²	86	48 Å²	48	40%	0.402	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-18.6	175.5	60.9	-68.7	139.7	0	0	114.8	R252	R252-E424 IonicContact CZ-OE2 3.69Å; R252-E424 VanDerWaalsContact CZ-OE2 3.29Å; R252-E424 IonicContact NH1-OE2 3.33Å; R252-E424 PolarHBondContact NH1-OE2 3.17Å; R252-E424 IonicContact NH2-OE1 3.71Å; R252-E424 IonicContact NH2-OE2 3.36Å; R252-E424 PolarHBondContact NH2-OE2 2.79Å
425	T	91.1	Very high	96.4	Very high	98 Å²	98	44.8 Å²	44.8	60%	0.601	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.5	15.9	174.9	68.2	0	0	0	0	113.4	N423 K427	N423-T425 VanDerWaalsContact CG-OG1 3.3Å; N423-T425 PolarHBondContact ND2-OG1 2.79Å; N423-T425 PolarHBondContact O-N 3.32Å; N423-T425 VanDerWaalsContact O-N 3.08Å; N423-T425 PolarHBondContact OD1-N 3.42Å; N423-T425 VanDerWaalsContact OD1-N 3.16Å; N423-T425 PolarHBondContact OD1-OG1 3.21Å; T425-K427 PolarHBondContact O-N 2.87Å; T425-K427 VanDerWaalsContact O-N 3.1Å
426	D	91.4	Very high	96.5	Very high	86 Å²	86	45.2 Å²	45.2	46%	0.46	24%	0.236	S	C	.	.	S	Bend	trans	55.8	21.9	-175.3	-72.8	-48.4	0	0	0	115	K393 N423	K393-D426 WeakPolarHBondContact CD-OD1 3.43Å; K393-D426 WeakPolarHBondContact CE-OD1 3.29Å; K393-D426 IonicContact NZ-OD1 2.92Å; K393-D426 PolarHBondContact NZ-OD1 2.9Å; K393-D426 IonicContact NZ-OD2 3.29Å; K393-D426 PolarHBondContact NZ-OD2 2.93Å; N423-D426 PolarHBondContact O-N 3.13Å; N423-D426 PolarHBondContact OD1-N 2.68Å
427	K	95.3	Very high	96.4	Very high	147 Å²	147	44.5 Å²	44.5	64%	0.639	24%	0.235	S	C	*	.			trans	-86.7	133.6	173.3	-176.8	-176.1	175	-175.5	0	109.9	L422 N423 T425 V429	L422-K427 WeakPolarHBondContact CA-O 3.31Å; N423-K427 PolarHBondContact N-O 2.84Å; N423-K427 WeakPolarHBondContact OD1-CA 3.23Å; N423-K427 WeakPolarHBondContact OD1-CB 3.32Å; N423-K427 PolarHBondContact OD1-N 2.82Å; N423-K427 PolarHBondContact OD1-O 3.15Å; T425-K427 PolarHBondContact O-N 2.87Å; T425-K427 VanDerWaalsContact O-N 3.1Å; K427-V429 PolarHBondContact O-N 2.94Å
428	A	97	Very high	96.3	Very high	41 Å²	41	48 Å²	48	34%	0.339	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	130.8	174.2	0	0	0	0	0	112.1	Q420 L422	Q420-A428 HydrophobicContact CB-CB 4.18Å; Q420-A428 HydrophobicContact CG-CB 4.23Å; L422-A428 HydrophobicContact CD2-CB 4.1Å
429	V	97.6	Very high	96.3	Very high	60 Å²	60	43.4 Å²	43.4	36%	0.364	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	-40.4	177.8	-176.7	0	0	0	0	111.2	F253 V421 N423 K427	F253-V429 HydrophobicContact CB-CG1 4.37Å; F253-V429 HydrophobicContact CD1-CB 4.32Å; F253-V429 HydrophobicContact CD1-CG1 4.46Å; F253-V429 HydrophobicContact CD1-CG2 4.31Å; F253-V429 HydrophobicContact CD2-CB 4.45Å; F253-V429 HydrophobicContact CD2-CG1 3.75Å; F253-V429 HydrophobicContact CE1-CG2 4.01Å; F253-V429 HydrophobicContact CE2-CG1 4.05Å; F253-V429 HydrophobicContact CE2-CG2 4.28Å; F253-V429 HydrophobicContact CG-CB 4.28Å; F253-V429 HydrophobicContact CG-CG1 3.95Å; F253-V429 HydrophobicContact CZ-CG2 3.96Å; V421-V429 PolarHBondContact O-N 2.87Å; N423-V429 HydrophobicContact CB-CG2 3.92Å; K427-V429 PolarHBondContact O-N 2.94Å
430	L	98.4	Very high	96.3	Very high	16 Å²	16	43.4 Å²	43.4	8%	0.084	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	142.1	175.3	-54	173.8	0	0	0	109.6	F253 M254 A257 Q420 V421 I442 N443	F253-L430 VanDerWaalsContact C-CD1 3.48Å; F253-L430 HydrophobicContact CB-CD1 3.75Å; F253-L430 HydrophobicContact CB-CG 4.17Å; M254-L430 HydrophobicContact CG-CD1 4.26Å; M254-L430 HydrophobicContact SD-CD1 3.73Å; M254-L430 HydrophobicContact SD-CD2 4.36Å; A257-L430 HydrophobicContact CB-CD1 4.07Å; Q420-L430 CarbonylContact C-O 3.57Å; Q420-L430 VanDerWaalsContact CA-O 3.27Å; Q420-L430 WeakPolarHBondContact CA-O 3.27Å; V421-L430 HydrophobicContact CB-CB 4.04Å; V421-L430 HydrophobicContact CB-CD1 4.44Å; V421-L430 HydrophobicContact CB-CG 4.47Å; V421-L430 HydrophobicContact CG2-CB 4.11Å; V421-L430 HydrophobicContact CG2-CD1 4.27Å; V421-L430 PolarHBondContact N-O 3.22Å; V421-L430 PolarHBondContact O-N 3.27Å; L430-I442 HydrophobicContact CB-CG2 4.17Å; L430-I442 HydrophobicContact CD1-CG2 4.1Å; L430-I442 HydrophobicContact CD2-CG2 4.28Å; L430-I442 HydrophobicContact CG-CG2 4.43Å; L430-N443 WeakPolarHBondContact CD2-ND2 3.47Å
431	E	98.6	Very high	96.3	Very high	75 Å²	75	43.9 Å²	43.9	35%	0.35	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	138.2	166.4	-169.7	-178.2	-119.3	0	0	109.7	W418 T433 I442 N443	W418-E431 PolarHBondContact NE1-OE1 3.47Å; E431-T433 HydrophobicContact CG-CG2 3.91Å; E431-I442 CarbonylContact O-C 3.45Å; E431-I442 WeakPolarHBondContact O-CA 3.36Å; E431-N443 PolarHBondContact N-OD1 2.57Å; E431-N443 PolarHBondContact O-N 2.78Å
432	I	98.7	Very high	96.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122.9	173.1	-62.5	170.4	0	0	0	108	A257 A260 I261 L396 W418 G419 V421 F441 I442	A257-I432 HydrophobicContact CB-CD1 3.9Å; A260-I432 HydrophobicContact CB-CD1 4.29Å; I261-I432 HydrophobicContact CD1-CG2 4.42Å; I261-I432 HydrophobicContact CG1-CG2 4.23Å; L396-I432 HydrophobicContact CD2-CB 3.77Å; L396-I432 HydrophobicContact CD2-CD1 3.92Å; L396-I432 HydrophobicContact CD2-CG1 4.41Å; L396-I432 HydrophobicContact CD2-CG2 3.86Å; W418-I432 CarbonylContact C-O 3.59Å; W418-I432 WeakPolarHBondContact CA-O 3.42Å; G419-I432 PolarHBondContact N-O 3.18Å; G419-I432 PolarHBondContact O-N 2.87Å; V421-I432 HydrophobicContact CG2-CD1 3.96Å; I432-F441 VanDerWaalsContact CA-O 3.31Å; I432-F441 WeakPolarHBondContact CA-O 3.39Å; I432-I442 HydrophobicContact CG1-CG1 4.44Å
433	T	98.6	Very high	96.4	Very high	36 Å²	36	48 Å²	48	22%	0.221	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	160.8	-178.9	51.6	0	0	0	0	111.7	I417 E431 L440 F441	I417-T433 CarbonylContact O-C 3.49Å; I417-T433 WeakPolarHBondContact O-CA 3.27Å; E431-T433 HydrophobicContact CG-CG2 3.91Å; T433-L440 WeakPolarHBondContact O-CA 3.43Å; T433-F441 PolarHBondContact N-O 3.48Å; T433-F441 PolarHBondContact O-N 3.35Å
434	G	98.2	Very high	96.7	Very high	21 Å²	21	49.7 Å²	49.7	22%	0.216	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	140.9	-142.7	167.7	0	0	0	0	0	112.8	I417 G439	I417-G434 PolarHBondContact N-O 2.78Å; I417-G434 PolarHBondContact O-N 2.84Å; G434-G439 WeakPolarHBondContact CA-O 3.38Å
435	N	97.8	Very high	97.1	Very high	33 Å²	33	50.6 Å²	50.6	18%	0.176	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	131.4	-174.5	-171.1	-52.9	0	0	0	110.5	R414 G415 T437 S438 G439	R414-N435 PolarHBondContact O-ND2 2.88Å; G415-N435 VanDerWaalsContact O-CA 3.3Å; G415-N435 WeakPolarHBondContact O-CA 3.17Å; G415-N435 VanDerWaalsContact O-CG 3.26Å; G415-N435 PolarHBondContact O-OD1 2.83Å; N435-T437 PolarHBondContact O-N 3.46Å; N435-T437 VanDerWaalsContact O-N 3.09Å; N435-T437 WeakPolarHBondContact OD1-CB 3.44Å; N435-T437 PolarHBondContact OD1-N 3.34Å; N435-T437 PolarHBondContact OD1-OG1 3.02Å; N435-S438 PolarHBondContact O-N 3.11Å; N435-S438 VanDerWaalsContact O-N 3.14Å; N435-G439 PolarHBondContact N-O 3.07Å; N435-G439 CarbonylContact O-C 3.57Å; N435-G439 PolarHBondContact O-N 3.03Å; N435-G439 VanDerWaalsContact O-O 3.05Å
436	W	97.1	Very high	97.5	Very high	9 Å²	9	48.3 Å²	48.3	3%	0.034	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.6	-177.9	64.6	-96.8	0	0	0	113.9	V264 Y267 Q271 H376 G415 I417 W448	V264-W436 HydrophobicContact CG1-CB 4.1Å; Y267-W436 VanDerWaalsContact O-CZ3 3.24Å; Y267-W436 WeakPolarHBondContact O-CZ3 3.26Å; Q271-W436 HydrophobicContact CB-CH2 4.15Å; Q271-W436 HydrophobicContact CB-CZ3 3.84Å; Q271-W436 HydrophobicContact CG-CH2 4.33Å; Q271-W436 HydrophobicContact CG-CZ3 4.35Å; H376-W436 AromaticContact CD2-CE2 3.71Å; H376-W436 AromaticContact CD2-CH2 3.85Å; H376-W436 AromaticContact CD2-CZ2 3.65Å; G415-W436 VanDerWaalsContact CA-CD1 3.43Å; G415-W436 VanDerWaalsContact O-CD1 3.26Å; G415-W436 PolarHBondContact O-N 2.93Å; I417-W436 HydrophobicContact CD1-CB 3.85Å; W436-W448 WeakPolarHBondContact O-CH2 3.49Å
437	T	95.9	Very high	97.8	Very high	35 Å²	35	44.9 Å²	44.9	22%	0.215	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-23.6	175.7	67.3	0	0	0	0	114	K268 Q271 N435	K268-T437 PolarHBondContact NZ-O 3.1Å; Q271-T437 HydrophobicContact CG-CG2 4.33Å; N435-T437 PolarHBondContact O-N 3.46Å; N435-T437 VanDerWaalsContact O-N 3.09Å; N435-T437 WeakPolarHBondContact OD1-CB 3.44Å; N435-T437 PolarHBondContact OD1-N 3.34Å; N435-T437 PolarHBondContact OD1-OG1 3.02Å
438	S	96.7	Very high	97.9	Very high	74 Å²	74	38.4 Å²	38.4	52%	0.517	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.4	-21	-166.7	70.4	0	0	0	0	116.3	N435 P450	N435-S438 PolarHBondContact O-N 3.11Å; N435-S438 VanDerWaalsContact O-N 3.14Å; S438-P450 WeakPolarHBondContact O-CD 3.44Å
439	G	98	Very high	98	Very high	1 Å²	1	43 Å²	43	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.5	163.5	174.6	0	0	0	0	0	114.6	G434 N435 W448	G434-G439 WeakPolarHBondContact CA-O 3.38Å; N435-G439 PolarHBondContact N-O 3.07Å; N435-G439 CarbonylContact O-C 3.57Å; N435-G439 PolarHBondContact O-N 3.03Å; N435-G439 VanDerWaalsContact O-O 3.05Å; G439-W448 CarbonylContact C-O 3.51Å; G439-W448 WeakPolarHBondContact CA-O 3.4Å
440	L	98.6	Very high	98	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.9	-178.5	-67.8	167	0	0	0	111.3	I261 V264 I417 T433 A447 W448	I261-L440 HydrophobicContact CB-CD1 4.41Å; I261-L440 HydrophobicContact CD1-CB 4.19Å; I261-L440 HydrophobicContact CG1-CB 4.22Å; I261-L440 HydrophobicContact CG1-CD1 4.17Å; I261-L440 HydrophobicContact CG2-CB 4.35Å; I261-L440 HydrophobicContact CG2-CD1 4.06Å; V264-L440 HydrophobicContact CB-CD1 3.95Å; V264-L440 HydrophobicContact CG1-CD1 3.64Å; I417-L440 HydrophobicContact CB-CD2 4.06Å; I417-L440 HydrophobicContact CD1-CD2 4.28Å; I417-L440 HydrophobicContact CG2-CD2 4.12Å; T433-L440 WeakPolarHBondContact O-CA 3.43Å; L440-A447 PolarHBondContact O-N 2.71Å; L440-W448 HydrophobicContact CB-CE3 4.13Å; L440-W448 HydrophobicContact CD1-CE3 3.86Å; L440-W448 HydrophobicContact CD1-CZ3 4.26Å; L440-W448 HydrophobicContact CG-CE3 3.83Å; L440-W448 HydrophobicContact CG-CZ3 4.22Å; L440-W448 PolarHBondContact N-O 3.18Å; L440-W448 PolarHBondContact O-N 3.43Å; L440-W448 VanDerWaalsContact O-N 3.15Å
441	F	98.7	Very high	97.9	Very high	68 Å²	68	44.5 Å²	44.5	30%	0.298	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	140.8	-170.7	-56.6	-101.4	0	0	0	109.9	I432 T433 G444 V445 C446	I432-F441 VanDerWaalsContact CA-O 3.31Å; I432-F441 WeakPolarHBondContact CA-O 3.39Å; T433-F441 PolarHBondContact N-O 3.48Å; T433-F441 PolarHBondContact O-N 3.35Å; F441-G444 WeakPolarHBondContact CD1-O 3.5Å; F441-V445 CarbonylContact C-O 3.53Å; F441-V445 WeakPolarHBondContact CA-O 3.5Å; F441-C446 HydrophobicContact CD1-CB 3.9Å; F441-C446 HydrophobicContact CE1-CB 3.8Å
442	I	98.6	Very high	97.7	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.051	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	118.9	170.6	-57	167.5	0	0	0	106.8	M254 A257 I261 L430 E431 I432 G444 V445 A447	M254-I442 HydrophobicContact CE-CD1 3.77Å; M254-I442 HydrophobicContact SD-CD1 4.28Å; M254-I442 HydrophobicContact SD-CG2 3.95Å; A257-I442 HydrophobicContact CB-CD1 3.59Å; A257-I442 HydrophobicContact CB-CG1 4.08Å; I261-I442 HydrophobicContact CD1-CD1 3.91Å; I261-I442 HydrophobicContact CD1-CG1 3.68Å; L430-I442 HydrophobicContact CB-CG2 4.17Å; L430-I442 HydrophobicContact CD1-CG2 4.1Å; L430-I442 HydrophobicContact CD2-CG2 4.28Å; L430-I442 HydrophobicContact CG-CG2 4.43Å; E431-I442 CarbonylContact O-C 3.45Å; E431-I442 WeakPolarHBondContact O-CA 3.36Å; I432-I442 HydrophobicContact CG1-CG1 4.44Å; I442-G444 PolarHBondContact O-N 3.26Å; I442-G444 VanDerWaalsContact O-N 3.13Å; I442-V445 PolarHBondContact N-O 3.01Å; I442-V445 WeakPolarHBondContact O-CB 3.48Å; I442-V445 PolarHBondContact O-N 2.93Å; I442-A447 HydrophobicContact CD1-CB 3.64Å; I442-A447 HydrophobicContact CG1-CB 3.75Å
443	N	98.1	Very high	97.5	Very high	94 Å²	94	48.7 Å²	48.7	50%	0.503	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	39.1	-174.4	-65.9	-12.5	0	0	0	113.1	L430 E431 V445	L430-N443 WeakPolarHBondContact CD2-ND2 3.47Å; E431-N443 PolarHBondContact N-OD1 2.57Å; E431-N443 PolarHBondContact O-N 2.78Å; N443-V445 VanDerWaalsContact C-N 3.29Å; N443-V445 PolarHBondContact O-N 3.45Å
444	G	97.4	Very high	97.3	Very high	53 Å²	53	47.5 Å²	47.5	55%	0.546	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	-7	-177.2	0	0	0	0	0	115.9	F441 I442	F441-G444 WeakPolarHBondContact CD1-O 3.5Å; I442-G444 PolarHBondContact O-N 3.26Å; I442-G444 VanDerWaalsContact O-N 3.13Å
445	V	98.2	Very high	97	Very high	105 Å²	105	52.7 Å²	52.7	64%	0.636	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	126.2	175.6	-176.9	0	0	0	0	110.1	F441 I442 N443 A447	F441-V445 CarbonylContact C-O 3.53Å; F441-V445 WeakPolarHBondContact CA-O 3.5Å; I442-V445 PolarHBondContact N-O 3.01Å; I442-V445 WeakPolarHBondContact O-CB 3.48Å; I442-V445 PolarHBondContact O-N 2.93Å; N443-V445 VanDerWaalsContact C-N 3.29Å; N443-V445 PolarHBondContact O-N 3.45Å; V445-A447 PolarHBondContact O-N 3.2Å
446	C	98.1	Very high	96.7	Very high	51 Å²	51	54.2 Å²	54.2	35%	0.345	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	116.2	-179.1	178.2	0	0	0	0	111.9	F441 K449	F441-C446 HydrophobicContact CD1-CB 3.9Å; F441-C446 HydrophobicContact CE1-CB 3.8Å; C446-K449 VanDerWaalsContact SG-CE 3.57Å
447	A	98	Very high	96.6	Very high	14 Å²	14	56 Å²	56	12%	0.116	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-30.3	-177.6	0	0	0	0	0	113.1	I261 L440 I442 V445	I261-A447 HydrophobicContact CD1-CB 3.6Å; L440-A447 PolarHBondContact O-N 2.71Å; I442-A447 HydrophobicContact CD1-CB 3.64Å; I442-A447 HydrophobicContact CG1-CB 3.75Å; V445-A447 PolarHBondContact O-N 3.2Å
448	W	98.6	Very high	96.5	Very high	11 Å²	11	59.3 Å²	59.3	4%	0.042	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	143.1	174	169.7	81.1	0	0	0	111.4	Y239 L242 I261 K268 W436 G439 L440 P450	Y239-W448 AromaticContact CD1-CD1 3.69Å; Y239-W448 AromaticContact CD1-NE1 3.07Å; Y239-W448 AromaticContact CD2-NE1 3.77Å; Y239-W448 HydrophobicContact CE1-CZ2 4.42Å; Y239-W448 AromaticContact CE1-NE1 3.24Å; Y239-W448 HydrophobicContact CE2-CZ2 4.14Å; Y239-W448 AromaticContact CE2-NE1 3.95Å; Y239-W448 AromaticContact CG-NE1 3.36Å; Y239-W448 AromaticContact CZ-NE1 3.72Å; L242-W448 HydrophobicContact CD1-CG 4.37Å; L242-W448 HydrophobicContact CD2-CB 4.46Å; I261-W448 HydrophobicContact CG2-CB 3.37Å; I261-W448 HydrophobicContact CG2-CG 4.05Å; K268-W448 HydrophobicContact CB-CH2 4.05Å; K268-W448 HydrophobicContact CB-CZ2 4.06Å; K268-W448 HydrophobicContact CG-CH2 4.47Å; K268-W448 HydrophobicContact CG-CZ2 4.42Å; W436-W448 WeakPolarHBondContact O-CH2 3.49Å; G439-W448 CarbonylContact C-O 3.51Å; G439-W448 WeakPolarHBondContact CA-O 3.4Å; L440-W448 HydrophobicContact CB-CE3 4.13Å; L440-W448 HydrophobicContact CD1-CE3 3.86Å; L440-W448 HydrophobicContact CD1-CZ3 4.26Å; L440-W448 HydrophobicContact CG-CE3 3.83Å; L440-W448 HydrophobicContact CG-CZ3 4.22Å; L440-W448 PolarHBondContact N-O 3.18Å; L440-W448 PolarHBondContact O-N 3.43Å; L440-W448 VanDerWaalsContact O-N 3.15Å; W448-P450 HydrophobicContact CH2-CB 4.19Å; W448-P450 HydrophobicContact CZ2-CB 3.98Å
449	K	97.9	Very high	96.3	Very high	136 Å²	136	61 Å²	61	59%	0.591	34%	0.337	S	S	*	.			trans	-132.1	148.1	164.5	-74.9	-175.2	178.1	-176.5	0	108.1	C446	C446-K449 VanDerWaalsContact SG-CE 3.57Å
450	P	97.4	Very high	96.1	Very high	30 Å²	30	62.8 Å²	62.8	20%	0.195	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-66.5	154.4	174.1	31.1	-37.7	0	0	0	111.6	K268 S438 W448	K268-P450 HydrophobicContact CD-CB 3.64Å; K268-P450 HydrophobicContact CD-CG 4.3Å; K268-P450 HydrophobicContact CG-CB 3.72Å; S438-P450 WeakPolarHBondContact O-CD 3.44Å; W448-P450 HydrophobicContact CH2-CB 4.19Å; W448-P450 HydrophobicContact CZ2-CB 3.98Å
451	N	96.5	Very high	95.9	Very high	79 Å²	79	63.2 Å²	63.2	42%	0.422	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-65.4	152.7	167.2	-62.1	-41	0	0	0	110.4	E238 Y239	E238-N451 PolarHBondContact OE1-ND2 3.39Å; Y239-N451 VanDerWaalsContact CE1-ND2 3.31Å; Y239-N451 WeakPolarHBondContact CE1-ND2 3.47Å; Y239-N451 PolarHBondContact OH-N 3.35Å; Y239-N451 PolarHBondContact OH-ND2 2.89Å
452	T	94.9	Very high	95.7	Very high	123 Å²	123	60.1 Å²	60.1	76%	0.755	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-65.2	139.5	169.8	-53	0	0	0	0	109.4
453	L	94.9	Very high	95.7	Very high	39 Å²	39	59.8 Å²	59.8	20%	0.204	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-75.8	148	175.7	-69.5	170.4	0	0	0	111.2	H272 Y457 T464	H272-L453 VanDerWaalsContact CD2-CD1 3.46Å; H272-L453 WeakPolarHBondContact CD2-CD1 3.4Å; L453-Y457 HydrophobicContact CB-CD1 3.84Å; L453-Y457 HydrophobicContact CB-CE1 4.49Å; L453-Y457 HydrophobicContact CB-CG 3.93Å; L453-Y457 HydrophobicContact CD1-CD1 4.17Å; L453-Y457 HydrophobicContact CD1-CD2 3.83Å; L453-Y457 HydrophobicContact CD1-CE1 4.23Å; L453-Y457 HydrophobicContact CD1-CE2 3.91Å; L453-Y457 HydrophobicContact CD1-CG 4.01Å; L453-Y457 HydrophobicContact CG-CG 4.44Å; L453-T464 HydrophobicContact CD2-CG2 3.98Å
454	P	94.2	Very high	95.6	Very high	12 Å²	12	55.5 Å²	55.5	8%	0.078	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-54.3	149.2	172.8	-22.9	30.4	0	0	0	112.7	N456 Y457 F463 E465 L468	P454-N456 PolarHBondContact O-N 3.26Å; P454-Y457 WeakPolarHBondContact O-CB 3.44Å; P454-Y457 WeakPolarHBondContact O-CD1 3.2Å; P454-Y457 PolarHBondContact O-N 3.48Å; P454-Y457 VanDerWaalsContact O-N 3.08Å; P454-F463 WeakPolarHBondContact CD-O 3.49Å; P454-E465 HydrophobicContact CG-CG 3.89Å; P454-L468 HydrophobicContact CB-CD1 3.98Å; P454-L468 HydrophobicContact CG-CD1 3.52Å
455	V	92.3	Very high	95.5	Very high	129 Å²	129	57.7 Å²	57.7	78%	0.782	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	127.8	172	-169.6	0	0	0	0	109.1
456	N	91.6	Very high	95.4	Very high	66 Å²	66	53.2 Å²	53.2	35%	0.353	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	30.2	-170.2	-40.7	-101	0	0	0	115.3	P454 E458 K459	P454-N456 PolarHBondContact O-N 3.26Å; N456-E458 PolarHBondContact O-N 2.84Å; N456-K459 HydrophobicContact CB-CB 4.2Å; N456-K459 HydrophobicContact CB-CD 3.84Å; N456-K459 HydrophobicContact CB-CG 4.03Å; N456-K459 WeakPolarHBondContact O-CB 3.41Å; N456-K459 PolarHBondContact O-N 2.83Å; N456-K459 WeakPolarHBondContact OD1-CE 3.43Å; N456-K459 PolarHBondContact OD1-NZ 2.91Å
457	Y	94.3	Very high	95.4	Very high	47 Å²	47	50.8 Å²	50.8	18%	0.184	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-50.7	-30.4	174.7	69.3	-80.5	0	0	0	112.8	H272 L453 P454 K459 Y460 G462	H272-Y457 HydrophobicContact CB-CD2 4.01Å; H272-Y457 HydrophobicContact CB-CE2 3.7Å; H272-Y457 AromaticContact CD2-CE2 3.87Å; H272-Y457 AromaticContact CE1-CE2 3.95Å; H272-Y457 AromaticContact CG-CE2 3.4Å; H272-Y457 VanDerWaalsContact CG-CE2 3.4Å; H272-Y457 AromaticContact ND1-CE2 3.48Å; H272-Y457 WeakPolarHBondContact ND1-CE2 3.31Å; L453-Y457 HydrophobicContact CB-CD1 3.84Å; L453-Y457 HydrophobicContact CB-CE1 4.49Å; L453-Y457 HydrophobicContact CB-CG 3.93Å; L453-Y457 HydrophobicContact CD1-CD1 4.17Å; L453-Y457 HydrophobicContact CD1-CD2 3.83Å; L453-Y457 HydrophobicContact CD1-CE1 4.23Å; L453-Y457 HydrophobicContact CD1-CE2 3.91Å; L453-Y457 HydrophobicContact CD1-CG 4.01Å; L453-Y457 HydrophobicContact CG-CG 4.44Å; P454-Y457 WeakPolarHBondContact O-CB 3.44Å; P454-Y457 WeakPolarHBondContact O-CD1 3.2Å; P454-Y457 PolarHBondContact O-N 3.48Å; P454-Y457 VanDerWaalsContact O-N 3.08Å; Y457-K459 VanDerWaalsContact C-N 3.3Å; Y457-K459 PolarHBondContact O-N 3.12Å; Y457-Y460 CarbonylContact O-C 3.49Å; Y457-Y460 VanDerWaalsContact O-C 3.27Å; Y457-Y460 PolarHBondContact O-N 3.47Å; Y457-G462 WeakPolarHBondContact O-CA 3.4Å; Y457-G462 PolarHBondContact O-N 3.12Å
458	E	92.7	Very high	95.3	Very high	104 Å²	104	50.1 Å²	50.1	49%	0.486	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-62.3	-31.9	175	-52.3	90.6	158.2	0	0	113.4	M195 N456 Y460	M195-E458 WeakPolarHBondContact CE-O 3.28Å; N456-E458 PolarHBondContact O-N 2.84Å; E458-Y460 VanDerWaalsContact C-N 3.26Å
459	K	93.4	Very high	95.2	Very high	109 Å²	109	50.1 Å²	50.1	47%	0.474	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-75.5	-17.4	175.1	-64.1	-176.5	-173.7	157.4	0	112.4	S194 M195 N456 Y457	S194-K459 WeakPolarHBondContact CA-O 3.41Å; M195-K459 WeakPolarHBondContact CB-O 3.39Å; M195-K459 PolarHBondContact N-O 3.36Å; N456-K459 HydrophobicContact CB-CB 4.2Å; N456-K459 HydrophobicContact CB-CD 3.84Å; N456-K459 HydrophobicContact CB-CG 4.03Å; N456-K459 WeakPolarHBondContact O-CB 3.41Å; N456-K459 PolarHBondContact O-N 2.83Å; N456-K459 WeakPolarHBondContact OD1-CE 3.43Å; N456-K459 PolarHBondContact OD1-NZ 2.91Å; Y457-K459 VanDerWaalsContact C-N 3.3Å; Y457-K459 PolarHBondContact O-N 3.12Å
460	Y	94.9	Very high	95.2	Very high	39 Å²	39	43.7 Å²	43.7	15%	0.153	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-120.4	55.1	-176.6	-57.3	-60.2	0	0	0	110.7	V190 L191 Y457 E458 G462 F463 L468	V190-Y460 HydrophobicContact CB-CE1 4.4Å; V190-Y460 HydrophobicContact CB-CE2 4.04Å; V190-Y460 HydrophobicContact CG1-CE2 3.78Å; L191-Y460 HydrophobicContact CB-CD1 3.66Å; L191-Y460 HydrophobicContact CB-CE1 4.01Å; L191-Y460 HydrophobicContact CD1-CD1 4.13Å; L191-Y460 HydrophobicContact CG-CD1 3.87Å; L191-Y460 HydrophobicContact CG-CG 4.34Å; Y457-Y460 CarbonylContact O-C 3.49Å; Y457-Y460 VanDerWaalsContact O-C 3.27Å; Y457-Y460 PolarHBondContact O-N 3.47Å; E458-Y460 VanDerWaalsContact C-N 3.26Å; Y460-G462 PolarHBondContact O-N 3.02Å; Y460-F463 WeakPolarHBondContact O-CB 3.37Å; Y460-F463 VanDerWaalsContact O-CG 3.28Å; Y460-F463 WeakPolarHBondContact O-CG 3.44Å; Y460-F463 PolarHBondContact O-N 2.94Å; Y460-L468 HydrophobicContact CG-CD2 4.44Å
461	Y	94.3	Very high	95.2	Very high	9 Å²	9	42.3 Å²	42.3	4%	0.035	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	6.8	171	-59.3	-96.5	0	0	0	115.7	L191 M195 E225 P226 R273 R276 F463	L191-Y461 HydrophobicContact CD1-CD2 3.58Å; L191-Y461 HydrophobicContact CD1-CE2 3.79Å; M195-Y461 HydrophobicContact CB-CD1 4.26Å; M195-Y461 HydrophobicContact CB-CD2 3.98Å; M195-Y461 HydrophobicContact CB-CE1 4Å; M195-Y461 HydrophobicContact CB-CE2 3.71Å; M195-Y461 HydrophobicContact CB-CG 4.24Å; M195-Y461 HydrophobicContact CG-CD1 3.86Å; M195-Y461 HydrophobicContact CG-CD2 4.47Å; M195-Y461 HydrophobicContact CG-CE1 3.56Å; M195-Y461 HydrophobicContact CG-CE2 4.23Å; M195-Y461 HydrophobicContact CG-CG 4.29Å; M195-Y461 HydrophobicContact SD-CD1 3.73Å; M195-Y461 HydrophobicContact SD-CE1 4.04Å; M195-Y461 HydrophobicContact SD-CG 4.1Å; E225-Y461 HydrophobicContact CB-CD1 3.52Å; E225-Y461 HydrophobicContact CB-CE1 4.22Å; E225-Y461 HydrophobicContact CB-CG 4.05Å; P226-Y461 HydrophobicContact CG-CD2 4.05Å; P226-Y461 HydrophobicContact CG-CE2 3.85Å; R273-Y461 WeakPolarHBondContact CG-O 3.28Å; R276-Y461 HydrophobicContact CG-CD1 3.94Å; R276-Y461 HydrophobicContact CG-CE1 4.47Å; Y461-F463 VanDerWaalsContact CB-CE1 3.48Å; Y461-F463 HydrophobicContact CD2-CE2 4.48Å; Y461-F463 HydrophobicContact CD2-CZ 4.46Å; Y461-F463 HydrophobicContact CG-CE1 4.41Å; Y461-F463 HydrophobicContact CG-CZ 4.19Å
462	G	94.6	Very high	95.1	Very high	3 Å²	3	40.2 Å²	40.2	3%	0.031	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	13.9	-174.4	0	0	0	0	0	114.4	Y457 Y460	Y457-G462 WeakPolarHBondContact O-CA 3.4Å; Y457-G462 PolarHBondContact O-N 3.12Å; Y460-G462 PolarHBondContact O-N 3.02Å
463	F	96.8	Very high	95	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.009	18%	0.179	C	C	.	.			trans	-68.8	147.6	-172.9	-65.9	-10.6	0	0	0	114	L191 E225 P226 L227 P454 Y460 Y461 L468	L191-F463 HydrophobicContact CD1-CD2 4.24Å; L191-F463 HydrophobicContact CD1-CE2 3.99Å; L191-F463 HydrophobicContact CD2-CE2 4.47Å; E225-F463 HydrophobicContact CB-CE1 4.2Å; E225-F463 HydrophobicContact CB-CZ 4.11Å; E225-F463 HydrophobicContact CG-CE1 4.35Å; E225-F463 HydrophobicContact CG-CZ 4.41Å; P226-F463 HydrophobicContact CG-CE2 4.09Å; P226-F463 HydrophobicContact CG-CZ 4.15Å; L227-F463 HydrophobicContact CD1-CD1 4.35Å; L227-F463 HydrophobicContact CD1-CD2 4.45Å; L227-F463 HydrophobicContact CD1-CE1 3.78Å; L227-F463 HydrophobicContact CD1-CE2 3.89Å; L227-F463 HydrophobicContact CD1-CZ 3.52Å; L227-F463 HydrophobicContact CG-CE1 4.38Å; L227-F463 HydrophobicContact CG-CE2 4.07Å; L227-F463 HydrophobicContact CG-CZ 3.7Å; P454-F463 WeakPolarHBondContact CD-O 3.49Å; Y460-F463 WeakPolarHBondContact O-CB 3.37Å; Y460-F463 VanDerWaalsContact O-CG 3.28Å; Y460-F463 WeakPolarHBondContact O-CG 3.44Å; Y460-F463 PolarHBondContact O-N 2.94Å; Y461-F463 VanDerWaalsContact CB-CE1 3.48Å; Y461-F463 HydrophobicContact CD2-CE2 4.48Å; Y461-F463 HydrophobicContact CD2-CZ 4.46Å; Y461-F463 HydrophobicContact CG-CE1 4.41Å; Y461-F463 HydrophobicContact CG-CZ 4.19Å; F463-L468 HydrophobicContact CB-CD2 4.34Å; F463-L468 HydrophobicContact CB-CG 4.03Å; F463-L468 HydrophobicContact CD2-CD2 4.19Å
464	T	96.6	Very high	94.5	Very high	4 Å²	4	35.4 Å²	35.4	3%	0.025	18%	0.179	C	C	.	.			trans	-75.3	170.3	165.8	68.7	0	0	0	0	110.5	E238 L453 F466 G467 L468	E238-T464 VanDerWaalsContact OE2-CB 3.29Å; E238-T464 WeakPolarHBondContact OE2-CB 3.25Å; E238-T464 WeakPolarHBondContact OE2-CG2 3.32Å; E238-T464 PolarHBondContact OE2-OG1 2.72Å; L453-T464 HydrophobicContact CD2-CG2 3.98Å; T464-F466 PolarHBondContact O-N 3.34Å; T464-F466 PolarHBondContact OG1-N 2.92Å; T464-G467 PolarHBondContact O-N 2.88Å; T464-G467 PolarHBondContact OG1-N 3.31Å; T464-L468 WeakPolarHBondContact O-CG 3.43Å; T464-L468 PolarHBondContact O-N 3.49Å
465	E	95.8	Very high	94.2	Very high	99 Å²	99	39.8 Å²	39.8	46%	0.463	21%	0.207	S	C	.	.	H	α-helix	trans	-54.4	-34.6	170.6	-70.3	-174.7	168.7	0	0	112	P454	P454-E465 HydrophobicContact CG-CG 3.89Å
466	F	96.6	Very high	93.7	Very high	11 Å²	11	36.5 Å²	36.5	5%	0.048	19%	0.19	C	C	.	.	H	α-helix	trans	-77.3	-42.5	177	-176.3	-133	0	0	0	112.4	C234 E235 E238 Y289 R291 W296 T464 L468 T469 L470	C234-F466 WeakPolarHBondContact O-CE1 3.35Å; E235-F466 HydrophobicContact CG-CD1 4.38Å; E238-F466 HydrophobicContact CB-CD1 3.64Å; E238-F466 HydrophobicContact CB-CE1 4.29Å; E238-F466 HydrophobicContact CB-CG 4.47Å; E238-F466 HydrophobicContact CG-CB 3.91Å; E238-F466 HydrophobicContact CG-CD1 3.95Å; E238-F466 HydrophobicContact CG-CG 4.31Å; Y289-F466 HydrophobicContact CD1-CE2 4.41Å; Y289-F466 AromaticContact CE1-CE2 3.93Å; Y289-F466 HydrophobicContact CE1-CE2 3.93Å; R291-F466 VanDerWaalsContact NH1-CD2 3.29Å; W296-F466 AromaticContact CH2-CZ 3.89Å; W296-F466 HydrophobicContact CH2-CZ 3.89Å; W296-F466 HydrophobicContact CZ2-CZ 4.19Å; T464-F466 PolarHBondContact O-N 3.34Å; T464-F466 PolarHBondContact OG1-N 2.92Å; F466-L468 PolarHBondContact O-N 2.82Å; F466-T469 PolarHBondContact O-N 3.28Å; F466-T469 PolarHBondContact O-OG1 2.85Å; F466-L470 HydrophobicContact CE1-CD2 4.21Å; F466-L470 HydrophobicContact CE2-CD2 3.95Å; F466-L470 HydrophobicContact CZ-CD2 3.78Å; F466-L470 PolarHBondContact O-N 3.09Å
467	G	96.9	Very high	93.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-55.4	-37.7	173.4	0	0	0	0	0	112.3	T464 T469 L470	T464-G467 PolarHBondContact O-N 2.88Å; T464-G467 PolarHBondContact OG1-N 3.31Å; G467-T469 VanDerWaalsContact C-N 3.29Å; G467-T469 PolarHBondContact O-N 3.01Å; G467-L470 PolarHBondContact O-N 2.92Å
468	L	96.7	Very high	93.3	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-62	-27.2	173.7	-77.1	168.7	0	0	0	114.1	R188 Q189 L191 P454 Y460 F463 T464 F466	R188-L468 PolarHBondContact NE-O 2.87Å; R188-L468 PolarHBondContact NH2-O 3.19Å; Q189-L468 WeakPolarHBondContact O-CD1 3.42Å; L191-L468 HydrophobicContact CD2-CD2 3.77Å; L191-L468 HydrophobicContact CG-CD2 3.76Å; P454-L468 HydrophobicContact CB-CD1 3.98Å; P454-L468 HydrophobicContact CG-CD1 3.52Å; Y460-L468 HydrophobicContact CG-CD2 4.44Å; F463-L468 HydrophobicContact CB-CD2 4.34Å; F463-L468 HydrophobicContact CB-CG 4.03Å; F463-L468 HydrophobicContact CD2-CD2 4.19Å; T464-L468 WeakPolarHBondContact O-CG 3.43Å; T464-L468 PolarHBondContact O-N 3.49Å; F466-L468 PolarHBondContact O-N 2.82Å
469	T	96.1	Very high	93.1	Very high	11 Å²	11	37.2 Å²	37.2	7%	0.067	20%	0.202	C	C	.	.	H	α-helix	trans	-89	-17.2	-178.9	63	0	0	0	0	114	S186 Y289 F466 G467 N471 D472	S186-T469 WeakPolarHBondContact O-CG2 3.17Å; Y289-T469 WeakPolarHBondContact OH-CB 3.47Å; Y289-T469 PolarHBondContact OH-OG1 2.86Å; F466-T469 PolarHBondContact O-N 3.28Å; F466-T469 PolarHBondContact O-OG1 2.85Å; G467-T469 VanDerWaalsContact C-N 3.29Å; G467-T469 PolarHBondContact O-N 3.01Å; T469-N471 PolarHBondContact O-N 2.68Å; T469-D472 WeakPolarHBondContact O-CB 3.32Å; T469-D472 PolarHBondContact O-N 3.48Å
470	L	97.1	Very high	92.8	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-44.8	-168.5	-68.2	174.6	0	0	0	114.2	L227 Q231 C234 E235 Y287 Y289 F466 G467	L227-L470 HydrophobicContact CD1-CD1 4.03Å; L227-L470 HydrophobicContact CD2-CB 3.67Å; L227-L470 HydrophobicContact CD2-CD1 4.35Å; Q231-L470 HydrophobicContact CB-CB 4.41Å; Q231-L470 HydrophobicContact CB-CD1 4.29Å; Q231-L470 HydrophobicContact CG-CB 4.35Å; C234-L470 HydrophobicContact CB-CD2 4.24Å; E235-L470 HydrophobicContact CB-CD1 4.05Å; E235-L470 HydrophobicContact CG-CD1 4.25Å; Y287-L470 WeakPolarHBondContact CE2-O 3.48Å; Y287-L470 VanDerWaalsContact OH-C 3.29Å; Y287-L470 VanDerWaalsContact OH-CA 3.28Å; Y287-L470 WeakPolarHBondContact OH-CA 3.47Å; Y287-L470 WeakPolarHBondContact OH-CB 3.12Å; Y287-L470 WeakPolarHBondContact OH-CD2 3.38Å; Y287-L470 PolarHBondContact OH-O 2.73Å; Y289-L470 HydrophobicContact CD2-CD2 4.28Å; Y289-L470 HydrophobicContact CE2-CD2 4.33Å; F466-L470 HydrophobicContact CE1-CD2 4.21Å; F466-L470 HydrophobicContact CE2-CD2 3.95Å; F466-L470 HydrophobicContact CZ-CD2 3.78Å; F466-L470 PolarHBondContact O-N 3.09Å; G467-L470 PolarHBondContact O-N 2.92Å
471	N	97.2	Very high	92.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	6.3	180	-152.2	41	0	0	0	114.3	L227 Q231 T469 Q492 R493 E496	L227-N471 HydrophobicContact CD2-CB 3.97Å; Q231-N471 PolarHBondContact NE2-OD1 3.1Å; T469-N471 PolarHBondContact O-N 2.68Å; N471-Q492 PolarHBondContact OD1-NE2 2.88Å; N471-R493 PolarHBondContact ND2-NH1 3.33Å; N471-R493 VanDerWaalsContact O-CZ 3.26Å; N471-R493 PolarHBondContact O-NH1 3.44Å; N471-R493 PolarHBondContact O-NH2 2.77Å; N471-E496 PolarHBondContact ND2-OE2 2.94Å
472	D	95	Very high	92.7	Very high	35 Å²	35	38.9 Å²	38.9	19%	0.187	21%	0.211	C	C	.	.			trans	-66.4	137.4	-179.5	-168.6	29.7	0	0	0	111.7	S186 R188 T469 R487	S186-D472 VanDerWaalsContact CB-OD2 3.28Å; S186-D472 WeakPolarHBondContact CB-OD2 3.43Å; S186-D472 WeakPolarHBondContact OG-CB 3.49Å; S186-D472 PolarHBondContact OG-OD2 2.92Å; R188-D472 HydrophobicContact CB-CB 4.41Å; R188-D472 IonicContact NH1-OD1 3.15Å; T469-D472 WeakPolarHBondContact O-CB 3.32Å; T469-D472 PolarHBondContact O-N 3.48Å; D472-R487 WeakPolarHBondContact O-CD 3.46Å; D472-R487 PolarHBondContact O-NE 3.23Å
473	L	92.6	Very high	92.8	Very high	33 Å²	33	44.7 Å²	44.7	17%	0.173	25%	0.249	C	C	.	.			trans	-125.8	76.4	-174.2	-175.3	58.6	0	0	0	110.6	M477 Q478 L481 R487 F488	L473-M477 HydrophobicContact CD1-CG 4.08Å; L473-M477 HydrophobicContact CD1-SD 4.26Å; L473-Q478 HydrophobicContact CD1-CG 3.66Å; L473-Q478 HydrophobicContact CD2-CG 4.35Å; L473-Q478 HydrophobicContact CG-CG 3.89Å; L473-L481 HydrophobicContact CD1-CD1 3.57Å; L473-R487 HydrophobicContact CB-CB 4.25Å; L473-R487 HydrophobicContact CD1-CB 3.82Å; L473-R487 HydrophobicContact CD1-CG 4.48Å; L473-R487 HydrophobicContact CD2-CB 4.27Å; L473-R487 HydrophobicContact CG-CB 4.32Å; L473-F488 HydrophobicContact CD1-CE1 4.32Å; L473-F488 HydrophobicContact CD2-CD1 4.02Å; L473-F488 HydrophobicContact CD2-CE1 4.04Å
474	C	85.4	Confident	92.8	Very high	29 Å²	29	46.3 Å²	46.3	20%	0.196	26%	0.26	C	S	.	.			trans	-62.2	132.1	176.3	-77	0	0	0	0	111.1	S476 M477	C474-S476 PolarHBondContact O-N 3.31Å; C474-M477 HydrophobicContact CB-SD 4.18Å; C474-M477 VanDerWaalsContact O-CG 3.29Å; C474-M477 WeakPolarHBondContact O-CG 3.49Å; C474-M477 PolarHBondContact O-N 3.32Å
475	P	86.7	Confident	92.9	Very high	104 Å²	104	46.2 Å²	46.2	68%	0.675	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-27.4	-179.9	-29.4	36	0	0	0	114.9	M477	P475-M477 VanDerWaalsContact C-N 3.34Å; P475-M477 PolarHBondContact O-N 3.12Å
476	S	83.2	Confident	93	Very high	60 Å²	60	41.6 Å²	41.6	42%	0.42	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-26.5	175.9	51.4	0	0	0	0	114.3	C474 Y480	C474-S476 PolarHBondContact O-N 3.31Å; S476-Y480 WeakPolarHBondContact O-CD2 3.2Å; S476-Y480 WeakPolarHBondContact O-CE2 3.5Å
477	M	87	Confident	93.1	Very high	45 Å²	45	41.2 Å²	41.2	22%	0.222	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-27.8	-178.3	86	-162	-73.1	0	0	112.8	L473 C474 P475 P479 Y480 L481 R487	L473-M477 HydrophobicContact CD1-CG 4.08Å; L473-M477 HydrophobicContact CD1-SD 4.26Å; C474-M477 HydrophobicContact CB-SD 4.18Å; C474-M477 VanDerWaalsContact O-CG 3.29Å; C474-M477 WeakPolarHBondContact O-CG 3.49Å; C474-M477 PolarHBondContact O-N 3.32Å; P475-M477 VanDerWaalsContact C-N 3.34Å; P475-M477 PolarHBondContact O-N 3.12Å; M477-P479 VanDerWaalsContact C-N 3.31Å; M477-P479 VanDerWaalsContact O-N 3.13Å; M477-Y480 PolarHBondContact O-N 3.17Å; M477-L481 HydrophobicContact CE-CD1 4.32Å; M477-L481 HydrophobicContact CE-CD2 4.19Å; M477-L481 HydrophobicContact CG-CD1 3.93Å; M477-L481 HydrophobicContact CG-CG 4.26Å; M477-L481 PolarHBondContact O-N 3.42Å; M477-R487 VanDerWaalsContact CE-CZ 3.49Å
478	Q	89.3	Confident	93.1	Very high	84 Å²	84	45 Å²	45	39%	0.393	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-40	-177	-65	-179.1	13.1	0	0	114.7	L473 Y480 F488	L473-Q478 HydrophobicContact CD1-CG 3.66Å; L473-Q478 HydrophobicContact CD2-CG 4.35Å; L473-Q478 HydrophobicContact CG-CG 3.89Å; Q478-Y480 PolarHBondContact O-N 3.14Å; Q478-F488 HydrophobicContact CB-CE1 4.48Å; Q478-F488 HydrophobicContact CB-CZ 4.35Å; Q478-F488 HydrophobicContact CG-CE1 4.26Å
479	P	89.4	Confident	93.2	Very high	103 Å²	103	46 Å²	46	67%	0.669	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-7	-179.6	-19.9	34.6	0	0	0	115.5	M477	M477-P479 VanDerWaalsContact C-N 3.31Å; M477-P479 VanDerWaalsContact O-N 3.13Å
480	Y	87.3	Confident	93.3	Very high	146 Å²	146	48.1 Å²	48.1	57%	0.573	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-27.3	-176.8	-57.7	-79.6	0	0	0	113	S476 M477 Q478	S476-Y480 WeakPolarHBondContact O-CD2 3.2Å; S476-Y480 WeakPolarHBondContact O-CE2 3.5Å; M477-Y480 PolarHBondContact O-N 3.17Å; Q478-Y480 PolarHBondContact O-N 3.14Å
481	L	91.5	Very high	93.3	Very high	15 Å²	15	48.1 Å²	48.1	8%	0.079	27%	0.27	C	S	.	.	S	Bend	trans	-65.1	143	178.4	-66.5	179.7	0	0	0	111.7	E288 L473 M477 D485 F488	E288-L481 HydrophobicContact CG-CD2 3.58Å; E288-L481 WeakPolarHBondContact OE1-CD2 3.44Å; L473-L481 HydrophobicContact CD1-CD1 3.57Å; M477-L481 HydrophobicContact CE-CD1 4.32Å; M477-L481 HydrophobicContact CE-CD2 4.19Å; M477-L481 HydrophobicContact CG-CD1 3.93Å; M477-L481 HydrophobicContact CG-CG 4.26Å; M477-L481 PolarHBondContact O-N 3.42Å; L481-D485 HydrophobicContact CB-CB 4.12Å; L481-D485 HydrophobicContact CD1-CB 4.32Å; L481-D485 HydrophobicContact CD2-CB 4.32Å; L481-D485 HydrophobicContact CG-CB 4.49Å; L481-F488 HydrophobicContact CB-CE2 3.56Å; L481-F488 HydrophobicContact CB-CZ 4.02Å; L481-F488 HydrophobicContact CD1-CE2 3.98Å; L481-F488 HydrophobicContact CD1-CZ 4.03Å; L481-F488 HydrophobicContact CG-CE2 4.44Å
482	P	94.9	Very high	93.3	Very high	30 Å²	30	48 Å²	48	20%	0.195	27%	0.27	C	S	.	.			trans	-67.2	153.5	167.1	31.2	-35.2	0	0	0	110.3	S484 D485 F488	P482-S484 PolarHBondContact O-N 3.14Å; P482-D485 HydrophobicContact CG-CB 4.2Å; P482-D485 WeakPolarHBondContact O-CB 3.26Å; P482-D485 PolarHBondContact O-N 2.79Å; P482-F488 WeakPolarHBondContact O-CE2 3.19Å
483	P	96.6	Very high	93.4	Very high	126 Å²	126	47.6 Å²	47.6	82%	0.818	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-10.2	176.1	29.1	-36.6	0	0	0	113.4
484	S	97.4	Very high	93.7	Very high	35 Å²	35	47.5 Å²	47.5	25%	0.245	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-0.5	172.6	52.9	0	0	0	0	113.7	T286 P482 T486	T286-S484 PolarHBondContact N-O 3.37Å; T286-S484 VanDerWaalsContact OG1-CB 3.32Å; T286-S484 WeakPolarHBondContact OG1-CB 3.49Å; T286-S484 PolarHBondContact OG1-O 3.25Å; T286-S484 PolarHBondContact OG1-OG 3Å; P482-S484 PolarHBondContact O-N 3.14Å; S484-T486 PolarHBondContact O-N 3Å
485	D	98.2	Very high	94.2	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.016	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-66.4	129.7	178.6	-169.6	-94.2	0	0	0	111.3	T286 Y287 E288 L481 P482 R487 F488	T286-D485 CarbonylContact O-C 3.54Å; T286-D485 WeakPolarHBondContact O-CA 3.48Å; T286-D485 PolarHBondContact OG1-N 2.97Å; Y287-D485 WeakPolarHBondContact CA-OD2 3.2Å; E288-D485 PolarHBondContact N-OD2 2.76Å; L481-D485 HydrophobicContact CB-CB 4.12Å; L481-D485 HydrophobicContact CD1-CB 4.32Å; L481-D485 HydrophobicContact CD2-CB 4.32Å; L481-D485 HydrophobicContact CG-CB 4.49Å; P482-D485 HydrophobicContact CG-CB 4.2Å; P482-D485 WeakPolarHBondContact O-CB 3.26Å; P482-D485 PolarHBondContact O-N 2.79Å; D485-R487 VanDerWaalsContact CG-NH1 3.32Å; D485-R487 PolarHBondContact O-N 2.7Å; D485-R487 VanDerWaalsContact OD1-CB 3.26Å; D485-R487 WeakPolarHBondContact OD1-CB 3.46Å; D485-R487 WeakPolarHBondContact OD1-CD 3.17Å; D485-R487 WeakPolarHBondContact OD1-CG 3.37Å; D485-R487 IonicContact OD1-CZ 3.45Å; D485-R487 PolarHBondContact OD1-N 3.38Å; D485-R487 IonicContact OD1-NH1 2.68Å; D485-R487 PolarHBondContact OD1-NH1 3.43Å; D485-R487 IonicContact OD2-NH1 3.94Å; D485-R487 PolarHBondContact OD2-NH1 2.75Å; D485-R487 VanDerWaalsContact OD2-NH1 3.08Å; D485-F488 HydrophobicContact CB-CD2 4.14Å; D485-F488 HydrophobicContact CB-CE2 4.43Å; D485-F488 PolarHBondContact O-N 3.43Å
486	T	98.4	Very high	94.6	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.006	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-48.9	-29.1	-179.6	-65	0	0	0	0	113.9	N228 E285 T286 S484 F488 R489	N228-T486 HydrophobicContact CB-CG2 4.3Å; N228-T486 VanDerWaalsContact ND2-CG2 3.29Å; N228-T486 WeakPolarHBondContact ND2-CG2 3.45Å; N228-T486 PolarHBondContact ND2-OG1 3.28Å; E285-T486 WeakPolarHBondContact OE1-CB 3.4Å; E285-T486 WeakPolarHBondContact OE1-CG2 3.24Å; E285-T486 PolarHBondContact OE1-OG1 3.28Å; T286-T486 PolarHBondContact O-N 3.12Å; T286-T486 PolarHBondContact O-OG1 2.83Å; S484-T486 PolarHBondContact O-N 3Å; T486-F488 PolarHBondContact O-N 3.04Å; T486-F488 VanDerWaalsContact O-N 3.16Å; T486-R489 WeakPolarHBondContact O-CB 3.22Å; T486-R489 PolarHBondContact O-N 3.29Å
487	R	97.5	Very high	95.2	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.015	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-63.1	-23.3	178.3	-65.2	171.9	-173.3	88.1	-3.6	113.6	Y287 E288 D472 L473 M477 D485 R493	Y287-R487 VanDerWaalsContact CE2-CZ 3.41Å; E288-R487 VanDerWaalsContact O-CZ 3.27Å; E288-R487 PolarHBondContact O-NH1 2.91Å; E288-R487 PolarHBondContact O-NH2 3.45Å; D472-R487 WeakPolarHBondContact O-CD 3.46Å; D472-R487 PolarHBondContact O-NE 3.23Å; L473-R487 HydrophobicContact CB-CB 4.25Å; L473-R487 HydrophobicContact CD1-CB 3.82Å; L473-R487 HydrophobicContact CD1-CG 4.48Å; L473-R487 HydrophobicContact CD2-CB 4.27Å; L473-R487 HydrophobicContact CG-CB 4.32Å; M477-R487 VanDerWaalsContact CE-CZ 3.49Å; D485-R487 VanDerWaalsContact CG-NH1 3.32Å; D485-R487 PolarHBondContact O-N 2.7Å; D485-R487 VanDerWaalsContact OD1-CB 3.26Å; D485-R487 WeakPolarHBondContact OD1-CB 3.46Å; D485-R487 WeakPolarHBondContact OD1-CD 3.17Å; D485-R487 WeakPolarHBondContact OD1-CG 3.37Å; D485-R487 IonicContact OD1-CZ 3.45Å; D485-R487 PolarHBondContact OD1-N 3.38Å; D485-R487 IonicContact OD1-NH1 2.68Å; D485-R487 PolarHBondContact OD1-NH1 3.43Å; D485-R487 IonicContact OD2-NH1 3.94Å; D485-R487 PolarHBondContact OD2-NH1 2.75Å; D485-R487 VanDerWaalsContact OD2-NH1 3.08Å; R487-R493 PolarHBondContact O-NE 3.06Å; R487-R493 PolarHBondContact O-NH2 2.95Å
488	F	97.8	Very high	95.6	Very high	79 Å²	79	42.3 Å²	42.3	35%	0.346	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-86.4	-6.1	173.8	-61.6	-58.2	0	0	0	113.4	L473 Q478 L481 P482 D485 T486 P490	L473-F488 HydrophobicContact CD1-CE1 4.32Å; L473-F488 HydrophobicContact CD2-CD1 4.02Å; L473-F488 HydrophobicContact CD2-CE1 4.04Å; Q478-F488 HydrophobicContact CB-CE1 4.48Å; Q478-F488 HydrophobicContact CB-CZ 4.35Å; Q478-F488 HydrophobicContact CG-CE1 4.26Å; L481-F488 HydrophobicContact CB-CE2 3.56Å; L481-F488 HydrophobicContact CB-CZ 4.02Å; L481-F488 HydrophobicContact CD1-CE2 3.98Å; L481-F488 HydrophobicContact CD1-CZ 4.03Å; L481-F488 HydrophobicContact CG-CE2 4.44Å; P482-F488 WeakPolarHBondContact O-CE2 3.19Å; D485-F488 HydrophobicContact CB-CD2 4.14Å; D485-F488 HydrophobicContact CB-CE2 4.43Å; D485-F488 PolarHBondContact O-N 3.43Å; T486-F488 PolarHBondContact O-N 3.04Å; T486-F488 VanDerWaalsContact O-N 3.16Å; F488-P490 WeakPolarHBondContact O-CD 3.13Å
489	R	97.9	Very high	95.9	Very high	23 Å²	23	44.1 Å²	44.1	9%	0.087	23%	0.228	C	C	.	.			trans	-68.6	116.4	-178.3	-163.6	-166.2	158	138.8	-6.1	110.5	N280 E285 T486 D491 R493 I510	N280-R489 PolarHBondContact O-NH1 3.48Å; E285-R489 WeakPolarHBondContact OE1-CD 3.46Å; E285-R489 IonicContact OE2-CZ 2.72Å; E285-R489 IonicContact OE2-NH1 2.82Å; E285-R489 PolarHBondContact OE2-NH1 2.85Å; T486-R489 WeakPolarHBondContact O-CB 3.22Å; T486-R489 PolarHBondContact O-N 3.29Å; R489-D491 WeakPolarHBondContact CD-OD1 3.11Å; R489-D491 VanDerWaalsContact CG-OD1 3.26Å; R489-D491 WeakPolarHBondContact CG-OD1 3.39Å; R489-D491 IonicContact CZ-OD1 2.69Å; R489-D491 IonicContact CZ-OD2 3.49Å; R489-D491 IonicContact NE-OD1 3.56Å; R489-D491 PolarHBondContact NE-OD1 3.15Å; R489-D491 IonicContact NE-OD2 3.09Å; R489-D491 PolarHBondContact NE-OD2 2.73Å; R489-D491 IonicContact NH2-OD1 3.42Å; R489-D491 IonicContact NH2-OD2 3.58Å; R489-D491 PolarHBondContact NH2-OD2 3.47Å; R489-R493 WeakPolarHBondContact O-CB 3.4Å; R489-R493 PolarHBondContact O-N 3.19Å; R489-I510 HydrophobicContact CG-CD1 4.5Å
490	P	97.9	Very high	96.1	Very high	54 Å²	54	41.2 Å²	41.2	35%	0.351	21%	0.206	S	C	.	.	H	α-helix	trans	-78.8	-36.9	-162.4	28.7	-35.2	0	0	0	114.5	F488 R493 M494 K506 I510	F488-P490 WeakPolarHBondContact O-CD 3.13Å; P490-R493 PolarHBondContact O-N 3.07Å; P490-M494 VanDerWaalsContact O-CG 3.31Å; P490-M494 WeakPolarHBondContact O-CG 3.47Å; P490-M494 PolarHBondContact O-N 3.22Å; P490-K506 HydrophobicContact CB-CG 4.33Å; P490-K506 HydrophobicContact CG-CB 4.37Å; P490-I510 HydrophobicContact CG-CD1 3.95Å
491	D	98	Very high	96.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.1	-50.3	177.1	58.4	-21.4	0	0	0	111.8	F279 R489 R493 M494 V495 K506 K507 I510	F279-D491 HydrophobicContact CE1-CB 4.29Å; F279-D491 WeakPolarHBondContact CE1-OD2 3.02Å; R489-D491 WeakPolarHBondContact CD-OD1 3.11Å; R489-D491 VanDerWaalsContact CG-OD1 3.26Å; R489-D491 WeakPolarHBondContact CG-OD1 3.39Å; R489-D491 IonicContact CZ-OD1 2.69Å; R489-D491 IonicContact CZ-OD2 3.49Å; R489-D491 IonicContact NE-OD1 3.56Å; R489-D491 PolarHBondContact NE-OD1 3.15Å; R489-D491 IonicContact NE-OD2 3.09Å; R489-D491 PolarHBondContact NE-OD2 2.73Å; R489-D491 IonicContact NH2-OD1 3.42Å; R489-D491 IonicContact NH2-OD2 3.58Å; R489-D491 PolarHBondContact NH2-OD2 3.47Å; D491-R493 VanDerWaalsContact C-N 3.31Å; D491-R493 PolarHBondContact O-N 2.7Å; D491-M494 PolarHBondContact O-N 3.36Å; D491-V495 PolarHBondContact O-N 3.26Å; D491-V495 VanDerWaalsContact O-N 3.09Å; D491-K506 HydrophobicContact CB-CB 4.02Å; D491-K507 HydrophobicContact CB-CB 3.82Å; D491-I510 HydrophobicContact CB-CD1 4.17Å; D491-I510 WeakPolarHBondContact OD1-CD1 3.45Å
492	Q	97.8	Very high	96.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-39.7	176.1	-175.3	-178	-35.1	0	0	112.1	P226 F279 N471 V495 E496	P226-Q492 PolarHBondContact O-NE2 3.37Å; F279-Q492 HydrophobicContact CD2-CB 4Å; F279-Q492 HydrophobicContact CD2-CG 3.77Å; F279-Q492 HydrophobicContact CE1-CB 4.5Å; F279-Q492 HydrophobicContact CE2-CB 3.94Å; F279-Q492 HydrophobicContact CE2-CG 3.91Å; F279-Q492 HydrophobicContact CG-CB 4.31Å; F279-Q492 HydrophobicContact CG-CG 4.42Å; F279-Q492 HydrophobicContact CZ-CB 4.21Å; N471-Q492 PolarHBondContact OD1-NE2 2.88Å; Q492-V495 PolarHBondContact O-N 3.19Å; Q492-E496 PolarHBondContact O-N 2.99Å
493	R	97.2	Very high	96.8	Very high	25 Å²	25	42.3 Å²	42.3	9%	0.094	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-38.1	176.6	-174.4	63.1	64.3	-173.6	3.1	112.3	N471 R487 R489 P490 D491 E496 Y497	N471-R493 PolarHBondContact ND2-NH1 3.33Å; N471-R493 VanDerWaalsContact O-CZ 3.26Å; N471-R493 PolarHBondContact O-NH1 3.44Å; N471-R493 PolarHBondContact O-NH2 2.77Å; R487-R493 PolarHBondContact O-NE 3.06Å; R487-R493 PolarHBondContact O-NH2 2.95Å; R489-R493 WeakPolarHBondContact O-CB 3.4Å; R489-R493 PolarHBondContact O-N 3.19Å; P490-R493 PolarHBondContact O-N 3.07Å; D491-R493 VanDerWaalsContact C-N 3.31Å; D491-R493 PolarHBondContact O-N 2.7Å; R493-E496 IonicContact CZ-OE2 3.96Å; R493-E496 IonicContact NE-OE2 2.78Å; R493-E496 IonicContact NH1-OE1 2.71Å; R493-E496 IonicContact NH1-OE2 3.01Å; R493-E496 PolarHBondContact NH1-OE2 3.47Å; R493-E496 WeakPolarHBondContact O-CB 3.36Å; R493-E496 PolarHBondContact O-N 3.19Å; R493-Y497 HydrophobicContact CG-CD2 3.9Å; R493-Y497 HydrophobicContact CG-CE2 3.44Å; R493-Y497 VanDerWaalsContact CG-CE2 3.44Å; R493-Y497 VanDerWaalsContact O-CD2 3.28Å; R493-Y497 WeakPolarHBondContact O-CD2 3.44Å; R493-Y497 PolarHBondContact O-N 3.18Å; R493-Y497 VanDerWaalsContact O-N 3.12Å
494	M	97.3	Very high	96.7	Very high	32 Å²	32	38.2 Å²	38.2	16%	0.158	19%	0.188	C	C	.	.	H	α-helix	trans	-68.1	-37.4	176.8	-69.5	-48.5	-172.4	0	0	112.1	P490 D491 E496 Y497 G498 R499 E502 A503	P490-M494 VanDerWaalsContact O-CG 3.31Å; P490-M494 WeakPolarHBondContact O-CG 3.47Å; P490-M494 PolarHBondContact O-N 3.22Å; D491-M494 PolarHBondContact O-N 3.36Å; M494-E496 VanDerWaalsContact C-N 3.29Å; M494-E496 PolarHBondContact O-N 3.37Å; M494-Y497 CarbonylContact O-C 3.55Å; M494-Y497 PolarHBondContact O-N 3.39Å; M494-G498 PolarHBondContact O-N 2.86Å; M494-G498 VanDerWaalsContact O-N 3.08Å; M494-R499 HydrophobicContact CB-CB 4.3Å; M494-R499 PolarHBondContact O-N 2.93Å; M494-R499 HydrophobicContact SD-CB 4.4Å; M494-E502 WeakPolarHBondContact CE-OE2 3.42Å; M494-E502 HydrophobicContact CG-CB 4.11Å; M494-A503 HydrophobicContact CB-CB 3.61Å
495	V	96.1	Very high	96.7	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-59.2	-40.3	169.9	172.6	0	0	0	0	111.6	V221 P226 F279 D491 Q492 Y497 G498 L500 A503	V221-V495 HydrophobicContact CB-CG2 4.06Å; P226-V495 HydrophobicContact CB-CG1 4.37Å; F279-V495 HydrophobicContact CE2-CB 4.47Å; F279-V495 HydrophobicContact CE2-CG2 4.26Å; F279-V495 HydrophobicContact CZ-CB 4.46Å; F279-V495 HydrophobicContact CZ-CG2 3.82Å; D491-V495 PolarHBondContact O-N 3.26Å; D491-V495 VanDerWaalsContact O-N 3.09Å; Q492-V495 PolarHBondContact O-N 3.19Å; V495-Y497 VanDerWaalsContact C-N 3.3Å; V495-Y497 PolarHBondContact O-N 2.9Å; V495-G498 PolarHBondContact O-N 3.31Å; V495-L500 HydrophobicContact CG2-CD2 4.24Å; V495-A503 HydrophobicContact CG2-CB 3.73Å
496	E	96.2	Very high	96.6	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-29.3	178.1	-157.9	175.5	-163.2	0	0	113.7	R188 L191 P226 N471 Q492 R493 M494 G498	R188-E496 IonicContact CZ-OE1 3.29Å; R188-E496 IonicContact NH1-OE1 3.8Å; R188-E496 PolarHBondContact NH1-OE1 3.31Å; R188-E496 IonicContact NH1-OE2 2.72Å; R188-E496 IonicContact NH2-OE1 2.73Å; R188-E496 PolarHBondContact NH2-OE1 3.45Å; L191-E496 HydrophobicContact CD2-CG 4.34Å; P226-E496 HydrophobicContact CB-CB 3.58Å; P226-E496 HydrophobicContact CB-CG 3.82Å; P226-E496 HydrophobicContact CG-CB 4.24Å; P226-E496 HydrophobicContact CG-CG 4.07Å; N471-E496 PolarHBondContact ND2-OE2 2.94Å; Q492-E496 PolarHBondContact O-N 2.99Å; R493-E496 IonicContact CZ-OE2 3.96Å; R493-E496 IonicContact NE-OE2 2.78Å; R493-E496 IonicContact NH1-OE1 2.71Å; R493-E496 IonicContact NH1-OE2 3.01Å; R493-E496 PolarHBondContact NH1-OE2 3.47Å; R493-E496 WeakPolarHBondContact O-CB 3.36Å; R493-E496 PolarHBondContact O-N 3.19Å; M494-E496 VanDerWaalsContact C-N 3.29Å; M494-E496 PolarHBondContact O-N 3.37Å; E496-G498 VanDerWaalsContact C-N 3.35Å
497	Y	96.2	Very high	96.5	Very high	100 Å²	100	46.3 Å²	46.3	39%	0.392	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	5	171.4	-64.8	-46.3	0	0	0	113.7	P192 T193 R493 M494 V495 R499	P192-Y497 HydrophobicContact CB-CD1 3.65Å; P192-Y497 HydrophobicContact CB-CE1 3.93Å; P192-Y497 HydrophobicContact CG-CD1 3.78Å; P192-Y497 HydrophobicContact CG-CE1 3.66Å; T193-Y497 VanDerWaalsContact OG1-C 3.32Å; T193-Y497 PolarHBondContact OG1-O 2.87Å; R493-Y497 HydrophobicContact CG-CD2 3.9Å; R493-Y497 HydrophobicContact CG-CE2 3.44Å; R493-Y497 VanDerWaalsContact CG-CE2 3.44Å; R493-Y497 VanDerWaalsContact O-CD2 3.28Å; R493-Y497 WeakPolarHBondContact O-CD2 3.44Å; R493-Y497 PolarHBondContact O-N 3.18Å; R493-Y497 VanDerWaalsContact O-N 3.12Å; M494-Y497 CarbonylContact O-C 3.55Å; M494-Y497 PolarHBondContact O-N 3.39Å; V495-Y497 VanDerWaalsContact C-N 3.3Å; V495-Y497 PolarHBondContact O-N 2.9Å; Y497-R499 VanDerWaalsContact C-N 3.26Å; Y497-R499 PolarHBondContact O-N 3.14Å
498	G	94.3	Very high	96.4	Very high	25 Å²	25	50.2 Å²	50.2	26%	0.258	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	12.1	-179.6	0	0	0	0	0	115.7	M494 V495 E496 L500	M494-G498 PolarHBondContact O-N 2.86Å; M494-G498 VanDerWaalsContact O-N 3.08Å; V495-G498 PolarHBondContact O-N 3.31Å; E496-G498 VanDerWaalsContact C-N 3.35Å; G498-L500 PolarHBondContact O-N 2.78Å
499	R	95.8	Very high	96.3	Very high	121 Å²	121	49 Å²	49	46%	0.457	24%	0.243	S	C	.	.			trans	-91.3	72.2	-177.1	-49.7	-164.9	-157.9	172.2	-0.1	110.7	M494 Y497 D501 E502 A503	M494-R499 HydrophobicContact CB-CB 4.3Å; M494-R499 PolarHBondContact O-N 2.93Å; M494-R499 HydrophobicContact SD-CB 4.4Å; Y497-R499 VanDerWaalsContact C-N 3.26Å; Y497-R499 PolarHBondContact O-N 3.14Å; R499-D501 PolarHBondContact O-N 3.44Å; R499-E502 HydrophobicContact CB-CB 4.24Å; R499-E502 HydrophobicContact CB-CG 4.49Å; R499-E502 WeakPolarHBondContact CD-OE1 3.45Å; R499-E502 IonicContact NE-OE1 3.8Å; R499-E502 IonicContact NH1-OE1 3.97Å; R499-E502 PolarHBondContact NH1-OE1 2.77Å; R499-E502 IonicContact NH1-OE2 2.83Å; R499-A503 WeakPolarHBondContact O-CB 3.48Å; R499-A503 PolarHBondContact O-N 3.16Å
500	L	93.6	Very high	96.2	Very high	42 Å²	42	49.5 Å²	49.5	22%	0.22	25%	0.247	C	C	.	.	H	α-helix	trans	-65.7	-38.1	-168.3	-60.6	-176.6	0	0	0	113.4	V221 F222 V495 G498 A503 E504	V221-L500 HydrophobicContact CG2-CB 4.34Å; V221-L500 WeakPolarHBondContact CG2-O 3.43Å; F222-L500 HydrophobicContact CB-CD1 4.28Å; V495-L500 HydrophobicContact CG2-CD2 4.24Å; G498-L500 PolarHBondContact O-N 2.78Å; L500-A503 WeakPolarHBondContact O-CB 3.29Å; L500-A503 PolarHBondContact O-N 3.36Å; L500-E504 PolarHBondContact O-N 3.2Å
501	D	93.9	Very high	95.9	Very high	139 Å²	139	49.3 Å²	49.3	74%	0.743	24%	0.242	S	C	*	.	H	α-helix	trans	-66.9	-48	-179.4	-51.9	-37.8	0	0	0	111.1	R499 A503 E504 E505	R499-D501 PolarHBondContact O-N 3.44Å; D501-A503 PolarHBondContact O-N 3.13Å; D501-E504 PolarHBondContact O-N 3.15Å; D501-E505 PolarHBondContact O-N 2.76Å
502	E	97	Very high	95.7	Very high	76 Å²	76	54.4 Å²	54.4	36%	0.355	27%	0.266	S	S	.	.	H	α-helix	trans	-57.1	-37.9	171.1	-68.7	-174.5	-115.5	0	0	111.8	M494 R499 K506	M494-E502 WeakPolarHBondContact CE-OE2 3.42Å; M494-E502 HydrophobicContact CG-CB 4.11Å; R499-E502 HydrophobicContact CB-CB 4.24Å; R499-E502 HydrophobicContact CB-CG 4.49Å; R499-E502 WeakPolarHBondContact CD-OE1 3.45Å; R499-E502 IonicContact NE-OE1 3.8Å; R499-E502 IonicContact NH1-OE1 3.97Å; R499-E502 PolarHBondContact NH1-OE1 2.77Å; R499-E502 IonicContact NH1-OE2 2.83Å; E502-K506 WeakPolarHBondContact O-CG 3.16Å; E502-K506 PolarHBondContact O-N 3Å; E502-K506 VanDerWaalsContact O-N 3.12Å
503	A	96.9	Very high	95.6	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.4	-41.5	178.8	0	0	0	0	0	112.2	V221 M494 V495 R499 L500 D501 K506 K507	V221-A503 HydrophobicContact CB-CB 4.24Å; V221-A503 HydrophobicContact CG1-CB 3.97Å; V221-A503 HydrophobicContact CG2-CB 4.18Å; M494-A503 HydrophobicContact CB-CB 3.61Å; V495-A503 HydrophobicContact CG2-CB 3.73Å; R499-A503 WeakPolarHBondContact O-CB 3.48Å; R499-A503 PolarHBondContact O-N 3.16Å; L500-A503 WeakPolarHBondContact O-CB 3.29Å; L500-A503 PolarHBondContact O-N 3.36Å; D501-A503 PolarHBondContact O-N 3.13Å; A503-K506 PolarHBondContact O-N 3.04Å; A503-K507 VanDerWaalsContact O-CB 3.28Å; A503-K507 WeakPolarHBondContact O-CB 3.22Å; A503-K507 PolarHBondContact O-N 2.75Å
504	E	95	Very high	95.3	Very high	40 Å²	40	61.5 Å²	61.5	19%	0.187	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-46.5	-179.9	-172.3	59.4	-133.5	0	0	110.8	P220 V221 L500 D501 K506 K507 Q508	P220-E504 WeakPolarHBondContact CA-OE2 3.34Å; V221-E504 HydrophobicContact CG1-CB 4.27Å; V221-E504 WeakPolarHBondContact CG1-OE2 3.37Å; V221-E504 HydrophobicContact CG2-CB 3.88Å; V221-E504 WeakPolarHBondContact CG2-OE2 3.47Å; V221-E504 PolarHBondContact N-OE2 3.35Å; L500-E504 PolarHBondContact O-N 3.2Å; D501-E504 PolarHBondContact O-N 3.15Å; E504-K506 VanDerWaalsContact C-N 3.35Å; E504-K506 PolarHBondContact O-N 3.14Å; E504-K507 PolarHBondContact O-N 3.4Å; E504-Q508 WeakPolarHBondContact O-CG 3.35Å; E504-Q508 PolarHBondContact O-N 3.46Å; E504-Q508 PolarHBondContact OE1-NE2 3.24Å
505	E	96.9	Very high	95	Very high	121 Å²	121	65.9 Å²	65.9	57%	0.565	31%	0.313	S	S	*	.	H	α-helix	trans	-55.5	-47.4	173.3	-68.8	-179	-177.7	0	0	112.2	D501 A509	D501-E505 PolarHBondContact O-N 2.76Å; E505-A509 WeakPolarHBondContact O-CB 3.42Å; E505-A509 PolarHBondContact O-N 2.87Å; E505-A509 VanDerWaalsContact O-N 3.08Å
506	K	97.6	Very high	94.9	Very high	86 Å²	86	69.4 Å²	69.4	37%	0.374	34%	0.338	S	S	.	.	H	α-helix	trans	-67.3	-37	179.3	-65.2	-47.3	174	-139.9	0	112.1	P490 D491 E502 A503 E504 I510	P490-K506 HydrophobicContact CB-CG 4.33Å; P490-K506 HydrophobicContact CG-CB 4.37Å; D491-K506 HydrophobicContact CB-CB 4.02Å; E502-K506 WeakPolarHBondContact O-CG 3.16Å; E502-K506 PolarHBondContact O-N 3Å; E502-K506 VanDerWaalsContact O-N 3.12Å; A503-K506 PolarHBondContact O-N 3.04Å; E504-K506 VanDerWaalsContact C-N 3.35Å; E504-K506 PolarHBondContact O-N 3.14Å; K506-I510 WeakPolarHBondContact O-CB 3.33Å; K506-I510 WeakPolarHBondContact O-CD1 3.49Å; K506-I510 WeakPolarHBondContact O-CG1 3.42Å; K506-I510 PolarHBondContact O-N 3.33Å
507	K	96.2	Very high	94.8	Very high	2 Å²	2	73.7 Å²	73.7	1%	0.009	36%	0.356	C	S	.	.	H	α-helix	trans	-64.8	-46.2	177.9	-179.3	176.8	158	-65.4	0	111	S218 L219 V221 F279 D491 A503 E504 I510 E511	S218-K507 PolarHBondContact OG-NZ 3.24Å; L219-K507 WeakPolarHBondContact O-CE 3.47Å; L219-K507 PolarHBondContact O-NZ 3.05Å; V221-K507 HydrophobicContact CG1-CB 3.96Å; V221-K507 HydrophobicContact CG1-CD 3.47Å; V221-K507 VanDerWaalsContact CG1-CD 3.47Å; V221-K507 HydrophobicContact CG1-CG 4.39Å; F279-K507 HydrophobicContact CE1-CD 4.33Å; D491-K507 HydrophobicContact CB-CB 3.82Å; A503-K507 VanDerWaalsContact O-CB 3.28Å; A503-K507 WeakPolarHBondContact O-CB 3.22Å; A503-K507 PolarHBondContact O-N 2.75Å; E504-K507 PolarHBondContact O-N 3.4Å; K507-I510 PolarHBondContact O-N 2.7Å; K507-E511 WeakPolarHBondContact CE-OE1 3.39Å; K507-E511 WeakPolarHBondContact CG-OE1 3.07Å; K507-E511 IonicContact NZ-OE1 2.81Å; K507-E511 PolarHBondContact NZ-OE1 3.28Å; K507-E511 IonicContact NZ-OE2 3.86Å; K507-E511 WeakPolarHBondContact O-CB 3.48Å; K507-E511 WeakPolarHBondContact O-CG 3.49Å; K507-E511 PolarHBondContact O-N 3.16Å
508	Q	94	Very high	94.5	Very high	86 Å²	86	74.3 Å²	74.3	40%	0.402	36%	0.358	S	S	.	.	H	α-helix	trans	-59.3	-49.6	176.4	-69.9	174.5	12.2	0	0	111	E504 I510 E511 E512	E504-Q508 WeakPolarHBondContact O-CG 3.35Å; E504-Q508 PolarHBondContact O-N 3.46Å; E504-Q508 PolarHBondContact OE1-NE2 3.24Å; Q508-I510 VanDerWaalsContact C-N 3.32Å; Q508-I510 PolarHBondContact O-N 2.87Å; Q508-E511 PolarHBondContact O-N 2.72Å; Q508-E512 WeakPolarHBondContact O-CB 3.29Å; Q508-E512 VanDerWaalsContact O-CG 3.31Å; Q508-E512 WeakPolarHBondContact O-CG 3.28Å; Q508-E512 PolarHBondContact O-N 3.07Å
509	A	96.5	Very high	94.4	Very high	53 Å²	53	77.3 Å²	77.3	44%	0.438	36%	0.364	S	S	.	.	H	α-helix	trans	-59.7	-37.9	177.2	0	0	0	0	0	113.4	E505 F513	E505-A509 WeakPolarHBondContact O-CB 3.42Å; E505-A509 PolarHBondContact O-N 2.87Å; E505-A509 VanDerWaalsContact O-N 3.08Å; A509-F513 WeakPolarHBondContact O-CB 3.34Å; A509-F513 PolarHBondContact O-N 2.99Å
510	I	95.9	Very high	94.3	Very high	33 Å²	33	76.3 Å²	76.3	17%	0.169	36%	0.364	C	S	.	.	H	α-helix	trans	-66.8	-47.2	175.5	-73.3	165.3	0	0	0	111.2	V282 R489 P490 D491 K506 K507 Q508 E512 F513 Q514	V282-I510 HydrophobicContact CG1-CG2 3.42Å; V282-I510 VanDerWaalsContact CG1-CG2 3.42Å; R489-I510 HydrophobicContact CG-CD1 4.5Å; P490-I510 HydrophobicContact CG-CD1 3.95Å; D491-I510 HydrophobicContact CB-CD1 4.17Å; D491-I510 WeakPolarHBondContact OD1-CD1 3.45Å; K506-I510 WeakPolarHBondContact O-CB 3.33Å; K506-I510 WeakPolarHBondContact O-CD1 3.49Å; K506-I510 WeakPolarHBondContact O-CG1 3.42Å; K506-I510 PolarHBondContact O-N 3.33Å; K507-I510 PolarHBondContact O-N 2.7Å; Q508-I510 VanDerWaalsContact C-N 3.32Å; Q508-I510 PolarHBondContact O-N 2.87Å; I510-E512 VanDerWaalsContact C-N 3.34Å; I510-E512 PolarHBondContact O-N 3.04Å; I510-F513 PolarHBondContact O-N 3.04Å; I510-Q514 WeakPolarHBondContact O-CB 3.47Å; I510-Q514 PolarHBondContact O-N 3.4Å
511	E	92.2	Very high	94.2	Very high	51 Å²	51	75.7 Å²	75.7	24%	0.238	36%	0.361	C	S	.	.	H	α-helix	trans	-65.3	-36.3	178.7	-72.9	177.2	-164.8	0	0	112	S218 K507 Q508 R515	S218-E511 WeakPolarHBondContact CB-OE2 3.25Å; S218-E511 VanDerWaalsContact OG-CD 3.27Å; S218-E511 PolarHBondContact OG-OE1 3.27Å; S218-E511 PolarHBondContact OG-OE2 3.28Å; K507-E511 WeakPolarHBondContact CE-OE1 3.39Å; K507-E511 WeakPolarHBondContact CG-OE1 3.07Å; K507-E511 IonicContact NZ-OE1 2.81Å; K507-E511 PolarHBondContact NZ-OE1 3.28Å; K507-E511 IonicContact NZ-OE2 3.86Å; K507-E511 WeakPolarHBondContact O-CB 3.48Å; K507-E511 WeakPolarHBondContact O-CG 3.49Å; K507-E511 PolarHBondContact O-N 3.16Å; Q508-E511 PolarHBondContact O-N 2.72Å; E511-R515 WeakPolarHBondContact O-CB 3.26Å; E511-R515 VanDerWaalsContact O-CG 3.25Å; E511-R515 WeakPolarHBondContact O-CG 3.23Å; E511-R515 PolarHBondContact O-N 3.22Å; E511-R515 PolarHBondContact O-NE 3.34Å
512	E	93.3	Very high	94.1	Very high	107 Å²	107	72.5 Å²	72.5	50%	0.5	35%	0.354	S	S	.	.	H	α-helix	trans	-65.7	-48.2	172.8	-75.1	174.8	-174.9	0	0	112.3	Q508 I510 Q514 R515 S516	Q508-E512 WeakPolarHBondContact O-CB 3.29Å; Q508-E512 VanDerWaalsContact O-CG 3.31Å; Q508-E512 WeakPolarHBondContact O-CG 3.28Å; Q508-E512 PolarHBondContact O-N 3.07Å; I510-E512 VanDerWaalsContact C-N 3.34Å; I510-E512 PolarHBondContact O-N 3.04Å; E512-Q514 VanDerWaalsContact C-N 3.29Å; E512-Q514 PolarHBondContact O-N 3.34Å; E512-R515 PolarHBondContact O-N 3.38Å; E512-R515 IonicContact OE1-NH2 3.95Å; E512-S516 WeakPolarHBondContact O-CB 3.48Å; E512-S516 PolarHBondContact O-N 2.78Å
513	F	94.5	Very high	93.9	Very high	144 Å²	144	78.9 Å²	78.9	63%	0.632	38%	0.375	S	S	*	.	H	α-helix	trans	-58.6	-42.8	176.3	179.5	-103	0	0	0	111.5	A509 I510 S516 K517	A509-F513 WeakPolarHBondContact O-CB 3.34Å; A509-F513 PolarHBondContact O-N 2.99Å; I510-F513 PolarHBondContact O-N 3.04Å; F513-S516 PolarHBondContact O-N 3.25Å; F513-K517 HydrophobicContact CE1-CD 4.32Å; F513-K517 VanDerWaalsContact O-CB 3.31Å; F513-K517 WeakPolarHBondContact O-CB 3.46Å; F513-K517 PolarHBondContact O-N 3.04Å
514	Q	92.6	Very high	93.8	Very high	30 Å²	30	82.6 Å²	82.6	14%	0.14	39%	0.392	C	S	.	.	H	α-helix	trans	-65.5	-43.7	176.3	-172.4	175.7	-5	0	0	112.3	V282 H305 I510 E512 K517 R518	V282-Q514 VanDerWaalsContact CB-OE1 3.28Å; H305-Q514 PolarHBondContact CD2-NE2 3.33Å; H305-Q514 PolarHBondContact CE1-NE2 2.89Å; H305-Q514 VanDerWaalsContact CE1-NE2 3.3Å; H305-Q514 PolarHBondContact ND1-NE2 3.33Å; H305-Q514 VanDerWaalsContact ND1-NE2 3.14Å; H305-Q514 PolarHBondContact NE2-NE2 3.09Å; I510-Q514 WeakPolarHBondContact O-CB 3.47Å; I510-Q514 PolarHBondContact O-N 3.4Å; E512-Q514 VanDerWaalsContact C-N 3.29Å; E512-Q514 PolarHBondContact O-N 3.34Å; Q514-K517 PolarHBondContact O-N 3.3Å; Q514-R518 WeakPolarHBondContact O-CB 3.38Å; Q514-R518 PolarHBondContact O-N 3.05Å
515	R	91.2	Very high	93.5	Very high	124 Å²	124	89.5 Å²	89.5	47%	0.468	42%	0.424	S	S	.	.	H	α-helix	trans	-59.7	-45.7	174.7	-79.2	-179	-74.6	161.2	-8.1	111.8	E511 E512 R518 K519	E511-R515 WeakPolarHBondContact O-CB 3.26Å; E511-R515 VanDerWaalsContact O-CG 3.25Å; E511-R515 WeakPolarHBondContact O-CG 3.23Å; E511-R515 PolarHBondContact O-N 3.22Å; E511-R515 PolarHBondContact O-NE 3.34Å; E512-R515 PolarHBondContact O-N 3.38Å; E512-R515 IonicContact OE1-NH2 3.95Å; R515-R518 WeakPolarHBondContact O-CB 2.9Å; R515-R518 PolarHBondContact O-N 3.43Å; R515-K519 PolarHBondContact O-N 3Å
516	S	93.9	Very high	93.2	Very high	76 Å²	76	91.1 Å²	91.1	53%	0.531	43%	0.425	S	S	.	.	H	α-helix	trans	-62.4	-49.4	178.3	-176.9	0	0	0	0	111.7	E512 F513 R518 K519 Q520	E512-S516 WeakPolarHBondContact O-CB 3.48Å; E512-S516 PolarHBondContact O-N 2.78Å; F513-S516 PolarHBondContact O-N 3.25Å; S516-R518 VanDerWaalsContact C-N 3.28Å; S516-R518 PolarHBondContact O-N 2.83Å; S516-K519 PolarHBondContact O-N 3.32Å; S516-K519 VanDerWaalsContact O-N 3.13Å; S516-Q520 PolarHBondContact O-N 2.88Å
517	K	92.9	Very high	92.6	Very high	92 Å²	92	92.3 Å²	92.3	40%	0.4	44%	0.443	S	S	.	.	H	α-helix	trans	-60.6	-34.9	176.6	-171.7	177.4	-179.7	-176	0	112.7	F513 Q514 L521	F513-K517 HydrophobicContact CE1-CD 4.32Å; F513-K517 VanDerWaalsContact O-CB 3.31Å; F513-K517 WeakPolarHBondContact O-CB 3.46Å; F513-K517 PolarHBondContact O-N 3.04Å; Q514-K517 PolarHBondContact O-N 3.3Å; K517-L521 HydrophobicContact CG-CD1 4.46Å; K517-L521 WeakPolarHBondContact O-CB 3.49Å; K517-L521 WeakPolarHBondContact O-CG 3.34Å; K517-L521 PolarHBondContact O-N 2.81Å
518	R	90.6	Very high	92.2	Very high	112 Å²	112	95 Å²	95	42%	0.423	46%	0.455	S	S	.	.	H	α-helix	trans	-65.7	-48.8	172.7	-169	-170.6	73.9	-162.9	2.6	111.5	H306 Q514 R515 S516 Q520 L521 A522	H306-R518 PolarHBondContact NE2-NH1 3.03Å; Q514-R518 WeakPolarHBondContact O-CB 3.38Å; Q514-R518 PolarHBondContact O-N 3.05Å; R515-R518 WeakPolarHBondContact O-CB 2.9Å; R515-R518 PolarHBondContact O-N 3.43Å; S516-R518 VanDerWaalsContact C-N 3.28Å; S516-R518 PolarHBondContact O-N 2.83Å; R518-Q520 VanDerWaalsContact C-N 3.29Å; R518-Q520 PolarHBondContact O-N 3.39Å; R518-L521 PolarHBondContact O-N 2.68Å; R518-A522 PolarHBondContact O-N 2.87Å
519	K	92.2	Very high	92.1	Very high	88 Å²	88	96.8 Å²	96.8	38%	0.383	47%	0.472	S	S	.	.	H	α-helix	trans	-59.2	-38.5	175	-75	-167.4	173	-167.9	0	111.4	D120 R515 S516 R523	D120-K519 IonicContact OD2-NZ 2.65Å; D120-K519 PolarHBondContact OD2-NZ 2.82Å; R515-K519 PolarHBondContact O-N 3Å; S516-K519 PolarHBondContact O-N 3.32Å; S516-K519 VanDerWaalsContact O-N 3.13Å; K519-R523 VanDerWaalsContact O-CG 3.31Å; K519-R523 WeakPolarHBondContact O-CG 3.04Å; K519-R523 PolarHBondContact O-N 2.78Å
520	Q	93.5	Very high	91.8	Very high	101 Å²	101	96.1 Å²	96.1	47%	0.472	46%	0.463	S	S	.	.	H	α-helix	trans	-63.1	-53.6	174.5	-179.7	-175.4	-6	0	0	112.2	S516 R518 A522 R523 E524	S516-Q520 PolarHBondContact O-N 2.88Å; R518-Q520 VanDerWaalsContact C-N 3.29Å; R518-Q520 PolarHBondContact O-N 3.39Å; Q520-A522 VanDerWaalsContact C-N 3.28Å; Q520-A522 PolarHBondContact O-N 3.38Å; Q520-R523 WeakPolarHBondContact O-CB 3.27Å; Q520-R523 PolarHBondContact O-N 3.14Å; Q520-R523 VanDerWaalsContact O-N 3.13Å; Q520-E524 VanDerWaalsContact CG-OE1 3.28Å; Q520-E524 WeakPolarHBondContact CG-OE1 3.42Å; Q520-E524 PolarHBondContact NE2-OE1 2.96Å; Q520-E524 PolarHBondContact O-N 3.42Å
521	L	92.1	Very high	91.6	Very high	28 Å²	28	101.3 Å²	101.3	15%	0.147	48%	0.484	C	S	.	.	H	α-helix	trans	-59.1	-38.9	-178.7	-79.3	174.1	0	0	0	112.5	K517 R518 E524 Q525 R526 H528	K517-L521 HydrophobicContact CG-CD1 4.46Å; K517-L521 WeakPolarHBondContact O-CB 3.49Å; K517-L521 WeakPolarHBondContact O-CG 3.34Å; K517-L521 PolarHBondContact O-N 2.81Å; R518-L521 PolarHBondContact O-N 2.68Å; L521-E524 CarbonylContact O-C 3.55Å; L521-E524 PolarHBondContact O-N 3.47Å; L521-Q525 PolarHBondContact O-N 3.17Å; L521-Q525 VanDerWaalsContact O-N 3.15Å; L521-R526 WeakPolarHBondContact CB-O 3.43Å; L521-R526 HydrophobicContact CD2-CB 3.92Å; L521-R526 PolarHBondContact O-N 3.14Å; L521-H528 HydrophobicContact CD1-CB 4.48Å
522	A	91.1	Very high	91.6	Very high	72 Å²	72	103.9 Å²	103.9	60%	0.595	49%	0.492	S	S	*	.	H	α-helix	trans	-61.9	-46	174.1	0	0	0	0	0	112.5	R518 Q520 E524 Q525	R518-A522 PolarHBondContact O-N 2.87Å; Q520-A522 VanDerWaalsContact C-N 3.28Å; Q520-A522 PolarHBondContact O-N 3.38Å; A522-E524 VanDerWaalsContact C-N 3.28Å; A522-E524 PolarHBondContact O-N 3.04Å; A522-Q525 PolarHBondContact O-N 3.03Å
523	R	93.8	Very high	91.6	Very high	210 Å²	210	100.7 Å²	100.7	79%	0.792	48%	0.476	S	S	*	.	H	α-helix	trans	-62	-34.4	175.1	-71.1	170.2	-179.2	177.1	-0.5	112.9	K519 Q520 Q525	K519-R523 VanDerWaalsContact O-CG 3.31Å; K519-R523 WeakPolarHBondContact O-CG 3.04Å; K519-R523 PolarHBondContact O-N 2.78Å; Q520-R523 WeakPolarHBondContact O-CB 3.27Å; Q520-R523 PolarHBondContact O-N 3.14Å; Q520-R523 VanDerWaalsContact O-N 3.13Å; R523-Q525 PolarHBondContact O-N 3.14Å
524	E	94.3	Very high	91.1	Very high	78 Å²	78	101.1 Å²	101.1	36%	0.364	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-3.1	175.1	-68.1	178.5	-160.4	0	0	113.4	Q520 L521 A522 R526	Q520-E524 VanDerWaalsContact CG-OE1 3.28Å; Q520-E524 WeakPolarHBondContact CG-OE1 3.42Å; Q520-E524 PolarHBondContact NE2-OE1 2.96Å; Q520-E524 PolarHBondContact O-N 3.42Å; L521-E524 CarbonylContact O-C 3.55Å; L521-E524 PolarHBondContact O-N 3.47Å; A522-E524 VanDerWaalsContact C-N 3.28Å; A522-E524 PolarHBondContact O-N 3.04Å; E524-R526 HydrophobicContact CB-CB 4.3Å; E524-R526 HydrophobicContact CB-CG 4.09Å; E524-R526 WeakPolarHBondContact O-CG 3.15Å; E524-R526 PolarHBondContact O-N 3.47Å; E524-R526 WeakPolarHBondContact OE2-CD 3.32Å; E524-R526 IonicContact OE2-CZ 2.86Å; E524-R526 IonicContact OE2-NE 2.7Å; E524-R526 IonicContact OE2-NH1 4Å; E524-R526 PolarHBondContact OE2-NH1 2.88Å
525	Q	89	Confident	91.1	Very high	186 Å²	186	104.7 Å²	104.7	87%	0.869	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	36.6	-171.1	-60.2	-178.1	-7.3	0	0	113.1	L521 A522 R523	L521-Q525 PolarHBondContact O-N 3.17Å; L521-Q525 VanDerWaalsContact O-N 3.15Å; A522-Q525 PolarHBondContact O-N 3.03Å; R523-Q525 PolarHBondContact O-N 3.14Å
526	R	90	Very high	91.1	Very high	155 Å²	155	103.6 Å²	103.6	59%	0.585	50%	0.498	S	S	*	.			trans	-115.4	134.6	-177.1	-73.1	171.3	70.5	-157.4	5.2	111.5	L521 E524	L521-R526 WeakPolarHBondContact CB-O 3.43Å; L521-R526 HydrophobicContact CD2-CB 3.92Å; L521-R526 PolarHBondContact O-N 3.14Å; E524-R526 HydrophobicContact CB-CB 4.3Å; E524-R526 HydrophobicContact CB-CG 4.09Å; E524-R526 WeakPolarHBondContact O-CG 3.15Å; E524-R526 PolarHBondContact O-N 3.47Å; E524-R526 WeakPolarHBondContact OE2-CD 3.32Å; E524-R526 IonicContact OE2-CZ 2.86Å; E524-R526 IonicContact OE2-NE 2.7Å; E524-R526 IonicContact OE2-NH1 4Å; E524-R526 PolarHBondContact OE2-NH1 2.88Å
527	C	85.1	Confident	90.9	Very high	110 Å²	110	105.2 Å²	105.2	74%	0.743	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-80.6	156	167.3	-68.1	0	0	0	0	111.3
528	H	88.1	Confident	90.8	Very high	58 Å²	58	105.9 Å²	105.9	27%	0.269	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-66.5	132.1	163.4	175.6	68.3	0	0	0	109.5	L283 L521	L283-H528 HydrophobicContact CD2-CB 3.65Å; L283-H528 HydrophobicContact CG-CB 4.24Å; L521-H528 HydrophobicContact CD1-CB 4.48Å
529	V	90.4	Very high	90.8	Very high	124 Å²	124	105.6 Å²	105.6	75%	0.752	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-99.5	117.3	172.1	-178.2	0	0	0	0	107.6
530	T	91.9	Very high	90.7	Very high	40 Å²	40	106.7 Å²	106.7	25%	0.245	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-64	150.2	173	42.2	0	0	0	0	110.6	V303 F533	V303-T530 HydrophobicContact CB-CG2 3.67Å; V303-T530 HydrophobicContact CG1-CG2 3.75Å; T530-F533 VanDerWaalsContact CB-O 3.25Å; T530-F533 WeakPolarHBondContact CB-O 3.15Å; T530-F533 PolarHBondContact OG1-O 2.85Å
531	K	91.3	Very high	90.5	Very high	141 Å²	141	107.1 Å²	107.1	61%	0.613	52%	0.519	S	S	*	.	S	Bend	trans	-100.8	-29.3	-169.7	-170.3	172.1	178.4	178.9	0	114	E301	E301-K531 PolarHBondContact OE1-N 3.28Å; E301-K531 PolarHBondContact OE2-N 3.19Å
532	W	90.9	Very high	90.4	Very high	106 Å²	106	113.2 Å²	113.2	40%	0.402	55%	0.547	S	S	.	.	S	Bend	trans	-126.3	-10.5	-171.6	-49.9	109	0	0	0	114	W50 E301	W50-W532 AromaticContact CH2-CH2 3.9Å; W50-W532 HydrophobicContact CH2-CH2 3.9Å; W50-W532 HydrophobicContact CH2-CZ3 4.42Å; W50-W532 AromaticContact CZ2-CH2 3.88Å; W50-W532 HydrophobicContact CZ2-CH2 3.88Å; E301-W532 PolarHBondContact OE2-N 3.08Å
533	F	93.4	Very high	90.3	Very high	40 Å²	40	116.7 Å²	116.7	18%	0.175	54%	0.543	C	S	.	.			trans	-130.6	148.7	179.7	-62.4	-96.5	0	0	0	110	V299 E301 V303 A311 H313 T530	V299-F533 HydrophobicContact CG1-CZ 4.39Å; E301-F533 HydrophobicContact CB-CD2 3.57Å; E301-F533 HydrophobicContact CB-CE2 3.7Å; V303-F533 HydrophobicContact CG1-CB 3.9Å; V303-F533 HydrophobicContact CG1-CD2 4.33Å; V303-F533 HydrophobicContact CG1-CG 4.29Å; A311-F533 HydrophobicContact CB-CB 4.46Å; A311-F533 HydrophobicContact CB-CD1 3.73Å; A311-F533 HydrophobicContact CB-CD2 4.28Å; A311-F533 HydrophobicContact CB-CE1 3.99Å; A311-F533 HydrophobicContact CB-CG 3.9Å; A311-F533 HydrophobicContact CB-CZ 4.39Å; H313-F533 HydrophobicContact CB-CE1 4.04Å; H313-F533 HydrophobicContact CB-CZ 4.26Å; T530-F533 VanDerWaalsContact CB-O 3.25Å; T530-F533 WeakPolarHBondContact CB-O 3.15Å; T530-F533 PolarHBondContact OG1-O 2.85Å
534	E	85.6	Confident	90	Very high	152 Å²	152	108.2 Å²	108.2	71%	0.71	52%	0.521	S	S	*	.			trans	-126.9	0	175.5	-67.2	178.8	-177.8	0	0	109.4

Retrieved 534 of 534 residues in 140.2 ms (Link to these results)

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