A0A087X4R9_POEFO Loading...

NHL repeat-containing protein 3

AlphaFold DB , UniProt , Accession A0A087X4R9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 353 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	I	45	Very low	35.4	Very low	220 Å²	220	168.2 Å²	168.2	100%	1.128	83%	0.828	S	S	*	*				0	77.8	0	-52.9	167.1	0	0	0	106.2
2	K	37	Very low	35.1	Very low	208 Å²	208	164.8 Å²	164.8	90%	0.904	83%	0.833	S	S	*	*				47.6	96.9	51.5	-81.1	-167.4	-179	177.2	0	116.5
3	K	37.3	Very low	34.8	Very low	204 Å²	204	157.5 Å²	157.5	89%	0.887	82%	0.824	S	S	*	*			trans	-132.8	112	143.9	-77.6	-175.1	174.4	-178.3	0	104.4
4	R	37.9	Very low	34.6	Very low	240 Å²	240	159.2 Å²	159.2	91%	0.906	83%	0.829	S	S	*	*				45.1	128.8	65.3	-82.3	-171.7	170.8	-179	-2.2	111.6
5	S	34.8	Very low	34.5	Very low	99 Å²	99	157.8 Å²	157.8	69%	0.692	83%	0.83	S	S	*	*			cis	-161	141.5	22.7	55.4	0	0	0	0	110.5
6	H	36.9	Very low	34.5	Very low	169 Å²	169	154.4 Å²	154.4	78%	0.782	82%	0.823	S	S	*	*				45.6	131.6	105.5	-63.8	-53.8	0	0	0	119.3
7	W	33.8	Very low	34.3	Very low	233 Å²	233	155.5 Å²	155.5	88%	0.883	83%	0.828	S	S	*	*				160.4	117.5	119	-89.1	56.3	0	0	0	108
8	C	31	Very low	34.2	Very low	106 Å²	106	153.2 Å²	153.2	72%	0.716	82%	0.82	S	S	*	*				54.4	128.5	79	-98.9	0	0	0	0	112.3
9	L	33.2	Very low	34	Very low	136 Å²	136	152.9 Å²	152.9	71%	0.712	82%	0.818	S	S	*	*			cis	-174.9	154.7	34.6	-90.6	143.5	0	0	0	111
10	I	31.8	Very low	33.8	Very low	143 Å²	143	153.5 Å²	153.5	73%	0.733	81%	0.813	S	S	*	*			trans	73.5	108.5	134.5	-64.7	171.3	0	0	0	122
11	A	30.4	Very low	33.7	Very low	92 Å²	92	154.9 Å²	154.9	76%	0.76	82%	0.817	S	S	*	*				67.5	155.5	114.6	0	0	0	0	0	125
12	S	32.3	Very low	33	Very low	128 Å²	128	148.4 Å²	148.4	90%	0.895	79%	0.788	S	S	*	*			trans	85	133.4	162.1	-159.2	0	0	0	0	115.9
13	G	31.3	Very low	32.8	Very low	69 Å²	69	145.4 Å²	145.4	71%	0.711	78%	0.781	S	S	*	*			cis	-168.6	175.7	10.2	0	0	0	0	0	111.3
14	M	32.3	Very low	32.5	Very low	182 Å²	182	142.1 Å²	142.1	90%	0.897	77%	0.773	S	S	*	*			trans	-57.2	156	179.5	-70.5	-166.4	-98.6	0	0	113.8
15	V	33.1	Very low	32.2	Very low	138 Å²	138	141.2 Å²	141.2	84%	0.836	77%	0.77	S	S	*	*				165.7	127.6	115.5	161.4	0	0	0	0	110.4
16	S	33.8	Very low	32	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	77%	0.772	S	S	*	*			trans	-64.5	151.2	170.6	-48.7	0	0	0	0	113.1
17	L	31.9	Very low	31.6	Very low	172 Å²	172	136.9 Å²	136.9	90%	0.901	77%	0.771	S	S	*	*				-178.6	146	126.1	-105.6	138.6	0	0	0	113.3
18	V	31.3	Very low	31.5	Very low	114 Å²	114	131.3 Å²	131.3	69%	0.691	77%	0.768	S	S	*	*			trans	-91.4	156.3	-172.4	173.5	0	0	0	0	110.6
19	L	31.1	Very low	31.5	Very low	148 Å²	148	131.5 Å²	131.5	78%	0.775	77%	0.77	S	S	*	*			trans	152.4	110.9	134.7	-93	120.7	0	0	0	110.1
20	F	30.1	Very low	31.5	Very low	165 Å²	165	132.9 Å²	132.9	72%	0.724	78%	0.778	S	S	*	*				81.6	111.7	86.4	-115.7	-85.3	0	0	0	114	T22	F20-T22 HydrophobicContact CD1-CG2 4.15Å; F20-T22 HydrophobicContact CE1-CG2 3.92Å
21	M	32.3	Very low	31.4	Very low	183 Å²	183	129.8 Å²	129.8	90%	0.901	78%	0.781	S	S	*	*			trans	-162.5	141.8	137.2	-108.9	-62.5	-178.1	0	0	110.3
22	T	30.4	Very low	31.3	Very low	83 Å²	83	128.8 Å²	128.8	51%	0.509	78%	0.78	S	S	.	*			trans	-115.9	163.4	-157.6	39	0	0	0	0	112.6	F20	F20-T22 HydrophobicContact CD1-CG2 4.15Å; F20-T22 HydrophobicContact CE1-CG2 3.92Å
23	L	31.8	Very low	31.3	Very low	146 Å²	146	130.8 Å²	130.8	76%	0.764	78%	0.78	S	S	*	*			trans	78.9	133.8	154	-67.3	150.5	0	0	0	115.9
24	L	31.5	Very low	31.1	Very low	135 Å²	135	139.6 Å²	139.6	71%	0.707	79%	0.791	S	S	*	*			cis	-165.6	146.4	7.7	-91.7	153.9	0	0	0	107.4
25	Y	30.4	Very low	31.1	Very low	220 Å²	220	142.1 Å²	142.1	86%	0.863	79%	0.791	S	S	*	*				-174.7	118.9	113.5	-114.4	-93.7	0	0	0	111.6
26	S	31.2	Very low	31	Very low	104 Å²	104	143 Å²	143	73%	0.727	79%	0.791	S	S	*	*			trans	-4.4	137.4	162	57.5	0	0	0	0	122.3
27	G	29.9	Very low	30.9	Very low	73 Å²	73	143.1 Å²	143.1	75%	0.753	79%	0.792	S	S	*	*			trans	174.8	73	157	0	0	0	0	0	113.2
28	S	30.8	Very low	31	Very low	117 Å²	117	140.2 Å²	140.2	82%	0.818	79%	0.786	S	S	*	*			trans	-26.9	150.9	160.7	38.1	0	0	0	0	115.9
29	S	30.6	Very low	31.5	Very low	109 Å²	109	145.9 Å²	145.9	76%	0.762	80%	0.795	S	S	*	*			cis	-176.5	159.5	15.3	35.5	0	0	0	0	109.8
30	D	34	Very low	32	Very low	166 Å²	166	147 Å²	147	89%	0.888	80%	0.801	S	S	*	*			trans	70.8	117.2	170.5	-88.4	-12.5	0	0	0	118
31	G	29.5	Very low	32.3	Very low	77 Å²	77	149.7 Å²	149.7	79%	0.794	81%	0.806	S	S	*	*			cis	97.5	89.3	39.6	0	0	0	0	0	107.3
32	G	28.2	Very low	32.4	Very low	71 Å²	71	149.8 Å²	149.8	73%	0.732	80%	0.804	S	S	*	*				141.1	130.8	74.4	0	0	0	0	0	108.9
33	L	31.2	Very low	32.6	Very low	171 Å²	171	152.4 Å²	152.4	90%	0.895	82%	0.815	S	S	*	*			trans	6.8	123.1	171.1	-72.4	98.3	0	0	0	120.1
34	R	28.2	Very low	33	Very low	253 Å²	253	155.1 Å²	155.1	96%	0.955	82%	0.816	S	S	*	*			trans	-127.7	116.8	142.2	-88.2	-170.9	172	-172	-1.7	113.2
35	R	31.4	Very low	33.4	Very low	235 Å²	235	157.3 Å²	157.3	89%	0.887	82%	0.823	S	S	*	*			trans	-55.7	134.3	168.4	-161.6	173.4	-179.9	-179.3	-0.8	110	S37	R35-S37 PolarHBondContact O-N 3.21Å
36	N	32.6	Very low	34.3	Very low	156 Å²	156	149.1 Å²	149.1	83%	0.834	79%	0.794	S	S	*	*			trans	-64.6	109.8	175.8	-127.1	-6.1	0	0	0	110
37	S	31.6	Very low	35.2	Very low	108 Å²	108	152.7 Å²	152.7	76%	0.755	80%	0.801	S	S	*	*			trans	-143.8	61.8	162.9	68.9	0	0	0	0	109.6	R35 R39	R35-S37 PolarHBondContact O-N 3.21Å; S37-R39 PolarHBondContact O-N 3.18Å
38	S	34.1	Very low	36.8	Very low	111 Å²	111	152.1 Å²	152.1	78%	0.776	80%	0.796	S	S	*	*			trans	-86.5	66	168.6	64.2	0	0	0	0	110.3
39	R	41.5	Very low	38.8	Very low	232 Å²	232	154.4 Å²	154.4	88%	0.875	79%	0.786	S	S	*	*			trans	-131.7	96	153.3	-90.4	-171.9	-177.8	-179.3	0.9	105.3	S37	S37-R39 PolarHBondContact O-N 3.18Å
40	L	40.9	Very low	41.2	Very low	171 Å²	171	150.1 Å²	150.1	90%	0.895	76%	0.756	S	S	*	*			trans	152.1	88.8	161.8	-85.5	156.3	0	0	0	107.9
41	R	35.6	Very low	43.9	Very low	223 Å²	223	143.6 Å²	143.6	84%	0.842	72%	0.721	S	S	*	*			trans	-179.1	79.9	152.7	-99.1	165.9	-157.5	-120.6	5.1	105.9
42	H	35.5	Very low	46.9	Very low	185 Å²	185	141.3 Å²	141.3	86%	0.856	69%	0.689	S	S	*	*			trans	-81.7	114.7	147.5	-85.6	72	0	0	0	104.4	Y44	H42-Y44 PolarHBondContact O-N 3.15Å; H42-Y44 VanDerWaalsContact O-N 3.15Å
43	D	34.9	Very low	50.1	Low	138 Å²	138	143.6 Å²	143.6	74%	0.738	68%	0.678	S	S	*	*			trans	-61.4	111.6	-177.4	-68.4	-48.1	0	0	0	110.2	Q45	D43-Q45 VanDerWaalsContact C-N 3.3Å; D43-Q45 PolarHBondContact O-N 3.41Å
44	Y	39.7	Very low	53.1	Low	202 Å²	202	139 Å²	139	79%	0.792	65%	0.654	S	S	*	*			trans	-71	86.9	163.8	-80.7	-84.7	0	0	0	108.9	H42 L46	H42-Y44 PolarHBondContact O-N 3.15Å; H42-Y44 VanDerWaalsContact O-N 3.15Å; Y44-L46 VanDerWaalsContact C-N 3.28Å; Y44-L46 HydrophobicContact CD1-CD1 3.45Å; Y44-L46 VanDerWaalsContact CD1-CD1 3.45Å; Y44-L46 HydrophobicContact CD1-CG 4.07Å; Y44-L46 HydrophobicContact CE1-CD1 3.85Å; Y44-L46 PolarHBondContact O-N 3.02Å
45	Q	40.2	Very low	56.4	Low	182 Å²	182	129.1 Å²	129.1	85%	0.85	62%	0.62	S	S	*	*			trans	-89.6	72.4	152.6	-93.9	179	-22.4	0	0	108.8	D43 M47	D43-Q45 VanDerWaalsContact C-N 3.3Å; D43-Q45 PolarHBondContact O-N 3.41Å; Q45-M47 PolarHBondContact O-N 3.22Å
46	L	48.9	Very low	59.4	Low	48 Å²	48	125.3 Å²	125.3	25%	0.251	62%	0.617	S	S	.	*			trans	-82.8	42.4	167.7	-92	168	0	0	0	111	Y44 G48 R49 L51 L348	Y44-L46 VanDerWaalsContact C-N 3.28Å; Y44-L46 HydrophobicContact CD1-CD1 3.45Å; Y44-L46 VanDerWaalsContact CD1-CD1 3.45Å; Y44-L46 HydrophobicContact CD1-CG 4.07Å; Y44-L46 HydrophobicContact CE1-CD1 3.85Å; Y44-L46 PolarHBondContact O-N 3.02Å; L46-G48 PolarHBondContact O-N 3.24Å; L46-R49 HydrophobicContact CD2-CB 4.27Å; L46-L51 HydrophobicContact CD1-CD1 4.41Å; L46-L51 HydrophobicContact CD2-CD2 4.38Å; L46-L348 HydrophobicContact CB-CD1 4.3Å; L46-L348 HydrophobicContact CD1-CD1 3.46Å; L46-L348 VanDerWaalsContact CD1-CD1 3.46Å; L46-L348 HydrophobicContact CG-CD1 4.5Å
47	M	50.1	Low	62.4	Low	179 Å²	179	119.8 Å²	119.8	88%	0.882	60%	0.597	S	S	*	*			trans	-88.6	97.8	175.8	-68.2	-140.1	70.7	0	0	109.3	Q45	Q45-M47 PolarHBondContact O-N 3.22Å
48	G	63.4	Low	65.6	Low	61 Å²	61	115.1 Å²	115.1	63%	0.629	56%	0.562	S	S	*	*	S	Bend	trans	120.5	-2.7	165.4	0	0	0	0	0	117.4	L46 Y279	L46-G48 PolarHBondContact O-N 3.24Å; G48-Y279 PolarHBondContact O-OH 3.32Å
49	R	73.6	Confident	68.6	Low	164 Å²	164	110.3 Å²	110.3	62%	0.619	53%	0.529	S	S	*	.			trans	-84.7	142.2	174.5	-66	-171.9	-176.7	-161.5	3	111.1	L46 L51 A307	L46-R49 HydrophobicContact CD2-CB 4.27Å; R49-L51 PolarHBondContact O-N 3.06Å; R49-A307 WeakPolarHBondContact CD-O 3.47Å
50	P	81.1	Confident	71.2	Confident	20 Å²	20	104.3 Å²	104.3	13%	0.13	51%	0.509	C	S	.	.			trans	-70.7	124.8	175.4	31.2	-33.3	0	0	0	108.8	Y52 Y279 L292 S308	P50-Y52 HydrophobicContact CB-CE2 4.22Å; P50-Y279 HydrophobicContact CB-CD2 4.07Å; P50-Y279 HydrophobicContact CB-CE2 3.88Å; P50-Y279 HydrophobicContact CG-CD1 4.15Å; P50-Y279 HydrophobicContact CG-CD2 3.79Å; P50-Y279 HydrophobicContact CG-CE1 4.01Å; P50-Y279 HydrophobicContact CG-CE2 3.63Å; P50-Y279 HydrophobicContact CG-CG 4.05Å; P50-L292 HydrophobicContact CB-CD2 3.62Å; P50-L292 HydrophobicContact CG-CB 4.21Å; P50-L292 HydrophobicContact CG-CD2 3.45Å; P50-L292 VanDerWaalsContact CG-CD2 3.45Å; P50-L292 HydrophobicContact CG-CG 4.42Å; P50-S308 VanDerWaalsContact O-CB 3.22Å; P50-S308 WeakPolarHBondContact O-CB 3.07Å; P50-S308 PolarHBondContact O-OG 2.85Å
51	L	88.9	Confident	73.8	Confident	29 Å²	29	99.2 Å²	99.2	15%	0.152	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138.2	177.8	-61.7	174.8	0	0	0	109.2	L46 R49 P345 F346 L348	L46-L51 HydrophobicContact CD1-CD1 4.41Å; L46-L51 HydrophobicContact CD2-CD2 4.38Å; R49-L51 PolarHBondContact O-N 3.06Å; L51-P345 CarbonylContact O-C 3.56Å; L51-P345 VanDerWaalsContact O-CA 3.29Å; L51-P345 WeakPolarHBondContact O-CA 3.44Å; L51-F346 HydrophobicContact CB-CD1 3.94Å; L51-F346 HydrophobicContact CB-CD2 4.44Å; L51-F346 HydrophobicContact CB-CE1 3.57Å; L51-F346 HydrophobicContact CB-CE2 4.11Å; L51-F346 HydrophobicContact CB-CG 4.37Å; L51-F346 HydrophobicContact CB-CZ 3.66Å; L51-F346 HydrophobicContact CD1-CE2 3.99Å; L51-F346 HydrophobicContact CD1-CZ 4.09Å; L51-F346 HydrophobicContact CG-CZ 4.41Å; L51-F346 PolarHBondContact O-N 3.17Å; L51-L348 HydrophobicContact CD1-CD1 3.57Å; L51-L348 HydrophobicContact CD1-CG 3.9Å
52	Y	93.9	Very high	76.5	Confident	29 Å²	29	91.2 Å²	91.2	11%	0.114	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	138.2	-177	-78.4	-96.9	0	0	0	110.1	P50 L292 I310 G328 L330 F343 T344 P345 F346	P50-Y52 HydrophobicContact CB-CE2 4.22Å; Y52-L292 HydrophobicContact CD2-CD1 4.49Å; Y52-L292 HydrophobicContact CD2-CD2 4.15Å; Y52-L292 HydrophobicContact CE2-CD2 3.58Å; Y52-I310 VanDerWaalsContact CB-CD1 3.42Å; Y52-I310 HydrophobicContact CD1-CD1 4.27Å; Y52-I310 HydrophobicContact CD2-CD1 3.88Å; Y52-I310 HydrophobicContact CD2-CG1 4.39Å; Y52-I310 HydrophobicContact CG-CD1 3.61Å; Y52-I310 HydrophobicContact CG-CG1 4.35Å; Y52-G328 VanDerWaalsContact CE1-O 3.23Å; Y52-G328 WeakPolarHBondContact CE1-O 3.45Å; Y52-G328 PolarHBondContact OH-O 3.32Å; Y52-G328 VanDerWaalsContact OH-O 3.14Å; Y52-L330 HydrophobicContact CD1-CB 4.29Å; Y52-L330 HydrophobicContact CE1-CB 3.98Å; Y52-F343 HydrophobicContact CD1-CB 3.96Å; Y52-T344 VanDerWaalsContact CA-O 3.32Å; Y52-T344 WeakPolarHBondContact CA-O 3.21Å; Y52-P345 HydrophobicContact CE1-CB 4.32Å; Y52-F346 WeakPolarHBondContact O-CE1 3.4Å
53	K	94	Very high	79.3	Confident	119 Å²	119	88.2 Å²	88.2	52%	0.517	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142	174	63.7	175.7	-176.6	173.3	0	109.7	D55 F343 T344 F346	K53-D55 PolarHBondContact O-N 3.37Å; K53-F343 CarbonylContact O-C 3.51Å; K53-F343 VanDerWaalsContact O-CA 3.23Å; K53-F343 WeakPolarHBondContact O-CA 3.42Å; K53-T344 WeakPolarHBondContact CE-OG1 3.3Å; K53-T344 WeakPolarHBondContact CG-OG1 3.46Å; K53-T344 PolarHBondContact N-O 3.02Å; K53-T344 PolarHBondContact O-N 3.32Å; K53-F346 HydrophobicContact CB-CD1 3.82Å; K53-F346 HydrophobicContact CB-CE1 3.96Å; K53-F346 HydrophobicContact CD-CD1 4.49Å; K53-F346 HydrophobicContact CG-CD1 4.02Å
54	L	95.6	Very high	82.2	Confident	73 Å²	73	83.8 Å²	83.8	38%	0.382	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	130.4	170.8	178.7	59.4	0	0	0	109.8	L56 Q341 F343	L54-L56 HydrophobicContact CD2-CD2 3.61Å; L54-L56 HydrophobicContact CG-CD2 3.97Å; L54-Q341 HydrophobicContact CD1-CB 4.12Å; L54-Q341 HydrophobicContact CD1-CG 4.38Å; L54-Q341 VanDerWaalsContact CD1-OE1 3.27Å; L54-F343 HydrophobicContact CB-CD1 4.11Å; L54-F343 HydrophobicContact CB-CE1 3.85Å; L54-F343 HydrophobicContact CD1-CD1 4.4Å; L54-F343 HydrophobicContact CD1-CE1 3.92Å; L54-F343 HydrophobicContact CD1-CE2 4.29Å; L54-F343 HydrophobicContact CD1-CZ 3.85Å; L54-F343 HydrophobicContact CG-CE1 4.44Å
55	D	96.4	Very high	84.9	Confident	47 Å²	47	75 Å²	75	25%	0.251	39%	0.387	S	S	.	.			trans	-91.7	93.2	171.4	-173.3	-5.6	0	0	0	109	K53 G57 W58 K342 T344	K53-D55 PolarHBondContact O-N 3.37Å; D55-G57 PolarHBondContact O-N 2.83Å; D55-G57 VanDerWaalsContact O-N 3.11Å; D55-G57 PolarHBondContact OD1-N 3.18Å; D55-G57 VanDerWaalsContact OD1-N 3.12Å; D55-W58 HydrophobicContact CB-CB 4.48Å; D55-W58 PolarHBondContact O-N 2.88Å; D55-W58 VanDerWaalsContact O-N 3.1Å; D55-K342 HydrophobicContact CB-CB 4.24Å; D55-K342 HydrophobicContact CB-CD 4.15Å; D55-K342 HydrophobicContact CB-CG 4.2Å; D55-K342 WeakPolarHBondContact CB-O 3.33Å; D55-K342 PolarHBondContact N-O 3.25Å; D55-K342 WeakPolarHBondContact OD2-CD 3.37Å; D55-K342 IonicContact OD2-NZ 3.08Å; D55-K342 PolarHBondContact OD2-NZ 3.07Å; D55-K342 VanDerWaalsContact OD2-NZ 3.08Å; D55-T344 HydrophobicContact CB-CG2 4.38Å
56	L	95.1	Very high	87.5	Confident	155 Å²	155	70.4 Å²	70.4	81%	0.812	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.9	179.7	-64.1	174.9	0	0	0	113.5	L54 W58	L54-L56 HydrophobicContact CD2-CD2 3.61Å; L54-L56 HydrophobicContact CG-CD2 3.97Å; L56-W58 VanDerWaalsContact C-N 3.32Å
57	G	96.4	Very high	89.7	Confident	40 Å²	40	68.4 Å²	68.4	41%	0.412	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-5.3	176.3	0	0	0	0	0	113.8	D55 K60	D55-G57 PolarHBondContact O-N 2.83Å; D55-G57 VanDerWaalsContact O-N 3.11Å; D55-G57 PolarHBondContact OD1-N 3.18Å; D55-G57 VanDerWaalsContact OD1-N 3.12Å; G57-K60 WeakPolarHBondContact O-CG 3.38Å
58	W	97.6	Very high	91.9	Very high	9 Å²	9	64.1 Å²	64.1	3%	0.034	34%	0.341	C	S	.	.	S	Bend	trans	-123.5	128.1	-177.6	-168	102.8	0	0	0	111.5	D55 L56 V81 V83 F96 T97 T98 G100 Y331 A340 K342	D55-W58 HydrophobicContact CB-CB 4.48Å; D55-W58 PolarHBondContact O-N 2.88Å; D55-W58 VanDerWaalsContact O-N 3.1Å; L56-W58 VanDerWaalsContact C-N 3.32Å; W58-V81 HydrophobicContact CH2-CG1 4.05Å; W58-V81 HydrophobicContact CZ2-CB 3.92Å; W58-V81 HydrophobicContact CZ2-CG1 3.79Å; W58-V81 HydrophobicContact CZ2-CG2 4.03Å; W58-V83 HydrophobicContact CH2-CG2 4.28Å; W58-F96 HydrophobicContact CZ2-CB 4.38Å; W58-T97 PolarHBondContact NE1-O 2.81Å; W58-T98 VanDerWaalsContact CD1-O 3.31Å; W58-G100 VanDerWaalsContact NE1-CA 3.32Å; W58-Y331 HydrophobicContact CD2-CD1 4.33Å; W58-Y331 AromaticContact CD2-CE1 3.91Å; W58-Y331 HydrophobicContact CD2-CE1 3.91Å; W58-Y331 AromaticContact CE2-CE1 3.52Å; W58-Y331 HydrophobicContact CE3-CD1 4.22Å; W58-Y331 HydrophobicContact CE3-CE1 4.26Å; W58-Y331 AromaticContact CH2-CD1 3.59Å; W58-Y331 HydrophobicContact CH2-CD1 3.59Å; W58-Y331 AromaticContact CH2-CE1 3.96Å; W58-Y331 HydrophobicContact CH2-CE1 3.96Å; W58-Y331 AromaticContact CZ2-CD1 3.7Å; W58-Y331 HydrophobicContact CZ2-CD1 3.7Å; W58-Y331 AromaticContact CZ2-CE1 3.58Å; W58-Y331 HydrophobicContact CZ2-CE1 3.58Å; W58-Y331 AromaticContact CZ3-CD1 3.84Å; W58-Y331 HydrophobicContact CZ3-CD1 3.84Å; W58-Y331 HydrophobicContact CZ3-CE1 4.26Å; W58-Y331 AromaticContact NE1-CE1 3.86Å; W58-A340 HydrophobicContact CH2-CB 3.76Å; W58-A340 HydrophobicContact CZ3-CB 3.65Å; W58-A340 WeakPolarHBondContact CZ3-O 3.42Å; W58-K342 HydrophobicContact CB-CB 3.88Å; W58-K342 HydrophobicContact CB-CD 3.8Å; W58-K342 HydrophobicContact CD2-CB 3.7Å; W58-K342 HydrophobicContact CD2-CD 4.23Å; W58-K342 HydrophobicContact CE3-CB 3.52Å; W58-K342 HydrophobicContact CG-CB 3.83Å; W58-K342 HydrophobicContact CG-CD 3.69Å; W58-K342 HydrophobicContact CG-CG 4.44Å; W58-K342 HydrophobicContact CZ3-CB 4.32Å
59	P	97.3	Very high	93.5	Very high	11 Å²	11	61.2 Å²	61.2	7%	0.071	31%	0.311	C	S	.	.	S	Bend	cis	-77.3	160.9	-9.3	28.1	-25	0	0	0	111.4	N61 P62 F65 F96 A340	P59-N61 VanDerWaalsContact C-N 3.34Å; P59-P62 HydrophobicContact CG-CB 4.19Å; P59-F65 HydrophobicContact CG-CE2 3.6Å; P59-F65 HydrophobicContact CG-CZ 4.07Å; P59-F96 HydrophobicContact CB-CD1 4.24Å; P59-F96 HydrophobicContact CB-CE1 4.16Å; P59-A340 WeakPolarHBondContact CD-O 3.44Å
60	K	96.9	Very high	94.6	Very high	106 Å²	106	54.3 Å²	54.3	46%	0.461	29%	0.286	S	S	.	.	S	Bend	trans	-73.2	-26.9	-178.6	-69.4	-176.1	179.1	-173.6	0	113.8	G57 E99 G100 E101	G57-K60 WeakPolarHBondContact O-CG 3.38Å; K60-E99 WeakPolarHBondContact CE-O 3.35Å; K60-G100 PolarHBondContact N-O 2.86Å; K60-G100 VanDerWaalsContact N-O 3.07Å; K60-E101 HydrophobicContact CD-CG 4.41Å; K60-E101 WeakPolarHBondContact CD-OE1 3.49Å; K60-E101 VanDerWaalsContact CE-OE1 3.31Å; K60-E101 WeakPolarHBondContact CE-OE1 3.39Å; K60-E101 IonicContact NZ-OE1 2.99Å; K60-E101 PolarHBondContact NZ-OE1 2.97Å
61	N	94.1	Very high	95.4	Very high	64 Å²	64	53.4 Å²	53.4	34%	0.342	28%	0.28	S	S	.	.			trans	-129.8	69.5	-178	-70	92.6	0	0	0	110.1	P59 E63 I64	P59-N61 VanDerWaalsContact C-N 3.34Å; N61-E63 VanDerWaalsContact CA-OE2 3.27Å; N61-E63 WeakPolarHBondContact CA-OE2 3.41Å; N61-E63 WeakPolarHBondContact CB-OE1 3.25Å; N61-E63 PolarHBondContact ND2-OE1 3.33Å; N61-E63 PolarHBondContact O-N 3.24Å; N61-I64 HydrophobicContact CB-CD1 3.67Å; N61-I64 HydrophobicContact CB-CG1 4.04Å; N61-I64 WeakPolarHBondContact O-CB 3.28Å; N61-I64 WeakPolarHBondContact O-CG1 3.22Å; N61-I64 PolarHBondContact O-N 2.7Å
62	P	92.6	Very high	95.8	Very high	54 Å²	54	52.1 Å²	52.1	35%	0.351	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-63.1	-22.3	-176.6	27	-34.9	0	0	0	113.2	P59 I64 F65	P59-P62 HydrophobicContact CG-CB 4.19Å; P62-I64 PolarHBondContact O-N 3.3Å; P62-I64 VanDerWaalsContact O-N 3.09Å; P62-F65 WeakPolarHBondContact O-CD2 3.32Å; P62-F65 PolarHBondContact O-N 2.79Å; P62-F65 VanDerWaalsContact O-N 3.09Å
63	E	94.3	Very high	96	Very high	122 Å²	122	50.8 Å²	50.8	57%	0.57	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-63.5	-11.7	176.5	71.7	-75.8	177.9	0	0	114.5	N61 F65	N61-E63 VanDerWaalsContact CA-OE2 3.27Å; N61-E63 WeakPolarHBondContact CA-OE2 3.41Å; N61-E63 WeakPolarHBondContact CB-OE1 3.25Å; N61-E63 PolarHBondContact ND2-OE1 3.33Å; N61-E63 PolarHBondContact O-N 3.24Å; E63-F65 PolarHBondContact O-N 2.87Å
64	I	95.6	Very high	96.3	Very high	46 Å²	46	45.2 Å²	45.2	24%	0.236	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-69.1	-25.4	173.7	-64.6	176.9	0	0	0	111.1	N61 P62 T66 L94 F102	N61-I64 HydrophobicContact CB-CD1 3.67Å; N61-I64 HydrophobicContact CB-CG1 4.04Å; N61-I64 WeakPolarHBondContact O-CB 3.28Å; N61-I64 WeakPolarHBondContact O-CG1 3.22Å; N61-I64 PolarHBondContact O-N 2.7Å; P62-I64 PolarHBondContact O-N 3.3Å; P62-I64 VanDerWaalsContact O-N 3.09Å; I64-T66 PolarHBondContact O-N 2.91Å; I64-L94 HydrophobicContact CG2-CD1 3.86Å; I64-L94 HydrophobicContact CG2-CD2 4.04Å; I64-F102 HydrophobicContact CD1-CB 3.66Å; I64-F102 HydrophobicContact CD1-CD1 4.08Å; I64-F102 HydrophobicContact CD1-CD2 3.99Å; I64-F102 HydrophobicContact CD1-CG 3.64Å; I64-F102 HydrophobicContact CG2-CD2 4.16Å; I64-F102 HydrophobicContact CG2-CE2 4.08Å
65	F	96.4	Very high	96.4	Very high	16 Å²	16	41.9 Å²	41.9	7%	0.07	23%	0.226	C	C	.	.			trans	-68.3	119	169.8	-56.5	-57.9	0	0	0	109.3	P59 P62 E63 V69 V83 L94 F96 Q338 Q339 A340	P59-F65 HydrophobicContact CG-CE2 3.6Å; P59-F65 HydrophobicContact CG-CZ 4.07Å; P62-F65 WeakPolarHBondContact O-CD2 3.32Å; P62-F65 PolarHBondContact O-N 2.79Å; P62-F65 VanDerWaalsContact O-N 3.09Å; E63-F65 PolarHBondContact O-N 2.87Å; F65-V69 HydrophobicContact CB-CG2 4.2Å; F65-V69 HydrophobicContact CD1-CG2 3.61Å; F65-V69 HydrophobicContact CE1-CG2 4.15Å; F65-V69 HydrophobicContact CG-CG2 3.89Å; F65-V83 HydrophobicContact CD1-CG1 4.41Å; F65-V83 HydrophobicContact CE1-CB 4.06Å; F65-V83 HydrophobicContact CE1-CG1 3.6Å; F65-V83 HydrophobicContact CE1-CG2 4.4Å; F65-V83 HydrophobicContact CZ-CG1 4.19Å; F65-V83 HydrophobicContact CZ-CG2 4.5Å; F65-L94 HydrophobicContact CD1-CD1 3.52Å; F65-L94 HydrophobicContact CE1-CD1 3.78Å; F65-F96 AromaticContact CE1-CE2 3.75Å; F65-F96 HydrophobicContact CE1-CE2 3.75Å; F65-F96 AromaticContact CE1-CZ 3.86Å; F65-F96 HydrophobicContact CE1-CZ 3.86Å; F65-F96 AromaticContact CZ-CE2 3.86Å; F65-F96 HydrophobicContact CZ-CE2 3.86Å; F65-F96 AromaticContact CZ-CZ 3.82Å; F65-F96 HydrophobicContact CZ-CZ 3.82Å; F65-Q338 WeakPolarHBondContact CB-O 3.48Å; F65-Q339 HydrophobicContact CD2-CB 3.82Å; F65-Q339 HydrophobicContact CE2-CB 4.07Å; F65-A340 HydrophobicContact CZ-CB 4.06Å
66	T	95.6	Very high	96.3	Very high	86 Å²	86	41 Å²	41	53%	0.528	22%	0.221	S	C	.	.			trans	-124.4	4.1	-175.8	44.2	0	0	0	0	111.8	I64 Q85 V90	I64-T66 PolarHBondContact O-N 2.91Å; T66-Q85 VanDerWaalsContact N-OE1 3.12Å; T66-V90 WeakPolarHBondContact O-CG1 3.39Å
67	G	95.4	Very high	96.4	Very high	6 Å²	6	36.7 Å²	36.7	6%	0.062	20%	0.199	C	C	.	.	S	Bend	trans	-141.9	-177.9	178.2	0	0	0	0	0	111.8	V69 R86	G67-V69 PolarHBondContact O-N 2.82Å; G67-R86 CarbonylContact C-O 3.58Å; G67-R86 WeakPolarHBondContact CA-O 3.13Å
68	E	96	Very high	96.5	Very high	89 Å²	89	37.5 Å²	37.5	42%	0.416	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	113.3	179.7	-61.1	177.3	117.7	0	0	110.1	F70 Q85 R86	E68-F70 HydrophobicContact CB-CD2 4.06Å; E68-F70 HydrophobicContact CB-CE2 4.14Å; E68-F70 PolarHBondContact O-N 2.84Å; E68-Q85 CarbonylContact O-C 3.48Å; E68-Q85 WeakPolarHBondContact O-CA 3.39Å; E68-R86 HydrophobicContact CB-CB 4.38Å; E68-R86 PolarHBondContact N-O 2.93Å; E68-R86 PolarHBondContact O-N 2.87Å
69	V	96.8	Very high	96.5	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	120.2	178.2	175.9	0	0	0	0	109.8	F65 G67 V83 Q85 A333 E334 Q339 A340	F65-V69 HydrophobicContact CB-CG2 4.2Å; F65-V69 HydrophobicContact CD1-CG2 3.61Å; F65-V69 HydrophobicContact CE1-CG2 4.15Å; F65-V69 HydrophobicContact CG-CG2 3.89Å; G67-V69 PolarHBondContact O-N 2.82Å; V69-V83 HydrophobicContact CB-CG1 4.49Å; V69-V83 HydrophobicContact CG1-CG1 3.44Å; V69-V83 VanDerWaalsContact CG1-CG1 3.44Å; V69-V83 HydrophobicContact CG2-CG1 4.24Å; V69-Q85 HydrophobicContact CG2-CB 4.29Å; V69-A333 HydrophobicContact CG1-CB 3.83Å; V69-E334 CarbonylContact O-C 3.53Å; V69-Q339 WeakPolarHBondContact CB-O 3.24Å; V69-Q339 WeakPolarHBondContact CG1-O 3.36Å; V69-A340 HydrophobicContact CG1-CB 4.26Å
70	F	96.1	Very high	96.5	Very high	20 Å²	20	39.3 Å²	39.3	9%	0.088	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	-35.1	-167.9	-112.9	-94.7	0	0	0	113.9	E68 A84 R86 H319 A333 I335	E68-F70 HydrophobicContact CB-CD2 4.06Å; E68-F70 HydrophobicContact CB-CE2 4.14Å; E68-F70 PolarHBondContact O-N 2.84Å; F70-A84 PolarHBondContact N-O 2.84Å; F70-R86 HydrophobicContact CB-CG 4.37Å; F70-R86 HydrophobicContact CD2-CB 4.44Å; F70-R86 HydrophobicContact CD2-CG 3.79Å; F70-R86 HydrophobicContact CE2-CG 4.36Å; F70-R86 HydrophobicContact CG-CG 4.14Å; F70-R86 VanDerWaalsContact CG-NE 3.29Å; F70-R86 VanDerWaalsContact CZ-CZ 3.41Å; F70-H319 AromaticContact CD1-CE1 3.27Å; F70-H319 WeakPolarHBondContact CD1-CE1 3.45Å; F70-H319 AromaticContact CD1-ND1 3.46Å; F70-H319 WeakPolarHBondContact CD1-ND1 3.31Å; F70-H319 AromaticContact CD1-NE2 3.89Å; F70-H319 AromaticContact CE1-CE1 3.46Å; F70-H319 VanDerWaalsContact CE1-CE1 3.46Å; F70-H319 WeakPolarHBondContact CE1-CE1 3.32Å; F70-H319 AromaticContact CE1-ND1 3.91Å; F70-H319 AromaticContact CE1-NE2 3.59Å; F70-H319 PolarHBondContact O-ND1 2.58Å; F70-A333 VanDerWaalsContact C-CB 3.45Å; F70-A333 WeakPolarHBondContact O-CB 2.85Å; F70-I335 HydrophobicContact CD1-CD1 4.27Å; F70-I335 HydrophobicContact CD2-CD1 4.19Å; F70-I335 HydrophobicContact CD2-CG1 3.98Å; F70-I335 HydrophobicContact CE1-CD1 3.73Å; F70-I335 HydrophobicContact CE2-CD1 3.66Å; F70-I335 HydrophobicContact CE2-CG1 3.79Å; F70-I335 HydrophobicContact CE2-CG2 4.33Å; F70-I335 HydrophobicContact CG-CD1 4.49Å; F70-I335 HydrophobicContact CG-CG1 4.46Å; F70-I335 HydrophobicContact CZ-CD1 3.41Å; F70-I335 VanDerWaalsContact CZ-CD1 3.41Å; F70-I335 HydrophobicContact CZ-CG1 4.08Å
71	C	97.6	Very high	96.6	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.007	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	160.4	177.6	51.4	0	0	0	0	112.8	A84 H115 M117 L320	C71-A84 PolarHBondContact O-N 3.45Å; C71-A84 WeakPolarHBondContact SG-CB 3.33Å; C71-H115 WeakPolarHBondContact CB-O 3.29Å; C71-H115 PolarHBondContact SG-O 3.08Å; C71-M117 HydrophobicContact CB-CB 3.96Å; C71-L320 HydrophobicContact CB-CB 4.33Å; C71-L320 HydrophobicContact CB-CD1 3.77Å
72	V	98.5	Very high	96.8	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.012	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	152.2	177.3	-69	0	0	0	0	109.6	Y82 V83 D322 Y331 A333 A340	V72-Y82 CarbonylContact C-O 3.58Å; V72-Y82 VanDerWaalsContact CA-O 3.22Å; V72-Y82 WeakPolarHBondContact CA-O 3.3Å; V72-V83 HydrophobicContact CG1-CB 4.4Å; V72-V83 HydrophobicContact CG1-CG1 4.12Å; V72-V83 HydrophobicContact CG1-CG2 4.05Å; V72-D322 HydrophobicContact CG2-CB 4.2Å; V72-Y331 WeakPolarHBondContact CG2-O 3.3Å; V72-A333 HydrophobicContact CG1-CB 4.14Å; V72-A340 HydrophobicContact CG1-CB 4.02Å
73	A	98.6	Very high	97.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	145.8	162.8	0	0	0	0	0	110	Y82 M117 L119 D322	A73-Y82 PolarHBondContact N-O 3.12Å; A73-Y82 PolarHBondContact O-N 2.92Å; A73-M117 HydrophobicContact CB-CB 4.38Å; A73-M117 HydrophobicContact CB-CG 3.64Å; A73-M117 HydrophobicContact CB-SD 3.76Å; A73-L119 HydrophobicContact CB-CB 4.3Å; A73-D322 WeakPolarHBondContact CA-OD2 3.29Å
74	V	98.6	Very high	97.3	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.012	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.5	-179	57.6	0	0	0	0	111.6	Q76 V81 T98 L119 D322 L323 D324 Y331	V74-Q76 PolarHBondContact O-OE1 2.96Å; V74-V81 HydrophobicContact CB-CG2 4.45Å; V74-V81 HydrophobicContact CG2-CG2 4.06Å; V74-T98 HydrophobicContact CG2-CG2 4.23Å; V74-L119 WeakPolarHBondContact O-CD2 3.4Å; V74-D322 HydrophobicContact CG1-CB 4.44Å; V74-D322 PolarHBondContact N-OD2 2.94Å; V74-L323 VanDerWaalsContact CG1-O 3.26Å; V74-L323 WeakPolarHBondContact CG1-O 3.32Å; V74-D324 HydrophobicContact CG1-CB 4.4Å; V74-D324 HydrophobicContact CG2-CB 4.34Å; V74-Y331 HydrophobicContact CB-CD2 4.02Å; V74-Y331 HydrophobicContact CB-CE2 4.16Å; V74-Y331 HydrophobicContact CG1-CD2 4.13Å; V74-Y331 HydrophobicContact CG1-CE2 4.46Å; V74-Y331 HydrophobicContact CG2-CD2 4.23Å; V74-Y331 HydrophobicContact CG2-CE2 3.85Å
75	N	98.2	Very high	97.4	Very high	4 Å²	4	21 Å²	21	2%	0.021	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	93.3	166.2	-170	-25.6	0	0	0	109.3	D77 A78 A79 V80 Y82 L119	N75-D77 PolarHBondContact O-N 3.1Å; N75-D77 WeakPolarHBondContact OD1-CA 3.46Å; N75-D77 WeakPolarHBondContact OD1-CB 3.48Å; N75-D77 PolarHBondContact OD1-N 3.25Å; N75-A78 HydrophobicContact CB-CB 4.12Å; N75-A78 PolarHBondContact O-N 3.22Å; N75-A78 PolarHBondContact OD1-N 3.02Å; N75-A79 WeakPolarHBondContact O-CA 3.23Å; N75-A79 PolarHBondContact O-N 3.1Å; N75-V80 PolarHBondContact N-O 2.76Å; N75-V80 PolarHBondContact O-N 3.11Å; N75-Y82 HydrophobicContact CB-CE2 4.28Å; N75-L119 HydrophobicContact CB-CD1 4.34Å; N75-L119 HydrophobicContact CB-CD2 3.35Å; N75-L119 HydrophobicContact CB-CG 4.5Å
76	Q	95.6	Very high	97.4	Very high	28 Å²	28	21.4 Å²	21.4	13%	0.131	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.1	177.4	69.6	-75.8	-12.4	0	0	114.2	V74 D324 L325 K326	V74-Q76 PolarHBondContact O-OE1 2.96Å; Q76-D324 HydrophobicContact CB-CB 4.48Å; Q76-D324 VanDerWaalsContact CB-CG 3.49Å; Q76-D324 WeakPolarHBondContact CB-OD1 3.25Å; Q76-L325 HydrophobicContact CG-CB 4.31Å; Q76-K326 HydrophobicContact CB-CB 4.35Å; Q76-K326 HydrophobicContact CB-CD 4.29Å; Q76-K326 HydrophobicContact CB-CG 4.31Å; Q76-K326 HydrophobicContact CG-CB 4.31Å; Q76-K326 HydrophobicContact CG-CD 4Å; Q76-K326 HydrophobicContact CG-CG 3.81Å; Q76-K326 PolarHBondContact O-NZ 2.7Å
77	D	96.6	Very high	97.3	Very high	65 Å²	65	18.8 Å²	18.8	35%	0.348	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-37.6	176.5	-70.7	-51	0	0	0	111.4	N75 A122 S123 K326	N75-D77 PolarHBondContact O-N 3.1Å; N75-D77 WeakPolarHBondContact OD1-CA 3.46Å; N75-D77 WeakPolarHBondContact OD1-CB 3.48Å; N75-D77 PolarHBondContact OD1-N 3.25Å; D77-A122 VanDerWaalsContact OD2-C 3.28Å; D77-S123 VanDerWaalsContact OD2-CA 3.26Å; D77-S123 WeakPolarHBondContact OD2-CA 3.42Å; D77-S123 WeakPolarHBondContact OD2-CB 3.42Å; D77-S123 PolarHBondContact OD2-N 2.78Å; D77-S123 VanDerWaalsContact OD2-N 3.12Å; D77-K326 WeakPolarHBondContact OD1-CE 3.47Å; D77-K326 IonicContact OD1-NZ 2.84Å; D77-K326 PolarHBondContact OD1-NZ 2.74Å
78	A	97.3	Very high	97.1	Very high	57 Å²	57	23 Å²	23	47%	0.471	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-6.2	176.3	0	0	0	0	0	113.9	N75 V80	N75-A78 HydrophobicContact CB-CB 4.12Å; N75-A78 PolarHBondContact O-N 3.22Å; N75-A78 PolarHBondContact OD1-N 3.02Å; A78-V80 VanDerWaalsContact C-N 3.31Å; A78-V80 HydrophobicContact CB-CB 4.41Å; A78-V80 HydrophobicContact CB-CG2 4.24Å; A78-V80 PolarHBondContact O-N 3.4Å
79	A	97.6	Very high	96.9	Very high	39 Å²	39	26.4 Å²	26.4	32%	0.322	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	42.4	-172.9	0	0	0	0	0	112.7	N75 T97 T98	N75-A79 WeakPolarHBondContact O-CA 3.23Å; N75-A79 PolarHBondContact O-N 3.1Å; A79-T97 CarbonylContact O-C 3.59Å; A79-T97 VanDerWaalsContact O-CA 3.27Å; A79-T97 WeakPolarHBondContact O-CA 3.4Å; A79-T98 HydrophobicContact CB-CG2 4.47Å; A79-T98 WeakPolarHBondContact CB-OG1 3.28Å; A79-T98 PolarHBondContact O-N 3.12Å
80	V	98.4	Very high	96.9	Very high	18 Å²	18	27.5 Å²	27.5	11%	0.109	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	142	-175.1	170.8	0	0	0	0	111.4	N75 A78 Y82 V95 F96 L103	N75-V80 PolarHBondContact N-O 2.76Å; N75-V80 PolarHBondContact O-N 3.11Å; A78-V80 VanDerWaalsContact C-N 3.31Å; A78-V80 HydrophobicContact CB-CB 4.41Å; A78-V80 HydrophobicContact CB-CG2 4.24Å; A78-V80 PolarHBondContact O-N 3.4Å; V80-Y82 HydrophobicContact CG1-CD2 4.37Å; V80-Y82 HydrophobicContact CG1-CE1 4.14Å; V80-Y82 HydrophobicContact CG1-CE2 3.84Å; V80-V95 HydrophobicContact CG1-CG1 3.25Å; V80-F96 CarbonylContact C-O 3.52Å; V80-F96 VanDerWaalsContact CA-O 3.32Å; V80-F96 WeakPolarHBondContact CA-O 3.23Å; V80-L103 HydrophobicContact CG2-CD1 3.84Å
81	V	98.8	Very high	96.8	Very high	0 Å²	0	29 Å²	29	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.3	174.5	-172.6	0	0	0	0	109.1	W58 V74 V83 V95 F96 T98 Y331	W58-V81 HydrophobicContact CH2-CG1 4.05Å; W58-V81 HydrophobicContact CZ2-CB 3.92Å; W58-V81 HydrophobicContact CZ2-CG1 3.79Å; W58-V81 HydrophobicContact CZ2-CG2 4.03Å; V74-V81 HydrophobicContact CB-CG2 4.45Å; V74-V81 HydrophobicContact CG2-CG2 4.06Å; V81-V83 HydrophobicContact CG1-CG2 4.18Å; V81-V95 WeakPolarHBondContact O-CA 3.33Å; V81-F96 PolarHBondContact N-O 3.2Å; V81-F96 PolarHBondContact O-N 3.1Å; V81-T98 HydrophobicContact CG2-CG2 4.12Å; V81-Y331 HydrophobicContact CB-CE1 4.49Å; V81-Y331 HydrophobicContact CG1-CD1 3.93Å; V81-Y331 HydrophobicContact CG1-CE1 4.27Å; V81-Y331 HydrophobicContact CG1-CG 4.18Å; V81-Y331 HydrophobicContact CG2-CD1 4.05Å; V81-Y331 HydrophobicContact CG2-CD2 4.49Å; V81-Y331 HydrophobicContact CG2-CE1 3.54Å; V81-Y331 HydrophobicContact CG2-CE2 4.05Å; V81-Y331 HydrophobicContact CG2-CG 4.49Å
82	Y	98.9	Very high	96.8	Very high	6 Å²	6	30.3 Å²	30.3	2%	0.024	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132	172.5	-56	-87.9	0	0	0	108.7	V72 A73 N75 V80 V93 V95 W106 M117 L119 I129 P148	V72-Y82 CarbonylContact C-O 3.58Å; V72-Y82 VanDerWaalsContact CA-O 3.22Å; V72-Y82 WeakPolarHBondContact CA-O 3.3Å; A73-Y82 PolarHBondContact N-O 3.12Å; A73-Y82 PolarHBondContact O-N 2.92Å; N75-Y82 HydrophobicContact CB-CE2 4.28Å; V80-Y82 HydrophobicContact CG1-CD2 4.37Å; V80-Y82 HydrophobicContact CG1-CE1 4.14Å; V80-Y82 HydrophobicContact CG1-CE2 3.84Å; Y82-V93 HydrophobicContact CD1-CG1 4.4Å; Y82-V95 HydrophobicContact CD1-CG1 4.11Å; Y82-V95 HydrophobicContact CD1-CG2 3.77Å; Y82-V95 HydrophobicContact CE1-CG1 3.94Å; Y82-V95 HydrophobicContact CE1-CG2 4.02Å; Y82-W106 AromaticContact CD1-CZ2 3.84Å; Y82-W106 HydrophobicContact CD1-CZ2 3.84Å; Y82-W106 AromaticContact CE1-CZ2 3.99Å; Y82-W106 HydrophobicContact CE1-CZ2 3.99Å; Y82-M117 VanDerWaalsContact CB-SD 3.58Å; Y82-L119 HydrophobicContact CE2-CD1 4.39Å; Y82-I129 HydrophobicContact CD1-CG1 4.38Å; Y82-I129 HydrophobicContact CD2-CG1 4.12Å; Y82-I129 HydrophobicContact CE1-CD1 4.23Å; Y82-I129 HydrophobicContact CE1-CG1 4.28Å; Y82-I129 HydrophobicContact CE2-CD1 4.15Å; Y82-I129 HydrophobicContact CE2-CG1 4Å; Y82-I129 HydrophobicContact CG-CG1 4.32Å; Y82-P148 WeakPolarHBondContact CE1-O 3.41Å; Y82-P148 WeakPolarHBondContact OH-CB 3.4Å
83	V	98.7	Very high	96.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	120.4	179.1	-173.9	0	0	0	0	108.3	W58 F65 V69 V72 V81 V93 L94 F96 A340	W58-V83 HydrophobicContact CH2-CG2 4.28Å; F65-V83 HydrophobicContact CD1-CG1 4.41Å; F65-V83 HydrophobicContact CE1-CB 4.06Å; F65-V83 HydrophobicContact CE1-CG1 3.6Å; F65-V83 HydrophobicContact CE1-CG2 4.4Å; F65-V83 HydrophobicContact CZ-CG1 4.19Å; F65-V83 HydrophobicContact CZ-CG2 4.5Å; V69-V83 HydrophobicContact CB-CG1 4.49Å; V69-V83 HydrophobicContact CG1-CG1 3.44Å; V69-V83 VanDerWaalsContact CG1-CG1 3.44Å; V69-V83 HydrophobicContact CG2-CG1 4.24Å; V72-V83 HydrophobicContact CG1-CB 4.4Å; V72-V83 HydrophobicContact CG1-CG1 4.12Å; V72-V83 HydrophobicContact CG1-CG2 4.05Å; V81-V83 HydrophobicContact CG1-CG2 4.18Å; V83-V93 CarbonylContact O-C 3.54Å; V83-V93 WeakPolarHBondContact O-CA 3.23Å; V83-L94 PolarHBondContact N-O 3.18Å; V83-L94 PolarHBondContact O-N 3.31Å; V83-F96 HydrophobicContact CB-CE2 4.34Å; V83-F96 HydrophobicContact CG2-CD2 3.91Å; V83-F96 HydrophobicContact CG2-CE2 4.01Å; V83-A340 HydrophobicContact CG1-CB 3.91Å; V83-A340 HydrophobicContact CG2-CB 4.05Å
84	A	98.3	Very high	96.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	138.1	177.8	0	0	0	0	0	111.6	F70 C71 K92 V93 P114 M117	F70-A84 PolarHBondContact N-O 2.84Å; C71-A84 PolarHBondContact O-N 3.45Å; C71-A84 WeakPolarHBondContact SG-CB 3.33Å; A84-K92 CarbonylContact C-O 3.59Å; A84-K92 WeakPolarHBondContact CA-O 3.39Å; A84-V93 HydrophobicContact CB-CG2 4.27Å; A84-P114 HydrophobicContact CB-CB 3.81Å; A84-P114 HydrophobicContact CB-CG 3.89Å; A84-M117 HydrophobicContact CB-CE 3.46Å; A84-M117 VanDerWaalsContact CB-CE 3.46Å
85	Q	97.3	Very high	96.9	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	153.5	179.6	61.3	-177.8	-5.7	0	0	112.3	T66 E68 V69 V90 P91 K92	T66-Q85 VanDerWaalsContact N-OE1 3.12Å; E68-Q85 CarbonylContact O-C 3.48Å; E68-Q85 WeakPolarHBondContact O-CA 3.39Å; V69-Q85 HydrophobicContact CG2-CB 4.29Å; Q85-V90 HydrophobicContact CG-CG2 4Å; Q85-P91 WeakPolarHBondContact CG-O 3.29Å; Q85-P91 PolarHBondContact NE2-O 2.83Å; Q85-K92 PolarHBondContact N-O 3.25Å
86	R	96.4	Very high	96.9	Very high	25 Å²	25	30.2 Å²	30.2	9%	0.094	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	153	177.1	-60.4	-177.6	-179.9	-178.8	3.8	111.1	G67 E68 F70 M113 P114 H115	G67-R86 CarbonylContact C-O 3.58Å; G67-R86 WeakPolarHBondContact CA-O 3.13Å; E68-R86 HydrophobicContact CB-CB 4.38Å; E68-R86 PolarHBondContact N-O 2.93Å; E68-R86 PolarHBondContact O-N 2.87Å; F70-R86 HydrophobicContact CB-CG 4.37Å; F70-R86 HydrophobicContact CD2-CB 4.44Å; F70-R86 HydrophobicContact CD2-CG 3.79Å; F70-R86 HydrophobicContact CE2-CG 4.36Å; F70-R86 HydrophobicContact CG-CG 4.14Å; F70-R86 VanDerWaalsContact CG-NE 3.29Å; F70-R86 VanDerWaalsContact CZ-CZ 3.41Å; R86-M113 HydrophobicContact CG-CG 4.06Å; R86-P114 HydrophobicContact CG-CG 4.43Å; R86-P114 PolarHBondContact NE-O 3.18Å; R86-P114 PolarHBondContact NH2-O 2.78Å; R86-H115 VanDerWaalsContact NH2-CB 3.35Å; R86-H115 PolarHBondContact NH2-CD2 2.88Å
87	G	94.6	Very high	97	Very high	31 Å²	31	30 Å²	30	32%	0.32	20%	0.195	S	C	.	.			trans	148.2	149.8	-177.8	0	0	0	0	0	110.8	K92	G87-K92 PolarHBondContact O-NZ 3.06Å
88	A	91.1	Very high	97.1	Very high	94 Å²	94	27.4 Å²	27.4	78%	0.777	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-41.9	-175.4	0	0	0	0	0	112.5
89	N	91.4	Very high	97.1	Very high	162 Å²	162	29.9 Å²	29.9	87%	0.866	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.6	44.9	-171.4	-61.1	-38.2	0	0	0	112
90	V	95.3	Very high	97.2	Very high	22 Å²	22	28 Å²	28	13%	0.133	17%	0.169	C	C	.	.	S	Bend	trans	-122.4	148.5	179.3	-54.3	0	0	0	0	110.5	T66 Q85 K92	T66-V90 WeakPolarHBondContact O-CG1 3.39Å; Q85-V90 HydrophobicContact CG-CG2 4Å; V90-K92 PolarHBondContact O-N 3.03Å
91	P	95.9	Very high	97.2	Very high	52 Å²	52	31.3 Å²	31.3	34%	0.338	18%	0.183	S	C	.	.			trans	-61	127.5	166.5	-15	27.5	0	0	0	109.5	Q85 V93 L94	Q85-P91 WeakPolarHBondContact CG-O 3.29Å; Q85-P91 PolarHBondContact NE2-O 2.83Å; P91-V93 PolarHBondContact O-N 2.58Å; P91-L94 HydrophobicContact CB-CD2 4.09Å; P91-L94 HydrophobicContact CG-CD2 4.38Å
92	K	97.3	Very high	97.1	Very high	29 Å²	29	34.8 Å²	34.8	13%	0.126	20%	0.198	C	C	.	.	S	Bend	trans	-73.2	-28.1	-170.7	-58.4	-63.4	-178.9	172.4	0	113.8	A84 Q85 G87 V90 L111 E112	A84-K92 CarbonylContact C-O 3.59Å; A84-K92 WeakPolarHBondContact CA-O 3.39Å; Q85-K92 PolarHBondContact N-O 3.25Å; G87-K92 PolarHBondContact O-NZ 3.06Å; V90-K92 PolarHBondContact O-N 3.03Å; K92-L111 HydrophobicContact CB-CB 4.45Å; K92-L111 HydrophobicContact CB-CD2 3.83Å; K92-L111 HydrophobicContact CB-CG 4.2Å; K92-L111 HydrophobicContact CG-CB 4.47Å; K92-L111 WeakPolarHBondContact CG-O 3.36Å; K92-E112 WeakPolarHBondContact CE-O 3.21Å; K92-E112 PolarHBondContact NZ-O 3.24Å
93	V	98.7	Very high	97.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	128.5	177.5	-178.9	0	0	0	0	109.2	Y82 V83 A84 P91 V95 S105 W106 L111 M117 I131	Y82-V93 HydrophobicContact CD1-CG1 4.4Å; V83-V93 CarbonylContact O-C 3.54Å; V83-V93 WeakPolarHBondContact O-CA 3.23Å; A84-V93 HydrophobicContact CB-CG2 4.27Å; P91-V93 PolarHBondContact O-N 2.58Å; V93-V95 HydrophobicContact CG1-CG2 4.39Å; V93-S105 WeakPolarHBondContact O-CA 2.97Å; V93-W106 HydrophobicContact CB-CB 4.1Å; V93-W106 HydrophobicContact CB-CD2 3.6Å; V93-W106 HydrophobicContact CB-CE3 3.61Å; V93-W106 HydrophobicContact CB-CG 3.84Å; V93-W106 HydrophobicContact CB-CZ3 4.26Å; V93-W106 HydrophobicContact CG1-CD2 3.71Å; V93-W106 HydrophobicContact CG1-CE3 3.99Å; V93-W106 HydrophobicContact CG1-CG 4.11Å; V93-W106 HydrophobicContact CG1-CH2 4.41Å; V93-W106 HydrophobicContact CG1-CZ2 4.18Å; V93-W106 HydrophobicContact CG1-CZ3 4.34Å; V93-W106 HydrophobicContact CG2-CD2 4.05Å; V93-W106 HydrophobicContact CG2-CE3 3.5Å; V93-W106 HydrophobicContact CG2-CZ3 3.81Å; V93-W106 PolarHBondContact O-N 2.83Å; V93-L111 HydrophobicContact CG2-CD2 3.93Å; V93-M117 HydrophobicContact CG1-CE 4.29Å; V93-M117 HydrophobicContact CG2-CE 3.99Å; V93-I131 HydrophobicContact CG2-CD1 3.91Å
94	L	98.6	Very high	97.1	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.016	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	144	172.4	-58.8	171.7	0	0	0	108.3	I64 F65 V83 P91 F96 F102	I64-L94 HydrophobicContact CG2-CD1 3.86Å; I64-L94 HydrophobicContact CG2-CD2 4.04Å; F65-L94 HydrophobicContact CD1-CD1 3.52Å; F65-L94 HydrophobicContact CE1-CD1 3.78Å; V83-L94 PolarHBondContact N-O 3.18Å; V83-L94 PolarHBondContact O-N 3.31Å; P91-L94 HydrophobicContact CB-CD2 4.09Å; P91-L94 HydrophobicContact CG-CD2 4.38Å; L94-F96 HydrophobicContact CB-CD2 4.45Å; L94-F96 HydrophobicContact CB-CE2 3.58Å; L94-F96 HydrophobicContact CB-CZ 4.13Å; L94-F96 HydrophobicContact CD1-CE2 4.43Å; L94-F96 HydrophobicContact CD1-CZ 4.39Å; L94-F102 HydrophobicContact CB-CE2 4.41Å; L94-F102 HydrophobicContact CD2-CE2 3.96Å
95	V	98.8	Very high	97.1	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.5	-174.8	-170	0	0	0	0	108.8	V80 V81 Y82 V93 L103 M104	V80-V95 HydrophobicContact CG1-CG1 3.25Å; V81-V95 WeakPolarHBondContact O-CA 3.33Å; Y82-V95 HydrophobicContact CD1-CG1 4.11Å; Y82-V95 HydrophobicContact CD1-CG2 3.77Å; Y82-V95 HydrophobicContact CE1-CG1 3.94Å; Y82-V95 HydrophobicContact CE1-CG2 4.02Å; V93-V95 HydrophobicContact CG1-CG2 4.39Å; V95-L103 HydrophobicContact CB-CB 4.47Å; V95-L103 HydrophobicContact CG1-CB 4.42Å; V95-L103 HydrophobicContact CG1-CD1 4.22Å; V95-L103 WeakPolarHBondContact O-CB 3.34Å; V95-L103 PolarHBondContact O-N 3.17Å; V95-M104 HydrophobicContact CB-CE 4.32Å; V95-M104 HydrophobicContact CB-CG 3.87Å; V95-M104 WeakPolarHBondContact CB-O 2.97Å; V95-M104 HydrophobicContact CG1-CE 4.32Å; V95-M104 HydrophobicContact CG2-CE 3.88Å; V95-M104 HydrophobicContact CG2-CG 3.89Å; V95-M104 PolarHBondContact N-O 2.02Å; V95-M104 PolarHBondContact O-N 2.82Å
96	F	98.8	Very high	97.1	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	161.4	-178.9	-59.8	-95.5	0	0	0	110.6	W58 P59 F65 V80 V81 V83 L94 E101 F102	W58-F96 HydrophobicContact CZ2-CB 4.38Å; P59-F96 HydrophobicContact CB-CD1 4.24Å; P59-F96 HydrophobicContact CB-CE1 4.16Å; F65-F96 AromaticContact CE1-CE2 3.75Å; F65-F96 HydrophobicContact CE1-CE2 3.75Å; F65-F96 AromaticContact CE1-CZ 3.86Å; F65-F96 HydrophobicContact CE1-CZ 3.86Å; F65-F96 AromaticContact CZ-CE2 3.86Å; F65-F96 HydrophobicContact CZ-CE2 3.86Å; F65-F96 AromaticContact CZ-CZ 3.82Å; F65-F96 HydrophobicContact CZ-CZ 3.82Å; V80-F96 CarbonylContact C-O 3.52Å; V80-F96 VanDerWaalsContact CA-O 3.32Å; V80-F96 WeakPolarHBondContact CA-O 3.23Å; V81-F96 PolarHBondContact N-O 3.2Å; V81-F96 PolarHBondContact O-N 3.1Å; V83-F96 HydrophobicContact CB-CE2 4.34Å; V83-F96 HydrophobicContact CG2-CD2 3.91Å; V83-F96 HydrophobicContact CG2-CE2 4.01Å; L94-F96 HydrophobicContact CB-CD2 4.45Å; L94-F96 HydrophobicContact CB-CE2 3.58Å; L94-F96 HydrophobicContact CB-CZ 4.13Å; L94-F96 HydrophobicContact CD1-CE2 4.43Å; L94-F96 HydrophobicContact CD1-CZ 4.39Å; F96-E101 CarbonylContact C-O 3.55Å; F96-E101 WeakPolarHBondContact CA-O 3.41Å; F96-E101 WeakPolarHBondContact CB-O 3.37Å; F96-F102 HydrophobicContact CD1-CB 4.07Å; F96-F102 HydrophobicContact CD1-CD2 4.34Å; F96-F102 HydrophobicContact CE1-CB 3.96Å; F96-F102 AromaticContact CE1-CD2 3.91Å; F96-F102 HydrophobicContact CE1-CD2 3.91Å; F96-F102 HydrophobicContact CE1-CG 4.43Å; F96-F102 HydrophobicContact CZ-CD2 4.09Å
97	T	98.6	Very high	97	Very high	23 Å²	23	51.4 Å²	51.4	14%	0.141	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	164.8	162.8	72.3	0	0	0	0	110.8	W58 A79 E99 G100 E101 L103	W58-T97 PolarHBondContact NE1-O 2.81Å; A79-T97 CarbonylContact O-C 3.59Å; A79-T97 VanDerWaalsContact O-CA 3.27Å; A79-T97 WeakPolarHBondContact O-CA 3.4Å; T97-E99 WeakPolarHBondContact CB-OE2 3.32Å; T97-E99 PolarHBondContact O-N 3.45Å; T97-E99 PolarHBondContact OG1-N 2.83Å; T97-E99 PolarHBondContact OG1-OE2 2.86Å; T97-G100 PolarHBondContact O-N 3.42Å; T97-G100 PolarHBondContact OG1-N 2.78Å; T97-E101 HydrophobicContact CG2-CB 3.97Å; T97-E101 PolarHBondContact N-O 3.14Å; T97-E101 PolarHBondContact OG1-N 2.81Å; T97-L103 HydrophobicContact CG2-CD1 3.9Å; T97-L103 HydrophobicContact CG2-CD2 3.69Å; T97-L103 HydrophobicContact CG2-CG 3.89Å
98	T	98.1	Very high	96.9	Very high	12 Å²	12	51 Å²	51	7%	0.074	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.8	170.6	42.3	0	0	0	0	113.1	W58 V74 A79 V81 Y331 K342	W58-T98 VanDerWaalsContact CD1-O 3.31Å; V74-T98 HydrophobicContact CG2-CG2 4.23Å; A79-T98 HydrophobicContact CB-CG2 4.47Å; A79-T98 WeakPolarHBondContact CB-OG1 3.28Å; A79-T98 PolarHBondContact O-N 3.12Å; V81-T98 HydrophobicContact CG2-CG2 4.12Å; T98-Y331 PolarHBondContact O-OH 3.08Å; T98-K342 PolarHBondContact O-NZ 3.22Å
99	E	98.1	Very high	97	Very high	108 Å²	108	51.4 Å²	51.4	51%	0.505	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-4.4	174.6	-58.4	65.2	-130.3	0	0	113.1	K60 T97	K60-E99 WeakPolarHBondContact CE-O 3.35Å; T97-E99 WeakPolarHBondContact CB-OE2 3.32Å; T97-E99 PolarHBondContact O-N 3.45Å; T97-E99 PolarHBondContact OG1-N 2.83Å; T97-E99 PolarHBondContact OG1-OE2 2.86Å
100	G	98.1	Very high	97.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.242	C	C	.	.			trans	95.3	8.9	168.9	0	0	0	0	0	115.4	W58 K60 T97	W58-G100 VanDerWaalsContact NE1-CA 3.32Å; K60-G100 PolarHBondContact N-O 2.86Å; K60-G100 VanDerWaalsContact N-O 3.07Å; T97-G100 PolarHBondContact O-N 3.42Å; T97-G100 PolarHBondContact OG1-N 2.78Å
101	E	98.6	Very high	97.3	Very high	87 Å²	87	44.2 Å²	44.2	41%	0.407	24%	0.237	S	C	.	.			trans	-72.9	133.5	172.3	-63.8	-64	164.4	0	0	110.1	K60 F96 T97	K60-E101 HydrophobicContact CD-CG 4.41Å; K60-E101 WeakPolarHBondContact CD-OE1 3.49Å; K60-E101 VanDerWaalsContact CE-OE1 3.31Å; K60-E101 WeakPolarHBondContact CE-OE1 3.39Å; K60-E101 IonicContact NZ-OE1 2.99Å; K60-E101 PolarHBondContact NZ-OE1 2.97Å; F96-E101 CarbonylContact C-O 3.55Å; F96-E101 WeakPolarHBondContact CA-O 3.41Å; F96-E101 WeakPolarHBondContact CB-O 3.37Å; T97-E101 HydrophobicContact CG2-CB 3.97Å; T97-E101 PolarHBondContact N-O 3.14Å; T97-E101 PolarHBondContact OG1-N 2.81Å
102	F	98.5	Very high	97.2	Very high	74 Å²	74	44.5 Å²	44.5	33%	0.325	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	129.3	172.3	175.1	-106.4	0	0	0	110.5	I64 L94 F96 M104	I64-F102 HydrophobicContact CD1-CB 3.66Å; I64-F102 HydrophobicContact CD1-CD1 4.08Å; I64-F102 HydrophobicContact CD1-CD2 3.99Å; I64-F102 HydrophobicContact CD1-CG 3.64Å; I64-F102 HydrophobicContact CG2-CD2 4.16Å; I64-F102 HydrophobicContact CG2-CE2 4.08Å; L94-F102 HydrophobicContact CB-CE2 4.41Å; L94-F102 HydrophobicContact CD2-CE2 3.96Å; F96-F102 HydrophobicContact CD1-CB 4.07Å; F96-F102 HydrophobicContact CD1-CD2 4.34Å; F96-F102 HydrophobicContact CE1-CB 3.96Å; F96-F102 AromaticContact CE1-CD2 3.91Å; F96-F102 HydrophobicContact CE1-CD2 3.91Å; F96-F102 HydrophobicContact CE1-CG 4.43Å; F96-F102 HydrophobicContact CZ-CD2 4.09Å; F102-M104 VanDerWaalsContact CE2-C 3.42Å; F102-M104 VanDerWaalsContact CE2-O 3.29Å; F102-M104 WeakPolarHBondContact CE2-O 3.44Å
103	L	98.4	Very high	97.2	Very high	90 Å²	90	46.1 Å²	46.1	47%	0.471	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-53.9	180	-64.7	177.9	0	0	0	111.7	V80 V95 T97	V80-L103 HydrophobicContact CG2-CD1 3.84Å; V95-L103 HydrophobicContact CB-CB 4.47Å; V95-L103 HydrophobicContact CG1-CB 4.42Å; V95-L103 HydrophobicContact CG1-CD1 4.22Å; V95-L103 WeakPolarHBondContact O-CB 3.34Å; V95-L103 PolarHBondContact O-N 3.17Å; T97-L103 HydrophobicContact CG2-CD1 3.9Å; T97-L103 HydrophobicContact CG2-CD2 3.69Å; T97-L103 HydrophobicContact CG2-CG 3.89Å
104	M	98.1	Very high	97.2	Very high	69 Å²	69	46.1 Å²	46.1	34%	0.34	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	162.3	-176.8	61.8	-178.7	178	0	0	112.2	V95 F102 P148	V95-M104 HydrophobicContact CB-CE 4.32Å; V95-M104 HydrophobicContact CB-CG 3.87Å; V95-M104 WeakPolarHBondContact CB-O 2.97Å; V95-M104 HydrophobicContact CG1-CE 4.32Å; V95-M104 HydrophobicContact CG2-CE 3.88Å; V95-M104 HydrophobicContact CG2-CG 3.89Å; V95-M104 PolarHBondContact N-O 2.02Å; V95-M104 PolarHBondContact O-N 2.82Å; F102-M104 VanDerWaalsContact CE2-C 3.42Å; F102-M104 VanDerWaalsContact CE2-O 3.29Å; F102-M104 WeakPolarHBondContact CE2-O 3.44Å; M104-P148 WeakPolarHBondContact CE-O 3.43Å
105	S	98.2	Very high	97.2	Very high	55 Å²	55	46 Å²	46	39%	0.385	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	140.6	160.7	60.8	0	0	0	0	109.8	V93	V93-S105 WeakPolarHBondContact O-CA 2.97Å
106	W	98.3	Very high	97.2	Very high	8 Å²	8	45.9 Å²	45.9	3%	0.03	24%	0.242	C	C	.	.			trans	-68.5	137.9	171.1	-71.3	1.4	0	0	0	111.2	Y82 V93 T108 I129 I131 Y146 P148 G150	Y82-W106 AromaticContact CD1-CZ2 3.84Å; Y82-W106 HydrophobicContact CD1-CZ2 3.84Å; Y82-W106 AromaticContact CE1-CZ2 3.99Å; Y82-W106 HydrophobicContact CE1-CZ2 3.99Å; V93-W106 HydrophobicContact CB-CB 4.1Å; V93-W106 HydrophobicContact CB-CD2 3.6Å; V93-W106 HydrophobicContact CB-CE3 3.61Å; V93-W106 HydrophobicContact CB-CG 3.84Å; V93-W106 HydrophobicContact CB-CZ3 4.26Å; V93-W106 HydrophobicContact CG1-CD2 3.71Å; V93-W106 HydrophobicContact CG1-CE3 3.99Å; V93-W106 HydrophobicContact CG1-CG 4.11Å; V93-W106 HydrophobicContact CG1-CH2 4.41Å; V93-W106 HydrophobicContact CG1-CZ2 4.18Å; V93-W106 HydrophobicContact CG1-CZ3 4.34Å; V93-W106 HydrophobicContact CG2-CD2 4.05Å; V93-W106 HydrophobicContact CG2-CE3 3.5Å; V93-W106 HydrophobicContact CG2-CZ3 3.81Å; V93-W106 PolarHBondContact O-N 2.83Å; W106-T108 HydrophobicContact CB-CG2 4.38Å; W106-T108 HydrophobicContact CE3-CG2 4.41Å; W106-I129 HydrophobicContact CH2-CB 3.9Å; W106-I129 HydrophobicContact CH2-CG1 4.34Å; W106-I129 HydrophobicContact CH2-CG2 3.86Å; W106-I129 HydrophobicContact CZ2-CB 4.41Å; W106-I129 HydrophobicContact CZ2-CG1 4.36Å; W106-I131 HydrophobicContact CH2-CD1 4.08Å; W106-I131 HydrophobicContact CZ3-CD1 3.58Å; W106-Y146 HydrophobicContact CE3-CG 4.49Å; W106-Y146 HydrophobicContact CH2-CD2 4.38Å; W106-Y146 HydrophobicContact CH2-CG 4.07Å; W106-Y146 HydrophobicContact CZ3-CD1 4.14Å; W106-Y146 AromaticContact CZ3-CD2 3.84Å; W106-Y146 HydrophobicContact CZ3-CD2 3.84Å; W106-Y146 HydrophobicContact CZ3-CE2 4.48Å; W106-Y146 AromaticContact CZ3-CG 3.63Å; W106-Y146 HydrophobicContact CZ3-CG 3.63Å; W106-P148 PolarHBondContact NE1-O 2.86Å; W106-G150 VanDerWaalsContact CE2-CA 3.45Å
107	N	94.6	Very high	97.2	Very high	158 Å²	158	46 Å²	46	85%	0.845	24%	0.242	S	C	*	.			trans	-104.1	71	172.4	-171.9	12	0	0	0	109.8
108	T	91.7	Very high	97.2	Very high	23 Å²	23	46.1 Å²	46.1	14%	0.141	24%	0.241	C	C	.	.			trans	-115.7	135.8	177.8	-179	0	0	0	0	110.6	W106 T110 L111	W106-T108 HydrophobicContact CB-CG2 4.38Å; W106-T108 HydrophobicContact CE3-CG2 4.41Å; T108-T110 PolarHBondContact OG1-N 3.2Å; T108-T110 PolarHBondContact OG1-OG1 3.17Å; T108-L111 HydrophobicContact CG2-CB 4.06Å
109	T	92.9	Very high	97.2	Very high	103 Å²	103	46.4 Å²	46.4	63%	0.632	24%	0.241	S	C	*	.	S	Bend	trans	-98.8	-1.6	174.5	55.9	0	0	0	0	112.6	Y139	T109-Y139 WeakPolarHBondContact O-CD2 3.43Å; T109-Y139 WeakPolarHBondContact O-CE2 3.13Å
110	T	96.2	Very high	97.1	Very high	28 Å²	28	41.3 Å²	41.3	17%	0.172	22%	0.218	C	C	.	.	S	Bend	trans	-96	5.9	-173.4	60.2	0	0	0	0	113.3	T108 Y139 K144 Y146 L152	T108-T110 PolarHBondContact OG1-N 3.2Å; T108-T110 PolarHBondContact OG1-OG1 3.17Å; T110-Y139 HydrophobicContact CG2-CE1 4.34Å; T110-Y139 WeakPolarHBondContact O-CB 3.24Å; T110-K144 WeakPolarHBondContact O-CD 3.43Å; T110-K144 WeakPolarHBondContact O-CE 3.35Å; T110-K144 PolarHBondContact O-NZ 2.85Å; T110-Y146 PolarHBondContact OG1-OH 3.27Å; T110-L152 HydrophobicContact CG2-CD2 3.96Å
111	L	97.1	Very high	96.9	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.026	24%	0.237	C	C	.	.			trans	-123.9	122.8	-178.9	-174	62	0	0	0	109	K92 V93 T108 P114 I131 D133	K92-L111 HydrophobicContact CB-CB 4.45Å; K92-L111 HydrophobicContact CB-CD2 3.83Å; K92-L111 HydrophobicContact CB-CG 4.2Å; K92-L111 HydrophobicContact CG-CB 4.47Å; K92-L111 WeakPolarHBondContact CG-O 3.36Å; V93-L111 HydrophobicContact CG2-CD2 3.93Å; T108-L111 HydrophobicContact CG2-CB 4.06Å; L111-P114 HydrophobicContact CD1-CB 4.19Å; L111-P114 HydrophobicContact CD2-CB 4.18Å; L111-P114 HydrophobicContact CD2-CG 4.44Å; L111-P114 HydrophobicContact CG-CB 4.32Å; L111-I131 HydrophobicContact CD1-CB 4.41Å; L111-I131 HydrophobicContact CD1-CG2 3.73Å; L111-I131 HydrophobicContact CD2-CD1 3.8Å; L111-I131 HydrophobicContact CD2-CG2 4.22Å; L111-D133 HydrophobicContact CD1-CB 4.06Å
112	E	94.3	Very high	96.6	Very high	58 Å²	58	41.4 Å²	41.4	27%	0.271	22%	0.224	S	C	.	.	S	Bend	trans	-107	-60.7	-173.2	-176	-178	143.7	0	0	111.6	K92 D133 G136 G137	K92-E112 WeakPolarHBondContact CE-O 3.21Å; K92-E112 PolarHBondContact NZ-O 3.24Å; E112-D133 PolarHBondContact N-OD2 2.86Å; E112-G136 PolarHBondContact OE1-N 3.2Å; E112-G137 WeakPolarHBondContact OE1-CA 3.39Å; E112-G137 PolarHBondContact OE1-N 3.37Å; E112-G137 WeakPolarHBondContact OE2-CA 3.48Å; E112-G137 PolarHBondContact OE2-N 2.82Å
113	M	97.3	Very high	96.2	Very high	63 Å²	63	42.9 Å²	42.9	31%	0.31	24%	0.243	S	C	.	.	S	Bend	trans	-133.1	78.4	-175.2	-164.2	160.3	77.5	0	0	109.6	R86 H115 D133 V134	R86-M113 HydrophobicContact CG-CG 4.06Å; M113-H115 PolarHBondContact O-N 3.24Å; M113-D133 PolarHBondContact N-OD1 2.88Å; M113-V134 HydrophobicContact CB-CG2 4.18Å; M113-V134 HydrophobicContact CE-CB 4.24Å; M113-V134 HydrophobicContact CE-CG2 3.45Å; M113-V134 VanDerWaalsContact CE-CG2 3.45Å; M113-V134 WeakPolarHBondContact CE-O 3.25Å; M113-V134 HydrophobicContact CG-CG2 3.87Å; M113-V134 VanDerWaalsContact O-CG2 3.32Å; M113-V134 WeakPolarHBondContact O-CG2 3.37Å; M113-V134 PolarHBondContact O-N 3.36Å; M113-V134 VanDerWaalsContact O-N 3.07Å; M113-V134 HydrophobicContact SD-CG2 4.45Å
114	P	98.3	Very high	95.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	137	-179.7	24.2	-33.3	0	0	0	111.2	A84 R86 L111 I131 T132	A84-P114 HydrophobicContact CB-CB 3.81Å; A84-P114 HydrophobicContact CB-CG 3.89Å; R86-P114 HydrophobicContact CG-CG 4.43Å; R86-P114 PolarHBondContact NE-O 3.18Å; R86-P114 PolarHBondContact NH2-O 2.78Å; L111-P114 HydrophobicContact CD1-CB 4.19Å; L111-P114 HydrophobicContact CD2-CB 4.18Å; L111-P114 HydrophobicContact CD2-CG 4.44Å; L111-P114 HydrophobicContact CG-CB 4.32Å; P114-I131 HydrophobicContact CB-CG2 3.77Å; P114-T132 WeakPolarHBondContact CA-O 3.46Å
115	H	98.3	Very high	95.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	-78.9	176.3	-170.7	-69	0	0	0	111.6	C71 R86 M113 T132 V134 A175 D191 H225 H319 L320	C71-H115 WeakPolarHBondContact CB-O 3.29Å; C71-H115 PolarHBondContact SG-O 3.08Å; R86-H115 VanDerWaalsContact NH2-CB 3.35Å; R86-H115 PolarHBondContact NH2-CD2 2.88Å; M113-H115 PolarHBondContact O-N 3.24Å; H115-T132 PolarHBondContact N-O 2.96Å; H115-V134 HydrophobicContact CB-CB 4.38Å; H115-V134 HydrophobicContact CB-CG1 3.54Å; H115-V134 HydrophobicContact CB-CG2 3.9Å; H115-A175 PolarHBondContact ND1-O 2.59Å; H115-D191 IonicContact CD2-OD2 2.83Å; H115-D191 PolarHBondContact CD2-OD2 3.42Å; H115-D191 IonicContact NE2-OD1 3.22Å; H115-D191 IonicContact NE2-OD2 2.71Å; H115-D191 PolarHBondContact NE2-OD2 2.85Å; H115-D191 VanDerWaalsContact NE2-OD2 3.08Å; H115-H225 AromaticContact CE1-CD2 3.72Å; H115-H225 AromaticContact CE1-CE1 3.39Å; H115-H225 PolarHBondContact CE1-CE1 3.38Å; H115-H225 AromaticContact CE1-NE2 3.21Å; H115-H225 PolarHBondContact CE1-NE2 2.91Å; H115-H225 AromaticContact NE2-CD2 3.75Å; H115-H225 AromaticContact NE2-CE1 3.73Å; H115-H225 AromaticContact NE2-NE2 3.13Å; H115-H225 PolarHBondContact NE2-NE2 2.96Å; H115-H225 VanDerWaalsContact NE2-NE2 3.13Å; H115-H319 AromaticContact CE1-CE1 3.7Å; H115-H319 AromaticContact NE2-CE1 3.67Å; H115-H319 AromaticContact NE2-NE2 3.8Å; H115-L320 WeakPolarHBondContact O-CD1 3.31Å
116	G	98.4	Very high	95.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	149.3	175.3	0	0	0	0	0	111.6	I131 T132 A175	G116-I131 VanDerWaalsContact O-CA 3.31Å; G116-I131 WeakPolarHBondContact O-CA 3.31Å; G116-T132 PolarHBondContact N-OG1 3.09Å; G116-T132 PolarHBondContact O-N 2.92Å; G116-A175 WeakPolarHBondContact CA-O 3.18Å; G116-A175 PolarHBondContact N-O 2.99Å; G116-A175 VanDerWaalsContact N-O 3.13Å
117	M	98.6	Very high	95.3	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137.4	173.2	-173.4	179.6	-77.7	0	0	109.8	C71 A73 Y82 A84 V93 I129 W130 I131	C71-M117 HydrophobicContact CB-CB 3.96Å; A73-M117 HydrophobicContact CB-CB 4.38Å; A73-M117 HydrophobicContact CB-CG 3.64Å; A73-M117 HydrophobicContact CB-SD 3.76Å; Y82-M117 VanDerWaalsContact CB-SD 3.58Å; A84-M117 HydrophobicContact CB-CE 3.46Å; A84-M117 VanDerWaalsContact CB-CE 3.46Å; V93-M117 HydrophobicContact CG1-CE 4.29Å; V93-M117 HydrophobicContact CG2-CE 3.99Å; M117-I129 HydrophobicContact CE-CG2 4.43Å; M117-I129 HydrophobicContact CG-CG2 3.75Å; M117-I129 HydrophobicContact SD-CG2 4.07Å; M117-W130 CarbonylContact C-O 3.57Å; M117-W130 VanDerWaalsContact CA-O 3.27Å; M117-W130 WeakPolarHBondContact CA-O 3.13Å; M117-I131 HydrophobicContact CE-CD1 3.54Å; M117-I131 HydrophobicContact CE-CG1 3.88Å; M117-I131 HydrophobicContact CG-CG1 4.14Å
118	F	98.6	Very high	95.5	Very high	27 Å²	27	44.5 Å²	44.5	12%	0.118	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	129.8	179.2	-174.3	-94.4	0	0	0	110.7	A120 W130 I177 F178 V179	F118-A120 HydrophobicContact CD1-CB 4.35Å; F118-A120 HydrophobicContact CE1-CB 4.23Å; F118-W130 HydrophobicContact CB-CB 4.49Å; F118-W130 PolarHBondContact N-O 3.07Å; F118-W130 PolarHBondContact O-N 2.6Å; F118-I177 HydrophobicContact CB-CG2 4.33Å; F118-I177 WeakPolarHBondContact CB-O 3.49Å; F118-F178 HydrophobicContact CD2-CD2 4.24Å; F118-F178 AromaticContact CE2-CD2 3.43Å; F118-F178 HydrophobicContact CE2-CD2 3.43Å; F118-F178 VanDerWaalsContact CE2-CD2 3.43Å; F118-F178 AromaticContact CE2-CE2 3.72Å; F118-F178 HydrophobicContact CE2-CE2 3.72Å; F118-F178 HydrophobicContact CE2-CG 4.16Å; F118-F178 AromaticContact CZ-CD2 3.8Å; F118-F178 HydrophobicContact CZ-CD2 3.8Å; F118-F178 AromaticContact CZ-CE2 3.82Å; F118-F178 HydrophobicContact CZ-CE2 3.82Å; F118-F178 HydrophobicContact CZ-CG 4.29Å; F118-F178 HydrophobicContact CZ-CZ 4.32Å; F118-V179 HydrophobicContact CD1-CB 3.89Å; F118-V179 HydrophobicContact CD1-CG2 3.92Å; F118-V179 HydrophobicContact CE1-CB 3.71Å; F118-V179 HydrophobicContact CE1-CG2 4.27Å; F118-V179 VanDerWaalsContact CE1-N 3.31Å; F118-V179 WeakPolarHBondContact CE1-O 3.33Å; F118-V179 WeakPolarHBondContact CZ-O 3.45Å
119	L	98.3	Very high	95.8	Very high	17 Å²	17	43.4 Å²	43.4	9%	0.089	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	118.7	170.9	-179.9	77.4	0	0	0	109.7	A73 V74 N75 Y82 A122 P127 I129	A73-L119 HydrophobicContact CB-CB 4.3Å; V74-L119 WeakPolarHBondContact O-CD2 3.4Å; N75-L119 HydrophobicContact CB-CD1 4.34Å; N75-L119 HydrophobicContact CB-CD2 3.35Å; N75-L119 HydrophobicContact CB-CG 4.5Å; Y82-L119 HydrophobicContact CE2-CD1 4.39Å; L119-A122 HydrophobicContact CD2-CB 3.64Å; L119-A122 HydrophobicContact CG-CB 4.44Å; L119-P127 HydrophobicContact CD1-CB 4.28Å; L119-I129 HydrophobicContact CD1-CD1 3.94Å; L119-I129 HydrophobicContact CD1-CG1 3.93Å
120	A	97.3	Very high	96.1	Very high	2 Å²	2	39 Å²	39	2%	0.017	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	141.2	173.1	0	0	0	0	0	111	F118 T128 V179	F118-A120 HydrophobicContact CD1-CB 4.35Å; F118-A120 HydrophobicContact CE1-CB 4.23Å; A120-T128 PolarHBondContact N-O 3.18Å; A120-T128 PolarHBondContact O-N 3.29Å; A120-T128 VanDerWaalsContact O-N 3.09Å; A120-V179 HydrophobicContact CB-CB 4.01Å; A120-V179 HydrophobicContact CB-CG1 4.1Å
121	D	92.9	Very high	96.2	Very high	72 Å²	72	37.7 Å²	37.7	39%	0.385	20%	0.203	S	C	.	.			trans	54.7	51.6	173	-52.9	-39.2	0	0	0	113.9	S123 S124 P127	D121-S123 PolarHBondContact O-N 3.23Å; D121-S124 WeakPolarHBondContact O-CB 3.42Å; D121-S124 PolarHBondContact O-N 2.99Å; D121-P127 WeakPolarHBondContact O-CB 3.37Å
122	A	92.7	Very high	96.3	Very high	16 Å²	16	37.5 Å²	37.5	13%	0.132	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-38.5	-175.2	0	0	0	0	0	114.3	D77 L119 S124	D77-A122 VanDerWaalsContact OD2-C 3.28Å; L119-A122 HydrophobicContact CD2-CB 3.64Å; L119-A122 HydrophobicContact CG-CB 4.44Å; A122-S124 VanDerWaalsContact C-N 3.33Å
123	S	90.5	Very high	96.5	Very high	105 Å²	105	34.7 Å²	34.7	73%	0.734	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-3	-179	65.9	0	0	0	0	114.4	D77 D121	D77-S123 VanDerWaalsContact OD2-CA 3.26Å; D77-S123 WeakPolarHBondContact OD2-CA 3.42Å; D77-S123 WeakPolarHBondContact OD2-CB 3.42Å; D77-S123 PolarHBondContact OD2-N 2.78Å; D77-S123 VanDerWaalsContact OD2-N 3.12Å; D121-S123 PolarHBondContact O-N 3.23Å
124	S	92.3	Very high	96.5	Very high	56 Å²	56	31.8 Å²	31.8	39%	0.392	18%	0.175	S	C	.	.	S	Bend	trans	-70.6	160.5	177.1	-177.8	0	0	0	0	111.2	D121 A122 D126 P127	D121-S124 WeakPolarHBondContact O-CB 3.42Å; D121-S124 PolarHBondContact O-N 2.99Å; A122-S124 VanDerWaalsContact C-N 3.33Å; S124-D126 PolarHBondContact O-N 3.04Å; S124-D126 PolarHBondContact OG-N 3.24Å; S124-P127 WeakPolarHBondContact O-CD 3.39Å
125	K	91.1	Very high	96.5	Very high	202 Å²	202	31.8 Å²	31.8	88%	0.878	18%	0.175	S	C	*	.	S	Bend	trans	-69	-24.9	168.6	-67	-174.2	178.8	-178.4	0	112.2	P127	K125-P127 VanDerWaalsContact C-CD 3.47Å
126	D	92.9	Very high	96.3	Very high	131 Å²	131	34.7 Å²	34.7	70%	0.701	21%	0.205	S	C	*	.	S	Bend	trans	-126.7	64.9	-178	-59	-59.3	0	0	0	109.8	S124	S124-D126 PolarHBondContact O-N 3.04Å; S124-D126 PolarHBondContact OG-N 3.24Å
127	P	97.1	Very high	96.2	Very high	13 Å²	13	35.7 Å²	35.7	8%	0.084	22%	0.215	C	C	.	.			trans	-65	149.7	177.1	29.9	-33.3	0	0	0	109.3	L119 D121 S124 K125 P148	L119-P127 HydrophobicContact CD1-CB 4.28Å; D121-P127 WeakPolarHBondContact O-CB 3.37Å; S124-P127 WeakPolarHBondContact O-CD 3.39Å; K125-P127 VanDerWaalsContact C-CD 3.47Å; P127-P148 HydrophobicContact CG-CG 3.86Å; P127-P148 VanDerWaalsContact O-CD 3.3Å; P127-P148 WeakPolarHBondContact O-CD 3.43Å
128	T	98.3	Very high	96.2	Very high	13 Å²	13	40.1 Å²	40.1	8%	0.08	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	144.9	-177.2	61.2	0	0	0	0	112.2	A120 W130 Q145 Y146 L153	A120-T128 PolarHBondContact N-O 3.18Å; A120-T128 PolarHBondContact O-N 3.29Å; A120-T128 VanDerWaalsContact O-N 3.09Å; T128-W130 PolarHBondContact OG1-NE1 3.22Å; T128-Q145 HydrophobicContact CG2-CG 4.16Å; T128-Q145 PolarHBondContact OG1-NE2 2.82Å; T128-Y146 WeakPolarHBondContact CA-O 3.22Å; T128-L153 HydrophobicContact CG2-CD1 3.89Å
129	I	98.7	Very high	96.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.7	-179.3	-62.5	74.5	0	0	0	107.3	Y82 W106 M117 L119 I131 Q145 Y146 P148	Y82-I129 HydrophobicContact CD1-CG1 4.38Å; Y82-I129 HydrophobicContact CD2-CG1 4.12Å; Y82-I129 HydrophobicContact CE1-CD1 4.23Å; Y82-I129 HydrophobicContact CE1-CG1 4.28Å; Y82-I129 HydrophobicContact CE2-CD1 4.15Å; Y82-I129 HydrophobicContact CE2-CG1 4Å; Y82-I129 HydrophobicContact CG-CG1 4.32Å; W106-I129 HydrophobicContact CH2-CB 3.9Å; W106-I129 HydrophobicContact CH2-CG1 4.34Å; W106-I129 HydrophobicContact CH2-CG2 3.86Å; W106-I129 HydrophobicContact CZ2-CB 4.41Å; W106-I129 HydrophobicContact CZ2-CG1 4.36Å; M117-I129 HydrophobicContact CE-CG2 4.43Å; M117-I129 HydrophobicContact CG-CG2 3.75Å; M117-I129 HydrophobicContact SD-CG2 4.07Å; L119-I129 HydrophobicContact CD1-CD1 3.94Å; L119-I129 HydrophobicContact CD1-CG1 3.93Å; I129-I131 HydrophobicContact CG2-CD1 4.25Å; I129-I131 HydrophobicContact CG2-CG1 3.97Å; I129-Q145 CarbonylContact O-C 3.49Å; I129-Q145 WeakPolarHBondContact O-CA 3.49Å; I129-Y146 PolarHBondContact N-O 3.41Å; I129-Y146 PolarHBondContact O-N 3.29Å; I129-P148 HydrophobicContact CD1-CB 4.36Å; I129-P148 HydrophobicContact CD1-CG 4.13Å
130	W	98.8	Very high	96.1	Very high	11 Å²	11	42.4 Å²	42.4	4%	0.042	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	130.6	176.8	-67.7	79.4	0	0	0	109.5	M117 F118 T128 I143 K144 Q145 L156 I177 V179 M185	M117-W130 CarbonylContact C-O 3.57Å; M117-W130 VanDerWaalsContact CA-O 3.27Å; M117-W130 WeakPolarHBondContact CA-O 3.13Å; F118-W130 HydrophobicContact CB-CB 4.49Å; F118-W130 PolarHBondContact N-O 3.07Å; F118-W130 PolarHBondContact O-N 2.6Å; T128-W130 PolarHBondContact OG1-NE1 3.22Å; W130-I143 HydrophobicContact CE3-CG2 4.1Å; W130-K144 CarbonylContact C-O 3.53Å; W130-K144 WeakPolarHBondContact CA-O 3.34Å; W130-Q145 HydrophobicContact CD2-CB 3.95Å; W130-Q145 HydrophobicContact CD2-CG 4.02Å; W130-Q145 HydrophobicContact CE3-CB 3.96Å; W130-Q145 HydrophobicContact CH2-CB 3.95Å; W130-Q145 HydrophobicContact CH2-CG 4.25Å; W130-Q145 HydrophobicContact CZ2-CB 3.93Å; W130-Q145 HydrophobicContact CZ2-CG 3.72Å; W130-Q145 VanDerWaalsContact CZ2-NE2 3.28Å; W130-Q145 HydrophobicContact CZ3-CB 3.96Å; W130-L156 HydrophobicContact CE3-CD1 4.46Å; W130-L156 HydrophobicContact CH2-CD1 4.4Å; W130-L156 HydrophobicContact CZ3-CD1 3.66Å; W130-L156 HydrophobicContact CZ3-CG 3.92Å; W130-I177 HydrophobicContact CB-CG2 3.84Å; W130-I177 HydrophobicContact CD2-CD1 4.26Å; W130-I177 HydrophobicContact CE3-CD1 3.85Å; W130-I177 HydrophobicContact CZ3-CD1 4.41Å; W130-V179 HydrophobicContact CD2-CG2 4.08Å; W130-V179 HydrophobicContact CG-CG2 3.91Å; W130-M185 HydrophobicContact CH2-SD 3.95Å; W130-M185 HydrophobicContact CZ2-SD 4.45Å; W130-M185 HydrophobicContact CZ3-SD 4.19Å
131	I	98.9	Very high	96.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.5	-179.2	-54.2	177.7	0	0	0	108.9	V93 W106 L111 P114 G116 M117 I129 I143 K144 Y146	V93-I131 HydrophobicContact CG2-CD1 3.91Å; W106-I131 HydrophobicContact CH2-CD1 4.08Å; W106-I131 HydrophobicContact CZ3-CD1 3.58Å; L111-I131 HydrophobicContact CD1-CB 4.41Å; L111-I131 HydrophobicContact CD1-CG2 3.73Å; L111-I131 HydrophobicContact CD2-CD1 3.8Å; L111-I131 HydrophobicContact CD2-CG2 4.22Å; P114-I131 HydrophobicContact CB-CG2 3.77Å; G116-I131 VanDerWaalsContact O-CA 3.31Å; G116-I131 WeakPolarHBondContact O-CA 3.31Å; M117-I131 HydrophobicContact CE-CD1 3.54Å; M117-I131 HydrophobicContact CE-CG1 3.88Å; M117-I131 HydrophobicContact CG-CG1 4.14Å; I129-I131 HydrophobicContact CG2-CD1 4.25Å; I129-I131 HydrophobicContact CG2-CG1 3.97Å; I131-I143 WeakPolarHBondContact O-CA 3.27Å; I131-K144 PolarHBondContact N-O 3.02Å; I131-K144 PolarHBondContact O-N 3.23Å; I131-Y146 HydrophobicContact CB-CE2 4.42Å; I131-Y146 HydrophobicContact CD1-CD2 3.97Å; I131-Y146 HydrophobicContact CD1-CE2 4.12Å; I131-Y146 HydrophobicContact CG1-CD2 4.25Å; I131-Y146 HydrophobicContact CG1-CE2 4.47Å
132	T	98.9	Very high	96.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	137.6	168.5	74.5	0	0	0	0	109.7	P114 H115 G116 I143 P174 A175 I177	P114-T132 WeakPolarHBondContact CA-O 3.46Å; H115-T132 PolarHBondContact N-O 2.96Å; G116-T132 PolarHBondContact N-OG1 3.09Å; G116-T132 PolarHBondContact O-N 2.92Å; T132-I143 HydrophobicContact CG2-CD1 4.06Å; T132-I143 HydrophobicContact CG2-CG1 3.93Å; T132-I143 HydrophobicContact CG2-CG2 4.14Å; T132-P174 WeakPolarHBondContact CB-O 3.46Å; T132-P174 HydrophobicContact CG2-CB 4.37Å; T132-P174 PolarHBondContact OG1-O 3.09Å; T132-A175 PolarHBondContact OG1-O 3.28Å; T132-I177 HydrophobicContact CG2-CB 4.3Å; T132-I177 HydrophobicContact CG2-CG2 3.99Å
133	D	98.4	Very high	96.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	109.8	-178.1	-167.1	-18.2	0	0	0	109.1	L111 E112 M113 G135 H141 S142 K144	L111-D133 HydrophobicContact CD1-CB 4.06Å; E112-D133 PolarHBondContact N-OD2 2.86Å; M113-D133 PolarHBondContact N-OD1 2.88Å; D133-G135 VanDerWaalsContact C-N 3.3Å; D133-G135 PolarHBondContact OD1-N 3.22Å; D133-H141 PolarHBondContact O-N 3.48Å; D133-S142 PolarHBondContact N-O 3.49Å; D133-S142 PolarHBondContact O-N 2.86Å; D133-K144 VanDerWaalsContact CB-NZ 3.28Å; D133-K144 IonicContact OD2-NZ 3.86Å; D133-K144 PolarHBondContact OD2-NZ 2.97Å
134	V	98.2	Very high	97.1	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.012	20%	0.195	C	C	.	.			trans	-91.2	5.1	-177.2	-63.4	0	0	0	0	112.2	M113 H115 Q173 P174 D191	M113-V134 HydrophobicContact CB-CG2 4.18Å; M113-V134 HydrophobicContact CE-CB 4.24Å; M113-V134 HydrophobicContact CE-CG2 3.45Å; M113-V134 VanDerWaalsContact CE-CG2 3.45Å; M113-V134 WeakPolarHBondContact CE-O 3.25Å; M113-V134 HydrophobicContact CG-CG2 3.87Å; M113-V134 VanDerWaalsContact O-CG2 3.32Å; M113-V134 WeakPolarHBondContact O-CG2 3.37Å; M113-V134 PolarHBondContact O-N 3.36Å; M113-V134 VanDerWaalsContact O-N 3.07Å; M113-V134 HydrophobicContact SD-CG2 4.45Å; H115-V134 HydrophobicContact CB-CB 4.38Å; H115-V134 HydrophobicContact CB-CG1 3.54Å; H115-V134 HydrophobicContact CB-CG2 3.9Å; V134-Q173 HydrophobicContact CB-CB 4.07Å; V134-Q173 HydrophobicContact CB-CG 4.23Å; V134-Q173 HydrophobicContact CG1-CB 4.04Å; V134-P174 VanDerWaalsContact CG1-O 3.22Å; V134-P174 WeakPolarHBondContact CG1-O 3.48Å; V134-D191 HydrophobicContact CG1-CB 4.41Å
135	G	96.8	Very high	97.4	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.184	C	C	.	.			trans	-57.5	153.7	-177.4	0	0	0	0	0	113	D133 G140 H141	D133-G135 VanDerWaalsContact C-N 3.3Å; D133-G135 PolarHBondContact OD1-N 3.22Å; G135-G140 CarbonylContact O-C 3.52Å; G135-G140 WeakPolarHBondContact O-CA 3.37Å; G135-H141 PolarHBondContact O-CD2 3.3Å; G135-H141 VanDerWaalsContact O-CD2 3.22Å; G135-H141 PolarHBondContact O-N 3.18Å; G135-H141 PolarHBondContact O-NE2 2.82Å
136	G	96	Very high	97.7	Very high	61 Å²	61	23.4 Å²	23.4	63%	0.629	14%	0.142	S	C	*	.	S	Bend	trans	-91.5	-11.3	174.3	0	0	0	0	0	113.7	E112	E112-G136 PolarHBondContact OE1-N 3.2Å
137	G	96.2	Very high	98	Very high	21 Å²	21	18 Å²	18	22%	0.216	11%	0.114	C	C	.	.	S	Bend	trans	-83.7	-168.6	-179.5	0	0	0	0	0	113.7	E112 Y139 G140 G160	E112-G137 WeakPolarHBondContact OE1-CA 3.39Å; E112-G137 PolarHBondContact OE1-N 3.37Å; E112-G137 WeakPolarHBondContact OE2-CA 3.48Å; E112-G137 PolarHBondContact OE2-N 2.82Å; G137-Y139 PolarHBondContact O-N 3.16Å; G137-G140 PolarHBondContact O-N 2.79Å; G137-G140 VanDerWaalsContact O-N 3.15Å; G137-G160 WeakPolarHBondContact O-CA 3.47Å
138	P	97.1	Very high	98	Very high	93 Å²	93	19.3 Å²	19.3	60%	0.604	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-13.3	-166.2	27	-35.6	0	0	0	114.5	P159 G160	P138-P159 CarbonylContact O-C 3.57Å; P138-P159 WeakPolarHBondContact O-CB 3.27Å; P138-G160 PolarHBondContact O-N 3.48Å
139	Y	97	Very high	98	Very high	93 Å²	93	22.4 Å²	22.4	37%	0.365	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-16.2	179.9	-57.2	-66.9	0	0	0	113.2	T109 T110 G137 S142 K144	T109-Y139 WeakPolarHBondContact O-CD2 3.43Å; T109-Y139 WeakPolarHBondContact O-CE2 3.13Å; T110-Y139 HydrophobicContact CG2-CE1 4.34Å; T110-Y139 WeakPolarHBondContact O-CB 3.24Å; G137-Y139 PolarHBondContact O-N 3.16Å; Y139-S142 PolarHBondContact O-OG 2.97Å; Y139-K144 WeakPolarHBondContact O-CE 3.18Å; Y139-K144 PolarHBondContact O-NZ 3.06Å
140	G	97.8	Very high	97.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	15%	0.149	C	C	.	.			trans	-74.6	-165.8	-175.1	0	0	0	0	0	114.3	G135 G137 S142 P159 G160	G135-G140 CarbonylContact O-C 3.52Å; G135-G140 WeakPolarHBondContact O-CA 3.37Å; G137-G140 PolarHBondContact O-N 2.79Å; G137-G140 VanDerWaalsContact O-N 3.15Å; G140-S142 PolarHBondContact O-N 2.76Å; G140-S142 VanDerWaalsContact O-N 3.12Å; G140-S142 PolarHBondContact O-OG 2.84Å; G140-P159 WeakPolarHBondContact O-CA 3.31Å; G140-G160 PolarHBondContact O-N 2.84Å
141	H	98.2	Very high	97.9	Very high	20 Å²	20	29 Å²	29	9%	0.093	18%	0.177	C	C	.	.	S	Bend	trans	46.2	39.6	-173.6	-51.4	-79.5	0	0	0	113.5	D133 G135 D172	D133-H141 PolarHBondContact O-N 3.48Å; G135-H141 PolarHBondContact O-CD2 3.3Å; G135-H141 VanDerWaalsContact O-CD2 3.22Å; G135-H141 PolarHBondContact O-N 3.18Å; G135-H141 PolarHBondContact O-NE2 2.82Å; H141-D172 IonicContact CE1-OD1 3.16Å; H141-D172 PolarHBondContact CE1-OD1 2.93Å; H141-D172 IonicContact ND1-OD1 2.94Å; H141-D172 PolarHBondContact ND1-OD1 2.83Å
142	S	98.6	Very high	97.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	165.3	-174.9	63.2	0	0	0	0	112.1	D133 Y139 G140 K144 L156	D133-S142 PolarHBondContact N-O 3.49Å; D133-S142 PolarHBondContact O-N 2.86Å; Y139-S142 PolarHBondContact O-OG 2.97Å; G140-S142 PolarHBondContact O-N 2.76Å; G140-S142 VanDerWaalsContact O-N 3.12Å; G140-S142 PolarHBondContact O-OG 2.84Å; S142-K144 VanDerWaalsContact OG-CE 3.26Å; S142-K144 WeakPolarHBondContact OG-CE 3.26Å; S142-K144 PolarHBondContact OG-NZ 2.83Å; S142-L156 WeakPolarHBondContact CB-O 3.38Å
143	I	98.8	Very high	97.8	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.9	173.9	-51	177.3	0	0	0	107.7	W130 I131 T132 L156 F171 P174 I177 I187	W130-I143 HydrophobicContact CE3-CG2 4.1Å; I131-I143 WeakPolarHBondContact O-CA 3.27Å; T132-I143 HydrophobicContact CG2-CD1 4.06Å; T132-I143 HydrophobicContact CG2-CG1 3.93Å; T132-I143 HydrophobicContact CG2-CG2 4.14Å; I143-L156 HydrophobicContact CB-CB 4.23Å; I143-L156 PolarHBondContact N-O 2.9Å; I143-L156 PolarHBondContact O-N 3.08Å; I143-F171 HydrophobicContact CD1-CE1 4.16Å; I143-F171 HydrophobicContact CD1-CE2 4.12Å; I143-F171 HydrophobicContact CD1-CZ 3.87Å; I143-F171 HydrophobicContact CG1-CD2 4.36Å; I143-F171 HydrophobicContact CG1-CE2 4.14Å; I143-F171 HydrophobicContact CG1-CZ 4.4Å; I143-P174 HydrophobicContact CD1-CB 3.95Å; I143-P174 HydrophobicContact CG1-CB 3.84Å; I143-P174 HydrophobicContact CG1-CG 3.85Å; I143-I177 HydrophobicContact CG2-CD1 4.06Å; I143-I177 HydrophobicContact CG2-CG2 4.2Å; I143-I187 HydrophobicContact CD1-CB 4.4Å; I143-I187 HydrophobicContact CD1-CD1 3.87Å; I143-I187 HydrophobicContact CD1-CG1 3.94Å; I143-I187 HydrophobicContact CD1-CG2 3.54Å
144	K	98.6	Very high	97.8	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.009	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	134.3	-170.7	-61.3	-176.4	-167.1	89.8	0	110.9	T110 W130 I131 D133 Y139 S142 Y146 L152 Q154 V155	T110-K144 WeakPolarHBondContact O-CD 3.43Å; T110-K144 WeakPolarHBondContact O-CE 3.35Å; T110-K144 PolarHBondContact O-NZ 2.85Å; W130-K144 CarbonylContact C-O 3.53Å; W130-K144 WeakPolarHBondContact CA-O 3.34Å; I131-K144 PolarHBondContact N-O 3.02Å; I131-K144 PolarHBondContact O-N 3.23Å; D133-K144 VanDerWaalsContact CB-NZ 3.28Å; D133-K144 IonicContact OD2-NZ 3.86Å; D133-K144 PolarHBondContact OD2-NZ 2.97Å; Y139-K144 WeakPolarHBondContact O-CE 3.18Å; Y139-K144 PolarHBondContact O-NZ 3.06Å; S142-K144 VanDerWaalsContact OG-CE 3.26Å; S142-K144 WeakPolarHBondContact OG-CE 3.26Å; S142-K144 PolarHBondContact OG-NZ 2.83Å; K144-Y146 HydrophobicContact CB-CD2 4.15Å; K144-Y146 HydrophobicContact CB-CE2 3.37Å; K144-Y146 HydrophobicContact CD-CE2 4.33Å; K144-Y146 WeakPolarHBondContact CD-OH 3.41Å; K144-Y146 HydrophobicContact CG-CE2 4.47Å; K144-L152 HydrophobicContact CB-CD1 3.78Å; K144-L152 HydrophobicContact CD-CD1 4.14Å; K144-L152 HydrophobicContact CG-CD1 4.16Å; K144-Q154 WeakPolarHBondContact CA-O 3.48Å; K144-V155 HydrophobicContact CG-CG2 4.34Å
145	Q	98.6	Very high	97.8	Very high	31 Å²	31	40.9 Å²	40.9	15%	0.145	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131.2	173.2	-170.8	-173.5	35.7	0	0	109.3	T128 I129 W130 L153 Q154	T128-Q145 HydrophobicContact CG2-CG 4.16Å; T128-Q145 PolarHBondContact OG1-NE2 2.82Å; I129-Q145 CarbonylContact O-C 3.49Å; I129-Q145 WeakPolarHBondContact O-CA 3.49Å; W130-Q145 HydrophobicContact CD2-CB 3.95Å; W130-Q145 HydrophobicContact CD2-CG 4.02Å; W130-Q145 HydrophobicContact CE3-CB 3.96Å; W130-Q145 HydrophobicContact CH2-CB 3.95Å; W130-Q145 HydrophobicContact CH2-CG 4.25Å; W130-Q145 HydrophobicContact CZ2-CB 3.93Å; W130-Q145 HydrophobicContact CZ2-CG 3.72Å; W130-Q145 VanDerWaalsContact CZ2-NE2 3.28Å; W130-Q145 HydrophobicContact CZ3-CB 3.96Å; Q145-L153 HydrophobicContact CG-CB 4.44Å; Q145-L153 PolarHBondContact O-N 3.24Å; Q145-Q154 HydrophobicContact CB-CB 3.88Å; Q145-Q154 PolarHBondContact N-O 3.16Å; Q145-Q154 PolarHBondContact O-N 3.2Å
146	Y	98.8	Very high	97.8	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	153.2	-179.7	-66.5	-85.3	0	0	0	111.5	W106 T110 T128 I129 I131 K144 G150 K151 L152	W106-Y146 HydrophobicContact CE3-CG 4.49Å; W106-Y146 HydrophobicContact CH2-CD2 4.38Å; W106-Y146 HydrophobicContact CH2-CG 4.07Å; W106-Y146 HydrophobicContact CZ3-CD1 4.14Å; W106-Y146 AromaticContact CZ3-CD2 3.84Å; W106-Y146 HydrophobicContact CZ3-CD2 3.84Å; W106-Y146 HydrophobicContact CZ3-CE2 4.48Å; W106-Y146 AromaticContact CZ3-CG 3.63Å; W106-Y146 HydrophobicContact CZ3-CG 3.63Å; T110-Y146 PolarHBondContact OG1-OH 3.27Å; T128-Y146 WeakPolarHBondContact CA-O 3.22Å; I129-Y146 PolarHBondContact N-O 3.41Å; I129-Y146 PolarHBondContact O-N 3.29Å; I131-Y146 HydrophobicContact CB-CE2 4.42Å; I131-Y146 HydrophobicContact CD1-CD2 3.97Å; I131-Y146 HydrophobicContact CD1-CE2 4.12Å; I131-Y146 HydrophobicContact CG1-CD2 4.25Å; I131-Y146 HydrophobicContact CG1-CE2 4.47Å; K144-Y146 HydrophobicContact CB-CD2 4.15Å; K144-Y146 HydrophobicContact CB-CE2 3.37Å; K144-Y146 HydrophobicContact CD-CE2 4.33Å; K144-Y146 WeakPolarHBondContact CD-OH 3.41Å; K144-Y146 HydrophobicContact CG-CE2 4.47Å; Y146-G150 WeakPolarHBondContact CD1-O 3.3Å; Y146-K151 CarbonylContact C-O 3.19Å; Y146-K151 VanDerWaalsContact CA-O 3.28Å; Y146-K151 WeakPolarHBondContact CA-O 3.23Å; Y146-L152 HydrophobicContact CD1-CB 4.11Å; Y146-L152 HydrophobicContact CD1-CD1 4.21Å; Y146-L152 HydrophobicContact CE1-CB 3.77Å; Y146-L152 HydrophobicContact CE1-CD1 3.67Å; Y146-L152 HydrophobicContact CE1-CG 4.32Å; Y146-L152 HydrophobicContact CE2-CD1 4.37Å
147	S	98.1	Very high	97.9	Very high	17 Å²	17	39 Å²	39	12%	0.119	22%	0.219	C	C	.	.			trans	-68.4	164.9	161.4	72.1	0	0	0	0	110.6	S149 G150 K151	S147-S149 PolarHBondContact O-N 3.16Å; S147-S149 VanDerWaalsContact O-N 3.08Å; S147-S149 PolarHBondContact OG-N 3.46Å; S147-S149 PolarHBondContact OG-OG 2.88Å; S147-G150 PolarHBondContact O-N 2.99Å; S147-G150 PolarHBondContact OG-N 2.84Å; S147-K151 PolarHBondContact N-O 3.38Å; S147-K151 VanDerWaalsContact OG-CB 3.3Å; S147-K151 WeakPolarHBondContact OG-CB 3.5Å; S147-K151 PolarHBondContact OG-N 3.19Å
148	P	97.8	Very high	98	Very high	42 Å²	42	40.3 Å²	40.3	27%	0.273	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-27.8	171.8	-32.3	41.6	0	0	0	114.5	Y82 M104 W106 P127 I129	Y82-P148 WeakPolarHBondContact CE1-O 3.41Å; Y82-P148 WeakPolarHBondContact OH-CB 3.4Å; M104-P148 WeakPolarHBondContact CE-O 3.43Å; W106-P148 PolarHBondContact NE1-O 2.86Å; P127-P148 HydrophobicContact CG-CG 3.86Å; P127-P148 VanDerWaalsContact O-CD 3.3Å; P127-P148 WeakPolarHBondContact O-CD 3.43Å; I129-P148 HydrophobicContact CD1-CB 4.36Å; I129-P148 HydrophobicContact CD1-CG 4.13Å
149	S	97	Very high	98	Very high	78 Å²	78	38.3 Å²	38.3	55%	0.545	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-0.1	177.7	56.1	0	0	0	0	114.7	S147	S147-S149 PolarHBondContact O-N 3.16Å; S147-S149 VanDerWaalsContact O-N 3.08Å; S147-S149 PolarHBondContact OG-N 3.46Å; S147-S149 PolarHBondContact OG-OG 2.88Å
150	G	97.8	Very high	98	Very high	8 Å²	8	35.5 Å²	35.5	8%	0.082	21%	0.209	C	C	.	.			trans	85.1	14.6	179.2	0	0	0	0	0	115.1	W106 Y146 S147	W106-G150 VanDerWaalsContact CE2-CA 3.45Å; Y146-G150 WeakPolarHBondContact CD1-O 3.3Å; S147-G150 PolarHBondContact O-N 2.99Å; S147-G150 PolarHBondContact OG-N 2.84Å
151	K	97.9	Very high	98	Very high	142 Å²	142	41.1 Å²	41.1	62%	0.617	23%	0.234	S	C	*	.			trans	-74.6	125.3	170.8	-177.6	-173.7	174	-174.6	0	109.1	Y146 S147 L153	Y146-K151 CarbonylContact C-O 3.19Å; Y146-K151 VanDerWaalsContact CA-O 3.28Å; Y146-K151 WeakPolarHBondContact CA-O 3.23Å; S147-K151 PolarHBondContact N-O 3.38Å; S147-K151 VanDerWaalsContact OG-CB 3.3Å; S147-K151 WeakPolarHBondContact OG-CB 3.5Å; S147-K151 PolarHBondContact OG-N 3.19Å; K151-L153 HydrophobicContact CD-CD2 4.41Å; K151-L153 PolarHBondContact O-N 3.29Å
152	L	98.5	Very high	98	Very high	60 Å²	60	41.9 Å²	41.9	31%	0.314	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	127.8	173.9	-177.2	66.3	0	0	0	110.1	T110 K144 Y146 Q154 V155	T110-L152 HydrophobicContact CG2-CD2 3.96Å; K144-L152 HydrophobicContact CB-CD1 3.78Å; K144-L152 HydrophobicContact CD-CD1 4.14Å; K144-L152 HydrophobicContact CG-CD1 4.16Å; Y146-L152 HydrophobicContact CD1-CB 4.11Å; Y146-L152 HydrophobicContact CD1-CD1 4.21Å; Y146-L152 HydrophobicContact CE1-CB 3.77Å; Y146-L152 HydrophobicContact CE1-CD1 3.67Å; Y146-L152 HydrophobicContact CE1-CG 4.32Å; Y146-L152 HydrophobicContact CE2-CD1 4.37Å; L152-Q154 WeakPolarHBondContact CD1-O 3.36Å; L152-V155 HydrophobicContact CD1-CG2 4.12Å; L152-V155 HydrophobicContact CD2-CG2 3.91Å; L152-V155 HydrophobicContact CG-CG2 4.4Å
153	L	98.1	Very high	98	Very high	86 Å²	86	42.2 Å²	42.2	45%	0.45	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-41.9	180	-57.9	-180	0	0	0	111.6	T128 Q145 K151	T128-L153 HydrophobicContact CG2-CD1 3.89Å; Q145-L153 HydrophobicContact CG-CB 4.44Å; Q145-L153 PolarHBondContact O-N 3.24Å; K151-L153 HydrophobicContact CD-CD2 4.41Å; K151-L153 PolarHBondContact O-N 3.29Å
154	Q	97.2	Very high	97.9	Very high	51 Å²	51	45 Å²	45	24%	0.238	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	151.8	-174.9	-175.5	-179.7	-13.4	0	0	111.3	K144 Q145 L152	K144-Q154 WeakPolarHBondContact CA-O 3.48Å; Q145-Q154 HydrophobicContact CB-CB 3.88Å; Q145-Q154 PolarHBondContact N-O 3.16Å; Q145-Q154 PolarHBondContact O-N 3.2Å; L152-Q154 WeakPolarHBondContact CD1-O 3.36Å
155	V	98.3	Very high	97.9	Very high	53 Å²	53	46.1 Å²	46.1	32%	0.321	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.3	171.7	-179.9	0	0	0	0	109	K144 L152 P159	K144-V155 HydrophobicContact CG-CG2 4.34Å; L152-V155 HydrophobicContact CD1-CG2 4.12Å; L152-V155 HydrophobicContact CD2-CG2 3.91Å; L152-V155 HydrophobicContact CG-CG2 4.4Å; V155-P159 HydrophobicContact CG1-CG 3.57Å
156	L	98.3	Very high	97.7	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.7	163.5	-52.4	-179.4	0	0	0	108.8	W130 S142 I143 F171 M185 I187 L201 Q205	W130-L156 HydrophobicContact CE3-CD1 4.46Å; W130-L156 HydrophobicContact CH2-CD1 4.4Å; W130-L156 HydrophobicContact CZ3-CD1 3.66Å; W130-L156 HydrophobicContact CZ3-CG 3.92Å; S142-L156 WeakPolarHBondContact CB-O 3.38Å; I143-L156 HydrophobicContact CB-CB 4.23Å; I143-L156 PolarHBondContact N-O 2.9Å; I143-L156 PolarHBondContact O-N 3.08Å; L156-F171 HydrophobicContact CB-CE2 3.81Å; L156-F171 HydrophobicContact CB-CZ 4.32Å; L156-M185 HydrophobicContact CD1-SD 3.88Å; L156-I187 HydrophobicContact CD1-CD1 4.28Å; L156-L201 HydrophobicContact CD1-CD1 4.48Å; L156-Q205 HydrophobicContact CD2-CG 3.71Å
157	G	97.2	Very high	97.5	Very high	20 Å²	20	55.9 Å²	55.9	21%	0.206	33%	0.332	C	S	.	.	S	Bend	trans	94.8	-176.3	-175.1	0	0	0	0	0	112.6	L169	G157-L169 CarbonylContact C-O 3.59Å; G157-L169 VanDerWaalsContact CA-O 3.23Å; G157-L169 WeakPolarHBondContact CA-O 3.47Å
158	T	97.4	Very high	97.3	Very high	49 Å²	49	58.9 Å²	58.9	30%	0.301	35%	0.351	S	S	.	.			trans	-112.5	101.9	170.9	-55.3	0	0	0	0	108.1	G160 K161	T158-G160 PolarHBondContact O-N 3.27Å; T158-K161 HydrophobicContact CG2-CB 3.89Å; T158-K161 HydrophobicContact CG2-CD 4.18Å; T158-K161 PolarHBondContact O-N 3.25Å
159	P	97.8	Very high	97.2	Very high	50 Å²	50	58 Å²	58	33%	0.325	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	135.6	-177.2	-30	36.3	0	0	0	113.3	P138 G140 V155 K161	P138-P159 CarbonylContact O-C 3.57Å; P138-P159 WeakPolarHBondContact O-CB 3.27Å; G140-P159 WeakPolarHBondContact O-CA 3.31Å; V155-P159 HydrophobicContact CG1-CG 3.57Å; P159-K161 PolarHBondContact O-N 3.42Å
160	G	97.3	Very high	97.3	Very high	34 Å²	34	55.5 Å²	55.5	35%	0.351	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	4.8	-178.9	0	0	0	0	0	115.4	G137 P138 G140 T158	G137-G160 WeakPolarHBondContact O-CA 3.47Å; P138-G160 PolarHBondContact O-N 3.48Å; G140-G160 PolarHBondContact O-N 2.84Å; T158-G160 PolarHBondContact O-N 3.27Å
161	K	97.6	Very high	97.3	Very high	118 Å²	118	55.1 Å²	55.1	51%	0.513	32%	0.32	S	S	.	.			trans	-122.6	93.1	177.9	-169.1	-173.7	177.3	-170.3	0	111.2	T158 P159	T158-K161 HydrophobicContact CG2-CB 3.89Å; T158-K161 HydrophobicContact CG2-CD 4.18Å; T158-K161 PolarHBondContact O-N 3.25Å; P159-K161 PolarHBondContact O-N 3.42Å
162	A	98.1	Very high	97.3	Very high	37 Å²	37	49 Å²	49	31%	0.306	29%	0.293	S	S	.	.			trans	-52.8	142.5	169.2	0	0	0	0	0	111.8	F171 D172 M194	A162-F171 CarbonylContact C-O 3.4Å; A162-F171 VanDerWaalsContact CA-O 3.3Å; A162-F171 WeakPolarHBondContact CA-O 3.21Å; A162-D172 HydrophobicContact CB-CB 4.19Å; A162-M194 HydrophobicContact CB-CE 4.07Å
163	G	98.1	Very high	97.3	Very high	7 Å²	7	48.5 Å²	48.5	7%	0.072	29%	0.289	C	S	.	.			trans	172.6	175.4	172.5	0	0	0	0	0	114.1	Q170 F171 N195	G163-Q170 CarbonylContact O-C 3.49Å; G163-F171 PolarHBondContact N-O 3.47Å; G163-F171 CarbonylContact O-C 3.54Å; G163-F171 WeakPolarHBondContact O-CA 3.35Å; G163-F171 PolarHBondContact O-N 3.08Å; G163-N195 PolarHBondContact O-ND2 3.23Å
164	S	97.9	Very high	97.3	Very high	58 Å²	58	44.4 Å²	44.4	41%	0.406	27%	0.268	S	S	.	.			trans	-112.1	1.6	-179.6	-42.8	0	0	0	0	113.2	N195 R197	S164-N195 VanDerWaalsContact CB-OD1 3.23Å; S164-N195 WeakPolarHBondContact CB-OD1 3.27Å; S164-N195 PolarHBondContact OG-OD1 2.53Å; S164-R197 PolarHBondContact O-NH1 2.88Å
165	G	97.3	Very high	97.4	Very high	26 Å²	26	42 Å²	42	27%	0.268	26%	0.257	S	S	.	.			trans	-55	146	-178.4	0	0	0	0	0	112.7	P168 L169 Q170	G165-P168 CarbonylContact C-O 3.34Å; G165-L169 WeakPolarHBondContact O-CA 3.05Å; G165-Q170 PolarHBondContact O-N 2.73Å
166	L	96	Very high	97.4	Very high	76 Å²	76	39.5 Å²	39.5	40%	0.398	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-106.6	-16.7	175.5	-59.3	-179.1	0	0	0	112.4	P168 L169 V207 M210	L166-P168 CarbonylContact C-O 3.51Å; L166-L169 HydrophobicContact CD2-CD1 4.1Å; L166-L169 PolarHBondContact O-N 2.7Å; L166-V207 HydrophobicContact CB-CG2 4.44Å; L166-V207 HydrophobicContact CD1-CG2 4.48Å; L166-V207 HydrophobicContact CD2-CG2 4.18Å; L166-M210 HydrophobicContact CD1-CE 3.97Å; L166-M210 HydrophobicContact CD1-SD 4.41Å; L166-M210 HydrophobicContact CD2-SD 4.02Å
167	D	93.8	Very high	97.4	Very high	160 Å²	160	39.4 Å²	39.4	86%	0.856	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-148.8	102.1	173.8	-169.9	9.3	0	0	0	110.4
168	P	94.1	Very high	97.5	Very high	79 Å²	79	39.8 Å²	39.8	51%	0.513	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	cis	-62.9	151.4	-7.2	29.9	-35.7	0	0	0	111	G165 L166 Q170	G165-P168 CarbonylContact C-O 3.34Å; L166-P168 CarbonylContact C-O 3.51Å; P168-Q170 PolarHBondContact O-N 2.88Å
169	L	96.5	Very high	97.5	Very high	24 Å²	24	38.1 Å²	38.1	13%	0.126	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-60.1	129.3	171.4	-172.3	62.6	0	0	0	109	G157 G165 L166 F171 L201	G157-L169 CarbonylContact C-O 3.59Å; G157-L169 VanDerWaalsContact CA-O 3.23Å; G157-L169 WeakPolarHBondContact CA-O 3.47Å; G165-L169 WeakPolarHBondContact O-CA 3.05Å; L166-L169 HydrophobicContact CD2-CD1 4.1Å; L166-L169 PolarHBondContact O-N 2.7Å; L169-F171 HydrophobicContact CD1-CE1 4.47Å; L169-F171 HydrophobicContact CD1-CZ 4.38Å; L169-F171 HydrophobicContact CD2-CE1 4.29Å; L169-F171 HydrophobicContact CD2-CE2 3.94Å; L169-F171 HydrophobicContact CD2-CZ 3.48Å; L169-F171 VanDerWaalsContact CD2-CZ 3.48Å; L169-F171 HydrophobicContact CG-CE1 4.34Å; L169-F171 HydrophobicContact CG-CE2 4.07Å; L169-F171 HydrophobicContact CG-CZ 3.81Å; L169-L201 HydrophobicContact CD2-CD1 3.84Å
170	Q	98	Very high	97.5	Very high	26 Å²	26	38 Å²	38	12%	0.121	22%	0.222	C	C	.	.			trans	-127.7	152.2	174.4	-61.1	-171.1	-82.8	0	0	108.9	G163 G165 P168 R197	G163-Q170 CarbonylContact O-C 3.49Å; G165-Q170 PolarHBondContact O-N 2.73Å; P168-Q170 PolarHBondContact O-N 2.88Å; Q170-R197 PolarHBondContact O-NH2 2.95Å
171	F	98.6	Very high	97.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.			trans	-124.1	166.6	174.8	-60.8	-74.1	0	0	0	110.2	I143 L156 A162 G163 L169 P174 I187 D189 I199	I143-F171 HydrophobicContact CD1-CE1 4.16Å; I143-F171 HydrophobicContact CD1-CE2 4.12Å; I143-F171 HydrophobicContact CD1-CZ 3.87Å; I143-F171 HydrophobicContact CG1-CD2 4.36Å; I143-F171 HydrophobicContact CG1-CE2 4.14Å; I143-F171 HydrophobicContact CG1-CZ 4.4Å; L156-F171 HydrophobicContact CB-CE2 3.81Å; L156-F171 HydrophobicContact CB-CZ 4.32Å; A162-F171 CarbonylContact C-O 3.4Å; A162-F171 VanDerWaalsContact CA-O 3.3Å; A162-F171 WeakPolarHBondContact CA-O 3.21Å; G163-F171 PolarHBondContact N-O 3.47Å; G163-F171 CarbonylContact O-C 3.54Å; G163-F171 WeakPolarHBondContact O-CA 3.35Å; G163-F171 PolarHBondContact O-N 3.08Å; L169-F171 HydrophobicContact CD1-CE1 4.47Å; L169-F171 HydrophobicContact CD1-CZ 4.38Å; L169-F171 HydrophobicContact CD2-CE1 4.29Å; L169-F171 HydrophobicContact CD2-CE2 3.94Å; L169-F171 HydrophobicContact CD2-CZ 3.48Å; L169-F171 VanDerWaalsContact CD2-CZ 3.48Å; L169-F171 HydrophobicContact CG-CE1 4.34Å; L169-F171 HydrophobicContact CG-CE2 4.07Å; L169-F171 HydrophobicContact CG-CZ 3.81Å; F171-P174 HydrophobicContact CB-CB 4.19Å; F171-P174 HydrophobicContact CB-CG 3.95Å; F171-P174 HydrophobicContact CD1-CB 4.31Å; F171-P174 HydrophobicContact CG-CB 4.26Å; F171-P174 HydrophobicContact CG-CG 4.3Å; F171-I187 HydrophobicContact CD1-CG2 4.47Å; F171-I187 HydrophobicContact CE1-CD1 4.26Å; F171-I187 HydrophobicContact CE1-CG2 3.87Å; F171-I187 HydrophobicContact CZ-CD1 4.02Å; F171-D189 HydrophobicContact CD1-CB 4.11Å; F171-I199 HydrophobicContact CE1-CD1 4.08Å
172	D	98.3	Very high	97.1	Very high	12 Å²	12	41.7 Å²	41.7	6%	0.064	24%	0.238	C	C	.	.	S	Bend	trans	-143	96.9	167.6	-174.7	16.6	0	0	0	109.5	H141 A162 D189 G193 M194 N195	H141-D172 IonicContact CE1-OD1 3.16Å; H141-D172 PolarHBondContact CE1-OD1 2.93Å; H141-D172 IonicContact ND1-OD1 2.94Å; H141-D172 PolarHBondContact ND1-OD1 2.83Å; A162-D172 HydrophobicContact CB-CB 4.19Å; D172-D189 PolarHBondContact N-OD1 2.81Å; D172-D189 VanDerWaalsContact O-OD1 3.11Å; D172-G193 WeakPolarHBondContact OD2-CA 3.44Å; D172-M194 HydrophobicContact CB-CE 4.19Å; D172-M194 HydrophobicContact CB-CG 3.96Å; D172-M194 VanDerWaalsContact OD2-CE 3.24Å; D172-M194 WeakPolarHBondContact OD2-CE 3.43Å; D172-M194 WeakPolarHBondContact OD2-CG 3.49Å; D172-M194 PolarHBondContact OD2-N 3.4Å; D172-N195 PolarHBondContact N-ND2 3.46Å
173	Q	98	Very high	97	Very high	50 Å²	50	40.7 Å²	40.7	23%	0.234	23%	0.232	C	C	.	.	S	Bend	trans	59.9	66	-173.3	-57.5	178.2	53.3	0	0	111.6	V134 A175 G190 D191	V134-Q173 HydrophobicContact CB-CB 4.07Å; V134-Q173 HydrophobicContact CB-CG 4.23Å; V134-Q173 HydrophobicContact CG1-CB 4.04Å; Q173-A175 PolarHBondContact O-N 2.95Å; Q173-G190 PolarHBondContact O-N 2.88Å; Q173-D191 HydrophobicContact CB-CB 4.42Å; Q173-D191 PolarHBondContact O-N 3.2Å; Q173-D191 PolarHBondContact OE1-O 2.88Å
174	P	98.6	Very high	97	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	121.6	174.9	27	-31.6	0	0	0	110.4	T132 V134 I143 F171	T132-P174 WeakPolarHBondContact CB-O 3.46Å; T132-P174 HydrophobicContact CG2-CB 4.37Å; T132-P174 PolarHBondContact OG1-O 3.09Å; V134-P174 VanDerWaalsContact CG1-O 3.22Å; V134-P174 WeakPolarHBondContact CG1-O 3.48Å; I143-P174 HydrophobicContact CD1-CB 3.95Å; I143-P174 HydrophobicContact CG1-CB 3.84Å; I143-P174 HydrophobicContact CG1-CG 3.85Å; F171-P174 HydrophobicContact CB-CB 4.19Å; F171-P174 HydrophobicContact CB-CG 3.95Å; F171-P174 HydrophobicContact CD1-CB 4.31Å; F171-P174 HydrophobicContact CG-CB 4.26Å; F171-P174 HydrophobicContact CG-CG 4.3Å
175	A	98.5	Very high	97	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	-45.9	-171.9	0	0	0	0	0	111.5	H115 G116 T132 Q173 V188 D191 P224 H225	H115-A175 PolarHBondContact ND1-O 2.59Å; G116-A175 WeakPolarHBondContact CA-O 3.18Å; G116-A175 PolarHBondContact N-O 2.99Å; G116-A175 VanDerWaalsContact N-O 3.13Å; T132-A175 PolarHBondContact OG1-O 3.28Å; Q173-A175 PolarHBondContact O-N 2.95Å; A175-V188 HydrophobicContact CB-CG2 4.16Å; A175-V188 PolarHBondContact N-O 2.85Å; A175-D191 HydrophobicContact CB-CB 3.85Å; A175-P224 WeakPolarHBondContact CB-O 3.43Å; A175-H225 WeakPolarHBondContact CB-O 3.24Å
176	E	98.6	Very high	97.1	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	159.4	-176.8	-165.8	165.3	-114.4	0	0	112.5	I187 V188 S226 V227 R272	E176-I187 WeakPolarHBondContact O-CA 3.35Å; E176-V188 HydrophobicContact CB-CG2 3.7Å; E176-V188 PolarHBondContact N-O 3.46Å; E176-V188 PolarHBondContact O-N 3.24Å; E176-S226 WeakPolarHBondContact OE2-CA 3.44Å; E176-S226 WeakPolarHBondContact OE2-CB 3.11Å; E176-S226 PolarHBondContact OE2-OG 2.8Å; E176-V227 HydrophobicContact CB-CG1 4.36Å; E176-V227 HydrophobicContact CG-CG1 4.37Å; E176-V227 PolarHBondContact OE2-N 2.91Å; E176-R272 IonicContact OE1-CZ 3.27Å; E176-R272 IonicContact OE1-NH1 3.64Å; E176-R272 PolarHBondContact OE1-NH1 2.88Å; E176-R272 IonicContact OE1-NH2 2.85Å; E176-R272 PolarHBondContact OE1-NH2 3.27Å; E176-R272 IonicContact OE2-CZ 3.47Å; E176-R272 IonicContact OE2-NH1 2.83Å; E176-R272 PolarHBondContact OE2-NH1 2.86Å; E176-R272 IonicContact OE2-NH2 3.07Å
177	I	98.8	Very high	97.2	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.4	175.1	-177.6	168.8	0	0	0	109.8	F118 W130 T132 I143 V179 M185 Y186 I187	F118-I177 HydrophobicContact CB-CG2 4.33Å; F118-I177 WeakPolarHBondContact CB-O 3.49Å; W130-I177 HydrophobicContact CB-CG2 3.84Å; W130-I177 HydrophobicContact CD2-CD1 4.26Å; W130-I177 HydrophobicContact CE3-CD1 3.85Å; W130-I177 HydrophobicContact CZ3-CD1 4.41Å; T132-I177 HydrophobicContact CG2-CB 4.3Å; T132-I177 HydrophobicContact CG2-CG2 3.99Å; I143-I177 HydrophobicContact CG2-CD1 4.06Å; I143-I177 HydrophobicContact CG2-CG2 4.2Å; I177-V179 HydrophobicContact CD1-CG2 3.92Å; I177-V179 HydrophobicContact CG1-CG2 3.96Å; I177-M185 HydrophobicContact CD1-CB 4.31Å; I177-M185 HydrophobicContact CD1-CG 4.33Å; I177-M185 HydrophobicContact CD1-SD 4.23Å; I177-Y186 CarbonylContact C-O 3.28Å; I177-Y186 WeakPolarHBondContact CA-O 3.4Å; I177-I187 HydrophobicContact CB-CG1 4.22Å; I177-I187 HydrophobicContact CD1-CD1 4.27Å; I177-I187 HydrophobicContact CD1-CG1 3.95Å; I177-I187 HydrophobicContact CG1-CG1 3.83Å
178	F	98.6	Very high	97.4	Very high	28 Å²	28	27.6 Å²	27.6	12%	0.123	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.8	163.1	178.7	-82.7	0	0	0	108.6	F118 H180 M185 Y186 V227 V229	F118-F178 HydrophobicContact CD2-CD2 4.24Å; F118-F178 AromaticContact CE2-CD2 3.43Å; F118-F178 HydrophobicContact CE2-CD2 3.43Å; F118-F178 VanDerWaalsContact CE2-CD2 3.43Å; F118-F178 AromaticContact CE2-CE2 3.72Å; F118-F178 HydrophobicContact CE2-CE2 3.72Å; F118-F178 HydrophobicContact CE2-CG 4.16Å; F118-F178 AromaticContact CZ-CD2 3.8Å; F118-F178 HydrophobicContact CZ-CD2 3.8Å; F118-F178 AromaticContact CZ-CE2 3.82Å; F118-F178 HydrophobicContact CZ-CE2 3.82Å; F118-F178 HydrophobicContact CZ-CG 4.29Å; F118-F178 HydrophobicContact CZ-CZ 4.32Å; F178-H180 HydrophobicContact CE1-CB 4.08Å; F178-M185 CarbonylContact O-C 3.52Å; F178-M185 WeakPolarHBondContact O-CA 3.1Å; F178-Y186 AromaticContact CD1-CD2 3.98Å; F178-Y186 HydrophobicContact CD1-CD2 3.98Å; F178-Y186 PolarHBondContact N-O 3.48Å; F178-Y186 PolarHBondContact O-N 2.77Å; F178-V227 HydrophobicContact CB-CG1 4.11Å; F178-V229 HydrophobicContact CD1-CB 3.97Å; F178-V229 HydrophobicContact CD1-CG2 3.53Å; F178-V229 HydrophobicContact CE1-CB 3.6Å; F178-V229 HydrophobicContact CE1-CG2 3.68Å; F178-V229 HydrophobicContact CE2-CB 4.42Å; F178-V229 HydrophobicContact CG-CG2 4.09Å; F178-V229 HydrophobicContact CZ-CB 3.85Å; F178-V229 HydrophobicContact CZ-CG2 4.34Å
179	V	98.2	Very high	97.7	Very high	14 Å²	14	23.9 Å²	23.9	9%	0.085	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	117.7	177.4	-171.8	0	0	0	0	108.8	F118 A120 W130 I177 M185	F118-V179 HydrophobicContact CD1-CB 3.89Å; F118-V179 HydrophobicContact CD1-CG2 3.92Å; F118-V179 HydrophobicContact CE1-CB 3.71Å; F118-V179 HydrophobicContact CE1-CG2 4.27Å; F118-V179 VanDerWaalsContact CE1-N 3.31Å; F118-V179 WeakPolarHBondContact CE1-O 3.33Å; F118-V179 WeakPolarHBondContact CZ-O 3.45Å; A120-V179 HydrophobicContact CB-CB 4.01Å; A120-V179 HydrophobicContact CB-CG1 4.1Å; W130-V179 HydrophobicContact CD2-CG2 4.08Å; W130-V179 HydrophobicContact CG-CG2 3.91Å; I177-V179 HydrophobicContact CD1-CG2 3.92Å; I177-V179 HydrophobicContact CG1-CG2 3.96Å; V179-M185 HydrophobicContact CG1-CG 4.17Å; V179-M185 HydrophobicContact CG2-CG 4.16Å
180	H	96.2	Very high	97.5	Very high	47 Å²	47	22.7 Å²	22.7	22%	0.218	12%	0.118	C	C	.	.			trans	-78.2	154.7	176.1	-174.7	-98.6	0	0	0	110.5	F178 S182 G183 E184	F178-H180 HydrophobicContact CE1-CB 4.08Å; H180-S182 WeakPolarHBondContact ND1-CB 3.47Å; H180-S182 PolarHBondContact ND1-N 2.75Å; H180-S182 VanDerWaalsContact ND1-N 3.11Å; H180-S182 PolarHBondContact ND1-OG 2.95Å; H180-S182 PolarHBondContact O-N 3.06Å; H180-G183 WeakPolarHBondContact O-CA 3.42Å; H180-G183 PolarHBondContact O-N 2.86Å; H180-E184 HydrophobicContact CB-CB 4.4Å; H180-E184 WeakPolarHBondContact CB-O 3.41Å; H180-E184 PolarHBondContact N-O 3.31Å
181	E	92.8	Very high	97.3	Very high	170 Å²	170	22.4 Å²	22.4	79%	0.794	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.5	178.8	-61.7	175.9	-179.7	0	0	113.5	G183	E181-G183 PolarHBondContact O-N 3.45Å
182	S	93.9	Very high	96.8	Very high	59 Å²	59	24.9 Å²	24.9	41%	0.413	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-10.6	172.9	64	0	0	0	0	113.7	H180 E184	H180-S182 WeakPolarHBondContact ND1-CB 3.47Å; H180-S182 PolarHBondContact ND1-N 2.75Å; H180-S182 VanDerWaalsContact ND1-N 3.11Å; H180-S182 PolarHBondContact ND1-OG 2.95Å; H180-S182 PolarHBondContact O-N 3.06Å; S182-E184 WeakPolarHBondContact OG-CG 3.46Å; S182-E184 PolarHBondContact OG-N 2.9Å
183	G	95.5	Very high	96.5	Very high	17 Å²	17	25.2 Å²	25.2	18%	0.175	15%	0.149	C	C	.	.	S	Bend	trans	85.4	0	-170.2	0	0	0	0	0	114.4	H180 E181 K203	H180-G183 WeakPolarHBondContact O-CA 3.42Å; H180-G183 PolarHBondContact O-N 2.86Å; E181-G183 PolarHBondContact O-N 3.45Å; G183-K203 VanDerWaalsContact O-CA 3.25Å; G183-K203 WeakPolarHBondContact O-CA 3.49Å; G183-K203 PolarHBondContact O-N 2.84Å
184	E	98	Very high	96.4	Very high	47 Å²	47	28.1 Å²	28.1	22%	0.22	16%	0.164	C	C	.	.			trans	-66.8	141.5	169.4	-67.2	-175.1	146.5	0	0	110.7	H180 S182 Y186 K200 L201 L208	H180-E184 HydrophobicContact CB-CB 4.4Å; H180-E184 WeakPolarHBondContact CB-O 3.41Å; H180-E184 PolarHBondContact N-O 3.31Å; S182-E184 WeakPolarHBondContact OG-CG 3.46Å; S182-E184 PolarHBondContact OG-N 2.9Å; E184-Y186 HydrophobicContact CB-CE2 4.48Å; E184-Y186 PolarHBondContact OE2-OH 2.96Å; E184-K200 VanDerWaalsContact OE1-CE 3.31Å; E184-K200 WeakPolarHBondContact OE1-CE 3.23Å; E184-K200 IonicContact OE1-NZ 2.89Å; E184-K200 PolarHBondContact OE1-NZ 2.81Å; E184-K200 WeakPolarHBondContact OE2-CE 3.48Å; E184-K200 IonicContact OE2-NZ 3.26Å; E184-K200 PolarHBondContact OE2-NZ 3.06Å; E184-L201 WeakPolarHBondContact CA-O 3.42Å; E184-L208 HydrophobicContact CG-CD1 4.41Å
185	M	98.6	Very high	96.4	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.025	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	140	-175.6	-60.6	168.8	-89.2	0	0	110.5	W130 L156 I177 F178 V179 K200 L201 S202 Q205	W130-M185 HydrophobicContact CH2-SD 3.95Å; W130-M185 HydrophobicContact CZ2-SD 4.45Å; W130-M185 HydrophobicContact CZ3-SD 4.19Å; L156-M185 HydrophobicContact CD1-SD 3.88Å; I177-M185 HydrophobicContact CD1-CB 4.31Å; I177-M185 HydrophobicContact CD1-CG 4.33Å; I177-M185 HydrophobicContact CD1-SD 4.23Å; F178-M185 CarbonylContact O-C 3.52Å; F178-M185 WeakPolarHBondContact O-CA 3.1Å; V179-M185 HydrophobicContact CG1-CG 4.17Å; V179-M185 HydrophobicContact CG2-CG 4.16Å; M185-K200 CarbonylContact O-C 3.37Å; M185-K200 VanDerWaalsContact O-CA 3.31Å; M185-K200 WeakPolarHBondContact O-CA 3.49Å; M185-L201 HydrophobicContact CB-CB 4.27Å; M185-L201 HydrophobicContact CE-CB 4.11Å; M185-L201 HydrophobicContact CE-CD1 4.33Å; M185-L201 PolarHBondContact N-O 3.32Å; M185-L201 PolarHBondContact O-N 2.77Å; M185-S202 WeakPolarHBondContact CE-O 3.15Å; M185-Q205 HydrophobicContact CE-CG 3.88Å
186	Y	98.9	Very high	96.4	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	121.3	173.5	-57.3	-98.6	0	0	0	107.5	I177 F178 E184 I199 K200 W209 V227 V229 V235 S250	I177-Y186 CarbonylContact C-O 3.28Å; I177-Y186 WeakPolarHBondContact CA-O 3.4Å; F178-Y186 AromaticContact CD1-CD2 3.98Å; F178-Y186 HydrophobicContact CD1-CD2 3.98Å; F178-Y186 PolarHBondContact N-O 3.48Å; F178-Y186 PolarHBondContact O-N 2.77Å; E184-Y186 HydrophobicContact CB-CE2 4.48Å; E184-Y186 PolarHBondContact OE2-OH 2.96Å; Y186-I199 WeakPolarHBondContact CA-O 3.16Å; Y186-K200 HydrophobicContact CD1-CB 4.21Å; Y186-K200 HydrophobicContact CD1-CD 4.48Å; Y186-K200 HydrophobicContact CD1-CG 4.08Å; Y186-K200 HydrophobicContact CE1-CB 4.19Å; Y186-K200 HydrophobicContact CE1-CD 3.65Å; Y186-K200 HydrophobicContact CE1-CG 3.71Å; Y186-K200 WeakPolarHBondContact OH-CE 3.32Å; Y186-K200 PolarHBondContact OH-NZ 2.8Å; Y186-K200 VanDerWaalsContact OH-NZ 3.16Å; Y186-W209 HydrophobicContact CD1-CH2 4.02Å; Y186-W209 HydrophobicContact CD1-CZ2 4.12Å; Y186-W209 HydrophobicContact CE1-CH2 4.05Å; Y186-W209 AromaticContact CE1-CZ2 3.68Å; Y186-W209 HydrophobicContact CE1-CZ2 3.68Å; Y186-V227 WeakPolarHBondContact O-CG1 3.09Å; Y186-V229 HydrophobicContact CD1-CG2 4.43Å; Y186-V229 HydrophobicContact CD2-CG2 3.62Å; Y186-V229 HydrophobicContact CE2-CG2 3.76Å; Y186-V229 HydrophobicContact CG-CG2 3.99Å; Y186-V235 HydrophobicContact CD1-CB 4.45Å; Y186-V235 HydrophobicContact CD1-CG1 3.97Å; Y186-V235 HydrophobicContact CD1-CG2 3.59Å; Y186-V235 HydrophobicContact CE1-CG2 3.42Å; Y186-V235 VanDerWaalsContact CE1-CG2 3.42Å; Y186-V235 HydrophobicContact CG-CG1 4.42Å; Y186-V235 HydrophobicContact CG-CG2 4.49Å; Y186-S250 WeakPolarHBondContact OH-CB 3.4Å; Y186-S250 PolarHBondContact OH-O 3.24Å
187	I	98.9	Very high	96.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.2	-172.3	-63.7	160.6	0	0	0	108.3	I143 L156 F171 E176 I177 D189 L198 I199 L201	I143-I187 HydrophobicContact CD1-CB 4.4Å; I143-I187 HydrophobicContact CD1-CD1 3.87Å; I143-I187 HydrophobicContact CD1-CG1 3.94Å; I143-I187 HydrophobicContact CD1-CG2 3.54Å; L156-I187 HydrophobicContact CD1-CD1 4.28Å; F171-I187 HydrophobicContact CD1-CG2 4.47Å; F171-I187 HydrophobicContact CE1-CD1 4.26Å; F171-I187 HydrophobicContact CE1-CG2 3.87Å; F171-I187 HydrophobicContact CZ-CD1 4.02Å; E176-I187 WeakPolarHBondContact O-CA 3.35Å; I177-I187 HydrophobicContact CB-CG1 4.22Å; I177-I187 HydrophobicContact CD1-CD1 4.27Å; I177-I187 HydrophobicContact CD1-CG1 3.95Å; I177-I187 HydrophobicContact CG1-CG1 3.83Å; I187-D189 HydrophobicContact CG2-CB 4.5Å; I187-L198 CarbonylContact O-C 3.54Å; I187-L198 WeakPolarHBondContact O-CA 3.34Å; I187-I199 PolarHBondContact N-O 3.29Å; I187-I199 PolarHBondContact O-N 2.81Å; I187-L201 HydrophobicContact CD1-CD1 3.64Å; I187-L201 HydrophobicContact CD1-CG 4.26Å
188	V	98.7	Very high	96.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	121.9	166.8	-72.5	0	0	0	0	109	A175 E176 R197 L198 P224 V227 V237	A175-V188 HydrophobicContact CB-CG2 4.16Å; A175-V188 PolarHBondContact N-O 2.85Å; E176-V188 HydrophobicContact CB-CG2 3.7Å; E176-V188 PolarHBondContact N-O 3.46Å; E176-V188 PolarHBondContact O-N 3.24Å; V188-R197 WeakPolarHBondContact CA-O 3.31Å; V188-L198 HydrophobicContact CG1-CD1 3.96Å; V188-P224 HydrophobicContact CB-CB 4.09Å; V188-P224 HydrophobicContact CB-CG 4.45Å; V188-P224 HydrophobicContact CG1-CB 4.1Å; V188-V227 HydrophobicContact CG1-CB 3.88Å; V188-V227 HydrophobicContact CG1-CG1 4.39Å; V188-V227 HydrophobicContact CG2-CB 4.2Å; V188-V227 HydrophobicContact CG2-CG1 4.05Å; V188-V237 HydrophobicContact CG1-CG1 3.71Å; V188-V237 HydrophobicContact CG1-CG2 4.18Å
189	D	98.6	Very high	96.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	105.1	-175.5	178.8	33.6	0	0	0	109.2	F171 D172 I187 N195 N196 R197	F171-D189 HydrophobicContact CD1-CB 4.11Å; D172-D189 PolarHBondContact N-OD1 2.81Å; D172-D189 VanDerWaalsContact O-OD1 3.11Å; I187-D189 HydrophobicContact CG2-CB 4.5Å; D189-N195 HydrophobicContact CB-CB 4.43Å; D189-N195 CarbonylContact O-C 3.58Å; D189-N195 VanDerWaalsContact O-C 3.28Å; D189-N195 WeakPolarHBondContact O-CB 3.39Å; D189-N195 WeakPolarHBondContact OD2-CB 2.93Å; D189-N195 PolarHBondContact OD2-ND2 2.83Å; D189-N196 PolarHBondContact O-N 3.27Å; D189-R197 HydrophobicContact CB-CG 3.85Å; D189-R197 PolarHBondContact N-O 2.67Å; D189-R197 PolarHBondContact O-N 2.8Å; D189-R197 IonicContact OD2-CZ 3.88Å; D189-R197 VanDerWaalsContact OD2-CZ 3.22Å; D189-R197 IonicContact OD2-NE 2.84Å; D189-R197 PolarHBondContact OD2-NE 3.42Å; D189-R197 IonicContact OD2-NH2 3.56Å; D189-R197 PolarHBondContact OD2-NH2 2.77Å
190	G	92.5	Very high	96.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.16	C	C	.	.			trans	160.6	34	-175.8	0	0	0	0	0	117.2	Q173 G192 N195 I223	Q173-G190 PolarHBondContact O-N 2.88Å; G190-G192 PolarHBondContact O-N 2.84Å; G190-N195 WeakPolarHBondContact CA-O 3.14Å; G190-I223 VanDerWaalsContact O-CA 3.25Å; G190-I223 WeakPolarHBondContact O-CA 3.31Å; G190-I223 WeakPolarHBondContact O-CG2 3.36Å
191	D	94.4	Very high	96.5	Very high	20 Å²	20	25.1 Å²	25.1	11%	0.107	15%	0.15	C	C	.	.	S	Bend	trans	-74.5	57	171.7	-174.4	39.8	0	0	0	112.3	H115 V134 Q173 A175 H225 R240	H115-D191 IonicContact CD2-OD2 2.83Å; H115-D191 PolarHBondContact CD2-OD2 3.42Å; H115-D191 IonicContact NE2-OD1 3.22Å; H115-D191 IonicContact NE2-OD2 2.71Å; H115-D191 PolarHBondContact NE2-OD2 2.85Å; H115-D191 VanDerWaalsContact NE2-OD2 3.08Å; V134-D191 HydrophobicContact CG1-CB 4.41Å; Q173-D191 HydrophobicContact CB-CB 4.42Å; Q173-D191 PolarHBondContact O-N 3.2Å; Q173-D191 PolarHBondContact OE1-O 2.88Å; A175-D191 HydrophobicContact CB-CB 3.85Å; D191-H225 IonicContact OD1-CD2 2.67Å; D191-H225 IonicContact OD1-NE2 3.54Å; D191-R240 IonicContact OD1-CZ 3.43Å; D191-R240 VanDerWaalsContact OD1-CZ 3.26Å; D191-R240 IonicContact OD1-NH1 3.4Å; D191-R240 PolarHBondContact OD1-NH1 2.87Å; D191-R240 IonicContact OD1-NH2 2.85Å; D191-R240 PolarHBondContact OD1-NH2 2.89Å
192	G	87.8	Confident	96.8	Very high	51 Å²	51	17.8 Å²	17.8	53%	0.526	12%	0.118	S	C	.	.	S	Bend	trans	96.1	-2.7	176.2	0	0	0	0	0	115.8	G190	G190-G192 PolarHBondContact O-N 2.84Å
193	G	92.7	Very high	96.9	Very high	20 Å²	20	22 Å²	22	21%	0.206	13%	0.129	C	C	.	.	S	Bend	trans	-76.2	-166.5	170.3	0	0	0	0	0	114.4	D172 N195	D172-G193 WeakPolarHBondContact OD2-CA 3.44Å; G193-N195 VanDerWaalsContact C-N 3.32Å
194	M	96.4	Very high	96.9	Very high	111 Å²	111	27 Å²	27	55%	0.547	15%	0.151	S	C	.	.	S	Bend	trans	-71.2	-27.9	177.1	74.9	-172.6	76.6	0	0	112.9	A162 D172	A162-M194 HydrophobicContact CB-CE 4.07Å; D172-M194 HydrophobicContact CB-CE 4.19Å; D172-M194 HydrophobicContact CB-CG 3.96Å; D172-M194 VanDerWaalsContact OD2-CE 3.24Å; D172-M194 WeakPolarHBondContact OD2-CE 3.43Å; D172-M194 WeakPolarHBondContact OD2-CG 3.49Å; D172-M194 PolarHBondContact OD2-N 3.4Å
195	N	98.3	Very high	96.8	Very high	8 Å²	8	28.7 Å²	28.7	4%	0.043	16%	0.159	C	C	.	.			trans	-81.9	146	-175.8	-66.1	-30.7	0	0	0	111.3	G163 S164 D172 D189 G190 G193 R197	G163-N195 PolarHBondContact O-ND2 3.23Å; S164-N195 VanDerWaalsContact CB-OD1 3.23Å; S164-N195 WeakPolarHBondContact CB-OD1 3.27Å; S164-N195 PolarHBondContact OG-OD1 2.53Å; D172-N195 PolarHBondContact N-ND2 3.46Å; D189-N195 HydrophobicContact CB-CB 4.43Å; D189-N195 CarbonylContact O-C 3.58Å; D189-N195 VanDerWaalsContact O-C 3.28Å; D189-N195 WeakPolarHBondContact O-CB 3.39Å; D189-N195 WeakPolarHBondContact OD2-CB 2.93Å; D189-N195 PolarHBondContact OD2-ND2 2.83Å; G190-N195 WeakPolarHBondContact CA-O 3.14Å; G193-N195 VanDerWaalsContact C-N 3.32Å; N195-R197 HydrophobicContact CB-CG 4.32Å
196	N	98.2	Very high	96.7	Very high	9 Å²	9	35.1 Å²	35.1	5%	0.048	19%	0.187	C	C	.	.			trans	-142.7	73.3	172.1	-71.8	-96	0	0	0	106.9	D189 K214 F221 Y222 I223	D189-N196 PolarHBondContact O-N 3.27Å; N196-K214 HydrophobicContact CB-CB 3.99Å; N196-K214 HydrophobicContact CB-CG 4.25Å; N196-F221 HydrophobicContact CB-CB 4.27Å; N196-Y222 WeakPolarHBondContact OD1-CA 3.21Å; N196-I223 PolarHBondContact OD1-N 2.78Å
197	R	98.5	Very high	96.6	Very high	5 Å²	5	37.7 Å²	37.7	2%	0.019	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	152.4	-167.4	67.1	-175.3	173.8	167.3	6.7	115	S164 Q170 V188 D189 N195 I199 H211 A212	S164-R197 PolarHBondContact O-NH1 2.88Å; Q170-R197 PolarHBondContact O-NH2 2.95Å; V188-R197 WeakPolarHBondContact CA-O 3.31Å; D189-R197 HydrophobicContact CB-CG 3.85Å; D189-R197 PolarHBondContact N-O 2.67Å; D189-R197 PolarHBondContact O-N 2.8Å; D189-R197 IonicContact OD2-CZ 3.88Å; D189-R197 VanDerWaalsContact OD2-CZ 3.22Å; D189-R197 IonicContact OD2-NE 2.84Å; D189-R197 PolarHBondContact OD2-NE 3.42Å; D189-R197 IonicContact OD2-NH2 3.56Å; D189-R197 PolarHBondContact OD2-NH2 2.77Å; N195-R197 HydrophobicContact CB-CG 4.32Å; R197-I199 HydrophobicContact CG-CD1 4.23Å; R197-I199 HydrophobicContact CG-CG1 3.95Å; R197-I199 VanDerWaalsContact CZ-CD1 3.46Å; R197-H211 CarbonylContact C-O 3.48Å; R197-H211 WeakPolarHBondContact CA-O 3.3Å; R197-H211 WeakPolarHBondContact CB-O 3.1Å; R197-A212 HydrophobicContact CB-CB 3.62Å
198	L	98.9	Very high	96.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	124	163.3	172.5	66.8	0	0	0	108	I187 V188 W209 M210 H211 F221 V227 V235 V237 F248	I187-L198 CarbonylContact O-C 3.54Å; I187-L198 WeakPolarHBondContact O-CA 3.34Å; V188-L198 HydrophobicContact CG1-CD1 3.96Å; L198-W209 HydrophobicContact CD2-CH2 3.78Å; L198-W209 HydrophobicContact CD2-CZ3 3.6Å; L198-W209 HydrophobicContact CG-CH2 4.24Å; L198-W209 HydrophobicContact CG-CZ3 3.82Å; L198-M210 VanDerWaalsContact O-CA 3.32Å; L198-M210 WeakPolarHBondContact O-CA 3.13Å; L198-M210 WeakPolarHBondContact O-CG 3.48Å; L198-H211 PolarHBondContact N-O 2.82Å; L198-H211 PolarHBondContact O-N 2.8Å; L198-F221 HydrophobicContact CB-CE2 3.69Å; L198-F221 HydrophobicContact CB-CZ 3.84Å; L198-F221 HydrophobicContact CD2-CZ 4.36Å; L198-V227 HydrophobicContact CD1-CG2 4.1Å; L198-V235 HydrophobicContact CD1-CG1 4.28Å; L198-V235 HydrophobicContact CD2-CG1 4.18Å; L198-V237 HydrophobicContact CD1-CG2 3.92Å; L198-V237 HydrophobicContact CD2-CG2 3.86Å; L198-V237 HydrophobicContact CG-CG2 4.36Å; L198-F248 HydrophobicContact CD2-CD2 3.83Å; L198-F248 HydrophobicContact CD2-CE2 4.13Å; L198-F248 HydrophobicContact CD2-CG 4.24Å
199	I	98.7	Very high	96.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.5	178.4	-43.1	177.3	0	0	0	108.9	F171 Y186 I187 R197 L201 V207 M210	F171-I199 HydrophobicContact CE1-CD1 4.08Å; Y186-I199 WeakPolarHBondContact CA-O 3.16Å; I187-I199 PolarHBondContact N-O 3.29Å; I187-I199 PolarHBondContact O-N 2.81Å; R197-I199 HydrophobicContact CG-CD1 4.23Å; R197-I199 HydrophobicContact CG-CG1 3.95Å; R197-I199 VanDerWaalsContact CZ-CD1 3.46Å; I199-L201 HydrophobicContact CG2-CD2 3.7Å; I199-L201 HydrophobicContact CG2-CG 4.25Å; I199-V207 HydrophobicContact CG2-CG1 4.25Å; I199-V207 HydrophobicContact CG2-CG2 4.31Å; I199-M210 HydrophobicContact CG1-CG 4.11Å; I199-M210 HydrophobicContact CG1-SD 4.12Å
200	K	98.8	Very high	96.6	Very high	5 Å²	5	46.3 Å²	46.3	2%	0.022	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.5	163.3	-173.9	-175.4	-179.8	175.8	0	110.1	E184 M185 Y186 L208 W209 S250	E184-K200 VanDerWaalsContact OE1-CE 3.31Å; E184-K200 WeakPolarHBondContact OE1-CE 3.23Å; E184-K200 IonicContact OE1-NZ 2.89Å; E184-K200 PolarHBondContact OE1-NZ 2.81Å; E184-K200 WeakPolarHBondContact OE2-CE 3.48Å; E184-K200 IonicContact OE2-NZ 3.26Å; E184-K200 PolarHBondContact OE2-NZ 3.06Å; M185-K200 CarbonylContact O-C 3.37Å; M185-K200 VanDerWaalsContact O-CA 3.31Å; M185-K200 WeakPolarHBondContact O-CA 3.49Å; Y186-K200 HydrophobicContact CD1-CB 4.21Å; Y186-K200 HydrophobicContact CD1-CD 4.48Å; Y186-K200 HydrophobicContact CD1-CG 4.08Å; Y186-K200 HydrophobicContact CE1-CB 4.19Å; Y186-K200 HydrophobicContact CE1-CD 3.65Å; Y186-K200 HydrophobicContact CE1-CG 3.71Å; Y186-K200 WeakPolarHBondContact OH-CE 3.32Å; Y186-K200 PolarHBondContact OH-NZ 2.8Å; Y186-K200 VanDerWaalsContact OH-NZ 3.16Å; K200-L208 HydrophobicContact CB-CB 4.49Å; K200-L208 HydrophobicContact CD-CB 4.18Å; K200-L208 HydrophobicContact CD-CD1 4.01Å; K200-L208 HydrophobicContact CG-CB 4.24Å; K200-L208 HydrophobicContact CG-CD1 4.17Å; K200-L208 PolarHBondContact O-N 3.31Å; K200-W209 HydrophobicContact CB-CD2 3.58Å; K200-W209 VanDerWaalsContact CB-CE2 3.49Å; K200-W209 HydrophobicContact CB-CE3 3.9Å; K200-W209 HydrophobicContact CB-CG 4.14Å; K200-W209 HydrophobicContact CB-CH2 4.02Å; K200-W209 HydrophobicContact CB-CZ2 3.75Å; K200-W209 HydrophobicContact CB-CZ3 4.09Å; K200-W209 HydrophobicContact CD-CD2 4.24Å; K200-W209 VanDerWaalsContact CD-CE2 3.41Å; K200-W209 HydrophobicContact CD-CG 4.46Å; K200-W209 HydrophobicContact CD-CZ2 3.75Å; K200-W209 HydrophobicContact CG-CZ2 4.24Å; K200-W209 PolarHBondContact N-O 3.4Å; K200-S250 WeakPolarHBondContact CD-O 3.26Å; K200-S250 WeakPolarHBondContact CE-O 3.48Å; K200-S250 PolarHBondContact NZ-O 3.44Å
201	L	98.6	Very high	96.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	149	172.9	-55.3	-179.4	0	0	0	111.1	L156 L169 E184 M185 I187 I199 K206 V207	L156-L201 HydrophobicContact CD1-CD1 4.48Å; L169-L201 HydrophobicContact CD2-CD1 3.84Å; E184-L201 WeakPolarHBondContact CA-O 3.42Å; M185-L201 HydrophobicContact CB-CB 4.27Å; M185-L201 HydrophobicContact CE-CB 4.11Å; M185-L201 HydrophobicContact CE-CD1 4.33Å; M185-L201 PolarHBondContact N-O 3.32Å; M185-L201 PolarHBondContact O-N 2.77Å; I187-L201 HydrophobicContact CD1-CD1 3.64Å; I187-L201 HydrophobicContact CD1-CG 4.26Å; I199-L201 HydrophobicContact CG2-CD2 3.7Å; I199-L201 HydrophobicContact CG2-CG 4.25Å; L201-K206 CarbonylContact C-O 3.35Å; L201-K206 VanDerWaalsContact CA-O 3.29Å; L201-K206 WeakPolarHBondContact CA-O 3.48Å; L201-V207 HydrophobicContact CD2-CB 4.34Å; L201-V207 HydrophobicContact CD2-CG2 3.74Å
202	S	98	Very high	97.1	Very high	17 Å²	17	50 Å²	50	12%	0.119	27%	0.27	C	S	.	.			trans	-72.6	170.4	163.6	75.3	0	0	0	0	111.1	M185 D204 Q205 K206	M185-S202 WeakPolarHBondContact CE-O 3.15Å; S202-D204 PolarHBondContact O-N 3.17Å; S202-D204 PolarHBondContact OG-N 3.39Å; S202-Q205 WeakPolarHBondContact O-CA 3.36Å; S202-Q205 PolarHBondContact O-N 3.45Å; S202-K206 PolarHBondContact N-O 2.82Å; S202-K206 PolarHBondContact OG-N 2.74Å
203	K	95.9	Very high	97.5	Very high	148 Å²	148	53.2 Å²	53.2	64%	0.643	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-33.2	170	-176.6	175.5	179.6	172	0	113.1	G183 Q205	G183-K203 VanDerWaalsContact O-CA 3.25Å; G183-K203 WeakPolarHBondContact O-CA 3.49Å; G183-K203 PolarHBondContact O-N 2.84Å; K203-Q205 PolarHBondContact O-N 2.77Å
204	D	95.5	Very high	97.8	Very high	120 Å²	120	58.5 Å²	58.5	64%	0.642	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	15	176.3	-53.2	-43.9	0	0	0	112.8	S202 K206	S202-D204 PolarHBondContact O-N 3.17Å; S202-D204 PolarHBondContact OG-N 3.39Å; D204-K206 PolarHBondContact O-N 2.85Å
205	Q	95.4	Very high	97.9	Very high	84 Å²	84	54.1 Å²	54.1	39%	0.393	27%	0.271	S	S	.	.			trans	62.8	21.2	176.9	-58.3	153.2	65.7	0	0	114.8	L156 M185 S202 K203	L156-Q205 HydrophobicContact CD2-CG 3.71Å; M185-Q205 HydrophobicContact CE-CG 3.88Å; S202-Q205 WeakPolarHBondContact O-CA 3.36Å; S202-Q205 PolarHBondContact O-N 3.45Å; K203-Q205 PolarHBondContact O-N 2.77Å
206	K	96.6	Very high	97.8	Very high	140 Å²	140	61 Å²	61	61%	0.609	30%	0.303	S	S	*	.			trans	-82.2	136.9	172.1	-62.3	-178.5	-179	175.1	0	109.6	L201 S202 D204 L208	L201-K206 CarbonylContact C-O 3.35Å; L201-K206 VanDerWaalsContact CA-O 3.29Å; L201-K206 WeakPolarHBondContact CA-O 3.48Å; S202-K206 PolarHBondContact N-O 2.82Å; S202-K206 PolarHBondContact OG-N 2.74Å; D204-K206 PolarHBondContact O-N 2.85Å; K206-L208 PolarHBondContact O-N 2.85Å
207	V	98.1	Very high	97.8	Very high	53 Å²	53	62 Å²	62	32%	0.321	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	121.4	173.1	-178.1	0	0	0	0	109.1	L166 I199 L201 M210	L166-V207 HydrophobicContact CB-CG2 4.44Å; L166-V207 HydrophobicContact CD1-CG2 4.48Å; L166-V207 HydrophobicContact CD2-CG2 4.18Å; I199-V207 HydrophobicContact CG2-CG1 4.25Å; I199-V207 HydrophobicContact CG2-CG2 4.31Å; L201-V207 HydrophobicContact CD2-CB 4.34Å; L201-V207 HydrophobicContact CD2-CG2 3.74Å; V207-M210 HydrophobicContact CG1-CB 4.32Å
208	L	98.4	Very high	97.8	Very high	84 Å²	84	67.4 Å²	67.4	44%	0.44	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-47.9	176.7	-67.1	176.1	0	0	0	110.7	E184 K200 K206	E184-L208 HydrophobicContact CG-CD1 4.41Å; K200-L208 HydrophobicContact CB-CB 4.49Å; K200-L208 HydrophobicContact CD-CB 4.18Å; K200-L208 HydrophobicContact CD-CD1 4.01Å; K200-L208 HydrophobicContact CG-CB 4.24Å; K200-L208 HydrophobicContact CG-CD1 4.17Å; K200-L208 PolarHBondContact O-N 3.31Å; K206-L208 PolarHBondContact O-N 2.85Å
209	W	98.6	Very high	97.7	Very high	32 Å²	32	68.2 Å²	68.2	12%	0.121	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	162.7	170	53.2	-109.9	0	0	0	109.8	Y186 L198 K200 V235 S250 I251	Y186-W209 HydrophobicContact CD1-CH2 4.02Å; Y186-W209 HydrophobicContact CD1-CZ2 4.12Å; Y186-W209 HydrophobicContact CE1-CH2 4.05Å; Y186-W209 AromaticContact CE1-CZ2 3.68Å; Y186-W209 HydrophobicContact CE1-CZ2 3.68Å; L198-W209 HydrophobicContact CD2-CH2 3.78Å; L198-W209 HydrophobicContact CD2-CZ3 3.6Å; L198-W209 HydrophobicContact CG-CH2 4.24Å; L198-W209 HydrophobicContact CG-CZ3 3.82Å; K200-W209 HydrophobicContact CB-CD2 3.58Å; K200-W209 VanDerWaalsContact CB-CE2 3.49Å; K200-W209 HydrophobicContact CB-CE3 3.9Å; K200-W209 HydrophobicContact CB-CG 4.14Å; K200-W209 HydrophobicContact CB-CH2 4.02Å; K200-W209 HydrophobicContact CB-CZ2 3.75Å; K200-W209 HydrophobicContact CB-CZ3 4.09Å; K200-W209 HydrophobicContact CD-CD2 4.24Å; K200-W209 VanDerWaalsContact CD-CE2 3.41Å; K200-W209 HydrophobicContact CD-CG 4.46Å; K200-W209 HydrophobicContact CD-CZ2 3.75Å; K200-W209 HydrophobicContact CG-CZ2 4.24Å; K200-W209 PolarHBondContact N-O 3.4Å; W209-V235 HydrophobicContact CH2-CG2 4.19Å; W209-V235 HydrophobicContact CZ2-CG2 4.29Å; W209-S250 PolarHBondContact NE1-O 2.97Å; W209-I251 VanDerWaalsContact CD1-O 3.28Å; W209-I251 PolarHBondContact NE1-O 3.19Å; W209-I251 VanDerWaalsContact NE1-O 3.11Å
210	M	98.6	Very high	97.7	Very high	65 Å²	65	70.1 Å²	70.1	32%	0.32	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	146.3	-178.3	178.9	-178.1	67.9	0	0	110.9	L166 L198 I199 V207 A212	L166-M210 HydrophobicContact CD1-CE 3.97Å; L166-M210 HydrophobicContact CD1-SD 4.41Å; L166-M210 HydrophobicContact CD2-SD 4.02Å; L198-M210 VanDerWaalsContact O-CA 3.32Å; L198-M210 WeakPolarHBondContact O-CA 3.13Å; L198-M210 WeakPolarHBondContact O-CG 3.48Å; I199-M210 HydrophobicContact CG1-CG 4.11Å; I199-M210 HydrophobicContact CG1-SD 4.12Å; V207-M210 HydrophobicContact CG1-CB 4.32Å; M210-A212 HydrophobicContact CE-CB 3.69Å; M210-A212 HydrophobicContact CG-CB 4.01Å; M210-A212 HydrophobicContact SD-CB 3.84Å
211	H	98.8	Very high	97.7	Very high	46 Å²	46	69.9 Å²	69.9	21%	0.213	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.1	163.8	-70.6	-61.1	0	0	0	108.5	R197 L198 F221 F248 G253	R197-H211 CarbonylContact C-O 3.48Å; R197-H211 WeakPolarHBondContact CA-O 3.3Å; R197-H211 WeakPolarHBondContact CB-O 3.1Å; L198-H211 PolarHBondContact N-O 2.82Å; L198-H211 PolarHBondContact O-N 2.8Å; H211-F221 HydrophobicContact CB-CD2 4.48Å; H211-F221 HydrophobicContact CB-CE2 3.8Å; H211-F248 AromaticContact CD2-CD1 3.73Å; H211-F248 AromaticContact CD2-CE1 3.63Å; H211-F248 AromaticContact NE2-CD1 3.69Å; H211-F248 AromaticContact NE2-CE1 3.82Å; H211-G253 PolarHBondContact NE2-O 2.78Å
212	A	97.6	Very high	97.7	Very high	52 Å²	52	74.3 Å²	74.3	43%	0.43	38%	0.376	S	S	.	.			trans	-138.4	20	-169.4	0	0	0	0	0	114.9	R197 M210	R197-A212 HydrophobicContact CB-CB 3.62Å; M210-A212 HydrophobicContact CE-CB 3.69Å; M210-A212 HydrophobicContact CG-CB 4.01Å; M210-A212 HydrophobicContact SD-CB 3.84Å
213	E	97.5	Very high	97.7	Very high	118 Å²	118	74.9 Å²	74.9	55%	0.551	38%	0.378	S	S	*	.			trans	-91.9	129.3	177.6	-171.3	178.7	-172.5	0	0	110.7	Q220 F221	E213-Q220 HydrophobicContact CB-CG 4.07Å; E213-Q220 HydrophobicContact CG-CG 3.99Å; E213-Q220 CarbonylContact O-C 3.54Å; E213-Q220 VanDerWaalsContact O-CA 3.22Å; E213-Q220 WeakPolarHBondContact O-CA 3.04Å; E213-Q220 PolarHBondContact OE1-NE2 3.21Å; E213-Q220 PolarHBondContact OE2-NE2 2.82Å; E213-F221 PolarHBondContact O-N 3.37Å
214	K	98	Very high	97.8	Very high	131 Å²	131	67.8 Å²	67.8	57%	0.57	35%	0.347	S	S	*	.	B	Isolated β-bridge	trans	-77.7	128.6	172.2	-176.6	-178.8	-179.5	175.4	0	110.1	N196 F221 Y222	N196-K214 HydrophobicContact CB-CB 3.99Å; N196-K214 HydrophobicContact CB-CG 4.25Å; K214-F221 CarbonylContact C-O 3.52Å; K214-F221 VanDerWaalsContact CA-O 3.22Å; K214-F221 WeakPolarHBondContact CA-O 3.42Å; K214-Y222 HydrophobicContact CG-CD2 4.44Å
215	G	98.1	Very high	98	Very high	19 Å²	19	62.1 Å²	62.1	20%	0.196	32%	0.316	C	S	.	.	S	Bend	trans	161.4	-165.7	176.2	0	0	0	0	0	113.7	F221 N242	G215-F221 PolarHBondContact N-O 2.89Å; G215-F221 CarbonylContact O-C 3.58Å; G215-N242 PolarHBondContact O-ND2 3.03Å
216	Q	97.9	Very high	98.1	Very high	153 Å²	153	58.1 Å²	58.1	72%	0.715	30%	0.298	S	S	*	.	S	Bend	trans	-111.8	-8.1	-176.8	-68.1	-178.6	-20.6	0	0	112.9	N242 R244	Q216-N242 VanDerWaalsContact CG-OD1 3.31Å; Q216-N242 WeakPolarHBondContact CG-OD1 3.11Å; Q216-R244 PolarHBondContact O-NH1 2.95Å; Q216-R244 PolarHBondContact O-NH2 3Å
217	G	98.1	Very high	98.2	Very high	30 Å²	30	51.4 Å²	51.4	31%	0.309	27%	0.269	S	S	.	.	S	Bend	trans	-70.2	-175.3	-179.6	0	0	0	0	0	113.7	A219 Q220 R244	G217-A219 PolarHBondContact O-N 2.94Å; G217-Q220 PolarHBondContact O-N 2.84Å; G217-R244 PolarHBondContact O-NH2 3.08Å
218	L	97.2	Very high	98.2	Very high	118 Å²	118	49.1 Å²	49.1	62%	0.618	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	131.5	175.8	-56.2	178.2	0	0	0	109.7	Q220 W255	L218-Q220 PolarHBondContact O-N 3.13Å; L218-W255 HydrophobicContact CD2-CD2 4.11Å; L218-W255 HydrophobicContact CD2-CE3 4.26Å; L218-W255 HydrophobicContact CD2-CH2 3.78Å; L218-W255 HydrophobicContact CD2-CZ2 3.61Å; L218-W255 HydrophobicContact CD2-CZ3 4.11Å
219	A	97.9	Very high	98.2	Very high	17 Å²	17	45.8 Å²	45.8	14%	0.14	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	8	-178.4	0	0	0	0	0	115.6	G217 F248	G217-A219 PolarHBondContact O-N 2.94Å; A219-F248 HydrophobicContact CB-CE1 3.79Å; A219-F248 HydrophobicContact CB-CZ 4.43Å
220	Q	98.7	Very high	98.1	Very high	40 Å²	40	44.5 Å²	44.5	19%	0.187	23%	0.234	C	C	.	.			trans	-90.1	142.8	169	-59.1	-178	-16.5	0	0	109.2	E213 G217 L218 R244 Q246	E213-Q220 HydrophobicContact CB-CG 4.07Å; E213-Q220 HydrophobicContact CG-CG 3.99Å; E213-Q220 CarbonylContact O-C 3.54Å; E213-Q220 VanDerWaalsContact O-CA 3.22Å; E213-Q220 WeakPolarHBondContact O-CA 3.04Å; E213-Q220 PolarHBondContact OE1-NE2 3.21Å; E213-Q220 PolarHBondContact OE2-NE2 2.82Å; G217-Q220 PolarHBondContact O-N 2.84Å; L218-Q220 PolarHBondContact O-N 3.13Å; Q220-R244 PolarHBondContact O-NH2 2.99Å; Q220-Q246 PolarHBondContact O-NE2 2.82Å
221	F	98.7	Very high	97.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-117.2	153.7	-179.7	-65.7	-76.9	0	0	0	111.9	N196 L198 H211 E213 K214 G215 P224 V237 D239 Q246 F248	N196-F221 HydrophobicContact CB-CB 4.27Å; L198-F221 HydrophobicContact CB-CE2 3.69Å; L198-F221 HydrophobicContact CB-CZ 3.84Å; L198-F221 HydrophobicContact CD2-CZ 4.36Å; H211-F221 HydrophobicContact CB-CD2 4.48Å; H211-F221 HydrophobicContact CB-CE2 3.8Å; E213-F221 PolarHBondContact O-N 3.37Å; K214-F221 CarbonylContact C-O 3.52Å; K214-F221 VanDerWaalsContact CA-O 3.22Å; K214-F221 WeakPolarHBondContact CA-O 3.42Å; G215-F221 PolarHBondContact N-O 2.89Å; G215-F221 CarbonylContact O-C 3.58Å; F221-P224 HydrophobicContact CB-CB 4.18Å; F221-P224 HydrophobicContact CB-CG 3.97Å; F221-P224 HydrophobicContact CD1-CB 3.9Å; F221-P224 HydrophobicContact CG-CB 4.13Å; F221-P224 HydrophobicContact CG-CG 4.25Å; F221-V237 HydrophobicContact CD1-CG1 4.09Å; F221-V237 HydrophobicContact CE1-CB 3.93Å; F221-V237 HydrophobicContact CE1-CG1 3.48Å; F221-V237 VanDerWaalsContact CE1-CG1 3.48Å; F221-V237 HydrophobicContact CE1-CG2 4.47Å; F221-V237 HydrophobicContact CZ-CB 4.41Å; F221-V237 HydrophobicContact CZ-CG1 4.17Å; F221-V237 HydrophobicContact CZ-CG2 4.48Å; F221-D239 HydrophobicContact CD1-CB 4.06Å; F221-Q246 HydrophobicContact CE1-CB 4.34Å; F221-F248 HydrophobicContact CE1-CE2 4.05Å; F221-F248 HydrophobicContact CE1-CZ 4.1Å; F221-F248 HydrophobicContact CE2-CZ 4.17Å; F221-F248 HydrophobicContact CZ-CE1 4.49Å; F221-F248 AromaticContact CZ-CE2 3.52Å; F221-F248 HydrophobicContact CZ-CE2 3.52Å; F221-F248 AromaticContact CZ-CZ 3.42Å; F221-F248 HydrophobicContact CZ-CZ 3.42Å; F221-F248 VanDerWaalsContact CZ-CZ 3.42Å
222	Y	98.4	Very high	97.6	Very high	94 Å²	94	44.1 Å²	44.1	37%	0.369	24%	0.244	S	C	.	.	S	Bend	trans	-135	105.9	163.8	-176.2	-139.5	0	0	0	108.8	N196 K214 D239 G241 N242	N196-Y222 WeakPolarHBondContact OD1-CA 3.21Å; K214-Y222 HydrophobicContact CG-CD2 4.44Å; Y222-D239 PolarHBondContact N-OD1 3.32Å; Y222-D239 VanDerWaalsContact O-OD1 3.14Å; Y222-G241 WeakPolarHBondContact O-CA 3.32Å; Y222-G241 PolarHBondContact O-N 3.23Å; Y222-N242 WeakPolarHBondContact CB-OD1 3.13Å; Y222-N242 PolarHBondContact N-ND2 2.71Å
223	I	98.1	Very high	97.5	Very high	28 Å²	28	44.9 Å²	44.9	14%	0.144	24%	0.239	C	C	.	.	S	Bend	trans	55	64.2	-174.6	-49.9	170	0	0	0	112.3	G190 N196 H225 R240	G190-I223 VanDerWaalsContact O-CA 3.25Å; G190-I223 WeakPolarHBondContact O-CA 3.31Å; G190-I223 WeakPolarHBondContact O-CG2 3.36Å; N196-I223 PolarHBondContact OD1-N 2.78Å; I223-H225 PolarHBondContact O-N 3.39Å; I223-R240 VanDerWaalsContact CG2-CZ 3.5Å; I223-R240 VanDerWaalsContact O-CB 3.24Å; I223-R240 WeakPolarHBondContact O-CB 3.16Å; I223-R240 PolarHBondContact O-N 3.46Å; I223-R240 VanDerWaalsContact O-N 3.17Å
224	P	98.4	Very high	97.5	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	132.8	173.5	31.3	-33.3	0	0	0	109.7	A175 V188 F221 V237 A238	A175-P224 WeakPolarHBondContact CB-O 3.43Å; V188-P224 HydrophobicContact CB-CB 4.09Å; V188-P224 HydrophobicContact CB-CG 4.45Å; V188-P224 HydrophobicContact CG1-CB 4.1Å; F221-P224 HydrophobicContact CB-CB 4.18Å; F221-P224 HydrophobicContact CB-CG 3.97Å; F221-P224 HydrophobicContact CD1-CB 3.9Å; F221-P224 HydrophobicContact CG-CB 4.13Å; F221-P224 HydrophobicContact CG-CG 4.25Å; P224-V237 HydrophobicContact CB-CG1 3.96Å; P224-A238 WeakPolarHBondContact CA-O 3.29Å
225	H	98.4	Very high	97.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	-33.6	-162.4	-167.2	-93.5	0	0	0	114.6	H115 A175 D191 I223 A238 R240 Y269 H319	H115-H225 AromaticContact CE1-CD2 3.72Å; H115-H225 AromaticContact CE1-CE1 3.39Å; H115-H225 PolarHBondContact CE1-CE1 3.38Å; H115-H225 AromaticContact CE1-NE2 3.21Å; H115-H225 PolarHBondContact CE1-NE2 2.91Å; H115-H225 AromaticContact NE2-CD2 3.75Å; H115-H225 AromaticContact NE2-CE1 3.73Å; H115-H225 AromaticContact NE2-NE2 3.13Å; H115-H225 PolarHBondContact NE2-NE2 2.96Å; H115-H225 VanDerWaalsContact NE2-NE2 3.13Å; A175-H225 WeakPolarHBondContact CB-O 3.24Å; D191-H225 IonicContact OD1-CD2 2.67Å; D191-H225 IonicContact OD1-NE2 3.54Å; I223-H225 PolarHBondContact O-N 3.39Å; H225-A238 PolarHBondContact N-O 2.78Å; H225-R240 HydrophobicContact CB-CB 3.91Å; H225-R240 PolarHBondContact CD2-NH1 2.81Å; H225-R240 PolarHBondContact NE2-NH1 2.94Å; H225-Y269 AromaticContact CE1-CD1 3.42Å; H225-Y269 VanDerWaalsContact CE1-CD1 3.42Å; H225-Y269 WeakPolarHBondContact CE1-CD1 3.47Å; H225-Y269 AromaticContact ND1-CD1 3.98Å; H225-Y269 PolarHBondContact ND1-O 3.09Å; H225-Y269 AromaticContact NE2-CD1 3.67Å; H225-H319 AromaticContact CE1-CE1 3.68Å; H225-H319 AromaticContact CE1-NE2 3.23Å; H225-H319 PolarHBondContact CE1-NE2 3.24Å; H225-H319 AromaticContact NE2-NE2 3.37Å; H225-H319 PolarHBondContact NE2-NE2 2.83Å
226	S	98.5	Very high	97.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	149.6	-179.5	172.7	0	0	0	0	111.1	E176 V237 A238 Y269 V271 R272	E176-S226 WeakPolarHBondContact OE2-CA 3.44Å; E176-S226 WeakPolarHBondContact OE2-CB 3.11Å; E176-S226 PolarHBondContact OE2-OG 2.8Å; S226-V237 CarbonylContact O-C 3.41Å; S226-V237 VanDerWaalsContact O-CA 3.3Å; S226-V237 WeakPolarHBondContact O-CA 3.37Å; S226-A238 PolarHBondContact O-N 3.06Å; S226-Y269 WeakPolarHBondContact CB-O 3.22Å; S226-V271 PolarHBondContact OG-N 2.87Å; S226-V271 VanDerWaalsContact OG-N 3.08Å; S226-R272 PolarHBondContact OG-NH1 2.96Å
227	V	98.8	Very high	97.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	137.5	179.3	62.6	0	0	0	0	111.2	E176 F178 Y186 V188 L198 V235 W236 V237 R272	E176-V227 HydrophobicContact CB-CG1 4.36Å; E176-V227 HydrophobicContact CG-CG1 4.37Å; E176-V227 PolarHBondContact OE2-N 2.91Å; F178-V227 HydrophobicContact CB-CG1 4.11Å; Y186-V227 WeakPolarHBondContact O-CG1 3.09Å; V188-V227 HydrophobicContact CG1-CB 3.88Å; V188-V227 HydrophobicContact CG1-CG1 4.39Å; V188-V227 HydrophobicContact CG2-CB 4.2Å; V188-V227 HydrophobicContact CG2-CG1 4.05Å; L198-V227 HydrophobicContact CD1-CG2 4.1Å; V227-V235 HydrophobicContact CG2-CG1 3.6Å; V227-W236 CarbonylContact C-O 3.49Å; V227-W236 VanDerWaalsContact CA-O 3.31Å; V227-W236 WeakPolarHBondContact CA-O 3.21Å; V227-V237 HydrophobicContact CG2-CG2 4.12Å; V227-R272 PolarHBondContact O-NH1 2.84Å
228	S	98	Very high	97.7	Very high	5 Å²	5	24.1 Å²	24.1	4%	0.035	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	153.1	172	-170.3	0	0	0	0	110.1	V235 W236 V271	S228-V235 CarbonylContact O-C 3.56Å; S228-V235 WeakPolarHBondContact O-CA 3.39Å; S228-W236 PolarHBondContact N-O 2.88Å; S228-W236 PolarHBondContact O-N 2.8Å; S228-V271 WeakPolarHBondContact CB-O 3.22Å
229	V	97.9	Very high	97.7	Very high	13 Å²	13	18.5 Å²	18.5	8%	0.079	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.2	174.4	-175.9	0	0	0	0	108.7	F178 Y186 R234 V235	F178-V229 HydrophobicContact CD1-CB 3.97Å; F178-V229 HydrophobicContact CD1-CG2 3.53Å; F178-V229 HydrophobicContact CE1-CB 3.6Å; F178-V229 HydrophobicContact CE1-CG2 3.68Å; F178-V229 HydrophobicContact CE2-CB 4.42Å; F178-V229 HydrophobicContact CG-CG2 4.09Å; F178-V229 HydrophobicContact CZ-CB 3.85Å; F178-V229 HydrophobicContact CZ-CG2 4.34Å; Y186-V229 HydrophobicContact CD1-CG2 4.43Å; Y186-V229 HydrophobicContact CD2-CG2 3.62Å; Y186-V229 HydrophobicContact CE2-CG2 3.76Å; Y186-V229 HydrophobicContact CG-CG2 3.99Å; V229-R234 VanDerWaalsContact CA-O 3.31Å; V229-R234 WeakPolarHBondContact CA-O 3.46Å; V229-V235 HydrophobicContact CG2-CG1 4.43Å; V229-V235 HydrophobicContact CG2-CG2 4.21Å
230	D	96.3	Very high	97.7	Very high	6 Å²	6	19.7 Å²	19.7	3%	0.032	10%	0.102	C	C	.	.			trans	-91.1	171	177.8	74.7	13.8	0	0	0	113.1	A232 Q233 R234 W236 L273 F280	D230-A232 PolarHBondContact O-N 3.15Å; D230-A232 VanDerWaalsContact O-N 3.08Å; D230-A232 VanDerWaalsContact OD1-CA 3.32Å; D230-A232 WeakPolarHBondContact OD1-CA 3.43Å; D230-A232 WeakPolarHBondContact OD1-CB 3.46Å; D230-A232 PolarHBondContact OD1-N 2.87Å; D230-Q233 PolarHBondContact O-N 3.12Å; D230-Q233 VanDerWaalsContact O-N 3.12Å; D230-Q233 PolarHBondContact OD1-N 3.45Å; D230-R234 PolarHBondContact N-O 2.94Å; D230-R234 WeakPolarHBondContact OD1-CB 3.27Å; D230-R234 PolarHBondContact OD1-N 2.8Å; D230-R234 IonicContact OD1-NE 3.13Å; D230-R234 IonicContact OD2-CZ 3.08Å; D230-R234 IonicContact OD2-NE 2.6Å; D230-R234 PolarHBondContact OD2-NE 2.82Å; D230-R234 IonicContact OD2-NH2 2.7Å; D230-R234 PolarHBondContact OD2-NH2 3.47Å; D230-W236 PolarHBondContact OD2-NE1 3.12Å; D230-L273 HydrophobicContact CB-CD2 3.87Å; D230-F280 HydrophobicContact CB-CZ 4.13Å
231	S	91.6	Very high	97.7	Very high	72 Å²	72	19.2 Å²	19.2	50%	0.503	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-5.4	179.2	60.6	0	0	0	0	114.8	Q233 K277	S231-Q233 VanDerWaalsContact C-N 3.35Å; S231-K277 WeakPolarHBondContact OG-CD 3.33Å
232	A	95.4	Very high	97.7	Very high	30 Å²	30	20.3 Å²	20.3	25%	0.248	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	14.9	175.6	0	0	0	0	0	111.6	D230 R234 V298	D230-A232 PolarHBondContact O-N 3.15Å; D230-A232 VanDerWaalsContact O-N 3.08Å; D230-A232 VanDerWaalsContact OD1-CA 3.32Å; D230-A232 WeakPolarHBondContact OD1-CA 3.43Å; D230-A232 WeakPolarHBondContact OD1-CB 3.46Å; D230-A232 PolarHBondContact OD1-N 2.87Å; A232-R234 VanDerWaalsContact C-N 3.31Å; A232-R234 HydrophobicContact CB-CG 4.34Å; A232-R234 PolarHBondContact O-N 3.28Å; A232-V298 HydrophobicContact CB-CG2 3.93Å
233	Q	95.5	Very high	97.7	Very high	68 Å²	68	20.4 Å²	20.4	32%	0.318	12%	0.115	S	C	.	.	S	Bend	trans	59.8	40.1	-177.9	-62	-57.4	104.7	0	0	112.4	D230 S231 S250	D230-Q233 PolarHBondContact O-N 3.12Å; D230-Q233 VanDerWaalsContact O-N 3.12Å; D230-Q233 PolarHBondContact OD1-N 3.45Å; S231-Q233 VanDerWaalsContact C-N 3.35Å; Q233-S250 WeakPolarHBondContact CB-OG 3.49Å; Q233-S250 PolarHBondContact NE2-OG 3.48Å; Q233-S250 WeakPolarHBondContact O-CB 3.46Å; Q233-S250 PolarHBondContact O-N 3.48Å; Q233-S250 PolarHBondContact O-OG 2.79Å
234	R	98.1	Very high	97.7	Very high	15 Å²	15	20.5 Å²	20.5	6%	0.057	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	136.2	173.4	-54.9	178.6	-66.7	-160.3	-1.3	110.5	V229 D230 A232 W236 V247 F248 L256 P296 P297	V229-R234 VanDerWaalsContact CA-O 3.31Å; V229-R234 WeakPolarHBondContact CA-O 3.46Å; D230-R234 PolarHBondContact N-O 2.94Å; D230-R234 WeakPolarHBondContact OD1-CB 3.27Å; D230-R234 PolarHBondContact OD1-N 2.8Å; D230-R234 IonicContact OD1-NE 3.13Å; D230-R234 IonicContact OD2-CZ 3.08Å; D230-R234 IonicContact OD2-NE 2.6Å; D230-R234 PolarHBondContact OD2-NE 2.82Å; D230-R234 IonicContact OD2-NH2 2.7Å; D230-R234 PolarHBondContact OD2-NH2 3.47Å; A232-R234 VanDerWaalsContact C-N 3.31Å; A232-R234 HydrophobicContact CB-CG 4.34Å; A232-R234 PolarHBondContact O-N 3.28Å; R234-W236 VanDerWaalsContact O-CD1 3.32Å; R234-V247 HydrophobicContact CB-CG1 3.85Å; R234-V247 HydrophobicContact CG-CG1 4.49Å; R234-F248 CarbonylContact C-O 3.58Å; R234-F248 VanDerWaalsContact CA-O 3.27Å; R234-F248 WeakPolarHBondContact CA-O 3.31Å; R234-L256 HydrophobicContact CB-CD1 4.45Å; R234-L256 HydrophobicContact CG-CD1 3.87Å; R234-P296 PolarHBondContact NH2-O 2.89Å; R234-P297 PolarHBondContact NH1-O 2.77Å
235	V	98.8	Very high	97.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	122.7	176.1	-169.3	0	0	0	0	108.4	Y186 L198 W209 V227 S228 V229 V237 V247 F248	Y186-V235 HydrophobicContact CD1-CB 4.45Å; Y186-V235 HydrophobicContact CD1-CG1 3.97Å; Y186-V235 HydrophobicContact CD1-CG2 3.59Å; Y186-V235 HydrophobicContact CE1-CG2 3.42Å; Y186-V235 VanDerWaalsContact CE1-CG2 3.42Å; Y186-V235 HydrophobicContact CG-CG1 4.42Å; Y186-V235 HydrophobicContact CG-CG2 4.49Å; L198-V235 HydrophobicContact CD1-CG1 4.28Å; L198-V235 HydrophobicContact CD2-CG1 4.18Å; W209-V235 HydrophobicContact CH2-CG2 4.19Å; W209-V235 HydrophobicContact CZ2-CG2 4.29Å; V227-V235 HydrophobicContact CG2-CG1 3.6Å; S228-V235 CarbonylContact O-C 3.56Å; S228-V235 WeakPolarHBondContact O-CA 3.39Å; V229-V235 HydrophobicContact CG2-CG1 4.43Å; V229-V235 HydrophobicContact CG2-CG2 4.21Å; V235-V237 HydrophobicContact CG1-CG2 4.17Å; V235-V247 CarbonylContact O-C 3.58Å; V235-V247 VanDerWaalsContact O-CA 3.27Å; V235-V247 WeakPolarHBondContact O-CA 3.27Å; V235-F248 HydrophobicContact CB-CB 4.3Å; V235-F248 PolarHBondContact N-O 2.88Å; V235-F248 PolarHBondContact O-N 3.46Å
236	W	98.8	Very high	97.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.7	-178.7	-64.3	80.3	0	0	0	108.8	V227 S228 D230 R234 I245 V247 W259 V271 F280 P296 I301	V227-W236 CarbonylContact C-O 3.49Å; V227-W236 VanDerWaalsContact CA-O 3.31Å; V227-W236 WeakPolarHBondContact CA-O 3.21Å; S228-W236 PolarHBondContact N-O 2.88Å; S228-W236 PolarHBondContact O-N 2.8Å; D230-W236 PolarHBondContact OD2-NE1 3.12Å; R234-W236 VanDerWaalsContact O-CD1 3.32Å; W236-I245 HydrophobicContact CB-CG2 4.35Å; W236-I245 HydrophobicContact CE3-CG2 3.78Å; W236-V247 HydrophobicContact CD2-CG1 4.06Å; W236-V247 HydrophobicContact CD2-CG2 3.91Å; W236-V247 HydrophobicContact CE3-CG1 4.42Å; W236-V247 HydrophobicContact CE3-CG2 3.43Å; W236-V247 VanDerWaalsContact CE3-CG2 3.43Å; W236-V247 HydrophobicContact CH2-CG1 4.35Å; W236-V247 HydrophobicContact CH2-CG2 3.76Å; W236-V247 HydrophobicContact CZ2-CG1 4Å; W236-V247 HydrophobicContact CZ2-CG2 4.23Å; W236-V247 HydrophobicContact CZ3-CG2 3.34Å; W236-W259 HydrophobicContact CE3-CE3 4.37Å; W236-W259 HydrophobicContact CE3-CZ3 4.24Å; W236-W259 AromaticContact CH2-CH2 3.67Å; W236-W259 HydrophobicContact CH2-CH2 3.67Å; W236-W259 AromaticContact CH2-CZ2 3.62Å; W236-W259 HydrophobicContact CH2-CZ2 3.62Å; W236-W259 HydrophobicContact CH2-CZ3 4.13Å; W236-W259 AromaticContact CZ3-CD2 3.8Å; W236-W259 HydrophobicContact CZ3-CD2 3.8Å; W236-W259 AromaticContact CZ3-CE2 3.79Å; W236-W259 AromaticContact CZ3-CE3 3.65Å; W236-W259 HydrophobicContact CZ3-CE3 3.65Å; W236-W259 AromaticContact CZ3-CH2 3.55Å; W236-W259 HydrophobicContact CZ3-CH2 3.55Å; W236-W259 AromaticContact CZ3-CZ2 3.7Å; W236-W259 HydrophobicContact CZ3-CZ2 3.7Å; W236-W259 AromaticContact CZ3-CZ3 3.51Å; W236-W259 HydrophobicContact CZ3-CZ3 3.51Å; W236-V271 HydrophobicContact CB-CG1 4.37Å; W236-V271 HydrophobicContact CB-CG2 4.29Å; W236-F280 HydrophobicContact CB-CE1 4.49Å; W236-F280 AromaticContact CD1-CE1 3.96Å; W236-F280 AromaticContact CD1-CZ 3.61Å; W236-F280 HydrophobicContact CD2-CE1 4.11Å; W236-F280 AromaticContact CD2-CE2 3.89Å; W236-F280 HydrophobicContact CD2-CE2 3.89Å; W236-F280 AromaticContact CD2-CZ 3.55Å; W236-F280 HydrophobicContact CD2-CZ 3.55Å; W236-F280 AromaticContact CE2-CE2 3.61Å; W236-F280 AromaticContact CE2-CZ 3.34Å; W236-F280 HydrophobicContact CE3-CE2 4.15Å; W236-F280 HydrophobicContact CE3-CZ 4.22Å; W236-F280 AromaticContact CG-CE1 3.94Å; W236-F280 HydrophobicContact CG-CE1 3.94Å; W236-F280 AromaticContact CG-CZ 3.76Å; W236-F280 HydrophobicContact CG-CZ 3.76Å; W236-F280 AromaticContact CH2-CE2 3.96Å; W236-F280 HydrophobicContact CH2-CE2 3.96Å; W236-F280 AromaticContact CZ2-CE2 3.65Å; W236-F280 HydrophobicContact CZ2-CE2 3.65Å; W236-F280 AromaticContact CZ2-CZ 3.87Å; W236-F280 HydrophobicContact CZ2-CZ 3.87Å; W236-F280 HydrophobicContact CZ3-CE2 4.19Å; W236-F280 AromaticContact NE1-CZ 3.36Å; W236-P296 HydrophobicContact CH2-CG 3.54Å; W236-P296 HydrophobicContact CZ2-CG 3.82Å; W236-I301 HydrophobicContact CH2-CG2 4.16Å; W236-I301 HydrophobicContact CZ2-CD1 4.48Å
237	V	98.9	Very high	97.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.2	-176.6	177.6	0	0	0	0	110.6	V188 L198 F221 P224 S226 V227 V235 D239 I245 Q246 F248	V188-V237 HydrophobicContact CG1-CG1 3.71Å; V188-V237 HydrophobicContact CG1-CG2 4.18Å; L198-V237 HydrophobicContact CD1-CG2 3.92Å; L198-V237 HydrophobicContact CD2-CG2 3.86Å; L198-V237 HydrophobicContact CG-CG2 4.36Å; F221-V237 HydrophobicContact CD1-CG1 4.09Å; F221-V237 HydrophobicContact CE1-CB 3.93Å; F221-V237 HydrophobicContact CE1-CG1 3.48Å; F221-V237 VanDerWaalsContact CE1-CG1 3.48Å; F221-V237 HydrophobicContact CE1-CG2 4.47Å; F221-V237 HydrophobicContact CZ-CB 4.41Å; F221-V237 HydrophobicContact CZ-CG1 4.17Å; F221-V237 HydrophobicContact CZ-CG2 4.48Å; P224-V237 HydrophobicContact CB-CG1 3.96Å; S226-V237 CarbonylContact O-C 3.41Å; S226-V237 VanDerWaalsContact O-CA 3.3Å; S226-V237 WeakPolarHBondContact O-CA 3.37Å; V227-V237 HydrophobicContact CG2-CG2 4.12Å; V235-V237 HydrophobicContact CG1-CG2 4.17Å; V237-D239 PolarHBondContact O-N 2.82Å; V237-I245 CarbonylContact O-C 3.54Å; V237-I245 VanDerWaalsContact O-CA 3.23Å; V237-I245 WeakPolarHBondContact O-CA 3.23Å; V237-Q246 PolarHBondContact N-O 3.44Å; V237-Q246 PolarHBondContact O-N 2.85Å; V237-F248 HydrophobicContact CG2-CD2 4.45Å; V237-F248 HydrophobicContact CG2-CE2 4.33Å
238	A	98.6	Very high	97.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	104.8	168.5	0	0	0	0	0	109.3	P224 H225 S226 R240 P268 V271	P224-A238 WeakPolarHBondContact CA-O 3.29Å; H225-A238 PolarHBondContact N-O 2.78Å; S226-A238 PolarHBondContact O-N 3.06Å; A238-R240 PolarHBondContact O-N 2.78Å; A238-P268 HydrophobicContact CB-CB 4.08Å; A238-P268 HydrophobicContact CB-CG 4.18Å; A238-V271 HydrophobicContact CB-CG1 4.45Å
239	D	98.6	Very high	97.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	76.6	179.8	-175.4	13.5	0	0	0	108.4	F221 Y222 V237 G241 N242 K243 R244 Q246	F221-D239 HydrophobicContact CD1-CB 4.06Å; Y222-D239 PolarHBondContact N-OD1 3.32Å; Y222-D239 VanDerWaalsContact O-OD1 3.14Å; V237-D239 PolarHBondContact O-N 2.82Å; D239-G241 PolarHBondContact O-N 2.97Å; D239-N242 HydrophobicContact CB-CB 4.49Å; D239-N242 CarbonylContact O-C 3.55Å; D239-N242 PolarHBondContact O-N 3.37Å; D239-N242 PolarHBondContact OD1-ND2 3.13Å; D239-N242 WeakPolarHBondContact OD2-CB 3.16Å; D239-N242 PolarHBondContact OD2-ND2 2.81Å; D239-K243 PolarHBondContact O-N 2.88Å; D239-K243 VanDerWaalsContact O-N 3.16Å; D239-R244 WeakPolarHBondContact CA-O 3.35Å; D239-R244 HydrophobicContact CB-CG 3.84Å; D239-R244 WeakPolarHBondContact CB-O 3.2Å; D239-R244 PolarHBondContact N-O 2.84Å; D239-R244 PolarHBondContact O-N 3.07Å; D239-R244 IonicContact OD2-CZ 3.66Å; D239-R244 IonicContact OD2-NE 2.59Å; D239-R244 PolarHBondContact OD2-NE 2.82Å; D239-R244 IonicContact OD2-NH2 2.73Å; D239-R244 PolarHBondContact OD2-NH2 3.12Å; D239-Q246 HydrophobicContact CB-CG 4.48Å; D239-Q246 PolarHBondContact OD2-NE2 2.89Å
240	R	97.8	Very high	97.7	Very high	43 Å²	43	21.9 Å²	21.9	16%	0.162	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-56.6	-51.2	-161.8	-176.1	-177.2	76.1	-170.3	-2.8	112.1	D191 I223 H225 A238 N242 K243 A267 Y269	D191-R240 IonicContact OD1-CZ 3.43Å; D191-R240 VanDerWaalsContact OD1-CZ 3.26Å; D191-R240 IonicContact OD1-NH1 3.4Å; D191-R240 PolarHBondContact OD1-NH1 2.87Å; D191-R240 IonicContact OD1-NH2 2.85Å; D191-R240 PolarHBondContact OD1-NH2 2.89Å; I223-R240 VanDerWaalsContact CG2-CZ 3.5Å; I223-R240 VanDerWaalsContact O-CB 3.24Å; I223-R240 WeakPolarHBondContact O-CB 3.16Å; I223-R240 PolarHBondContact O-N 3.46Å; I223-R240 VanDerWaalsContact O-N 3.17Å; H225-R240 HydrophobicContact CB-CB 3.91Å; H225-R240 PolarHBondContact CD2-NH1 2.81Å; H225-R240 PolarHBondContact NE2-NH1 2.94Å; A238-R240 PolarHBondContact O-N 2.78Å; R240-N242 PolarHBondContact O-N 2.95Å; R240-K243 PolarHBondContact O-N 2.95Å; R240-A267 HydrophobicContact CB-CB 4.37Å; R240-A267 HydrophobicContact CG-CB 3.62Å; R240-A267 WeakPolarHBondContact O-CB 3.19Å; R240-Y269 VanDerWaalsContact CD-CZ 3.44Å; R240-Y269 HydrophobicContact CG-CD2 4.2Å; R240-Y269 HydrophobicContact CG-CE2 3.93Å
241	G	97.8	Very high	97.7	Very high	29 Å²	29	27 Å²	27	30%	0.299	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-63.3	-24.4	-178.5	0	0	0	0	0	113.5	Y222 D239	Y222-G241 WeakPolarHBondContact O-CA 3.32Å; Y222-G241 PolarHBondContact O-N 3.23Å; D239-G241 PolarHBondContact O-N 2.97Å
242	N	98.3	Very high	98	Very high	24 Å²	24	27.1 Å²	27.1	13%	0.128	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-95.1	3.6	175.5	-69.8	-29.3	0	0	0	113.8	G215 Q216 Y222 D239 R240 R244	G215-N242 PolarHBondContact O-ND2 3.03Å; Q216-N242 VanDerWaalsContact CG-OD1 3.31Å; Q216-N242 WeakPolarHBondContact CG-OD1 3.11Å; Y222-N242 WeakPolarHBondContact CB-OD1 3.13Å; Y222-N242 PolarHBondContact N-ND2 2.71Å; D239-N242 HydrophobicContact CB-CB 4.49Å; D239-N242 CarbonylContact O-C 3.55Å; D239-N242 PolarHBondContact O-N 3.37Å; D239-N242 PolarHBondContact OD1-ND2 3.13Å; D239-N242 WeakPolarHBondContact OD2-CB 3.16Å; D239-N242 PolarHBondContact OD2-ND2 2.81Å; R240-N242 PolarHBondContact O-N 2.95Å; N242-R244 VanDerWaalsContact C-N 3.27Å; N242-R244 HydrophobicContact CB-CG 3.95Å; N242-R244 PolarHBondContact O-N 3.07Å
243	K	98.2	Very high	98.1	Very high	96 Å²	96	25.8 Å²	25.8	42%	0.417	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	46.5	-178.9	-59	-169.2	172.2	-162	0	112.8	D239 R240 F263 A267	D239-K243 PolarHBondContact O-N 2.88Å; D239-K243 VanDerWaalsContact O-N 3.16Å; R240-K243 PolarHBondContact O-N 2.95Å; K243-F263 HydrophobicContact CB-CB 4.48Å; K243-F263 WeakPolarHBondContact O-CB 3.35Å; K243-A267 HydrophobicContact CG-CB 4.11Å
244	R	98.6	Very high	98.3	Very high	29 Å²	29	27.3 Å²	27.3	11%	0.109	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	163.4	-179.1	70.6	-173.5	-178.7	179	-0.7	112.2	Q216 G217 Q220 D239 N242 Q246 T258 W259 P268	Q216-R244 PolarHBondContact O-NH1 2.95Å; Q216-R244 PolarHBondContact O-NH2 3Å; G217-R244 PolarHBondContact O-NH2 3.08Å; Q220-R244 PolarHBondContact O-NH2 2.99Å; D239-R244 WeakPolarHBondContact CA-O 3.35Å; D239-R244 HydrophobicContact CB-CG 3.84Å; D239-R244 WeakPolarHBondContact CB-O 3.2Å; D239-R244 PolarHBondContact N-O 2.84Å; D239-R244 PolarHBondContact O-N 3.07Å; D239-R244 IonicContact OD2-CZ 3.66Å; D239-R244 IonicContact OD2-NE 2.59Å; D239-R244 PolarHBondContact OD2-NE 2.82Å; D239-R244 IonicContact OD2-NH2 2.73Å; D239-R244 PolarHBondContact OD2-NH2 3.12Å; N242-R244 VanDerWaalsContact C-N 3.27Å; N242-R244 HydrophobicContact CB-CG 3.95Å; N242-R244 PolarHBondContact O-N 3.07Å; R244-Q246 HydrophobicContact CG-CG 4.23Å; R244-T258 WeakPolarHBondContact CD-OG1 3.36Å; R244-W259 CarbonylContact C-O 3.53Å; R244-W259 WeakPolarHBondContact CA-O 3.49Å; R244-W259 WeakPolarHBondContact CB-O 3.37Å; R244-P268 WeakPolarHBondContact O-CG 3.37Å
245	I	98.8	Very high	98.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.5	161.3	-63.1	177.1	0	0	0	108	W236 V237 T258 W259 F263 P268 V271 V282	W236-I245 HydrophobicContact CB-CG2 4.35Å; W236-I245 HydrophobicContact CE3-CG2 3.78Å; V237-I245 CarbonylContact O-C 3.54Å; V237-I245 VanDerWaalsContact O-CA 3.23Å; V237-I245 WeakPolarHBondContact O-CA 3.23Å; I245-T258 CarbonylContact O-C 3.5Å; I245-T258 WeakPolarHBondContact O-CA 3.44Å; I245-T258 WeakPolarHBondContact O-CB 3.22Å; I245-T258 PolarHBondContact O-OG1 3.06Å; I245-W259 HydrophobicContact CB-CB 4.45Å; I245-W259 PolarHBondContact N-O 2.85Å; I245-W259 PolarHBondContact O-N 3.19Å; I245-F263 HydrophobicContact CB-CE2 4.2Å; I245-F263 HydrophobicContact CD1-CE1 4.44Å; I245-F263 HydrophobicContact CD1-CE2 3.91Å; I245-F263 HydrophobicContact CD1-CZ 3.46Å; I245-F263 VanDerWaalsContact CD1-CZ 3.46Å; I245-F263 HydrophobicContact CG1-CE2 3.66Å; I245-F263 HydrophobicContact CG1-CZ 3.74Å; I245-P268 HydrophobicContact CD1-CB 4.3Å; I245-P268 HydrophobicContact CG1-CB 4.03Å; I245-P268 HydrophobicContact CG1-CG 3.89Å; I245-V271 HydrophobicContact CD1-CB 4.2Å; I245-V271 HydrophobicContact CD1-CG2 4.08Å; I245-V282 HydrophobicContact CD1-CG1 4.48Å; I245-V282 HydrophobicContact CD1-CG2 3.94Å
246	Q	98.6	Very high	98.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	147.9	171.9	-67.5	-165.5	79.2	0	0	110.5	Q220 F221 V237 D239 R244 F248	Q220-Q246 PolarHBondContact O-NE2 2.82Å; F221-Q246 HydrophobicContact CE1-CB 4.34Å; V237-Q246 PolarHBondContact N-O 3.44Å; V237-Q246 PolarHBondContact O-N 2.85Å; D239-Q246 HydrophobicContact CB-CG 4.48Å; D239-Q246 PolarHBondContact OD2-NE2 2.89Å; R244-Q246 HydrophobicContact CG-CG 4.23Å; Q246-F248 HydrophobicContact CB-CE2 3.52Å; Q246-F248 HydrophobicContact CB-CZ 3.82Å
247	V	98.7	Very high	98.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.2	-176	-164.3	0	0	0	0	110.3	R234 V235 W236 L256 G257 I301	R234-V247 HydrophobicContact CB-CG1 3.85Å; R234-V247 HydrophobicContact CG-CG1 4.49Å; V235-V247 CarbonylContact O-C 3.58Å; V235-V247 VanDerWaalsContact O-CA 3.27Å; V235-V247 WeakPolarHBondContact O-CA 3.27Å; W236-V247 HydrophobicContact CD2-CG1 4.06Å; W236-V247 HydrophobicContact CD2-CG2 3.91Å; W236-V247 HydrophobicContact CE3-CG1 4.42Å; W236-V247 HydrophobicContact CE3-CG2 3.43Å; W236-V247 VanDerWaalsContact CE3-CG2 3.43Å; W236-V247 HydrophobicContact CH2-CG1 4.35Å; W236-V247 HydrophobicContact CH2-CG2 3.76Å; W236-V247 HydrophobicContact CZ2-CG1 4Å; W236-V247 HydrophobicContact CZ2-CG2 4.23Å; W236-V247 HydrophobicContact CZ3-CG2 3.34Å; V247-L256 HydrophobicContact CB-CB 4.36Å; V247-L256 HydrophobicContact CG1-CB 4.37Å; V247-L256 HydrophobicContact CG1-CD1 4.42Å; V247-L256 PolarHBondContact O-N 2.82Å; V247-G257 PolarHBondContact N-O 3.42Å; V247-G257 PolarHBondContact O-N 3.03Å; V247-I301 HydrophobicContact CB-CD1 4.16Å; V247-I301 HydrophobicContact CB-CG1 4.21Å; V247-I301 HydrophobicContact CB-CG2 4.48Å; V247-I301 HydrophobicContact CG1-CD1 3.71Å; V247-I301 HydrophobicContact CG1-CG1 4.31Å; V247-I301 HydrophobicContact CG2-CD1 4.44Å; V247-I301 HydrophobicContact CG2-CG1 4.44Å; V247-I301 HydrophobicContact CG2-CG2 3.83Å
248	F	98.8	Very high	98.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	153.4	-177.4	-55.3	-93.9	0	0	0	111.4	L198 H211 A219 F221 R234 V235 V237 Q246 S250 D254 W255	L198-F248 HydrophobicContact CD2-CD2 3.83Å; L198-F248 HydrophobicContact CD2-CE2 4.13Å; L198-F248 HydrophobicContact CD2-CG 4.24Å; H211-F248 AromaticContact CD2-CD1 3.73Å; H211-F248 AromaticContact CD2-CE1 3.63Å; H211-F248 AromaticContact NE2-CD1 3.69Å; H211-F248 AromaticContact NE2-CE1 3.82Å; A219-F248 HydrophobicContact CB-CE1 3.79Å; A219-F248 HydrophobicContact CB-CZ 4.43Å; F221-F248 HydrophobicContact CE1-CE2 4.05Å; F221-F248 HydrophobicContact CE1-CZ 4.1Å; F221-F248 HydrophobicContact CE2-CZ 4.17Å; F221-F248 HydrophobicContact CZ-CE1 4.49Å; F221-F248 AromaticContact CZ-CE2 3.52Å; F221-F248 HydrophobicContact CZ-CE2 3.52Å; F221-F248 AromaticContact CZ-CZ 3.42Å; F221-F248 HydrophobicContact CZ-CZ 3.42Å; F221-F248 VanDerWaalsContact CZ-CZ 3.42Å; R234-F248 CarbonylContact C-O 3.58Å; R234-F248 VanDerWaalsContact CA-O 3.27Å; R234-F248 WeakPolarHBondContact CA-O 3.31Å; V235-F248 HydrophobicContact CB-CB 4.3Å; V235-F248 PolarHBondContact N-O 2.88Å; V235-F248 PolarHBondContact O-N 3.46Å; V237-F248 HydrophobicContact CG2-CD2 4.45Å; V237-F248 HydrophobicContact CG2-CE2 4.33Å; Q246-F248 HydrophobicContact CB-CE2 3.52Å; Q246-F248 HydrophobicContact CB-CZ 3.82Å; F248-S250 PolarHBondContact O-N 3.31Å; F248-D254 CarbonylContact C-O 3.53Å; F248-D254 VanDerWaalsContact CA-O 3.23Å; F248-D254 WeakPolarHBondContact CA-O 3.5Å; F248-W255 HydrophobicContact CD1-CB 4.22Å; F248-W255 HydrophobicContact CE1-CB 4.15Å; F248-W255 AromaticContact CE1-CD1 3.75Å; F248-W255 HydrophobicContact CE1-CG 4.37Å
249	N	98.1	Very high	98	Very high	47 Å²	47	36.5 Å²	36.5	25%	0.251	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	126.1	167.9	-174.8	-66.4	0	0	0	109	I251 T252 G253 D254 L256	N249-I251 PolarHBondContact O-N 2.85Å; N249-I251 WeakPolarHBondContact OD1-CA 3.39Å; N249-I251 WeakPolarHBondContact OD1-CB 3.17Å; N249-I251 PolarHBondContact OD1-N 2.71Å; N249-T252 WeakPolarHBondContact CB-OG1 3.22Å; N249-T252 PolarHBondContact OD1-N 2.62Å; N249-T252 PolarHBondContact OD1-OG1 2.9Å; N249-G253 VanDerWaalsContact O-CA 3.24Å; N249-G253 WeakPolarHBondContact O-CA 3.38Å; N249-G253 PolarHBondContact O-N 3.25Å; N249-D254 HydrophobicContact CB-CB 4.39Å; N249-D254 PolarHBondContact N-O 3.2Å; N249-L256 HydrophobicContact CB-CD1 4.2Å; N249-L256 HydrophobicContact CB-CD2 4.27Å; N249-L256 HydrophobicContact CB-CG 4.35Å
250	S	97.7	Very high	97.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-22.6	-175.4	82	0	0	0	0	113.4	Y186 K200 W209 Q233 F248	Y186-S250 WeakPolarHBondContact OH-CB 3.4Å; Y186-S250 PolarHBondContact OH-O 3.24Å; K200-S250 WeakPolarHBondContact CD-O 3.26Å; K200-S250 WeakPolarHBondContact CE-O 3.48Å; K200-S250 PolarHBondContact NZ-O 3.44Å; W209-S250 PolarHBondContact NE1-O 2.97Å; Q233-S250 WeakPolarHBondContact CB-OG 3.49Å; Q233-S250 PolarHBondContact NE2-OG 3.48Å; Q233-S250 WeakPolarHBondContact O-CB 3.46Å; Q233-S250 PolarHBondContact O-N 3.48Å; Q233-S250 PolarHBondContact O-OG 2.79Å; F248-S250 PolarHBondContact O-N 3.31Å
251	I	96.6	Very high	97.8	Very high	114 Å²	114	39.2 Å²	39.2	59%	0.585	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-56.3	-179.4	-57.4	177.1	0	0	0	110.2	W209 N249	W209-I251 VanDerWaalsContact CD1-O 3.28Å; W209-I251 PolarHBondContact NE1-O 3.19Å; W209-I251 VanDerWaalsContact NE1-O 3.11Å; N249-I251 PolarHBondContact O-N 2.85Å; N249-I251 WeakPolarHBondContact OD1-CA 3.39Å; N249-I251 WeakPolarHBondContact OD1-CB 3.17Å; N249-I251 PolarHBondContact OD1-N 2.71Å
252	T	97.8	Very high	97.7	Very high	74 Å²	74	39 Å²	39	45%	0.454	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-21.9	-172.4	63.1	0	0	0	0	113.6	N249 D254	N249-T252 WeakPolarHBondContact CB-OG1 3.22Å; N249-T252 PolarHBondContact OD1-N 2.62Å; N249-T252 PolarHBondContact OD1-OG1 2.9Å; T252-D254 VanDerWaalsContact CB-OD2 3.24Å; T252-D254 WeakPolarHBondContact CB-OD2 3.39Å; T252-D254 WeakPolarHBondContact OG1-CB 3.47Å; T252-D254 PolarHBondContact OG1-N 3.29Å; T252-D254 PolarHBondContact OG1-OD2 3.16Å
253	G	98.1	Very high	97.6	Very high	3 Å²	3	38.1 Å²	38.1	3%	0.031	21%	0.21	C	C	.	.			trans	79.4	1.4	-170.5	0	0	0	0	0	113.5	H211 N249 W255	H211-G253 PolarHBondContact NE2-O 2.78Å; N249-G253 VanDerWaalsContact O-CA 3.24Å; N249-G253 WeakPolarHBondContact O-CA 3.38Å; N249-G253 PolarHBondContact O-N 3.25Å; G253-W255 PolarHBondContact O-N 3.49Å
254	D	98.1	Very high	97.4	Very high	99 Å²	99	39 Å²	39	53%	0.529	22%	0.223	S	C	.	.			trans	-62.5	138.8	-178.1	-64.1	-41.7	0	0	0	111.7	F248 N249 T252 L256	F248-D254 CarbonylContact C-O 3.53Å; F248-D254 VanDerWaalsContact CA-O 3.23Å; F248-D254 WeakPolarHBondContact CA-O 3.5Å; N249-D254 HydrophobicContact CB-CB 4.39Å; N249-D254 PolarHBondContact N-O 3.2Å; T252-D254 VanDerWaalsContact CB-OD2 3.24Å; T252-D254 WeakPolarHBondContact CB-OD2 3.39Å; T252-D254 WeakPolarHBondContact OG1-CB 3.47Å; T252-D254 PolarHBondContact OG1-N 3.29Å; T252-D254 PolarHBondContact OG1-OD2 3.16Å; D254-L256 PolarHBondContact O-N 3.11Å
255	W	98.1	Very high	97.1	Very high	89 Å²	89	43.9 Å²	43.9	34%	0.337	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	129.9	174	-177.7	92	0	0	0	110.5	L218 F248 G253 G257 T258	L218-W255 HydrophobicContact CD2-CD2 4.11Å; L218-W255 HydrophobicContact CD2-CE3 4.26Å; L218-W255 HydrophobicContact CD2-CH2 3.78Å; L218-W255 HydrophobicContact CD2-CZ2 3.61Å; L218-W255 HydrophobicContact CD2-CZ3 4.11Å; F248-W255 HydrophobicContact CD1-CB 4.22Å; F248-W255 HydrophobicContact CE1-CB 4.15Å; F248-W255 AromaticContact CE1-CD1 3.75Å; F248-W255 HydrophobicContact CE1-CG 4.37Å; G253-W255 PolarHBondContact O-N 3.49Å; W255-G257 VanDerWaalsContact CH2-CA 3.48Å; W255-G257 PolarHBondContact NE1-O 2.79Å; W255-T258 HydrophobicContact CZ2-CG2 4.06Å
256	L	97.7	Very high	97	Very high	67 Å²	67	44.8 Å²	44.8	35%	0.351	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-23.5	-176.3	-60.1	-179	0	0	0	113.3	R234 V247 N249 D254 I301	R234-L256 HydrophobicContact CB-CD1 4.45Å; R234-L256 HydrophobicContact CG-CD1 3.87Å; V247-L256 HydrophobicContact CB-CB 4.36Å; V247-L256 HydrophobicContact CG1-CB 4.37Å; V247-L256 HydrophobicContact CG1-CD1 4.42Å; V247-L256 PolarHBondContact O-N 2.82Å; N249-L256 HydrophobicContact CB-CD1 4.2Å; N249-L256 HydrophobicContact CB-CD2 4.27Å; N249-L256 HydrophobicContact CB-CG 4.35Å; D254-L256 PolarHBondContact O-N 3.11Å; L256-I301 HydrophobicContact CB-CD1 4.18Å; L256-I301 HydrophobicContact CB-CG1 3.89Å; L256-I301 WeakPolarHBondContact O-CG1 3.32Å
257	G	96.8	Very high	96.9	Very high	6 Å²	6	45 Å²	45	6%	0.062	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.4	-179.7	-174.8	0	0	0	0	0	114.3	V247 W255	V247-G257 PolarHBondContact N-O 3.42Å; V247-G257 PolarHBondContact O-N 3.03Å; W255-G257 VanDerWaalsContact CH2-CA 3.48Å; W255-G257 PolarHBondContact NE1-O 2.79Å
258	T	97.8	Very high	96.9	Very high	45 Å²	45	45 Å²	45	28%	0.276	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	152.8	173.9	-171.2	0	0	0	0	111.8	R244 I245 W255	R244-T258 WeakPolarHBondContact CD-OG1 3.36Å; I245-T258 CarbonylContact O-C 3.5Å; I245-T258 WeakPolarHBondContact O-CA 3.44Å; I245-T258 WeakPolarHBondContact O-CB 3.22Å; I245-T258 PolarHBondContact O-OG1 3.06Å; W255-T258 HydrophobicContact CZ2-CG2 4.06Å
259	W	98.3	Very high	96.8	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117	170.7	-70.5	-13	0	0	0	109.9	W236 R244 I245 F263 F280 L293 D294 P296 I301 G302 C304	W236-W259 HydrophobicContact CE3-CE3 4.37Å; W236-W259 HydrophobicContact CE3-CZ3 4.24Å; W236-W259 AromaticContact CH2-CH2 3.67Å; W236-W259 HydrophobicContact CH2-CH2 3.67Å; W236-W259 AromaticContact CH2-CZ2 3.62Å; W236-W259 HydrophobicContact CH2-CZ2 3.62Å; W236-W259 HydrophobicContact CH2-CZ3 4.13Å; W236-W259 AromaticContact CZ3-CD2 3.8Å; W236-W259 HydrophobicContact CZ3-CD2 3.8Å; W236-W259 AromaticContact CZ3-CE2 3.79Å; W236-W259 AromaticContact CZ3-CE3 3.65Å; W236-W259 HydrophobicContact CZ3-CE3 3.65Å; W236-W259 AromaticContact CZ3-CH2 3.55Å; W236-W259 HydrophobicContact CZ3-CH2 3.55Å; W236-W259 AromaticContact CZ3-CZ2 3.7Å; W236-W259 HydrophobicContact CZ3-CZ2 3.7Å; W236-W259 AromaticContact CZ3-CZ3 3.51Å; W236-W259 HydrophobicContact CZ3-CZ3 3.51Å; R244-W259 CarbonylContact C-O 3.53Å; R244-W259 WeakPolarHBondContact CA-O 3.49Å; R244-W259 WeakPolarHBondContact CB-O 3.37Å; I245-W259 HydrophobicContact CB-CB 4.45Å; I245-W259 PolarHBondContact N-O 2.85Å; I245-W259 PolarHBondContact O-N 3.19Å; W259-F263 HydrophobicContact CB-CE2 4.12Å; W259-F263 VanDerWaalsContact O-CD2 3.3Å; W259-F263 WeakPolarHBondContact O-CD2 3.27Å; W259-F263 VanDerWaalsContact O-CE2 3.22Å; W259-F263 WeakPolarHBondContact O-CE2 3.31Å; W259-F280 AromaticContact CH2-CD2 3.99Å; W259-F280 HydrophobicContact CH2-CD2 3.99Å; W259-F280 HydrophobicContact CH2-CE2 4.39Å; W259-F280 AromaticContact CZ3-CD2 4Å; W259-F280 HydrophobicContact CZ3-CD2 4Å; W259-L293 HydrophobicContact CE3-CD1 4Å; W259-L293 HydrophobicContact CZ3-CB 4.15Å; W259-L293 HydrophobicContact CZ3-CD1 3.97Å; W259-D294 VanDerWaalsContact CH2-O 3.29Å; W259-D294 WeakPolarHBondContact CH2-O 3.07Å; W259-P296 HydrophobicContact CH2-CG 4.31Å; W259-P296 HydrophobicContact CZ2-CB 4.49Å; W259-P296 HydrophobicContact CZ2-CG 3.79Å; W259-I301 PolarHBondContact NE1-O 2.84Å; W259-G302 PolarHBondContact NE1-O 3.07Å; W259-C304 HydrophobicContact CB-CB 3.81Å; W259-C304 HydrophobicContact CD2-CB 3.51Å; W259-C304 HydrophobicContact CE3-CB 3.79Å; W259-C304 HydrophobicContact CG-CB 3.55Å; W259-C304 HydrophobicContact CZ3-CB 4.46Å
260	G	95.8	Very high	96.8	Very high	33 Å²	33	44.1 Å²	44.1	34%	0.34	25%	0.247	S	C	.	.			trans	-122.8	-25.2	174.5	0	0	0	0	0	113.8	C262 F263	G260-C262 PolarHBondContact O-N 2.86Å; G260-C262 VanDerWaalsContact O-N 3.12Å; G260-F263 PolarHBondContact O-N 3.48Å; G260-F263 VanDerWaalsContact O-N 3.08Å
261	S	95.4	Very high	96.8	Very high	67 Å²	67	44.1 Å²	44.1	47%	0.469	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-15.3	-172.2	54.9	0	0	0	0	114.9	C304	S261-C304 PolarHBondContact OG-SG 2.72Å
262	C	95.6	Very high	96.9	Very high	25 Å²	25	39.2 Å²	39.2	17%	0.169	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-1.2	177.2	-57.5	0	0	0	0	113.3	G260 Q284 L293 C304	G260-C262 PolarHBondContact O-N 2.86Å; G260-C262 VanDerWaalsContact O-N 3.12Å; C262-Q284 PolarHBondContact O-OE1 2.84Å; C262-L293 HydrophobicContact CB-CD2 4.12Å; C262-C304 HydrophobicContact CB-CB 4.02Å; C262-C304 WeakPolarHBondContact CB-SG 3.47Å; C262-C304 PolarHBondContact N-SG 3.41Å; C262-C304 VanDerWaalsContact SG-C 3.53Å; C262-C304 WeakPolarHBondContact SG-CB 3.39Å; C262-C304 CovalentContact SG-SG 2.02Å; C262-C304 PolarHBondContact SG-SG 2.91Å
263	F	96.4	Very high	96.8	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.018	21%	0.206	C	C	.	.			trans	-120.1	39.9	-172.3	-50.6	-54.2	0	0	0	111.1	K243 I245 W259 G260 D266 P268 V282 L293	K243-F263 HydrophobicContact CB-CB 4.48Å; K243-F263 WeakPolarHBondContact O-CB 3.35Å; I245-F263 HydrophobicContact CB-CE2 4.2Å; I245-F263 HydrophobicContact CD1-CE1 4.44Å; I245-F263 HydrophobicContact CD1-CE2 3.91Å; I245-F263 HydrophobicContact CD1-CZ 3.46Å; I245-F263 VanDerWaalsContact CD1-CZ 3.46Å; I245-F263 HydrophobicContact CG1-CE2 3.66Å; I245-F263 HydrophobicContact CG1-CZ 3.74Å; W259-F263 HydrophobicContact CB-CE2 4.12Å; W259-F263 VanDerWaalsContact O-CD2 3.3Å; W259-F263 WeakPolarHBondContact O-CD2 3.27Å; W259-F263 VanDerWaalsContact O-CE2 3.22Å; W259-F263 WeakPolarHBondContact O-CE2 3.31Å; G260-F263 PolarHBondContact O-N 3.48Å; G260-F263 VanDerWaalsContact O-N 3.08Å; F263-D266 CarbonylContact C-O 3.43Å; F263-D266 WeakPolarHBondContact CB-O 3.15Å; F263-P268 HydrophobicContact CD1-CB 4.12Å; F263-P268 HydrophobicContact CD1-CG 4.29Å; F263-P268 HydrophobicContact CD2-CG 4.16Å; F263-P268 HydrophobicContact CE1-CB 3.97Å; F263-P268 HydrophobicContact CE1-CG 4.42Å; F263-P268 HydrophobicContact CE2-CG 4.25Å; F263-P268 HydrophobicContact CG-CG 4.19Å; F263-P268 HydrophobicContact CZ-CB 4.19Å; F263-P268 HydrophobicContact CZ-CG 4.39Å; F263-V282 HydrophobicContact CE1-CG1 3.74Å; F263-V282 HydrophobicContact CZ-CG1 4.29Å; F263-L293 HydrophobicContact CE1-CD1 4.21Å; F263-L293 HydrophobicContact CZ-CD1 3.83Å
264	T	93.9	Very high	96.7	Very high	114 Å²	114	37 Å²	37	70%	0.699	21%	0.206	S	C	*	.	S	Bend	trans	-76.7	-30	-178.1	52.1	0	0	0	0	112.7
265	E	92.7	Very high	96.5	Very high	132 Å²	132	34.4 Å²	34.4	62%	0.617	20%	0.195	S	C	*	.	S	Bend	trans	-82.6	-54.3	-179.9	-64.3	-176.9	176.8	0	0	110.8	T287	E265-T287 HydrophobicContact CB-CG2 4.17Å
266	D	96.1	Very high	96.2	Very high	19 Å²	19	34 Å²	34	10%	0.102	20%	0.199	C	C	.	.	S	Bend	trans	-145.1	167.4	179.1	-166.1	23.9	0	0	0	111.8	F263 Q284 L285 N286 T287	F263-D266 CarbonylContact C-O 3.43Å; F263-D266 WeakPolarHBondContact CB-O 3.15Å; D266-Q284 HydrophobicContact CB-CB 3.85Å; D266-Q284 PolarHBondContact O-OE1 3.44Å; D266-L285 PolarHBondContact OD2-N 2.83Å; D266-N286 WeakPolarHBondContact OD2-CB 3.49Å; D266-N286 PolarHBondContact OD2-N 3.35Å; D266-N286 PolarHBondContact OD2-ND2 2.99Å; D266-T287 HydrophobicContact CB-CG2 3.92Å
267	A	96.5	Very high	96	Very high	5 Å²	5	36.7 Å²	36.7	4%	0.041	21%	0.208	C	C	.	.			trans	-73.1	150	-179.9	0	0	0	0	0	112.6	R240 K243 Y269 Q284	R240-A267 HydrophobicContact CB-CB 4.37Å; R240-A267 HydrophobicContact CG-CB 3.62Å; R240-A267 WeakPolarHBondContact O-CB 3.19Å; K243-A267 HydrophobicContact CG-CB 4.11Å; A267-Y269 HydrophobicContact CB-CE2 4.32Å; A267-Y269 WeakPolarHBondContact O-CD2 3.25Å; A267-Y269 PolarHBondContact O-N 3.26Å; A267-Q284 WeakPolarHBondContact O-CA 3.13Å; A267-Q284 VanDerWaalsContact O-CB 3.24Å; A267-Q284 WeakPolarHBondContact O-CB 3.48Å
268	P	97.8	Very high	95.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.231	C	C	.	.			trans	-70.3	128.5	168.2	30.1	-32.3	0	0	0	110.1	A238 R244 I245 F263 V282	A238-P268 HydrophobicContact CB-CB 4.08Å; A238-P268 HydrophobicContact CB-CG 4.18Å; R244-P268 WeakPolarHBondContact O-CG 3.37Å; I245-P268 HydrophobicContact CD1-CB 4.3Å; I245-P268 HydrophobicContact CG1-CB 4.03Å; I245-P268 HydrophobicContact CG1-CG 3.89Å; F263-P268 HydrophobicContact CD1-CB 4.12Å; F263-P268 HydrophobicContact CD1-CG 4.29Å; F263-P268 HydrophobicContact CD2-CG 4.16Å; F263-P268 HydrophobicContact CE1-CB 3.97Å; F263-P268 HydrophobicContact CE1-CG 4.42Å; F263-P268 HydrophobicContact CE2-CG 4.25Å; F263-P268 HydrophobicContact CG-CG 4.19Å; F263-P268 HydrophobicContact CZ-CB 4.19Å; F263-P268 HydrophobicContact CZ-CG 4.39Å; P268-V282 HydrophobicContact CB-CG1 3.79Å
269	Y	97.5	Very high	95.8	Very high	28 Å²	28	41.5 Å²	41.5	11%	0.11	22%	0.223	C	C	.	.			trans	-102.6	-36.9	175.9	-85.5	-114.6	0	0	0	112.1	H225 S226 R240 A267 V283 L285 H319	H225-Y269 AromaticContact CE1-CD1 3.42Å; H225-Y269 VanDerWaalsContact CE1-CD1 3.42Å; H225-Y269 WeakPolarHBondContact CE1-CD1 3.47Å; H225-Y269 AromaticContact ND1-CD1 3.98Å; H225-Y269 PolarHBondContact ND1-O 3.09Å; H225-Y269 AromaticContact NE2-CD1 3.67Å; S226-Y269 WeakPolarHBondContact CB-O 3.22Å; R240-Y269 VanDerWaalsContact CD-CZ 3.44Å; R240-Y269 HydrophobicContact CG-CD2 4.2Å; R240-Y269 HydrophobicContact CG-CE2 3.93Å; A267-Y269 HydrophobicContact CB-CE2 4.32Å; A267-Y269 WeakPolarHBondContact O-CD2 3.25Å; A267-Y269 PolarHBondContact O-N 3.26Å; Y269-V283 PolarHBondContact N-O 3.08Å; Y269-L285 HydrophobicContact CD1-CB 4.01Å; Y269-L285 HydrophobicContact CD2-CB 3.71Å; Y269-L285 HydrophobicContact CE1-CB 3.75Å; Y269-L285 HydrophobicContact CE1-CD2 3.63Å; Y269-L285 HydrophobicContact CE1-CG 4.17Å; Y269-L285 HydrophobicContact CE2-CB 3.42Å; Y269-L285 VanDerWaalsContact CE2-CB 3.42Å; Y269-L285 HydrophobicContact CE2-CD2 4.41Å; Y269-L285 HydrophobicContact CG-CB 4Å; Y269-L285 VanDerWaalsContact CZ-CB 3.42Å; Y269-L285 WeakPolarHBondContact OH-CD2 3.4Å; Y269-H319 WeakPolarHBondContact CB-O 3.22Å; Y269-H319 AromaticContact CD1-CD2 3.66Å; Y269-H319 AromaticContact CD1-NE2 3.95Å
270	S	97.7	Very high	95.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	145.9	176.7	-158.3	0	0	0	0	110.8	V282 V283 V321	S270-V282 VanDerWaalsContact O-CA 3.28Å; S270-V282 WeakPolarHBondContact O-CA 3.36Å; S270-V282 WeakPolarHBondContact O-CG1 3.36Å; S270-V283 PolarHBondContact O-N 2.91Å; S270-V321 PolarHBondContact OG-N 2.9Å
271	V	98.3	Very high	95.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	125.4	169	57.8	0	0	0	0	109.4	S226 S228 W236 A238 I245 F280 V281 V282	S226-V271 PolarHBondContact OG-N 2.87Å; S226-V271 VanDerWaalsContact OG-N 3.08Å; S228-V271 WeakPolarHBondContact CB-O 3.22Å; W236-V271 HydrophobicContact CB-CG1 4.37Å; W236-V271 HydrophobicContact CB-CG2 4.29Å; A238-V271 HydrophobicContact CB-CG1 4.45Å; I245-V271 HydrophobicContact CD1-CB 4.2Å; I245-V271 HydrophobicContact CD1-CG2 4.08Å; V271-F280 HydrophobicContact CG2-CB 4.3Å; V271-F280 HydrophobicContact CG2-CD1 3.53Å; V271-F280 HydrophobicContact CG2-CE1 4.16Å; V271-F280 HydrophobicContact CG2-CG 4.14Å; V271-V281 WeakPolarHBondContact CA-O 3.49Å; V271-V282 HydrophobicContact CB-CG2 4.4Å; V271-V282 HydrophobicContact CG2-CG2 4.23Å
272	R	97.9	Very high	96	Very high	11 Å²	11	36.6 Å²	36.6	4%	0.042	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	135.4	177.8	-67.8	-65.3	-174.1	-98.8	0.8	111.8	E176 S226 V227 F280 V281 V321 L323	E176-R272 IonicContact OE1-CZ 3.27Å; E176-R272 IonicContact OE1-NH1 3.64Å; E176-R272 PolarHBondContact OE1-NH1 2.88Å; E176-R272 IonicContact OE1-NH2 2.85Å; E176-R272 PolarHBondContact OE1-NH2 3.27Å; E176-R272 IonicContact OE2-CZ 3.47Å; E176-R272 IonicContact OE2-NH1 2.83Å; E176-R272 PolarHBondContact OE2-NH1 2.86Å; E176-R272 IonicContact OE2-NH2 3.07Å; S226-R272 PolarHBondContact OG-NH1 2.96Å; V227-R272 PolarHBondContact O-NH1 2.84Å; R272-F280 CarbonylContact O-C 3.59Å; R272-F280 VanDerWaalsContact O-CA 3.31Å; R272-F280 WeakPolarHBondContact O-CA 3.24Å; R272-V281 PolarHBondContact N-O 2.94Å; R272-V281 PolarHBondContact O-N 2.85Å; R272-V321 HydrophobicContact CB-CG2 4.29Å; R272-V321 HydrophobicContact CG-CG2 3.88Å; R272-V321 WeakPolarHBondContact CG-O 3.32Å; R272-V321 PolarHBondContact NE-O 2.91Å; R272-L323 HydrophobicContact CB-CD1 3.66Å
273	L	96.6	Very high	96.1	Very high	26 Å²	26	35.4 Å²	35.4	14%	0.136	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	135.2	176.7	-172.5	72	0	0	0	110.5	D230 K277 F280 A295 L323	D230-L273 HydrophobicContact CB-CD2 3.87Å; L273-K277 HydrophobicContact CD2-CB 4.17Å; L273-K277 HydrophobicContact CD2-CG 4.02Å; L273-F280 HydrophobicContact CB-CD1 4.21Å; L273-F280 HydrophobicContact CB-CE1 3.88Å; L273-F280 HydrophobicContact CD1-CD1 4.16Å; L273-F280 HydrophobicContact CD1-CD2 4.38Å; L273-F280 HydrophobicContact CD1-CE1 3.8Å; L273-F280 HydrophobicContact CD1-CE2 4.03Å; L273-F280 HydrophobicContact CD1-CG 4.43Å; L273-F280 HydrophobicContact CD1-CZ 3.72Å; L273-F280 HydrophobicContact CG-CE1 4.42Å; L273-A295 HydrophobicContact CD1-CB 3.91Å; L273-L323 WeakPolarHBondContact O-CD1 3.46Å
274	T	95.8	Very high	96.1	Very high	4 Å²	4	35.6 Å²	35.6	3%	0.025	18%	0.177	C	C	.	.			trans	-66.9	155.7	173.5	55.4	0	0	0	0	111.8	D276 K277 Y279 V281	T274-D276 WeakPolarHBondContact CB-OD1 3.44Å; T274-D276 PolarHBondContact O-N 2.97Å; T274-D276 PolarHBondContact OG1-OD1 2.78Å; T274-K277 WeakPolarHBondContact O-CA 3.24Å; T274-K277 PolarHBondContact O-N 2.95Å; T274-Y279 PolarHBondContact N-O 2.85Å; T274-Y279 PolarHBondContact OG1-N 3.26Å; T274-Y279 PolarHBondContact OG1-O 2.93Å; T274-Y279 VanDerWaalsContact OG1-O 3.06Å; T274-V281 HydrophobicContact CG2-CG2 3.8Å
275	P	93.1	Very high	96.1	Very high	45 Å²	45	31.3 Å²	31.3	29%	0.292	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-29.6	-175.4	-21.5	34.2	0	0	0	113.6	K277 L325	P275-K277 PolarHBondContact O-N 3.04Å; P275-L325 HydrophobicContact CB-CD2 4.3Å; P275-L325 WeakPolarHBondContact CB-O 3.36Å; P275-L325 HydrophobicContact CG-CB 4.5Å; P275-L325 HydrophobicContact CG-CD2 3.91Å
276	D	92.8	Very high	96.1	Very high	80 Å²	80	29.6 Å²	29.6	43%	0.428	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-2.7	174.3	72.6	-10.9	0	0	0	113.6	T274 K278	T274-D276 WeakPolarHBondContact CB-OD1 3.44Å; T274-D276 PolarHBondContact O-N 2.97Å; T274-D276 PolarHBondContact OG1-OD1 2.78Å; D276-K278 HydrophobicContact CB-CG 4.4Å; D276-K278 PolarHBondContact O-N 3.44Å; D276-K278 PolarHBondContact OD1-N 2.86Å; D276-K278 VanDerWaalsContact OD1-N 3.1Å; D276-K278 WeakPolarHBondContact OD2-CD 3.41Å
277	K	94.2	Very high	95.8	Very high	124 Å²	124	29.1 Å²	29.1	54%	0.539	14%	0.143	S	C	.	.	S	Bend	trans	63.2	16.7	177.9	-54.6	161.5	175.9	-176.7	0	113.9	S231 L273 T274 P275 A295	S231-K277 WeakPolarHBondContact OG-CD 3.33Å; L273-K277 HydrophobicContact CD2-CB 4.17Å; L273-K277 HydrophobicContact CD2-CG 4.02Å; T274-K277 WeakPolarHBondContact O-CA 3.24Å; T274-K277 PolarHBondContact O-N 2.95Å; P275-K277 PolarHBondContact O-N 3.04Å; K277-A295 WeakPolarHBondContact O-CB 3.48Å
278	K	93.8	Very high	95.5	Very high	124 Å²	124	31.2 Å²	31.2	54%	0.539	15%	0.153	S	C	.	.	S	Bend	trans	-93.4	-23.9	-176.6	-65.6	-174.6	-171.1	165.5	0	113.4	D276 A295	D276-K278 HydrophobicContact CB-CG 4.4Å; D276-K278 PolarHBondContact O-N 3.44Å; D276-K278 PolarHBondContact OD1-N 2.86Å; D276-K278 VanDerWaalsContact OD1-N 3.1Å; D276-K278 WeakPolarHBondContact OD2-CD 3.41Å; K278-A295 WeakPolarHBondContact O-CB 3.39Å; K278-A295 PolarHBondContact O-N 3.06Å
279	Y	96.1	Very high	95.2	Very high	28 Å²	28	33.4 Å²	33.4	11%	0.11	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.1	-173.5	-49.5	-74.8	0	0	0	112.1	G48 P50 T274 L293 D294 A307	G48-Y279 PolarHBondContact O-OH 3.32Å; P50-Y279 HydrophobicContact CB-CD2 4.07Å; P50-Y279 HydrophobicContact CB-CE2 3.88Å; P50-Y279 HydrophobicContact CG-CD1 4.15Å; P50-Y279 HydrophobicContact CG-CD2 3.79Å; P50-Y279 HydrophobicContact CG-CE1 4.01Å; P50-Y279 HydrophobicContact CG-CE2 3.63Å; P50-Y279 HydrophobicContact CG-CG 4.05Å; T274-Y279 PolarHBondContact N-O 2.85Å; T274-Y279 PolarHBondContact OG1-N 3.26Å; T274-Y279 PolarHBondContact OG1-O 2.93Å; T274-Y279 VanDerWaalsContact OG1-O 3.06Å; Y279-L293 CarbonylContact C-O 3.58Å; Y279-L293 WeakPolarHBondContact CA-O 3.14Å; Y279-D294 WeakPolarHBondContact CE1-OD1 3.37Å; Y279-A307 HydrophobicContact CD1-CB 3.64Å; Y279-A307 HydrophobicContact CE1-CB 3.53Å
280	F	97.8	Very high	95.1	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	126.9	159.2	-75	-77.6	0	0	0	109.4	D230 W236 W259 V271 R272 L273 V282 L292 L293 A295	D230-F280 HydrophobicContact CB-CZ 4.13Å; W236-F280 HydrophobicContact CB-CE1 4.49Å; W236-F280 AromaticContact CD1-CE1 3.96Å; W236-F280 AromaticContact CD1-CZ 3.61Å; W236-F280 HydrophobicContact CD2-CE1 4.11Å; W236-F280 AromaticContact CD2-CE2 3.89Å; W236-F280 HydrophobicContact CD2-CE2 3.89Å; W236-F280 AromaticContact CD2-CZ 3.55Å; W236-F280 HydrophobicContact CD2-CZ 3.55Å; W236-F280 AromaticContact CE2-CE2 3.61Å; W236-F280 AromaticContact CE2-CZ 3.34Å; W236-F280 HydrophobicContact CE3-CE2 4.15Å; W236-F280 HydrophobicContact CE3-CZ 4.22Å; W236-F280 AromaticContact CG-CE1 3.94Å; W236-F280 HydrophobicContact CG-CE1 3.94Å; W236-F280 AromaticContact CG-CZ 3.76Å; W236-F280 HydrophobicContact CG-CZ 3.76Å; W236-F280 AromaticContact CH2-CE2 3.96Å; W236-F280 HydrophobicContact CH2-CE2 3.96Å; W236-F280 AromaticContact CZ2-CE2 3.65Å; W236-F280 HydrophobicContact CZ2-CE2 3.65Å; W236-F280 AromaticContact CZ2-CZ 3.87Å; W236-F280 HydrophobicContact CZ2-CZ 3.87Å; W236-F280 HydrophobicContact CZ3-CE2 4.19Å; W236-F280 AromaticContact NE1-CZ 3.36Å; W259-F280 AromaticContact CH2-CD2 3.99Å; W259-F280 HydrophobicContact CH2-CD2 3.99Å; W259-F280 HydrophobicContact CH2-CE2 4.39Å; W259-F280 AromaticContact CZ3-CD2 4Å; W259-F280 HydrophobicContact CZ3-CD2 4Å; V271-F280 HydrophobicContact CG2-CB 4.3Å; V271-F280 HydrophobicContact CG2-CD1 3.53Å; V271-F280 HydrophobicContact CG2-CE1 4.16Å; V271-F280 HydrophobicContact CG2-CG 4.14Å; R272-F280 CarbonylContact O-C 3.59Å; R272-F280 VanDerWaalsContact O-CA 3.31Å; R272-F280 WeakPolarHBondContact O-CA 3.24Å; L273-F280 HydrophobicContact CB-CD1 4.21Å; L273-F280 HydrophobicContact CB-CE1 3.88Å; L273-F280 HydrophobicContact CD1-CD1 4.16Å; L273-F280 HydrophobicContact CD1-CD2 4.38Å; L273-F280 HydrophobicContact CD1-CE1 3.8Å; L273-F280 HydrophobicContact CD1-CE2 4.03Å; L273-F280 HydrophobicContact CD1-CG 4.43Å; L273-F280 HydrophobicContact CD1-CZ 3.72Å; L273-F280 HydrophobicContact CG-CE1 4.42Å; F280-V282 HydrophobicContact CB-CG2 4.29Å; F280-L292 CarbonylContact O-C 3.58Å; F280-L292 WeakPolarHBondContact O-CA 3.3Å; F280-L293 HydrophobicContact CB-CB 4.41Å; F280-L293 PolarHBondContact N-O 3.22Å; F280-L293 PolarHBondContact O-N 3.29Å; F280-A295 HydrophobicContact CD2-CB 3.99Å; F280-A295 HydrophobicContact CE2-CB 3.87Å
281	V	98.1	Very high	95.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	123.1	164.3	-173.6	0	0	0	0	108	V271 R272 T274 I290 L292 V321 L323 L330	V271-V281 WeakPolarHBondContact CA-O 3.49Å; R272-V281 PolarHBondContact N-O 2.94Å; R272-V281 PolarHBondContact O-N 2.85Å; T274-V281 HydrophobicContact CG2-CG2 3.8Å; V281-I290 HydrophobicContact CG1-CG2 3.39Å; V281-L292 HydrophobicContact CG2-CG 4.32Å; V281-V321 HydrophobicContact CG1-CG2 4.12Å; V281-L323 HydrophobicContact CB-CD1 4.46Å; V281-L323 HydrophobicContact CG2-CD1 4Å; V281-L323 HydrophobicContact CG2-CD2 4.17Å; V281-L330 HydrophobicContact CG1-CD1 3.87Å; V281-L330 HydrophobicContact CG1-CD2 3.97Å
282	V	98.2	Very high	95	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	132.4	178.9	-179.6	0	0	0	0	109.6	I245 F263 P268 S270 V271 F280 T291 L293	I245-V282 HydrophobicContact CD1-CG1 4.48Å; I245-V282 HydrophobicContact CD1-CG2 3.94Å; F263-V282 HydrophobicContact CE1-CG1 3.74Å; F263-V282 HydrophobicContact CZ-CG1 4.29Å; P268-V282 HydrophobicContact CB-CG1 3.79Å; S270-V282 VanDerWaalsContact O-CA 3.28Å; S270-V282 WeakPolarHBondContact O-CA 3.36Å; S270-V282 WeakPolarHBondContact O-CG1 3.36Å; V271-V282 HydrophobicContact CB-CG2 4.4Å; V271-V282 HydrophobicContact CG2-CG2 4.23Å; F280-V282 HydrophobicContact CB-CG2 4.29Å; V282-T291 PolarHBondContact N-O 2.74Å; V282-T291 PolarHBondContact O-N 2.83Å; V282-L293 HydrophobicContact CB-CD1 4.48Å; V282-L293 HydrophobicContact CG2-CD1 3.86Å; V282-L293 HydrophobicContact CG2-CG 4.39Å
283	V	96.9	Very high	95	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	146.4	172.5	-58.5	0	0	0	0	110.4	Y269 S270 I290 P318 H319 V321	Y269-V283 PolarHBondContact N-O 3.08Å; S270-V283 PolarHBondContact O-N 2.91Å; V283-I290 HydrophobicContact CG1-CB 4.39Å; V283-I290 HydrophobicContact CG1-CD1 4.49Å; V283-I290 HydrophobicContact CG1-CG1 4.05Å; V283-I290 HydrophobicContact CG1-CG2 3.92Å; V283-P318 HydrophobicContact CB-CB 3.99Å; V283-P318 HydrophobicContact CB-CG 4.06Å; V283-P318 HydrophobicContact CG1-CB 4Å; V283-P318 HydrophobicContact CG1-CG 4.39Å; V283-H319 WeakPolarHBondContact CG2-O 3.39Å; V283-V321 HydrophobicContact CG1-CG1 3.38Å; V283-V321 HydrophobicContact CG2-CG1 4.43Å
284	Q	95.7	Very high	95	Very high	8 Å²	8	32.8 Å²	32.8	4%	0.037	16%	0.163	C	C	.	.			trans	-126.2	127.4	171.7	-38.1	166.7	135.4	0	0	107	C262 D266 A267 N286 T287	C262-Q284 PolarHBondContact O-OE1 2.84Å; D266-Q284 HydrophobicContact CB-CB 3.85Å; D266-Q284 PolarHBondContact O-OE1 3.44Å; A267-Q284 WeakPolarHBondContact O-CA 3.13Å; A267-Q284 VanDerWaalsContact O-CB 3.24Å; A267-Q284 WeakPolarHBondContact O-CB 3.48Å; Q284-N286 VanDerWaalsContact C-N 3.34Å; Q284-N286 PolarHBondContact O-N 3.03Å; Q284-T287 HydrophobicContact CB-CG2 4.17Å; Q284-T287 WeakPolarHBondContact CB-OG1 3.49Å; Q284-T287 PolarHBondContact NE2-OG1 3.07Å; Q284-T287 PolarHBondContact O-N 3.28Å; Q284-T287 PolarHBondContact O-OG1 3Å
285	L	94.3	Very high	95	Very high	23 Å²	23	33.7 Å²	33.7	12%	0.12	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-40.6	-163.3	-178.3	70.4	0	0	0	113.7	D266 Y269 T287 K317 P318 H319 I335	D266-L285 PolarHBondContact OD2-N 2.83Å; Y269-L285 HydrophobicContact CD1-CB 4.01Å; Y269-L285 HydrophobicContact CD2-CB 3.71Å; Y269-L285 HydrophobicContact CE1-CB 3.75Å; Y269-L285 HydrophobicContact CE1-CD2 3.63Å; Y269-L285 HydrophobicContact CE1-CG 4.17Å; Y269-L285 HydrophobicContact CE2-CB 3.42Å; Y269-L285 VanDerWaalsContact CE2-CB 3.42Å; Y269-L285 HydrophobicContact CE2-CD2 4.41Å; Y269-L285 HydrophobicContact CG-CB 4Å; Y269-L285 VanDerWaalsContact CZ-CB 3.42Å; Y269-L285 WeakPolarHBondContact OH-CD2 3.4Å; L285-T287 VanDerWaalsContact C-N 3.31Å; L285-K317 HydrophobicContact CD1-CB 3.83Å; L285-K317 HydrophobicContact CG-CB 4.34Å; L285-K317 WeakPolarHBondContact O-CA 3.21Å; L285-K317 WeakPolarHBondContact O-CB 3.11Å; L285-P318 WeakPolarHBondContact CA-O 3.42Å; L285-H319 HydrophobicContact CD1-CB 4.32Å; L285-I335 HydrophobicContact CD1-CD1 4.02Å
286	N	93.1	Very high	95	Very high	97 Å²	97	32.4 Å²	32.4	52%	0.519	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	16.5	-174.3	-52.7	-72.7	0	0	0	112	D266 Q284	D266-N286 WeakPolarHBondContact OD2-CB 3.49Å; D266-N286 PolarHBondContact OD2-N 3.35Å; D266-N286 PolarHBondContact OD2-ND2 2.99Å; Q284-N286 VanDerWaalsContact C-N 3.34Å; Q284-N286 PolarHBondContact O-N 3.03Å
287	T	90.7	Very high	94.9	Very high	9 Å²	9	33.5 Å²	33.5	6%	0.055	17%	0.174	C	C	.	.	S	Bend	trans	-111.6	139.9	168	65.2	0	0	0	0	109.7	E265 D266 Q284 L285 Q289	E265-T287 HydrophobicContact CB-CG2 4.17Å; D266-T287 HydrophobicContact CB-CG2 3.92Å; Q284-T287 HydrophobicContact CB-CG2 4.17Å; Q284-T287 WeakPolarHBondContact CB-OG1 3.49Å; Q284-T287 PolarHBondContact NE2-OG1 3.07Å; Q284-T287 PolarHBondContact O-N 3.28Å; Q284-T287 PolarHBondContact O-OG1 3Å; L285-T287 VanDerWaalsContact C-N 3.31Å; T287-Q289 PolarHBondContact O-N 2.96Å
288	N	88.4	Confident	94.6	Very high	48 Å²	48	33.7 Å²	33.7	26%	0.257	19%	0.185	S	C	.	.	S	Bend	trans	-78.9	38.4	173.3	61.8	-4.5	0	0	0	111.2	Q311 L312	N288-Q311 PolarHBondContact ND2-NE2 3Å; N288-Q311 PolarHBondContact O-NE2 2.71Å; N288-Q311 PolarHBondContact OD1-NE2 2.78Å; N288-L312 HydrophobicContact CB-CB 4.48Å; N288-L312 WeakPolarHBondContact O-CA 3.39Å; N288-L312 VanDerWaalsContact O-CB 3.3Å; N288-L312 WeakPolarHBondContact O-CB 3.38Å; N288-L312 PolarHBondContact O-N 3.26Å
289	Q	92.9	Very high	94.2	Very high	46 Å²	46	30.3 Å²	30.3	22%	0.215	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	146.6	-171.4	-71.2	176.1	44.6	0	0	112.1	T287 V309 I310	T287-Q289 PolarHBondContact O-N 2.96Å; Q289-V309 HydrophobicContact CB-CG1 3.88Å; Q289-V309 HydrophobicContact CG-CG1 3.66Å; Q289-I310 WeakPolarHBondContact CA-O 3.3Å
290	I	95.6	Very high	93.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	125	163.4	-50.5	-179.9	0	0	0	107.4	V281 V283 V309 I310 L312 L330 V332 F343	V281-I290 HydrophobicContact CG1-CG2 3.39Å; V283-I290 HydrophobicContact CG1-CB 4.39Å; V283-I290 HydrophobicContact CG1-CD1 4.49Å; V283-I290 HydrophobicContact CG1-CG1 4.05Å; V283-I290 HydrophobicContact CG1-CG2 3.92Å; I290-V309 CarbonylContact O-C 3.55Å; I290-V309 WeakPolarHBondContact O-CA 3.43Å; I290-I310 HydrophobicContact CB-CB 4.02Å; I290-I310 HydrophobicContact CB-CD1 4.17Å; I290-I310 HydrophobicContact CB-CG1 4.27Å; I290-I310 HydrophobicContact CD1-CD1 4.41Å; I290-I310 HydrophobicContact CG2-CD1 4.29Å; I290-I310 PolarHBondContact N-O 2.63Å; I290-I310 PolarHBondContact O-N 2.71Å; I290-L312 HydrophobicContact CD1-CD1 4.35Å; I290-L312 HydrophobicContact CD1-CD2 3.97Å; I290-L312 HydrophobicContact CG1-CD1 3.84Å; I290-L312 HydrophobicContact CG1-CD2 4.03Å; I290-L312 HydrophobicContact CG1-CG 4.18Å; I290-L330 HydrophobicContact CD1-CD2 3.79Å; I290-L330 HydrophobicContact CG2-CD2 4.04Å; I290-V332 HydrophobicContact CD1-CG1 4.26Å; I290-V332 HydrophobicContact CD1-CG2 3.51Å; I290-F343 HydrophobicContact CD1-CD2 4.47Å; I290-F343 HydrophobicContact CD1-CE2 4.21Å
291	T	96.4	Very high	93.6	Very high	12 Å²	12	37 Å²	37	7%	0.074	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132	-175.3	-58.2	0	0	0	0	110.3	V282 L293 V306	V282-T291 PolarHBondContact N-O 2.74Å; V282-T291 PolarHBondContact O-N 2.83Å; T291-L293 HydrophobicContact CG2-CD2 3.5Å; T291-L293 HydrophobicContact CG2-CG 4.07Å; T291-V306 HydrophobicContact CG2-CB 4.46Å; T291-V306 HydrophobicContact CG2-CG1 3.93Å; T291-V306 HydrophobicContact CG2-CG2 3.96Å
292	L	97.4	Very high	93.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	115.4	168.1	-73.3	84.3	0	0	0	108.5	P50 Y52 F280 V281 A307 S308 I310	P50-L292 HydrophobicContact CB-CD2 3.62Å; P50-L292 HydrophobicContact CG-CB 4.21Å; P50-L292 HydrophobicContact CG-CD2 3.45Å; P50-L292 VanDerWaalsContact CG-CD2 3.45Å; P50-L292 HydrophobicContact CG-CG 4.42Å; Y52-L292 HydrophobicContact CD2-CD1 4.49Å; Y52-L292 HydrophobicContact CD2-CD2 4.15Å; Y52-L292 HydrophobicContact CE2-CD2 3.58Å; F280-L292 CarbonylContact O-C 3.58Å; F280-L292 WeakPolarHBondContact O-CA 3.3Å; V281-L292 HydrophobicContact CG2-CG 4.32Å; L292-A307 WeakPolarHBondContact O-CB 3.41Å; L292-A307 PolarHBondContact O-N 2.95Å; L292-S308 PolarHBondContact N-O 2.99Å; L292-S308 PolarHBondContact O-N 2.89Å; L292-I310 HydrophobicContact CD1-CD1 4.05Å; L292-I310 HydrophobicContact CD1-CG1 3.9Å
293	L	97.1	Very high	93.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	140.4	177.9	-57.5	179.1	0	0	0	109.9	W259 C262 F263 Y279 F280 V282 T291 A295 C304 K305 V306	W259-L293 HydrophobicContact CE3-CD1 4Å; W259-L293 HydrophobicContact CZ3-CB 4.15Å; W259-L293 HydrophobicContact CZ3-CD1 3.97Å; C262-L293 HydrophobicContact CB-CD2 4.12Å; F263-L293 HydrophobicContact CE1-CD1 4.21Å; F263-L293 HydrophobicContact CZ-CD1 3.83Å; Y279-L293 CarbonylContact C-O 3.58Å; Y279-L293 WeakPolarHBondContact CA-O 3.14Å; F280-L293 HydrophobicContact CB-CB 4.41Å; F280-L293 PolarHBondContact N-O 3.22Å; F280-L293 PolarHBondContact O-N 3.29Å; V282-L293 HydrophobicContact CB-CD1 4.48Å; V282-L293 HydrophobicContact CG2-CD1 3.86Å; V282-L293 HydrophobicContact CG2-CG 4.39Å; T291-L293 HydrophobicContact CG2-CD2 3.5Å; T291-L293 HydrophobicContact CG2-CG 4.07Å; L293-A295 PolarHBondContact O-N 2.86Å; L293-C304 HydrophobicContact CD1-CB 4.36Å; L293-K305 CarbonylContact C-O 3.56Å; L293-K305 VanDerWaalsContact CA-O 3.28Å; L293-K305 WeakPolarHBondContact CA-O 3.35Å; L293-V306 HydrophobicContact CD2-CB 4.43Å; L293-V306 HydrophobicContact CD2-CG2 3.79Å
294	D	96	Very high	93.1	Very high	41 Å²	41	46.5 Å²	46.5	22%	0.219	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	124.4	172.9	-74.1	-30.2	0	0	0	109.9	W259 Y279 K305 A307	W259-D294 VanDerWaalsContact CH2-O 3.29Å; W259-D294 WeakPolarHBondContact CH2-O 3.07Å; Y279-D294 WeakPolarHBondContact CE1-OD1 3.37Å; D294-K305 HydrophobicContact CB-CB 4.37Å; D294-K305 PolarHBondContact N-O 3.28Å; D294-K305 VanDerWaalsContact OD2-CD 3.3Å; D294-K305 WeakPolarHBondContact OD2-CD 3.5Å; D294-K305 WeakPolarHBondContact OD2-CE 3.47Å; D294-K305 WeakPolarHBondContact OD2-CG 3.37Å; D294-K305 IonicContact OD2-NZ 2.7Å; D294-K305 PolarHBondContact OD2-NZ 2.87Å; D294-A307 WeakPolarHBondContact OD1-CB 3.38Å
295	A	95.8	Very high	93.1	Very high	22 Å²	22	52.3 Å²	52.3	18%	0.182	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-71.1	126.7	169.6	0	0	0	0	0	108.6	L273 K277 K278 F280 L293	L273-A295 HydrophobicContact CD1-CB 3.91Å; K277-A295 WeakPolarHBondContact O-CB 3.48Å; K278-A295 WeakPolarHBondContact O-CB 3.39Å; K278-A295 PolarHBondContact O-N 3.06Å; F280-A295 HydrophobicContact CD2-CB 3.99Å; F280-A295 HydrophobicContact CE2-CB 3.87Å; L293-A295 PolarHBondContact O-N 2.86Å
296	P	94.6	Very high	93.1	Very high	18 Å²	18	54.6 Å²	54.6	12%	0.117	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-74.5	151.5	-176.5	28.2	-29.4	0	0	0	110	R234 W236 W259	R234-P296 PolarHBondContact NH2-O 2.89Å; W236-P296 HydrophobicContact CH2-CG 3.54Å; W236-P296 HydrophobicContact CZ2-CG 3.82Å; W259-P296 HydrophobicContact CH2-CG 4.31Å; W259-P296 HydrophobicContact CZ2-CB 4.49Å; W259-P296 HydrophobicContact CZ2-CG 3.79Å
297	P	89.6	Confident	93.2	Very high	104 Å²	104	50.5 Å²	50.5	68%	0.675	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-60.4	171.1	173.1	29.6	-36.1	0	0	0	111.2	R234 G299	R234-P297 PolarHBondContact NH1-O 2.77Å; P297-G299 PolarHBondContact O-N 3.46Å
298	V	87.2	Confident	93.4	Very high	128 Å²	128	50.9 Å²	50.9	78%	0.776	30%	0.303	S	S	*	.	S	Bend	trans	-59.6	134.2	170.2	-177.4	0	0	0	0	109.1	A232	A232-V298 HydrophobicContact CB-CG2 3.93Å
299	G	86.8	Confident	93.7	Very high	53 Å²	53	51.4 Å²	51.4	55%	0.546	31%	0.307	S	S	.	.	S	Bend	trans	115.7	-132.6	-176.7	0	0	0	0	0	112.2	P297 I301	P297-G299 PolarHBondContact O-N 3.46Å; G299-I301 PolarHBondContact O-N 3.11Å
300	L	85.8	Confident	93.8	Very high	160 Å²	160	49.7 Å²	49.7	84%	0.838	30%	0.3	S	S	*	.			trans	-62.6	133	-175.9	-64.7	175.3	0	0	0	111.7	G302	L300-G302 VanDerWaalsContact C-N 3.33Å; L300-G302 PolarHBondContact O-N 2.93Å
301	I	94.3	Very high	93.6	Very high	8 Å²	8	55 Å²	55	4%	0.041	33%	0.325	C	S	.	.			trans	-67.9	-32.8	179.3	-59.1	-52.1	0	0	0	112.3	W236 V247 L256 W259 G299	W236-I301 HydrophobicContact CH2-CG2 4.16Å; W236-I301 HydrophobicContact CZ2-CD1 4.48Å; V247-I301 HydrophobicContact CB-CD1 4.16Å; V247-I301 HydrophobicContact CB-CG1 4.21Å; V247-I301 HydrophobicContact CB-CG2 4.48Å; V247-I301 HydrophobicContact CG1-CD1 3.71Å; V247-I301 HydrophobicContact CG1-CG1 4.31Å; V247-I301 HydrophobicContact CG2-CD1 4.44Å; V247-I301 HydrophobicContact CG2-CG1 4.44Å; V247-I301 HydrophobicContact CG2-CG2 3.83Å; L256-I301 HydrophobicContact CB-CD1 4.18Å; L256-I301 HydrophobicContact CB-CG1 3.89Å; L256-I301 WeakPolarHBondContact O-CG1 3.32Å; W259-I301 PolarHBondContact NE1-O 2.84Å; G299-I301 PolarHBondContact O-N 3.11Å
302	G	92.9	Very high	93.4	Very high	46 Å²	46	55 Å²	55	47%	0.474	32%	0.324	S	S	.	.			trans	63	-164.2	179.8	0	0	0	0	0	113.6	W259 L300	W259-G302 PolarHBondContact NE1-O 3.07Å; L300-G302 VanDerWaalsContact C-N 3.33Å; L300-G302 PolarHBondContact O-N 2.93Å
303	Q	93.9	Very high	93	Very high	141 Å²	141	58.1 Å²	58.1	66%	0.659	35%	0.35	S	S	*	.			trans	-91.9	149.9	172.1	-62	-59.5	-45.4	0	0	109.8
304	C	96	Very high	92.4	Very high	12 Å²	12	66.4 Å²	66.4	8%	0.081	39%	0.389	C	S	.	.			trans	-64.9	147.2	173.1	61.9	0	0	0	0	110.5	W259 S261 C262 L293	W259-C304 HydrophobicContact CB-CB 3.81Å; W259-C304 HydrophobicContact CD2-CB 3.51Å; W259-C304 HydrophobicContact CE3-CB 3.79Å; W259-C304 HydrophobicContact CG-CB 3.55Å; W259-C304 HydrophobicContact CZ3-CB 4.46Å; S261-C304 PolarHBondContact OG-SG 2.72Å; C262-C304 HydrophobicContact CB-CB 4.02Å; C262-C304 WeakPolarHBondContact CB-SG 3.47Å; C262-C304 PolarHBondContact N-SG 3.41Å; C262-C304 VanDerWaalsContact SG-C 3.53Å; C262-C304 WeakPolarHBondContact SG-CB 3.39Å; C262-C304 CovalentContact SG-SG 2.02Å; C262-C304 PolarHBondContact SG-SG 2.91Å; L293-C304 HydrophobicContact CD1-CB 4.36Å
305	K	95.6	Very high	91.8	Very high	131 Å²	131	71.3 Å²	71.3	57%	0.57	42%	0.415	S	S	*	.			trans	-136.1	122.4	178.4	176.3	166.1	164.9	-105.1	0	109.7	L293 D294 A307	L293-K305 CarbonylContact C-O 3.56Å; L293-K305 VanDerWaalsContact CA-O 3.28Å; L293-K305 WeakPolarHBondContact CA-O 3.35Å; D294-K305 HydrophobicContact CB-CB 4.37Å; D294-K305 PolarHBondContact N-O 3.28Å; D294-K305 VanDerWaalsContact OD2-CD 3.3Å; D294-K305 WeakPolarHBondContact OD2-CD 3.5Å; D294-K305 WeakPolarHBondContact OD2-CE 3.47Å; D294-K305 WeakPolarHBondContact OD2-CG 3.37Å; D294-K305 IonicContact OD2-NZ 2.7Å; D294-K305 PolarHBondContact OD2-NZ 2.87Å; K305-A307 PolarHBondContact O-N 2.82Å
306	V	95.4	Very high	91.5	Very high	71 Å²	71	70.7 Å²	70.7	43%	0.43	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	116.4	176.5	-179.5	0	0	0	0	109.3	T291 L293 V309	T291-V306 HydrophobicContact CG2-CB 4.46Å; T291-V306 HydrophobicContact CG2-CG1 3.93Å; T291-V306 HydrophobicContact CG2-CG2 3.96Å; L293-V306 HydrophobicContact CD2-CB 4.43Å; L293-V306 HydrophobicContact CD2-CG2 3.79Å; V306-V309 HydrophobicContact CG1-CG2 3.88Å
307	A	94.8	Very high	91.4	Very high	10 Å²	10	74.2 Å²	74.2	8%	0.083	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-43.6	176.3	0	0	0	0	0	111.5	R49 Y279 L292 D294 K305	R49-A307 WeakPolarHBondContact CD-O 3.47Å; Y279-A307 HydrophobicContact CD1-CB 3.64Å; Y279-A307 HydrophobicContact CE1-CB 3.53Å; L292-A307 WeakPolarHBondContact O-CB 3.41Å; L292-A307 PolarHBondContact O-N 2.95Å; D294-A307 WeakPolarHBondContact OD1-CB 3.38Å; K305-A307 PolarHBondContact O-N 2.82Å
308	S	94.5	Very high	91.7	Very high	17 Å²	17	69.3 Å²	69.3	12%	0.119	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	164.1	-177.4	-163.2	0	0	0	0	110.7	P50 L292	P50-S308 VanDerWaalsContact O-CB 3.22Å; P50-S308 WeakPolarHBondContact O-CB 3.07Å; P50-S308 PolarHBondContact O-OG 2.85Å; L292-S308 PolarHBondContact N-O 2.99Å; L292-S308 PolarHBondContact O-N 2.89Å
309	V	94.1	Very high	92.1	Very high	59 Å²	59	63.4 Å²	63.4	36%	0.358	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	134.1	177.7	170.7	0	0	0	0	108.1	Q289 I290 V306	Q289-V309 HydrophobicContact CB-CG1 3.88Å; Q289-V309 HydrophobicContact CG-CG1 3.66Å; I290-V309 CarbonylContact O-C 3.55Å; I290-V309 WeakPolarHBondContact O-CA 3.43Å; V306-V309 HydrophobicContact CG1-CG2 3.88Å
310	I	95	Very high	92.6	Very high	11 Å²	11	61 Å²	61	6%	0.056	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	117.2	166.8	-45.6	176.5	0	0	0	106.9	Y52 Q289 I290 L292 L312 L330 F343	Y52-I310 VanDerWaalsContact CB-CD1 3.42Å; Y52-I310 HydrophobicContact CD1-CD1 4.27Å; Y52-I310 HydrophobicContact CD2-CD1 3.88Å; Y52-I310 HydrophobicContact CD2-CG1 4.39Å; Y52-I310 HydrophobicContact CG-CD1 3.61Å; Y52-I310 HydrophobicContact CG-CG1 4.35Å; Q289-I310 WeakPolarHBondContact CA-O 3.3Å; I290-I310 HydrophobicContact CB-CB 4.02Å; I290-I310 HydrophobicContact CB-CD1 4.17Å; I290-I310 HydrophobicContact CB-CG1 4.27Å; I290-I310 HydrophobicContact CD1-CD1 4.41Å; I290-I310 HydrophobicContact CG2-CD1 4.29Å; I290-I310 PolarHBondContact N-O 2.63Å; I290-I310 PolarHBondContact O-N 2.71Å; L292-I310 HydrophobicContact CD1-CD1 4.05Å; L292-I310 HydrophobicContact CD1-CG1 3.9Å; I310-L312 HydrophobicContact CG2-CD2 4.49Å; I310-L330 HydrophobicContact CD1-CD2 3.83Å; I310-F343 HydrophobicContact CG2-CD1 3.67Å; I310-F343 HydrophobicContact CG2-CE1 3.69Å
311	Q	93.3	Very high	93.2	Very high	111 Å²	111	53.3 Å²	53.3	52%	0.519	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	127.7	175.8	-173.9	60.7	56.9	0	0	109.8	N288	N288-Q311 PolarHBondContact ND2-NE2 3Å; N288-Q311 PolarHBondContact O-NE2 2.71Å; N288-Q311 PolarHBondContact OD1-NE2 2.78Å
312	L	92.1	Very high	93.4	Very high	11 Å²	11	54 Å²	54	6%	0.058	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-101.4	165.5	173.3	-48.5	176.9	0	0	0	109.9	N288 I290 I310 V316 P318 F343	N288-L312 HydrophobicContact CB-CB 4.48Å; N288-L312 WeakPolarHBondContact O-CA 3.39Å; N288-L312 VanDerWaalsContact O-CB 3.3Å; N288-L312 WeakPolarHBondContact O-CB 3.38Å; N288-L312 PolarHBondContact O-N 3.26Å; I290-L312 HydrophobicContact CD1-CD1 4.35Å; I290-L312 HydrophobicContact CD1-CD2 3.97Å; I290-L312 HydrophobicContact CG1-CD1 3.84Å; I290-L312 HydrophobicContact CG1-CD2 4.03Å; I290-L312 HydrophobicContact CG1-CG 4.18Å; I310-L312 HydrophobicContact CG2-CD2 4.49Å; L312-V316 HydrophobicContact CB-CB 3.96Å; L312-V316 HydrophobicContact CB-CG1 4.02Å; L312-V316 HydrophobicContact CB-CG2 4.49Å; L312-V316 HydrophobicContact CD1-CB 4.39Å; L312-V316 HydrophobicContact CD1-CG1 3.63Å; L312-V316 HydrophobicContact CG-CG1 4.35Å; L312-P318 HydrophobicContact CD1-CB 3.99Å; L312-P318 HydrophobicContact CD1-CG 3.64Å; L312-F343 HydrophobicContact CD2-CE1 3.94Å; L312-F343 HydrophobicContact CD2-CE2 4.18Å; L312-F343 HydrophobicContact CD2-CZ 3.39Å
313	A	89.1	Confident	93.6	Very high	67 Å²	67	52 Å²	52	55%	0.554	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-66	155.7	170.6	0	0	0	0	0	111.1	D315 V316	A313-D315 VanDerWaalsContact C-N 3.32Å; A313-D315 PolarHBondContact O-N 2.87Å; A313-V316 HydrophobicContact CB-CG2 3.97Å; A313-V316 WeakPolarHBondContact O-CB 3.03Å; A313-V316 PolarHBondContact O-N 3.31Å; A313-V316 VanDerWaalsContact O-N 3.1Å
314	E	84	Confident	93.7	Very high	174 Å²	174	45.8 Å²	45.8	81%	0.813	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-36.6	-169.5	-67.1	-174.1	166.8	0	0	114.3	V316	E314-V316 VanDerWaalsContact C-N 3.32Å
315	D	82.7	Confident	93.6	Very high	143 Å²	143	49.8 Å²	49.8	77%	0.765	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-0.2	-178.1	-64.4	-44.4	0	0	0	113.9	A313	A313-D315 VanDerWaalsContact C-N 3.32Å; A313-D315 PolarHBondContact O-N 2.87Å
316	V	89.3	Confident	93.5	Very high	10 Å²	10	50.1 Å²	50.1	6%	0.061	26%	0.264	C	S	.	.			trans	-77.5	127.9	-179.9	174.7	0	0	0	0	110.1	L312 A313 E314 E334	L312-V316 HydrophobicContact CB-CB 3.96Å; L312-V316 HydrophobicContact CB-CG1 4.02Å; L312-V316 HydrophobicContact CB-CG2 4.49Å; L312-V316 HydrophobicContact CD1-CB 4.39Å; L312-V316 HydrophobicContact CD1-CG1 3.63Å; L312-V316 HydrophobicContact CG-CG1 4.35Å; A313-V316 HydrophobicContact CB-CG2 3.97Å; A313-V316 WeakPolarHBondContact O-CB 3.03Å; A313-V316 PolarHBondContact O-N 3.31Å; A313-V316 VanDerWaalsContact O-N 3.1Å; E314-V316 VanDerWaalsContact C-N 3.32Å; V316-E334 HydrophobicContact CG1-CB 4.41Å; V316-E334 HydrophobicContact CG1-CG 3.84Å; V316-E334 VanDerWaalsContact CG1-OE1 3.23Å; V316-E334 WeakPolarHBondContact CG1-OE1 3.33Å
317	K	93.9	Very high	93.4	Very high	92 Å²	92	49.7 Å²	49.7	40%	0.4	27%	0.267	S	S	.	.			trans	-118.7	90.1	175.4	-61.1	-171.1	178.9	-171.5	0	110	L285 E334 I335	L285-K317 HydrophobicContact CD1-CB 3.83Å; L285-K317 HydrophobicContact CG-CB 4.34Å; L285-K317 WeakPolarHBondContact O-CA 3.21Å; L285-K317 WeakPolarHBondContact O-CB 3.11Å; K317-E334 WeakPolarHBondContact O-CA 3.45Å; K317-I335 PolarHBondContact O-N 2.82Å
318	P	95.3	Very high	93.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	129.3	-177.7	32	-35.3	0	0	0	109.9	V283 L285 L312 V332	V283-P318 HydrophobicContact CB-CB 3.99Å; V283-P318 HydrophobicContact CB-CG 4.06Å; V283-P318 HydrophobicContact CG1-CB 4Å; V283-P318 HydrophobicContact CG1-CG 4.39Å; L285-P318 WeakPolarHBondContact CA-O 3.42Å; L312-P318 HydrophobicContact CD1-CB 3.99Å; L312-P318 HydrophobicContact CD1-CG 3.64Å; P318-V332 HydrophobicContact CB-CG1 3.68Å
319	H	96.3	Very high	93.5	Very high	4 Å²	4	49 Å²	49	2%	0.019	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-63.1	-175.5	-176.2	-108.5	0	0	0	112.6	F70 H115 H225 Y269 V283 L285 A333 I335	F70-H319 AromaticContact CD1-CE1 3.27Å; F70-H319 WeakPolarHBondContact CD1-CE1 3.45Å; F70-H319 AromaticContact CD1-ND1 3.46Å; F70-H319 WeakPolarHBondContact CD1-ND1 3.31Å; F70-H319 AromaticContact CD1-NE2 3.89Å; F70-H319 AromaticContact CE1-CE1 3.46Å; F70-H319 VanDerWaalsContact CE1-CE1 3.46Å; F70-H319 WeakPolarHBondContact CE1-CE1 3.32Å; F70-H319 AromaticContact CE1-ND1 3.91Å; F70-H319 AromaticContact CE1-NE2 3.59Å; F70-H319 PolarHBondContact O-ND1 2.58Å; H115-H319 AromaticContact CE1-CE1 3.7Å; H115-H319 AromaticContact NE2-CE1 3.67Å; H115-H319 AromaticContact NE2-NE2 3.8Å; H225-H319 AromaticContact CE1-CE1 3.68Å; H225-H319 AromaticContact CE1-NE2 3.23Å; H225-H319 PolarHBondContact CE1-NE2 3.24Å; H225-H319 AromaticContact NE2-NE2 3.37Å; H225-H319 PolarHBondContact NE2-NE2 2.83Å; Y269-H319 WeakPolarHBondContact CB-O 3.22Å; Y269-H319 AromaticContact CD1-CD2 3.66Å; Y269-H319 AromaticContact CD1-NE2 3.95Å; V283-H319 WeakPolarHBondContact CG2-O 3.39Å; L285-H319 HydrophobicContact CD1-CB 4.32Å; H319-A333 PolarHBondContact N-O 3.4Å; H319-I335 HydrophobicContact CB-CD1 3.59Å; H319-I335 HydrophobicContact CB-CG1 3.78Å; H319-I335 WeakPolarHBondContact CD2-CD1 3.09Å; H319-I335 VanDerWaalsContact CG-CD1 3.46Å
320	L	97	Very high	93.6	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152	178.3	-72	173.7	0	0	0	110.3	C71 H115 A333	C71-L320 HydrophobicContact CB-CB 4.33Å; C71-L320 HydrophobicContact CB-CD1 3.77Å; H115-L320 WeakPolarHBondContact O-CD1 3.31Å; L320-A333 PolarHBondContact O-N 3.16Å
321	V	97.4	Very high	93.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155	-179.4	-57.7	0	0	0	0	111.7	S270 R272 V281 V283 L330 Y331 V332	S270-V321 PolarHBondContact OG-N 2.9Å; R272-V321 HydrophobicContact CB-CG2 4.29Å; R272-V321 HydrophobicContact CG-CG2 3.88Å; R272-V321 WeakPolarHBondContact CG-O 3.32Å; R272-V321 PolarHBondContact NE-O 2.91Å; V281-V321 HydrophobicContact CG1-CG2 4.12Å; V283-V321 HydrophobicContact CG1-CG1 3.38Å; V283-V321 HydrophobicContact CG2-CG1 4.43Å; V321-L330 HydrophobicContact CB-CD1 3.73Å; V321-L330 HydrophobicContact CG1-CD1 4.23Å; V321-L330 HydrophobicContact CG2-CD1 4.11Å; V321-Y331 VanDerWaalsContact CA-O 3.23Å; V321-Y331 WeakPolarHBondContact CA-O 3.46Å; V321-Y331 WeakPolarHBondContact CB-O 3.26Å; V321-V332 HydrophobicContact CG1-CB 4.26Å; V321-V332 HydrophobicContact CG1-CG1 4.04Å; V321-V332 HydrophobicContact CG1-CG2 3.93Å
322	D	98.1	Very high	94	Very high	22 Å²	22	40.5 Å²	40.5	12%	0.118	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	157.5	166.5	-160.4	24.4	0	0	0	111.1	V72 A73 V74 Y331	V72-D322 HydrophobicContact CG2-CB 4.2Å; A73-D322 WeakPolarHBondContact CA-OD2 3.29Å; V74-D322 HydrophobicContact CG1-CB 4.44Å; V74-D322 PolarHBondContact N-OD2 2.94Å; D322-Y331 PolarHBondContact N-O 3.28Å; D322-Y331 PolarHBondContact O-N 2.86Å
323	L	97	Very high	94.2	Very high	3 Å²	3	40 Å²	40	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.2	-172.4	-74.1	137.1	0	0	0	111.4	V74 R272 L273 V281 L325 A329 L330	V74-L323 VanDerWaalsContact CG1-O 3.26Å; V74-L323 WeakPolarHBondContact CG1-O 3.32Å; R272-L323 HydrophobicContact CB-CD1 3.66Å; L273-L323 WeakPolarHBondContact O-CD1 3.46Å; V281-L323 HydrophobicContact CB-CD1 4.46Å; V281-L323 HydrophobicContact CG2-CD1 4Å; V281-L323 HydrophobicContact CG2-CD2 4.17Å; L323-L325 HydrophobicContact CB-CD2 4.42Å; L323-L325 PolarHBondContact O-N 3.43Å; L323-L325 VanDerWaalsContact O-N 3.16Å; L323-A329 CarbonylContact C-O 3.5Å; L323-A329 WeakPolarHBondContact CA-O 3.47Å; L323-L330 HydrophobicContact CD2-CB 4.24Å; L323-L330 HydrophobicContact CD2-CD1 4Å; L323-L330 HydrophobicContact CG-CD1 3.95Å
324	D	96.8	Very high	94.4	Very high	12 Å²	12	36.8 Å²	36.8	6%	0.064	19%	0.191	C	C	.	.			trans	-68.2	111.4	165.6	-177.3	-43.4	0	0	0	108.3	V74 Q76 K326 A327 G328 A329 Y331	V74-D324 HydrophobicContact CG1-CB 4.4Å; V74-D324 HydrophobicContact CG2-CB 4.34Å; Q76-D324 HydrophobicContact CB-CB 4.48Å; Q76-D324 VanDerWaalsContact CB-CG 3.49Å; Q76-D324 WeakPolarHBondContact CB-OD1 3.25Å; D324-K326 PolarHBondContact O-N 3.12Å; D324-K326 WeakPolarHBondContact OD1-CA 3.43Å; D324-K326 WeakPolarHBondContact OD1-CB 3.43Å; D324-K326 PolarHBondContact OD1-N 2.98Å; D324-A327 HydrophobicContact CB-CB 4.32Å; D324-A327 PolarHBondContact OD1-N 2.83Å; D324-G328 WeakPolarHBondContact O-CA 3.42Å; D324-G328 PolarHBondContact O-N 3.37Å; D324-A329 HydrophobicContact CB-CB 4.07Å; D324-A329 PolarHBondContact N-O 2.77Å; D324-Y331 HydrophobicContact CB-CE2 4.33Å
325	L	93.6	Very high	94.6	Very high	96 Å²	96	29.8 Å²	29.8	50%	0.503	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-8.9	-174.8	-58.6	-176	0	0	0	114.6	Q76 P275 L323	Q76-L325 HydrophobicContact CG-CB 4.31Å; P275-L325 HydrophobicContact CB-CD2 4.3Å; P275-L325 WeakPolarHBondContact CB-O 3.36Å; P275-L325 HydrophobicContact CG-CB 4.5Å; P275-L325 HydrophobicContact CG-CD2 3.91Å; L323-L325 HydrophobicContact CB-CD2 4.42Å; L323-L325 PolarHBondContact O-N 3.43Å; L323-L325 VanDerWaalsContact O-N 3.16Å
326	K	93.1	Very high	94.4	Very high	138 Å²	138	24.9 Å²	24.9	60%	0.6	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-52.3	175	-73.7	176.7	-177	173.4	0	112	Q76 D77 D324	Q76-K326 HydrophobicContact CB-CB 4.35Å; Q76-K326 HydrophobicContact CB-CD 4.29Å; Q76-K326 HydrophobicContact CB-CG 4.31Å; Q76-K326 HydrophobicContact CG-CB 4.31Å; Q76-K326 HydrophobicContact CG-CD 4Å; Q76-K326 HydrophobicContact CG-CG 3.81Å; Q76-K326 PolarHBondContact O-NZ 2.7Å; D77-K326 WeakPolarHBondContact OD1-CE 3.47Å; D77-K326 IonicContact OD1-NZ 2.84Å; D77-K326 PolarHBondContact OD1-NZ 2.74Å; D324-K326 PolarHBondContact O-N 3.12Å; D324-K326 WeakPolarHBondContact OD1-CA 3.43Å; D324-K326 WeakPolarHBondContact OD1-CB 3.43Å; D324-K326 PolarHBondContact OD1-N 2.98Å
327	A	93.2	Very high	94.1	Very high	61 Å²	61	26.4 Å²	26.4	50%	0.504	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-18.2	-175.3	0	0	0	0	0	112.7	D324 A329 P345	D324-A327 HydrophobicContact CB-CB 4.32Å; D324-A327 PolarHBondContact OD1-N 2.83Å; A327-A329 PolarHBondContact O-N 3.06Å; A327-P345 VanDerWaalsContact O-CG 3.25Å; A327-P345 WeakPolarHBondContact O-CG 3.23Å
328	G	94.5	Very high	94	Very high	11 Å²	11	26.8 Å²	26.8	11%	0.113	16%	0.159	C	C	.	.			trans	71.2	9.4	-173.8	0	0	0	0	0	113.8	Y52 D324	Y52-G328 VanDerWaalsContact CE1-O 3.23Å; Y52-G328 WeakPolarHBondContact CE1-O 3.45Å; Y52-G328 PolarHBondContact OH-O 3.32Å; Y52-G328 VanDerWaalsContact OH-O 3.14Å; D324-G328 WeakPolarHBondContact O-CA 3.42Å; D324-G328 PolarHBondContact O-N 3.37Å
329	A	97.1	Very high	93.9	Very high	3 Å²	3	29.2 Å²	29.2	3%	0.025	17%	0.17	C	C	.	.			trans	-65.6	142.8	175.2	0	0	0	0	0	110.4	L323 D324 A327 Y331 F343 T344	L323-A329 CarbonylContact C-O 3.5Å; L323-A329 WeakPolarHBondContact CA-O 3.47Å; D324-A329 HydrophobicContact CB-CB 4.07Å; D324-A329 PolarHBondContact N-O 2.77Å; A327-A329 PolarHBondContact O-N 3.06Å; A329-Y331 HydrophobicContact CB-CE2 4.25Å; A329-F343 CarbonylContact C-O 3.46Å; A329-F343 VanDerWaalsContact CA-O 3.32Å; A329-F343 WeakPolarHBondContact CA-O 3.28Å; A329-T344 HydrophobicContact CB-CG2 4.45Å
330	L	97.3	Very high	93.9	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.3	180	173.7	70.3	0	0	0	108.8	Y52 V281 I290 I310 V321 L323 V332 K342 F343	Y52-L330 HydrophobicContact CD1-CB 4.29Å; Y52-L330 HydrophobicContact CE1-CB 3.98Å; V281-L330 HydrophobicContact CG1-CD1 3.87Å; V281-L330 HydrophobicContact CG1-CD2 3.97Å; I290-L330 HydrophobicContact CD1-CD2 3.79Å; I290-L330 HydrophobicContact CG2-CD2 4.04Å; I310-L330 HydrophobicContact CD1-CD2 3.83Å; V321-L330 HydrophobicContact CB-CD1 3.73Å; V321-L330 HydrophobicContact CG1-CD1 4.23Å; V321-L330 HydrophobicContact CG2-CD1 4.11Å; L323-L330 HydrophobicContact CD2-CB 4.24Å; L323-L330 HydrophobicContact CD2-CD1 4Å; L323-L330 HydrophobicContact CG-CD1 3.95Å; L330-V332 HydrophobicContact CD2-CG2 4.01Å; L330-V332 HydrophobicContact CG-CG2 3.89Å; L330-K342 CarbonylContact O-C 3.46Å; L330-K342 WeakPolarHBondContact O-CA 3.05Å; L330-F343 HydrophobicContact CB-CB 4.25Å; L330-F343 PolarHBondContact N-O 2.89Å; L330-F343 PolarHBondContact O-N 2.86Å
331	Y	98.2	Very high	93.9	Very high	1 Å²	1	30 Å²	30	0%	0.004	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	136.6	171.8	-65.5	-86.8	0	0	0	109.3	W58 V72 V74 V81 T98 V321 D322 D324 A329 Q341 K342	W58-Y331 HydrophobicContact CD2-CD1 4.33Å; W58-Y331 AromaticContact CD2-CE1 3.91Å; W58-Y331 HydrophobicContact CD2-CE1 3.91Å; W58-Y331 AromaticContact CE2-CE1 3.52Å; W58-Y331 HydrophobicContact CE3-CD1 4.22Å; W58-Y331 HydrophobicContact CE3-CE1 4.26Å; W58-Y331 AromaticContact CH2-CD1 3.59Å; W58-Y331 HydrophobicContact CH2-CD1 3.59Å; W58-Y331 AromaticContact CH2-CE1 3.96Å; W58-Y331 HydrophobicContact CH2-CE1 3.96Å; W58-Y331 AromaticContact CZ2-CD1 3.7Å; W58-Y331 HydrophobicContact CZ2-CD1 3.7Å; W58-Y331 AromaticContact CZ2-CE1 3.58Å; W58-Y331 HydrophobicContact CZ2-CE1 3.58Å; W58-Y331 AromaticContact CZ3-CD1 3.84Å; W58-Y331 HydrophobicContact CZ3-CD1 3.84Å; W58-Y331 HydrophobicContact CZ3-CE1 4.26Å; W58-Y331 AromaticContact NE1-CE1 3.86Å; V72-Y331 WeakPolarHBondContact CG2-O 3.3Å; V74-Y331 HydrophobicContact CB-CD2 4.02Å; V74-Y331 HydrophobicContact CB-CE2 4.16Å; V74-Y331 HydrophobicContact CG1-CD2 4.13Å; V74-Y331 HydrophobicContact CG1-CE2 4.46Å; V74-Y331 HydrophobicContact CG2-CD2 4.23Å; V74-Y331 HydrophobicContact CG2-CE2 3.85Å; V81-Y331 HydrophobicContact CB-CE1 4.49Å; V81-Y331 HydrophobicContact CG1-CD1 3.93Å; V81-Y331 HydrophobicContact CG1-CE1 4.27Å; V81-Y331 HydrophobicContact CG1-CG 4.18Å; V81-Y331 HydrophobicContact CG2-CD1 4.05Å; V81-Y331 HydrophobicContact CG2-CD2 4.49Å; V81-Y331 HydrophobicContact CG2-CE1 3.54Å; V81-Y331 HydrophobicContact CG2-CE2 4.05Å; V81-Y331 HydrophobicContact CG2-CG 4.49Å; T98-Y331 PolarHBondContact O-OH 3.08Å; V321-Y331 VanDerWaalsContact CA-O 3.23Å; V321-Y331 WeakPolarHBondContact CA-O 3.46Å; V321-Y331 WeakPolarHBondContact CB-O 3.26Å; D322-Y331 PolarHBondContact N-O 3.28Å; D322-Y331 PolarHBondContact O-N 2.86Å; D324-Y331 HydrophobicContact CB-CE2 4.33Å; A329-Y331 HydrophobicContact CB-CE2 4.25Å; Y331-Q341 CarbonylContact C-O 3.53Å; Y331-Q341 WeakPolarHBondContact CA-O 3.23Å; Y331-K342 HydrophobicContact CD1-CB 3.97Å; Y331-K342 HydrophobicContact CD1-CG 4.15Å; Y331-K342 HydrophobicContact CE1-CB 3.77Å; Y331-K342 HydrophobicContact CE1-CD 3.7Å; Y331-K342 HydrophobicContact CE1-CG 3.62Å; Y331-K342 WeakPolarHBondContact OH-CE 3.02Å
332	V	97.4	Very high	93.9	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	121.6	-171.9	-174.2	0	0	0	0	108.8	I290 P318 V321 L330 E334 A340 Q341 F343	I290-V332 HydrophobicContact CD1-CG1 4.26Å; I290-V332 HydrophobicContact CD1-CG2 3.51Å; P318-V332 HydrophobicContact CB-CG1 3.68Å; V321-V332 HydrophobicContact CG1-CB 4.26Å; V321-V332 HydrophobicContact CG1-CG1 4.04Å; V321-V332 HydrophobicContact CG1-CG2 3.93Å; L330-V332 HydrophobicContact CD2-CG2 4.01Å; L330-V332 HydrophobicContact CG-CG2 3.89Å; V332-E334 HydrophobicContact CG1-CG 3.98Å; V332-A340 CarbonylContact O-C 3.47Å; V332-A340 WeakPolarHBondContact O-CA 3.12Å; V332-Q341 PolarHBondContact N-O 3.18Å; V332-Q341 PolarHBondContact O-N 2.84Å; V332-F343 HydrophobicContact CB-CE2 4.36Å; V332-F343 HydrophobicContact CG2-CD2 3.77Å; V332-F343 HydrophobicContact CG2-CE2 3.74Å
333	A	97.1	Very high	93.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	127.6	167.2	0	0	0	0	0	109.8	V69 F70 V72 H319 L320	V69-A333 HydrophobicContact CG1-CB 3.83Å; F70-A333 VanDerWaalsContact C-CB 3.45Å; F70-A333 WeakPolarHBondContact O-CB 2.85Å; V72-A333 HydrophobicContact CG1-CB 4.14Å; H319-A333 PolarHBondContact N-O 3.4Å; L320-A333 PolarHBondContact O-N 3.16Å
334	E	92.3	Very high	93.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	117.3	-176.7	-58.3	179.3	170.3	0	0	111.3	V69 V316 K317 V332 A337 Q338 Q339 Q341	V69-E334 CarbonylContact O-C 3.53Å; V316-E334 HydrophobicContact CG1-CB 4.41Å; V316-E334 HydrophobicContact CG1-CG 3.84Å; V316-E334 VanDerWaalsContact CG1-OE1 3.23Å; V316-E334 WeakPolarHBondContact CG1-OE1 3.33Å; K317-E334 WeakPolarHBondContact O-CA 3.45Å; V332-E334 HydrophobicContact CG1-CG 3.98Å; E334-A337 HydrophobicContact CB-CB 4.45Å; E334-Q338 WeakPolarHBondContact O-CA 3.15Å; E334-Q338 PolarHBondContact O-N 2.89Å; E334-Q338 VanDerWaalsContact O-N 3.16Å; E334-Q339 WeakPolarHBondContact CB-O 3.36Å; E334-Q339 PolarHBondContact N-O 2.94Å; E334-Q339 PolarHBondContact O-N 3.15Å; E334-Q339 PolarHBondContact OE2-NE2 3.26Å; E334-Q341 VanDerWaalsContact OE1-CG 3.25Å; E334-Q341 WeakPolarHBondContact OE1-CG 3.18Å; E334-Q341 PolarHBondContact OE1-NE2 3.2Å; E334-Q341 PolarHBondContact OE1-OE1 3.34Å; E334-Q341 PolarHBondContact OE2-NE2 2.88Å
335	I	89.1	Confident	93.5	Very high	28 Å²	28	33.5 Å²	33.5	14%	0.144	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-46	-179.1	-63.8	169.3	0	0	0	110.2	F70 L285 K317 H319 A337 Q338	F70-I335 HydrophobicContact CD1-CD1 4.27Å; F70-I335 HydrophobicContact CD2-CD1 4.19Å; F70-I335 HydrophobicContact CD2-CG1 3.98Å; F70-I335 HydrophobicContact CE1-CD1 3.73Å; F70-I335 HydrophobicContact CE2-CD1 3.66Å; F70-I335 HydrophobicContact CE2-CG1 3.79Å; F70-I335 HydrophobicContact CE2-CG2 4.33Å; F70-I335 HydrophobicContact CG-CD1 4.49Å; F70-I335 HydrophobicContact CG-CG1 4.46Å; F70-I335 HydrophobicContact CZ-CD1 3.41Å; F70-I335 VanDerWaalsContact CZ-CD1 3.41Å; F70-I335 HydrophobicContact CZ-CG1 4.08Å; L285-I335 HydrophobicContact CD1-CD1 4.02Å; K317-I335 PolarHBondContact O-N 2.82Å; H319-I335 HydrophobicContact CB-CD1 3.59Å; H319-I335 HydrophobicContact CB-CG1 3.78Å; H319-I335 WeakPolarHBondContact CD2-CD1 3.09Å; H319-I335 VanDerWaalsContact CG-CD1 3.46Å; I335-A337 PolarHBondContact O-N 3Å; I335-Q338 PolarHBondContact O-N 3.2Å
336	G	79.3	Confident	93.1	Very high	40 Å²	40	32.8 Å²	32.8	41%	0.412	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-41.8	-173.7	0	0	0	0	0	113.3
337	A	82.3	Confident	92.2	Very high	42 Å²	42	30.8 Å²	30.8	35%	0.347	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-3.1	179.4	0	0	0	0	0	113.6	E334 I335 Q339	E334-A337 HydrophobicContact CB-CB 4.45Å; I335-A337 PolarHBondContact O-N 3Å; A337-Q339 VanDerWaalsContact C-N 3.26Å; A337-Q339 HydrophobicContact CB-CG 3.83Å; A337-Q339 PolarHBondContact O-N 3.46Å
338	Q	91.3	Very high	90.8	Very high	99 Å²	99	33 Å²	33	46%	0.463	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	41.7	-179.3	-58.3	177.3	32.3	0	0	113.1	F65 E334 I335	F65-Q338 WeakPolarHBondContact CB-O 3.48Å; E334-Q338 WeakPolarHBondContact O-CA 3.15Å; E334-Q338 PolarHBondContact O-N 2.89Å; E334-Q338 VanDerWaalsContact O-N 3.16Å; I335-Q338 PolarHBondContact O-N 3.2Å
339	Q	93.4	Very high	88.9	Confident	51 Å²	51	36 Å²	36	24%	0.238	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	170.2	-177.1	66.5	-178.8	-20	0	0	111.4	F65 V69 E334 A337 Q341	F65-Q339 HydrophobicContact CD2-CB 3.82Å; F65-Q339 HydrophobicContact CE2-CB 4.07Å; V69-Q339 WeakPolarHBondContact CB-O 3.24Å; V69-Q339 WeakPolarHBondContact CG1-O 3.36Å; E334-Q339 WeakPolarHBondContact CB-O 3.36Å; E334-Q339 PolarHBondContact N-O 2.94Å; E334-Q339 PolarHBondContact O-N 3.15Å; E334-Q339 PolarHBondContact OE2-NE2 3.26Å; A337-Q339 VanDerWaalsContact C-N 3.26Å; A337-Q339 HydrophobicContact CB-CG 3.83Å; A337-Q339 PolarHBondContact O-N 3.46Å; Q339-Q341 HydrophobicContact CG-CG 4.37Å; Q339-Q341 VanDerWaalsContact NE2-NE2 3.15Å
340	A	96.7	Very high	86.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	145	161.6	0	0	0	0	0	109.9	W58 P59 F65 V69 V72 V83 V332	W58-A340 HydrophobicContact CH2-CB 3.76Å; W58-A340 HydrophobicContact CZ3-CB 3.65Å; W58-A340 WeakPolarHBondContact CZ3-O 3.42Å; P59-A340 WeakPolarHBondContact CD-O 3.44Å; F65-A340 HydrophobicContact CZ-CB 4.06Å; V69-A340 HydrophobicContact CG1-CB 4.26Å; V72-A340 HydrophobicContact CG1-CB 4.02Å; V83-A340 HydrophobicContact CG1-CB 3.91Å; V83-A340 HydrophobicContact CG2-CB 4.05Å; V332-A340 CarbonylContact O-C 3.47Å; V332-A340 WeakPolarHBondContact O-CA 3.12Å
341	Q	95.9	Very high	83.4	Confident	22 Å²	22	43 Å²	43	10%	0.103	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	155.4	173.8	-65.9	-171.2	17.1	0	0	111.4	L54 Y331 V332 E334 Q339 F343	L54-Q341 HydrophobicContact CD1-CB 4.12Å; L54-Q341 HydrophobicContact CD1-CG 4.38Å; L54-Q341 VanDerWaalsContact CD1-OE1 3.27Å; Y331-Q341 CarbonylContact C-O 3.53Å; Y331-Q341 WeakPolarHBondContact CA-O 3.23Å; V332-Q341 PolarHBondContact N-O 3.18Å; V332-Q341 PolarHBondContact O-N 2.84Å; E334-Q341 VanDerWaalsContact OE1-CG 3.25Å; E334-Q341 WeakPolarHBondContact OE1-CG 3.18Å; E334-Q341 PolarHBondContact OE1-NE2 3.2Å; E334-Q341 PolarHBondContact OE1-OE1 3.34Å; E334-Q341 PolarHBondContact OE2-NE2 2.88Å; Q339-Q341 HydrophobicContact CG-CG 4.37Å; Q339-Q341 VanDerWaalsContact NE2-NE2 3.15Å; Q341-F343 HydrophobicContact CB-CE2 3.79Å; Q341-F343 HydrophobicContact CB-CZ 4.38Å; Q341-F343 VanDerWaalsContact OE1-CZ 3.29Å
342	K	97.7	Very high	80.5	Confident	23 Å²	23	51.7 Å²	51.7	10%	0.1	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	133.9	174.4	178.6	-173.2	175.6	-163.7	0	110.2	D55 W58 T98 L330 Y331 T344	D55-K342 HydrophobicContact CB-CB 4.24Å; D55-K342 HydrophobicContact CB-CD 4.15Å; D55-K342 HydrophobicContact CB-CG 4.2Å; D55-K342 WeakPolarHBondContact CB-O 3.33Å; D55-K342 PolarHBondContact N-O 3.25Å; D55-K342 WeakPolarHBondContact OD2-CD 3.37Å; D55-K342 IonicContact OD2-NZ 3.08Å; D55-K342 PolarHBondContact OD2-NZ 3.07Å; D55-K342 VanDerWaalsContact OD2-NZ 3.08Å; W58-K342 HydrophobicContact CB-CB 3.88Å; W58-K342 HydrophobicContact CB-CD 3.8Å; W58-K342 HydrophobicContact CD2-CB 3.7Å; W58-K342 HydrophobicContact CD2-CD 4.23Å; W58-K342 HydrophobicContact CE3-CB 3.52Å; W58-K342 HydrophobicContact CG-CB 3.83Å; W58-K342 HydrophobicContact CG-CD 3.69Å; W58-K342 HydrophobicContact CG-CG 4.44Å; W58-K342 HydrophobicContact CZ3-CB 4.32Å; T98-K342 PolarHBondContact O-NZ 3.22Å; L330-K342 CarbonylContact O-C 3.46Å; L330-K342 WeakPolarHBondContact O-CA 3.05Å; Y331-K342 HydrophobicContact CD1-CB 3.97Å; Y331-K342 HydrophobicContact CD1-CG 4.15Å; Y331-K342 HydrophobicContact CE1-CB 3.77Å; Y331-K342 HydrophobicContact CE1-CD 3.7Å; Y331-K342 HydrophobicContact CE1-CG 3.62Å; Y331-K342 WeakPolarHBondContact OH-CE 3.02Å; K342-T344 HydrophobicContact CG-CG2 4.48Å
343	F	97.3	Very high	77.5	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.018	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.7	172.8	-61.2	-98.8	0	0	0	109.5	Y52 K53 L54 I290 I310 L312 A329 L330 V332 Q341	Y52-F343 HydrophobicContact CD1-CB 3.96Å; K53-F343 CarbonylContact O-C 3.51Å; K53-F343 VanDerWaalsContact O-CA 3.23Å; K53-F343 WeakPolarHBondContact O-CA 3.42Å; L54-F343 HydrophobicContact CB-CD1 4.11Å; L54-F343 HydrophobicContact CB-CE1 3.85Å; L54-F343 HydrophobicContact CD1-CD1 4.4Å; L54-F343 HydrophobicContact CD1-CE1 3.92Å; L54-F343 HydrophobicContact CD1-CE2 4.29Å; L54-F343 HydrophobicContact CD1-CZ 3.85Å; L54-F343 HydrophobicContact CG-CE1 4.44Å; I290-F343 HydrophobicContact CD1-CD2 4.47Å; I290-F343 HydrophobicContact CD1-CE2 4.21Å; I310-F343 HydrophobicContact CG2-CD1 3.67Å; I310-F343 HydrophobicContact CG2-CE1 3.69Å; L312-F343 HydrophobicContact CD2-CE1 3.94Å; L312-F343 HydrophobicContact CD2-CE2 4.18Å; L312-F343 HydrophobicContact CD2-CZ 3.39Å; A329-F343 CarbonylContact C-O 3.46Å; A329-F343 VanDerWaalsContact CA-O 3.32Å; A329-F343 WeakPolarHBondContact CA-O 3.28Å; L330-F343 HydrophobicContact CB-CB 4.25Å; L330-F343 PolarHBondContact N-O 2.89Å; L330-F343 PolarHBondContact O-N 2.86Å; V332-F343 HydrophobicContact CB-CE2 4.36Å; V332-F343 HydrophobicContact CG2-CD2 3.77Å; V332-F343 HydrophobicContact CG2-CE2 3.74Å; Q341-F343 HydrophobicContact CB-CE2 3.79Å; Q341-F343 HydrophobicContact CB-CZ 4.38Å; Q341-F343 VanDerWaalsContact OE1-CZ 3.29Å
344	T	95.4	Very high	76.5	Confident	26 Å²	26	65.6 Å²	65.6	16%	0.16	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	138.2	-178.9	51.8	0	0	0	0	110.6	Y52 K53 D55 A329 K342	Y52-T344 VanDerWaalsContact CA-O 3.32Å; Y52-T344 WeakPolarHBondContact CA-O 3.21Å; K53-T344 WeakPolarHBondContact CE-OG1 3.3Å; K53-T344 WeakPolarHBondContact CG-OG1 3.46Å; K53-T344 PolarHBondContact N-O 3.02Å; K53-T344 PolarHBondContact O-N 3.32Å; D55-T344 HydrophobicContact CB-CG2 4.38Å; A329-T344 HydrophobicContact CB-CG2 4.45Å; K342-T344 HydrophobicContact CG-CG2 4.48Å
345	P	92.1	Very high	75.7	Confident	59 Å²	59	69 Å²	69	38%	0.383	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	143.8	174.5	26.8	-32.4	0	0	0	109.8	L51 Y52 A327	L51-P345 CarbonylContact O-C 3.56Å; L51-P345 VanDerWaalsContact O-CA 3.29Å; L51-P345 WeakPolarHBondContact O-CA 3.44Å; Y52-P345 HydrophobicContact CE1-CB 4.32Å; A327-P345 VanDerWaalsContact O-CG 3.25Å; A327-P345 WeakPolarHBondContact O-CG 3.23Å
346	F	84.8	Confident	74.9	Confident	80 Å²	80	71.3 Å²	71.3	35%	0.351	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	154.9	172.7	75.2	-84	0	0	0	111.1	L51 Y52 K53 L348	L51-F346 HydrophobicContact CB-CD1 3.94Å; L51-F346 HydrophobicContact CB-CD2 4.44Å; L51-F346 HydrophobicContact CB-CE1 3.57Å; L51-F346 HydrophobicContact CB-CE2 4.11Å; L51-F346 HydrophobicContact CB-CG 4.37Å; L51-F346 HydrophobicContact CB-CZ 3.66Å; L51-F346 HydrophobicContact CD1-CE2 3.99Å; L51-F346 HydrophobicContact CD1-CZ 4.09Å; L51-F346 HydrophobicContact CG-CZ 4.41Å; L51-F346 PolarHBondContact O-N 3.17Å; Y52-F346 WeakPolarHBondContact O-CE1 3.4Å; K53-F346 HydrophobicContact CB-CD1 3.82Å; K53-F346 HydrophobicContact CB-CE1 3.96Å; K53-F346 HydrophobicContact CD-CD1 4.49Å; K53-F346 HydrophobicContact CG-CD1 4.02Å; F346-L348 HydrophobicContact CD2-CG 4.49Å; F346-L348 HydrophobicContact CE2-CD2 4.04Å; F346-L348 HydrophobicContact CE2-CG 3.93Å
347	S	74.2	Confident	74.7	Confident	96 Å²	96	73.1 Å²	73.1	67%	0.671	44%	0.444	S	S	*	.			trans	-115.1	132.8	175	57	0	0	0	0	110.3	G349	S347-G349 PolarHBondContact O-N 3.41Å
348	L	64.3	Low	74.2	Confident	108 Å²	108	75.1 Å²	75.1	57%	0.565	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	89.9	167.4	-70	166.4	0	0	0	107.2	L46 L51 F346	L46-L348 HydrophobicContact CB-CD1 4.3Å; L46-L348 HydrophobicContact CD1-CD1 3.46Å; L46-L348 VanDerWaalsContact CD1-CD1 3.46Å; L46-L348 HydrophobicContact CG-CD1 4.5Å; L51-L348 HydrophobicContact CD1-CD1 3.57Å; L51-L348 HydrophobicContact CD1-CG 3.9Å; F346-L348 HydrophobicContact CD2-CG 4.49Å; F346-L348 HydrophobicContact CE2-CD2 4.04Å; F346-L348 HydrophobicContact CE2-CG 3.93Å
349	G	53.4	Low	73.1	Confident	73 Å²	73	73.5 Å²	73.5	75%	0.753	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	150.7	1.8	176.7	0	0	0	0	0	117.6	S347 S351	S347-G349 PolarHBondContact O-N 3.41Å; G349-S351 PolarHBondContact O-N 3.22Å
350	G	43.7	Very low	71.6	Confident	61 Å²	61	75.1 Å²	75.1	63%	0.629	47%	0.465	S	S	*	.			trans	-68.4	113.8	166.3	0	0	0	0	0	109.3	L352	G350-L352 PolarHBondContact O-N 3.48Å
351	S	35.7	Very low	69.7	Low	91 Å²	91	80.8 Å²	80.8	64%	0.636	50%	0.5	S	S	*	.			trans	-58.3	130.1	179.4	65.7	0	0	0	0	110.3	G349 L353	G349-S351 PolarHBondContact O-N 3.22Å; S351-L353 VanDerWaalsContact C-N 3.32Å; S351-L353 PolarHBondContact O-N 3.37Å
352	L	36.9	Very low	67.5	Low	182 Å²	182	85.8 Å²	85.8	95%	0.953	53%	0.533	S	S	*	.			trans	-60.1	103.2	146.9	-86.5	132.2	0	0	0	106.6	G350	G350-L352 PolarHBondContact O-N 3.48Å
353	L	34.6	Very low	64.8	Low	226 Å²	226	91.5 Å²	91.5	100%	1.183	57%	0.573	S	S	*	*			trans	-122.1	0	157.2	-79.1	176.2	0	0	0	107.9	S351	S351-L353 VanDerWaalsContact C-N 3.32Å; S351-L353 PolarHBondContact O-N 3.37Å

Retrieved 353 of 353 residues in 645.7 ms (Link to these results)

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