A0A087X1V8_HUMAN Loading...

Ovochymase 2

AlphaFold DB , UniProt , Accession A0A087X1V8, Species HUMAN (Homo sapiens, Human), Gene OVCH2, Length 565 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.5	Very low	31.5	Very low	237 Å²	237	165.3 Å²	165.3	100%	1.167	83%	0.826	S	S	*	*				0	113.4	0	-116	167.3	167.3	0	0	107.5
2	L	33.7	Very low	32.2	Very low	162 Å²	162	165.4 Å²	165.4	85%	0.848	83%	0.83	S	S	*	*			trans	36.6	103.9	172.3	-73.4	87.4	0	0	0	118
3	I	28.3	Very low	32.3	Very low	159 Å²	159	157.8 Å²	157.8	82%	0.815	82%	0.819	S	S	*	*				67.2	109.1	50.5	-56.8	-179.4	0	0	0	115.6
4	S	30.2	Very low	32.6	Very low	94 Å²	94	157.9 Å²	157.9	66%	0.657	82%	0.819	S	S	*	*			trans	77.4	149.5	135.8	175.1	0	0	0	0	119.6
5	R	33.6	Very low	32.4	Very low	223 Å²	223	155.6 Å²	155.6	84%	0.842	81%	0.814	S	S	*	*			cis	-167.4	150.9	-9.7	-103.7	160.9	95.1	177.4	5.4	106.8
6	N	31.4	Very low	32	Very low	148 Å²	148	157.5 Å²	157.5	79%	0.791	81%	0.814	S	S	*	*			trans	-11.5	135.3	145.5	-62.6	-14.7	0	0	0	117.7
7	K	30.6	Very low	31.6	Very low	203 Å²	203	159.8 Å²	159.8	88%	0.883	82%	0.817	S	S	*	*			trans	-122.1	114.2	138.1	-83.5	-172.8	176.4	-179.4	0	109.5
8	L	28.5	Very low	31.3	Very low	151 Å²	151	161.4 Å²	161.4	79%	0.791	82%	0.821	S	S	*	*			trans	-80.8	121.8	165.3	-165.7	84.3	0	0	0	106.9
9	I	32.9	Very low	31.2	Very low	152 Å²	152	165.1 Å²	165.1	78%	0.779	82%	0.823	S	S	*	*			trans	-121.8	116.1	160.1	-66	178.5	0	0	0	106
10	L	31.4	Very low	31	Very low	144 Å²	144	160.6 Å²	160.6	75%	0.754	82%	0.821	S	S	*	*			trans	-104.3	113.2	177.4	-149.3	135.3	0	0	0	106.2
11	L	32.5	Very low	30.9	Very low	145 Å²	145	162.5 Å²	162.5	76%	0.759	82%	0.823	S	S	*	*			trans	-153.5	101.8	164.5	-100.3	166.6	0	0	0	109.5
12	L	40.1	Very low	30.5	Very low	167 Å²	167	156.2 Å²	156.2	87%	0.874	80%	0.803	S	S	*	*			trans	39.6	107	144.5	-66.2	162.6	0	0	0	118.7
13	G	33.2	Very low	30.2	Very low	67 Å²	67	153.2 Å²	153.2	69%	0.691	80%	0.801	S	S	*	*			trans	153.4	100.9	158	0	0	0	0	0	114.3
14	I	36.2	Very low	30.1	Very low	158 Å²	158	151.6 Å²	151.6	81%	0.81	80%	0.799	S	S	*	*			trans	34.3	97	153	-50.5	175.1	0	0	0	116	F16	I14-F16 HydrophobicContact CG2-CD2 4.31Å; I14-F16 HydrophobicContact CG2-CE2 4.37Å
15	V	29.6	Very low	29.9	Very low	124 Å²	124	155.3 Å²	155.3	75%	0.752	81%	0.811	S	S	*	*			trans	-95.5	113.5	165.2	177	0	0	0	0	108.9	F17	V15-F17 PolarHBondContact O-N 3.04Å
16	F	26.4	Very low	29.5	Very low	186 Å²	186	149.7 Å²	149.7	82%	0.816	81%	0.805	S	S	*	*			trans	-65.2	120	161.4	-90.4	-97.3	0	0	0	108.9	I14 E18	I14-F16 HydrophobicContact CG2-CD2 4.31Å; I14-F16 HydrophobicContact CG2-CE2 4.37Å; F16-E18 PolarHBondContact O-N 2.98Å
17	F	25.6	Very low	29.3	Very low	197 Å²	197	150.2 Å²	150.2	86%	0.864	81%	0.807	S	S	*	*			trans	-81.4	93.8	167.4	-111.5	-88.8	0	0	0	108.6	V15 R19	V15-F17 PolarHBondContact O-N 3.04Å; F17-R19 PolarHBondContact O-N 2.98Å
18	E	25.9	Very low	29.1	Very low	188 Å²	188	146.4 Å²	146.4	88%	0.879	80%	0.804	S	S	*	*			trans	-81.1	107.5	157.5	-89.3	-165.4	156.8	0	0	108.9	F16 G20	F16-E18 PolarHBondContact O-N 2.98Å; E18-G20 PolarHBondContact O-N 3.39Å
19	R	28.8	Very low	29.2	Very low	231 Å²	231	148.8 Å²	148.8	87%	0.872	81%	0.808	S	S	*	*			trans	-67.2	109	174.7	-166.3	173.6	-171.5	169.4	1.5	108.5	F17 K21	F17-R19 PolarHBondContact O-N 2.98Å; R19-K21 PolarHBondContact O-N 3.19Å; R19-K21 VanDerWaalsContact O-N 3.08Å
20	G	27.7	Very low	29.3	Very low	75 Å²	75	144.8 Å²	144.8	77%	0.773	80%	0.797	S	S	*	*			trans	-50.3	114.9	171.5	0	0	0	0	0	110.7	E18 S22	E18-G20 PolarHBondContact O-N 3.39Å; G20-S22 PolarHBondContact O-N 2.99Å
21	K	28.3	Very low	30.1	Very low	201 Å²	201	140.9 Å²	140.9	87%	0.874	78%	0.78	S	S	*	*			trans	-76.9	117.7	173.3	-77.2	-178.2	178.4	175.9	0	108.5	R19 A23	R19-K21 PolarHBondContact O-N 3.19Å; R19-K21 VanDerWaalsContact O-N 3.08Å; K21-A23 PolarHBondContact O-N 3.2Å
22	S	25.7	Very low	31.6	Very low	106 Å²	106	135.1 Å²	135.1	74%	0.741	75%	0.752	S	S	*	*			trans	-45.7	119.4	160.7	-176	0	0	0	0	109.4	G20 T24	G20-S22 PolarHBondContact O-N 2.99Å; S22-T24 VanDerWaalsContact C-N 3.3Å; S22-T24 PolarHBondContact O-N 3.35Å
23	A	27	Very low	33.5	Very low	98 Å²	98	129.4 Å²	129.4	81%	0.81	73%	0.725	S	S	*	*			trans	-70.7	90.1	172.7	0	0	0	0	0	108.3	K21 L25	K21-A23 PolarHBondContact O-N 3.2Å; A23-L25 PolarHBondContact O-N 3.4Å; A23-L25 VanDerWaalsContact O-N 3.1Å
24	T	25.6	Very low	35.7	Very low	125 Å²	125	126.3 Å²	126.3	77%	0.767	69%	0.694	S	S	*	*			trans	-59.7	110.1	159.9	33	0	0	0	0	107.8	S22 S26	S22-T24 VanDerWaalsContact C-N 3.3Å; S22-T24 PolarHBondContact O-N 3.35Å; T24-S26 PolarHBondContact O-N 3.34Å
25	L	27.6	Very low	37.8	Very low	173 Å²	173	123.8 Å²	123.8	91%	0.906	68%	0.678	S	S	*	*			trans	-56	99.8	169.6	-166.1	80.9	0	0	0	108	A23 L27	A23-L25 PolarHBondContact O-N 3.4Å; A23-L25 VanDerWaalsContact O-N 3.1Å; L25-L27 PolarHBondContact O-N 2.03Å
26	S	24.8	Very low	39.9	Very low	104 Å²	104	119.2 Å²	119.2	73%	0.727	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-69.9	123.9	177.8	56.2	0	0	0	0	109.4	T24	T24-S26 PolarHBondContact O-N 3.34Å
27	L	26.3	Very low	41.9	Very low	159 Å²	159	115.9 Å²	115.9	83%	0.832	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-51.8	141.3	164.8	-90.8	98.2	0	0	0	110.2	L25 K29	L25-L27 PolarHBondContact O-N 2.03Å; L27-K29 PolarHBondContact O-N 3.42Å
28	P	27.3	Very low	44	Very low	124 Å²	124	107.2 Å²	107.2	81%	0.805	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-60.3	133.3	178.9	-18.3	29.7	0	0	0	111.4
29	K	31.3	Very low	45.1	Very low	201 Å²	201	107.7 Å²	107.7	87%	0.874	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-56.8	141.5	167.2	-71.7	174.2	178	173.6	0	109.2	L27	L27-K29 PolarHBondContact O-N 3.42Å
30	A	35	Very low	46	Very low	67 Å²	67	99.7 Å²	99.7	55%	0.554	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-50.4	130.3	173.5	0	0	0	0	0	110.4	S32	A30-S32 PolarHBondContact O-N 2.84Å
31	P	46.7	Very low	46.7	Very low	63 Å²	63	104.1 Å²	104.1	41%	0.409	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-73.7	131.5	-173.7	23.3	-25.6	0	0	0	110.5	F154	P31-F154 HydrophobicContact CB-CB 4.48Å; P31-F154 HydrophobicContact CG-CB 3.3Å; P31-F154 HydrophobicContact CG-CD2 3.74Å; P31-F154 HydrophobicContact CG-CG 3.97Å
32	S	65.7	Low	46.9	Very low	24 Å²	24	99.9 Å²	99.9	17%	0.168	58%	0.575	C	S	.	*	P	Polyproline II helix	trans	-80.6	145.9	174.3	54.7	0	0	0	0	111.7	A30 Q35 R304	A30-S32 PolarHBondContact O-N 2.84Å; S32-Q35 PolarHBondContact OG-NE2 2.81Å; S32-Q35 PolarHBondContact OG-OE1 2.77Å; S32-R304 VanDerWaalsContact CB-NH2 3.26Å; S32-R304 PolarHBondContact OG-NH2 2.81Å
33	C	79.3	Confident	47.5	Very low	46 Å²	46	101.2 Å²	101.2	31%	0.311	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.5	156.6	179.5	69	0	0	0	0	113.5	Q35 P160 C162	C33-Q35 PolarHBondContact O-N 2.5Å; C33-P160 CarbonylContact C-O 3.51Å; C33-P160 VanDerWaalsContact CA-O 3.28Å; C33-P160 WeakPolarHBondContact CA-O 3.25Å; C33-P160 HydrophobicContact CB-CB 4.42Å; C33-P160 HydrophobicContact CB-CG 4.14Å; C33-C162 HydrophobicContact CB-CB 4.01Å; C33-C162 WeakPolarHBondContact CB-SG 3.48Å; C33-C162 PolarHBondContact O-SG 2.82Å; C33-C162 WeakPolarHBondContact SG-CA 3.47Å; C33-C162 WeakPolarHBondContact SG-CB 3.4Å; C33-C162 CovalentContact SG-SG 2.05Å; C33-C162 PolarHBondContact SG-SG 3.01Å
34	G	78.8	Confident	47.8	Very low	2 Å²	2	101.3 Å²	101.3	2%	0.021	55%	0.55	C	S	.	*	T	Hydrogen-bonded Turn	trans	67.1	18	170.5	0	0	0	0	0	114.4	P160 W253	G34-P160 PolarHBondContact N-O 2.9Å; G34-W253 WeakPolarHBondContact CA-O 3.46Å; G34-W253 PolarHBondContact O-N 2.78Å
35	Q	79.6	Confident	48.2	Very low	105 Å²	105	103.9 Å²	103.9	49%	0.491	55%	0.547	S	S	.	.			trans	-110.2	130.8	176.5	-67	-167.8	-23.3	0	0	110.8	S32 C33 R304	S32-Q35 PolarHBondContact OG-NE2 2.81Å; S32-Q35 PolarHBondContact OG-OE1 2.77Å; C33-Q35 PolarHBondContact O-N 2.5Å; Q35-R304 VanDerWaalsContact NE2-NH2 3.12Å
36	S	74.7	Confident	48.4	Very low	28 Å²	28	103.7 Å²	103.7	20%	0.196	54%	0.54	C	S	.	.			trans	-106.1	136.9	166	178.8	0	0	0	0	109.1	V38 G61 S62	S36-V38 VanDerWaalsContact C-N 3.27Å; S36-V38 PolarHBondContact OG-N 3.02Å; S36-G61 PolarHBondContact OG-O 2.79Å; S36-S62 WeakPolarHBondContact CB-O 3.2Å; S36-S62 PolarHBondContact OG-O 2.78Å
37	L	67.4	Low	49	Very low	116 Å²	116	103.8 Å²	103.8	61%	0.607	53%	0.532	S	S	*	.	S	Bend	trans	-80.7	-12.5	175.1	-63.7	-178.7	0	0	0	112.2
38	V	69.4	Low	49.7	Very low	15 Å²	15	99.1 Å²	99.1	9%	0.091	51%	0.507	C	S	.	.	S	Bend	trans	-80.9	116.1	171.9	-176.6	0	0	0	0	107.9	S36 V40 E59	S36-V38 VanDerWaalsContact C-N 3.27Å; S36-V38 PolarHBondContact OG-N 3.02Å; V38-V40 PolarHBondContact O-N 3.17Å; V38-E59 HydrophobicContact CG1-CB 4.15Å; V38-E59 HydrophobicContact CG1-CG 4.1Å; V38-E59 WeakPolarHBondContact CG1-OE2 3.2Å
39	K	49.1	Very low	50	Low	198 Å²	198	101.6 Å²	101.6	86%	0.861	51%	0.505	S	S	*	.			trans	-68.5	102.4	176.6	-78.1	-172.8	178.7	179.5	0	109.1	Q41	K39-Q41 PolarHBondContact O-N 2.97Å
40	V	49.7	Very low	50	Low	64 Å²	64	94.4 Å²	94.4	39%	0.388	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-58.8	127.3	166.8	-169.9	0	0	0	0	108.2	V38	V38-V40 PolarHBondContact O-N 3.17Å
41	Q	40.8	Very low	49.7	Very low	167 Å²	167	102.5 Å²	102.5	78%	0.78	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-50.5	143.7	173.9	-72.5	-96.1	-7.2	0	0	110.3	K39 W43	K39-Q41 PolarHBondContact O-N 2.97Å; Q41-W43 PolarHBondContact O-N 3.49Å
42	P	34.1	Very low	49.1	Very low	112 Å²	112	104.5 Å²	104.5	73%	0.727	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-54.1	140.4	179.2	-21.9	31	0	0	0	111.9	N44	P42-N44 PolarHBondContact O-N 3.36Å; P42-N44 VanDerWaalsContact O-N 3.12Å
43	W	36.9	Very low	47.9	Very low	134 Å²	134	109.1 Å²	109.1	51%	0.508	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-48.9	116.4	175.7	-85.2	60.9	0	0	0	111.1	Q41 I175	Q41-W43 PolarHBondContact O-N 3.49Å; W43-I175 HydrophobicContact CH2-CB 4.07Å; W43-I175 HydrophobicContact CH2-CG2 4.05Å
44	N	32.9	Very low	46.8	Very low	100 Å²	100	107.9 Å²	107.9	54%	0.535	52%	0.521	S	S	.	.			trans	-101.1	103.8	169.6	-149.5	-8.3	0	0	0	107.8	P42 F46 N47	P42-N44 PolarHBondContact O-N 3.36Å; P42-N44 VanDerWaalsContact O-N 3.12Å; N44-F46 PolarHBondContact O-N 2.83Å; N44-N47 PolarHBondContact O-N 2.75Å
45	Y	34.1	Very low	46.2	Very low	180 Å²	180	108.6 Å²	108.6	71%	0.706	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-53	-18.6	-179.6	-119.1	-95.8	0	0	0	113	I48	Y45-I48 HydrophobicContact CD1-CD1 4.14Å; Y45-I48 HydrophobicContact CE1-CD1 4.4Å
46	F	33.4	Very low	46.3	Very low	169 Å²	169	106.1 Å²	106.1	74%	0.741	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-76.9	-16.2	177.8	-70.4	-79.7	0	0	0	115.4	N44 I48	N44-F46 PolarHBondContact O-N 2.83Å; F46-I48 VanDerWaalsContact C-N 3.28Å; F46-I48 PolarHBondContact O-N 2.76Å
47	N	36.4	Very low	46.8	Very low	105 Å²	105	110.6 Å²	110.6	56%	0.561	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-81.4	-2.5	177.2	-84.4	-17.4	0	0	0	113.9	N44 F49 S50	N44-N47 PolarHBondContact O-N 2.75Å; N47-F49 PolarHBondContact O-N 2.59Å; N47-S50 PolarHBondContact O-OG 3.16Å
48	I	41.7	Very low	47.7	Very low	62 Å²	62	105.4 Å²	105.4	32%	0.318	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-68.6	-26	174.1	-62.2	171.5	0	0	0	111	Y45 F46 R233	Y45-I48 HydrophobicContact CD1-CD1 4.14Å; Y45-I48 HydrophobicContact CE1-CD1 4.4Å; F46-I48 VanDerWaalsContact C-N 3.28Å; F46-I48 PolarHBondContact O-N 2.76Å; I48-R233 PolarHBondContact O-NH1 3.21Å; I48-R233 PolarHBondContact O-NH2 3.08Å; I48-R233 VanDerWaalsContact O-NH2 3.14Å
49	F	33.9	Very low	48.6	Very low	175 Å²	175	110.9 Å²	110.9	77%	0.768	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-101	-0.6	-176.4	-60.2	-76.7	0	0	0	114.7	N47	N47-F49 PolarHBondContact O-N 2.59Å
50	S	29.7	Very low	50.4	Low	50 Å²	50	103.5 Å²	103.5	35%	0.35	51%	0.505	S	S	.	.	S	Bend	trans	-82.8	123.3	173.8	64	0	0	0	0	110.2	N47 I52	N47-S50 PolarHBondContact O-OG 3.16Å; S50-I52 VanDerWaalsContact C-N 3.26Å; S50-I52 PolarHBondContact O-N 2.75Å
51	R	29.9	Very low	52.1	Low	237 Å²	237	101 Å²	101	89%	0.894	49%	0.492	S	S	*	.			trans	-79.4	65.1	-172.6	-160.2	-177.9	-170.4	-176.7	3.1	110.7
52	I	33.6	Very low	54.4	Low	105 Å²	105	93.5 Å²	93.5	54%	0.538	46%	0.458	S	S	.	.			trans	-91.8	109.8	169.7	-52.7	-73.5	0	0	0	107.7	S50	S50-I52 VanDerWaalsContact C-N 3.26Å; S50-I52 PolarHBondContact O-N 2.75Å
53	L	40.7	Very low	57.2	Low	121 Å²	121	88.7 Å²	88.7	63%	0.634	43%	0.426	S	S	*	.			trans	-77.4	134	169.9	-65.2	169.6	0	0	0	108.4	G232	L53-G232 VanDerWaalsContact CD2-O 3.31Å; L53-G232 WeakPolarHBondContact CD2-O 3.41Å
54	G	56.8	Low	59.8	Low	21 Å²	21	82.6 Å²	82.6	22%	0.216	40%	0.403	C	S	.	.	S	Bend	trans	90.2	17.7	165.3	0	0	0	0	0	117.6	L184	G54-L184 WeakPolarHBondContact CA-O 3.38Å; G54-L184 WeakPolarHBondContact O-CD2 3.47Å
55	G	64.8	Low	62.7	Low	16 Å²	16	77.9 Å²	77.9	17%	0.165	38%	0.378	C	S	.	.			trans	88.7	169.1	175.5	0	0	0	0	0	114.1	E196	G55-E196 CarbonylContact C-O 3.45Å; G55-E196 WeakPolarHBondContact CA-O 3.06Å
56	S	83.1	Confident	65.7	Low	53 Å²	53	69.5 Å²	69.5	37%	0.371	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	139	177.3	49.3	0	0	0	0	110.9	V58 Q195 E196	S56-V58 PolarHBondContact O-N 3.34Å; S56-Q195 CarbonylContact O-C 3.56Å; S56-Q195 WeakPolarHBondContact O-CA 2.91Å; S56-Q195 PolarHBondContact O-OE1 2.77Å; S56-E196 PolarHBondContact N-O 2.83Å; S56-E196 PolarHBondContact O-N 2.87Å; S56-E196 WeakPolarHBondContact OG-CG 3.23Å
57	Q	85	Confident	68.7	Low	122 Å²	122	61.4 Å²	61.4	57%	0.57	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.8	131.8	178	-176.8	176.6	-11.8	0	0	109.7	Y110 V193	Q57-Y110 PolarHBondContact NE2-OH 2.87Å; Q57-V193 HydrophobicContact CG-CB 4.43Å; Q57-V193 HydrophobicContact CG-CG1 3.72Å
58	V	86.4	Confident	71.6	Confident	7 Å²	7	56.4 Å²	56.4	4%	0.042	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-92.2	160.1	-178.7	-50.4	0	0	0	0	110.1	S56 Y63 Y110 L194 E196	S56-V58 PolarHBondContact O-N 3.34Å; V58-Y63 HydrophobicContact CB-CE2 4.3Å; V58-Y63 HydrophobicContact CG1-CD2 4.17Å; V58-Y63 HydrophobicContact CG1-CE2 3.71Å; V58-Y63 HydrophobicContact CG2-CD2 4.5Å; V58-Y110 HydrophobicContact CG2-CD2 4.44Å; V58-Y110 HydrophobicContact CG2-CE2 4.15Å; V58-Y110 WeakPolarHBondContact O-CE2 3.33Å; V58-Y110 PolarHBondContact O-OH 3.33Å; V58-L194 HydrophobicContact CG2-CB 3.84Å; V58-L194 HydrophobicContact CG2-CD2 3.76Å; V58-L194 HydrophobicContact CG2-CG 3.71Å; V58-L194 PolarHBondContact N-O 2.88Å; V58-E196 HydrophobicContact CG1-CB 3.59Å; V58-E196 HydrophobicContact CG1-CG 3.68Å; V58-E196 WeakPolarHBondContact CG1-OE2 3.29Å
59	E	87.9	Confident	74.2	Confident	130 Å²	130	53.5 Å²	53.5	61%	0.607	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-73.3	145.4	164.8	-170.6	174.2	176	0	0	110.3	V38 G61 S62	V38-E59 HydrophobicContact CG1-CB 4.15Å; V38-E59 HydrophobicContact CG1-CG 4.1Å; V38-E59 WeakPolarHBondContact CG1-OE2 3.2Å; E59-G61 PolarHBondContact O-N 3.48Å; E59-S62 VanDerWaalsContact O-CB 3.3Å; E59-S62 WeakPolarHBondContact O-CB 3.48Å; E59-S62 PolarHBondContact O-N 3.07Å; E59-S62 PolarHBondContact O-OG 2.98Å
60	K	86.9	Confident	77	Confident	43 Å²	43	46 Å²	46	19%	0.187	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	126.1	177.4	-179.8	172.4	178.6	176.4	0	110.3	Y110 D116 P117 F157	K60-Y110 HydrophobicContact CB-CD1 4.05Å; K60-Y110 HydrophobicContact CB-CD2 3.99Å; K60-Y110 HydrophobicContact CB-CE1 4.3Å; K60-Y110 HydrophobicContact CB-CE2 4.27Å; K60-Y110 HydrophobicContact CB-CG 3.86Å; K60-Y110 HydrophobicContact CD-CD1 4.25Å; K60-Y110 HydrophobicContact CD-CG 4.31Å; K60-Y110 HydrophobicContact CG-CD1 4.3Å; K60-Y110 HydrophobicContact CG-CD2 4.42Å; K60-Y110 HydrophobicContact CG-CG 3.96Å; K60-D116 VanDerWaalsContact NZ-CB 3.31Å; K60-D116 IonicContact NZ-OD1 3.68Å; K60-D116 PolarHBondContact NZ-OD1 3.14Å; K60-P117 PolarHBondContact NZ-O 3.49Å; K60-P117 VanDerWaalsContact NZ-O 3.1Å; K60-F157 HydrophobicContact CD-CE1 4.49Å; K60-F157 HydrophobicContact CG-CD1 4.1Å; K60-F157 HydrophobicContact CG-CE1 4.12Å
61	G	84.8	Confident	79.8	Confident	11 Å²	11	46.4 Å²	46.4	11%	0.113	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	2.1	-177	0	0	0	0	0	115.1	S36 E59 Y63 P64	S36-G61 PolarHBondContact OG-O 2.79Å; E59-G61 PolarHBondContact O-N 3.48Å; G61-Y63 PolarHBondContact O-N 3.29Å; G61-P64 WeakPolarHBondContact O-CD 3.46Å; G61-P64 WeakPolarHBondContact O-CG 3.13Å
62	S	89.3	Confident	82.5	Confident	10 Å²	10	45 Å²	45	7%	0.07	23%	0.226	C	C	.	.	S	Bend	trans	-57	-35.8	173.3	-73.6	0	0	0	0	112.8	S36 E59	S36-S62 WeakPolarHBondContact CB-O 3.2Å; S36-S62 PolarHBondContact OG-O 2.78Å; E59-S62 VanDerWaalsContact O-CB 3.3Å; E59-S62 WeakPolarHBondContact O-CB 3.48Å; E59-S62 PolarHBondContact O-N 3.07Å; E59-S62 PolarHBondContact O-OG 2.98Å
63	Y	93.4	Very high	84.9	Confident	12 Å²	12	46.2 Å²	46.2	5%	0.047	23%	0.23	C	C	.	.			trans	-127.8	76	-178.3	-57.6	-61.6	0	0	0	112.4	V58 G61 W65 Q66 A179 L194 E196 M245 W253	V58-Y63 HydrophobicContact CB-CE2 4.3Å; V58-Y63 HydrophobicContact CG1-CD2 4.17Å; V58-Y63 HydrophobicContact CG1-CE2 3.71Å; V58-Y63 HydrophobicContact CG2-CD2 4.5Å; G61-Y63 PolarHBondContact O-N 3.29Å; Y63-W65 AromaticContact CD1-CZ2 3.76Å; Y63-W65 HydrophobicContact CD1-CZ2 3.76Å; Y63-W65 PolarHBondContact O-N 3.24Å; Y63-Q66 WeakPolarHBondContact O-CB 3.07Å; Y63-Q66 PolarHBondContact O-N 3.19Å; Y63-A179 HydrophobicContact CD2-CB 3.75Å; Y63-A179 HydrophobicContact CE2-CB 4.09Å; Y63-A179 HydrophobicContact CG-CB 4.28Å; Y63-L194 HydrophobicContact CD2-CD2 4.47Å; Y63-E196 HydrophobicContact CE2-CB 3.94Å; Y63-E196 WeakPolarHBondContact CE2-OE2 3.33Å; Y63-E196 VanDerWaalsContact CZ-OE2 3.23Å; Y63-E196 PolarHBondContact OH-OE2 3.35Å; Y63-M245 HydrophobicContact CD1-CE 3.31Å; Y63-M245 HydrophobicContact CD1-SD 3.31Å; Y63-M245 WeakPolarHBondContact CD1-SD 3.43Å; Y63-M245 HydrophobicContact CD2-CE 4.28Å; Y63-M245 HydrophobicContact CE1-CE 3.51Å; Y63-M245 HydrophobicContact CE1-SD 3.31Å; Y63-M245 WeakPolarHBondContact CE1-SD 3.22Å; Y63-M245 HydrophobicContact CE2-CE 4.45Å; Y63-M245 HydrophobicContact CG-CE 3.72Å; Y63-M245 HydrophobicContact CG-SD 4.29Å; Y63-W253 HydrophobicContact CE1-CZ2 4.24Å
64	P	90.1	Very high	87.2	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.032	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-17	-173.2	-24.1	34.8	0	0	0	115.7	G61 F157 V158 G159	G61-P64 WeakPolarHBondContact O-CD 3.46Å; G61-P64 WeakPolarHBondContact O-CG 3.13Å; P64-F157 WeakPolarHBondContact CA-O 3.29Å; P64-V158 WeakPolarHBondContact O-CA 2.96Å; P64-G159 CarbonylContact C-O 3.57Å; P64-G159 PolarHBondContact O-N 2.8Å
65	W	95	Very high	88.9	Confident	1 Å²	1	48 Å²	48	0%	0.004	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-12.3	178.9	45.9	80.1	0	0	0	113.9	Y63 V67 S80 I81 G159 I161 M245 W253	Y63-W65 AromaticContact CD1-CZ2 3.76Å; Y63-W65 HydrophobicContact CD1-CZ2 3.76Å; Y63-W65 PolarHBondContact O-N 3.24Å; W65-V67 PolarHBondContact O-N 3.01Å; W65-S80 CarbonylContact O-C 3.59Å; W65-S80 WeakPolarHBondContact O-CA 3.19Å; W65-I81 HydrophobicContact CB-CB 4.39Å; W65-I81 PolarHBondContact O-N 2.84Å; W65-G159 WeakPolarHBondContact CA-O 3.02Å; W65-G159 VanDerWaalsContact CB-O 3.26Å; W65-G159 WeakPolarHBondContact CB-O 3.38Å; W65-G159 PolarHBondContact N-O 2.87Å; W65-I161 HydrophobicContact CB-CB 3.84Å; W65-I161 HydrophobicContact CB-CG2 4.41Å; W65-I161 HydrophobicContact CD2-CB 3.77Å; W65-I161 HydrophobicContact CD2-CD1 4.39Å; W65-I161 HydrophobicContact CD2-CG1 4.11Å; W65-I161 HydrophobicContact CE3-CB 4.25Å; W65-I161 HydrophobicContact CG-CB 3.57Å; W65-I161 HydrophobicContact CG-CD1 4.37Å; W65-I161 HydrophobicContact CG-CG1 4.26Å; W65-I161 HydrophobicContact CG-CG2 4.45Å; W65-M245 HydrophobicContact CZ2-SD 3.65Å; W65-W253 HydrophobicContact CH2-CB 3.52Å; W65-W253 AromaticContact CH2-CD1 3.37Å; W65-W253 AromaticContact CH2-CG 3.56Å; W65-W253 HydrophobicContact CH2-CG 3.56Å; W65-W253 HydrophobicContact CZ2-CB 3.55Å; W65-W253 AromaticContact CZ2-CD1 3.86Å; W65-W253 HydrophobicContact CZ2-CD2 4.32Å; W65-W253 AromaticContact CZ2-CG 3.64Å; W65-W253 HydrophobicContact CZ2-CG 3.64Å; W65-W253 HydrophobicContact CZ3-CB 4.39Å
66	Q	96.5	Very high	90.2	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.019	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	128	179.5	-172.5	67.9	23.2	0	0	109.4	Y63 A179 W181 L194 S243	Y63-Q66 WeakPolarHBondContact O-CB 3.07Å; Y63-Q66 PolarHBondContact O-N 3.19Å; Q66-A179 PolarHBondContact NE2-O 3.38Å; Q66-A179 VanDerWaalsContact NE2-O 3.13Å; Q66-A179 PolarHBondContact OE1-O 2.84Å; Q66-W181 HydrophobicContact CG-CH2 3.83Å; Q66-W181 HydrophobicContact CG-CZ3 3.78Å; Q66-L194 HydrophobicContact CG-CD1 4.04Å; Q66-L194 HydrophobicContact CG-CD2 4.5Å; Q66-S243 PolarHBondContact OE1-OG 3.01Å
67	V	97.4	Very high	90.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	153.4	174.9	-60.8	0	0	0	0	111.7	W65 L69 G78 G79 I81 V87 V105 T106 A107	W65-V67 PolarHBondContact O-N 3.01Å; V67-L69 HydrophobicContact CG2-CD1 4.03Å; V67-G78 CarbonylContact O-C 3.38Å; V67-G78 VanDerWaalsContact O-CA 3.31Å; V67-G78 WeakPolarHBondContact O-CA 3.31Å; V67-G79 VanDerWaalsContact CG2-CA 3.47Å; V67-G79 WeakPolarHBondContact CG2-O 3.49Å; V67-G79 PolarHBondContact N-O 3.22Å; V67-G79 PolarHBondContact O-N 3.03Å; V67-G79 VanDerWaalsContact O-N 3.07Å; V67-I81 HydrophobicContact CG1-CD1 3.65Å; V67-I81 HydrophobicContact CG1-CG1 3.42Å; V67-I81 VanDerWaalsContact CG1-CG1 3.42Å; V67-V87 HydrophobicContact CG2-CG1 3.68Å; V67-V87 HydrophobicContact CG2-CG2 4.42Å; V67-V105 HydrophobicContact CB-CG1 3.72Å; V67-V105 HydrophobicContact CG1-CG1 4.1Å; V67-V105 HydrophobicContact CG2-CG1 3.69Å; V67-T106 WeakPolarHBondContact CA-O 3.13Å; V67-T106 WeakPolarHBondContact CB-O 3.31Å; V67-A107 HydrophobicContact CG1-CB 3.82Å
68	S	96.6	Very high	91.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.6	171.4	166.1	0	0	0	0	109.7	K70 H75 T106	S68-K70 PolarHBondContact O-N 2.81Å; S68-K70 VanDerWaalsContact OG-CG 3.25Å; S68-K70 WeakPolarHBondContact OG-CG 3.01Å; S68-H75 WeakPolarHBondContact CB-ND1 3.27Å; S68-H75 PolarHBondContact OG-ND1 2.82Å; S68-T106 PolarHBondContact N-O 2.6Å; S68-T106 PolarHBondContact O-N 2.99Å
69	L	95.5	Very high	91.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	115.2	166	-79.1	58.3	0	0	0	107.5	V67 I76 C77 G78 T89 I94 L103 V105 L146	V67-L69 HydrophobicContact CG2-CD1 4.03Å; L69-I76 HydrophobicContact CB-CG1 4.25Å; L69-I76 VanDerWaalsContact O-CG1 3.28Å; L69-I76 WeakPolarHBondContact O-CG1 3.05Å; L69-I76 PolarHBondContact O-N 3.2Å; L69-C77 HydrophobicContact CB-CB 4.27Å; L69-C77 WeakPolarHBondContact CB-O 3.25Å; L69-C77 HydrophobicContact CD2-CB 4.21Å; L69-C77 PolarHBondContact N-O 3.13Å; L69-G78 WeakPolarHBondContact CD1-O 3.36Å; L69-T89 HydrophobicContact CD2-CG2 4.03Å; L69-I94 HydrophobicContact CD2-CG2 4.29Å; L69-L103 HydrophobicContact CB-CD1 4.34Å; L69-L103 HydrophobicContact CB-CD2 4.33Å; L69-L103 HydrophobicContact CD2-CD2 4.11Å; L69-L103 HydrophobicContact CG-CD2 4.21Å; L69-V105 HydrophobicContact CD1-CG1 4.49Å; L69-V105 HydrophobicContact CD1-CG2 4.45Å; L69-V105 HydrophobicContact CG-CG2 4.42Å; L69-L146 HydrophobicContact CD2-CD1 4.19Å; L69-L146 HydrophobicContact CG-CD1 4.49Å
70	K	92.8	Very high	92.2	Very high	17 Å²	17	35.4 Å²	35.4	7%	0.074	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.3	-176.6	-63.7	-175	-177.6	177.7	0	110.7	S68 K74 N104 E109	S68-K70 PolarHBondContact O-N 2.81Å; S68-K70 VanDerWaalsContact OG-CG 3.25Å; S68-K70 WeakPolarHBondContact OG-CG 3.01Å; K70-K74 CarbonylContact C-O 3.52Å; K70-K74 VanDerWaalsContact CA-O 3.23Å; K70-K74 WeakPolarHBondContact CA-O 3.25Å; K70-N104 PolarHBondContact N-O 2.96Å; K70-N104 PolarHBondContact O-N 3Å; K70-E109 WeakPolarHBondContact CE-OE2 3.09Å; K70-E109 IonicContact NZ-OE2 2.78Å; K70-E109 PolarHBondContact NZ-OE2 3.24Å
71	Q	89.6	Confident	92.5	Very high	59 Å²	59	33.3 Å²	33.3	28%	0.276	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.2	167	-173	179.1	38.7	0	0	108.8	Q73 K74 I76 T102 L103	Q71-Q73 PolarHBondContact O-N 2.64Å; Q71-K74 PolarHBondContact N-O 3.18Å; Q71-K74 PolarHBondContact O-N 2.8Å; Q71-I76 HydrophobicContact CB-CD1 4.33Å; Q71-I76 HydrophobicContact CB-CG2 4.01Å; Q71-T102 PolarHBondContact NE2-OG1 3.47Å; Q71-L103 HydrophobicContact CB-CD1 4.1Å
72	R	85.4	Confident	92.7	Very high	208 Å²	208	33.3 Å²	33.3	79%	0.785	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	49	46	-176.5	-58.6	178.8	179.6	-179.6	-0.6	112.3	K74	R72-K74 PolarHBondContact O-N 3.44Å
73	Q	84.9	Confident	92.3	Very high	131 Å²	131	33 Å²	33	61%	0.612	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.3	7.1	-177.7	-52.7	-60.7	-15.3	0	0	116.3	Q71	Q71-Q73 PolarHBondContact O-N 2.64Å
74	K	89.4	Confident	91.8	Very high	162 Å²	162	34 Å²	34	70%	0.704	15%	0.154	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104	130.5	174.2	-64.7	-172.2	178	-174.5	0	110.6	K70 Q71 R72 I76	K70-K74 CarbonylContact C-O 3.52Å; K70-K74 VanDerWaalsContact CA-O 3.23Å; K70-K74 WeakPolarHBondContact CA-O 3.25Å; Q71-K74 PolarHBondContact N-O 3.18Å; Q71-K74 PolarHBondContact O-N 2.8Å; R72-K74 PolarHBondContact O-N 3.44Å; K74-I76 PolarHBondContact O-N 2.88Å
75	H	92	Very high	91.5	Very high	18 Å²	18	37.7 Å²	37.7	8%	0.083	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	131.7	173.4	-179.6	76.6	0	0	0	111	S68 C77 L112 W181 G238	S68-H75 WeakPolarHBondContact CB-ND1 3.27Å; S68-H75 PolarHBondContact OG-ND1 2.82Å; H75-C77 PolarHBondContact CE1-O 2.86Å; H75-L112 HydrophobicContact CB-CD1 3.78Å; H75-L112 HydrophobicContact CB-CD2 4.12Å; H75-W181 AromaticContact CE1-CE3 3.61Å; H75-G238 PolarHBondContact NE2-O 3.18Å
76	I	91.4	Very high	91.3	Very high	53 Å²	53	38.5 Å²	38.5	27%	0.272	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	-36.5	175.5	61.4	161.6	0	0	0	113.1	L69 Q71 K74 I99 L103	L69-I76 HydrophobicContact CB-CG1 4.25Å; L69-I76 VanDerWaalsContact O-CG1 3.28Å; L69-I76 WeakPolarHBondContact O-CG1 3.05Å; L69-I76 PolarHBondContact O-N 3.2Å; Q71-I76 HydrophobicContact CB-CD1 4.33Å; Q71-I76 HydrophobicContact CB-CG2 4.01Å; K74-I76 PolarHBondContact O-N 2.88Å; I76-I99 HydrophobicContact CD1-CG2 4.31Å; I76-L103 HydrophobicContact CD1-CD1 3.52Å; I76-L103 HydrophobicContact CG1-CD1 4.09Å
77	C	93.8	Very high	91.3	Very high	8 Å²	8	38.3 Å²	38.3	5%	0.054	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	160.2	-176	-80.1	0	0	0	0	110.3	L69 H75 C93 S240	L69-C77 HydrophobicContact CB-CB 4.27Å; L69-C77 WeakPolarHBondContact CB-O 3.25Å; L69-C77 HydrophobicContact CD2-CB 4.21Å; L69-C77 PolarHBondContact N-O 3.13Å; H75-C77 PolarHBondContact CE1-O 2.86Å; C77-C93 HydrophobicContact CB-CB 3.7Å; C77-C93 WeakPolarHBondContact CB-SG 3.39Å; C77-C93 WeakPolarHBondContact SG-CB 3.33Å; C77-C93 CovalentContact SG-SG 2.04Å; C77-C93 PolarHBondContact SG-SG 3.16Å; C77-S240 CarbonylContact C-O 3.54Å; C77-S240 WeakPolarHBondContact CA-O 3.32Å; C77-S240 WeakPolarHBondContact CB-O 3.42Å
78	G	95.4	Very high	91.3	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	176.2	166.9	0	0	0	0	0	113.5	V67 L69 T89 S240 G241	V67-G78 CarbonylContact O-C 3.38Å; V67-G78 VanDerWaalsContact O-CA 3.31Å; V67-G78 WeakPolarHBondContact O-CA 3.31Å; L69-G78 WeakPolarHBondContact CD1-O 3.36Å; G78-T89 PolarHBondContact O-OG1 3.01Å; G78-S240 PolarHBondContact N-O 3.03Å; G78-G241 VanDerWaalsContact C-C 3.48Å; G78-G241 CarbonylContact C-O 3.53Å; G78-G241 CarbonylContact O-C 3.5Å; G78-G241 VanDerWaalsContact O-C 3.28Å; G78-G241 WeakPolarHBondContact O-CA 3.02Å
79	G	97.3	Very high	91.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	174.1	172	0	0	0	0	0	110.3	V67 I88 G241	V67-G79 VanDerWaalsContact CG2-CA 3.47Å; V67-G79 WeakPolarHBondContact CG2-O 3.49Å; V67-G79 PolarHBondContact N-O 3.22Å; V67-G79 PolarHBondContact O-N 3.03Å; V67-G79 VanDerWaalsContact O-N 3.07Å; G79-I88 CarbonylContact C-O 3.59Å; G79-I88 VanDerWaalsContact CA-O 3.28Å; G79-I88 WeakPolarHBondContact CA-O 3.39Å; G79-G241 WeakPolarHBondContact CA-O 3.2Å
80	S	97.8	Very high	91.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.2	-178.9	-49.5	0	0	0	0	111.1	W65 V82 V87 I88 S243	W65-S80 CarbonylContact O-C 3.59Å; W65-S80 WeakPolarHBondContact O-CA 3.19Å; S80-V82 PolarHBondContact O-N 3.03Å; S80-V87 CarbonylContact O-C 3.56Å; S80-V87 VanDerWaalsContact O-CA 3.29Å; S80-V87 WeakPolarHBondContact O-CA 3.23Å; S80-I88 PolarHBondContact N-O 3.49Å; S80-I88 PolarHBondContact O-N 3.48Å; S80-S243 VanDerWaalsContact OG-CB 3.31Å; S80-S243 WeakPolarHBondContact OG-CB 3.42Å
81	I	94.1	Very high	91.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	124.5	172.6	-56.4	173.4	0	0	0	108.9	W65 V67 S83 V87 A107 F152 F154 V158 P160 I161	W65-I81 HydrophobicContact CB-CB 4.39Å; W65-I81 PolarHBondContact O-N 2.84Å; V67-I81 HydrophobicContact CG1-CD1 3.65Å; V67-I81 HydrophobicContact CG1-CG1 3.42Å; V67-I81 VanDerWaalsContact CG1-CG1 3.42Å; I81-S83 VanDerWaalsContact CG2-O 3.23Å; I81-S83 WeakPolarHBondContact CG2-O 3.32Å; I81-V87 HydrophobicContact CG1-CG2 4.18Å; I81-A107 HydrophobicContact CD1-CB 3.7Å; I81-F152 HydrophobicContact CD1-CD2 4.12Å; I81-F152 HydrophobicContact CD1-CE2 4.31Å; I81-F152 HydrophobicContact CD1-CG 4.33Å; I81-F152 HydrophobicContact CG1-CD2 4.35Å; I81-F152 HydrophobicContact CG1-CE2 4.27Å; I81-F152 HydrophobicContact CG2-CD2 4.32Å; I81-F154 HydrophobicContact CG2-CE1 3.89Å; I81-F154 HydrophobicContact CG2-CZ 4.15Å; I81-V158 HydrophobicContact CD1-CG1 3.79Å; I81-P160 HydrophobicContact CG2-CB 4.37Å; I81-P160 CarbonylContact O-C 3.42Å; I81-P160 VanDerWaalsContact O-CA 3.28Å; I81-P160 WeakPolarHBondContact O-CA 3.43Å; I81-I161 PolarHBondContact O-N 3.49Å
82	V	89.4	Confident	91.5	Very high	10 Å²	10	37.5 Å²	37.5	6%	0.061	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	-19.7	175.5	-66.1	0	0	0	0	112.5	S80 W86 I88 I161 L163 I298 T300	S80-V82 PolarHBondContact O-N 3.03Å; V82-W86 HydrophobicContact CG2-CB 3.85Å; V82-W86 WeakPolarHBondContact CG2-O 3.4Å; V82-W86 PolarHBondContact N-O 2.74Å; V82-I88 HydrophobicContact CG1-CD1 3.7Å; V82-I88 HydrophobicContact CG1-CG1 3.79Å; V82-I88 HydrophobicContact CG2-CD1 4.27Å; V82-I88 HydrophobicContact CG2-CG1 3.95Å; V82-I161 HydrophobicContact CG1-CG2 4.07Å; V82-L163 HydrophobicContact CG1-CD2 4.09Å; V82-L163 HydrophobicContact CG1-CG 4.3Å; V82-I298 HydrophobicContact CG2-CD1 3.72Å; V82-I298 HydrophobicContact CG2-CG2 4.16Å; V82-T300 HydrophobicContact CB-CG2 4.28Å; V82-T300 HydrophobicContact CG2-CG2 4.22Å
83	S	81.4	Confident	91.8	Very high	5 Å²	5	28 Å²	28	4%	0.035	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	173.7	168.9	79.4	0	0	0	0	110.2	I81 Q85 W86	I81-S83 VanDerWaalsContact CG2-O 3.23Å; I81-S83 WeakPolarHBondContact CG2-O 3.32Å; S83-Q85 PolarHBondContact O-N 3.43Å; S83-W86 PolarHBondContact N-O 3.25Å; S83-W86 PolarHBondContact O-N 2.85Å; S83-W86 WeakPolarHBondContact OG-CB 3.48Å; S83-W86 PolarHBondContact OG-N 3.38Å
84	P	81.2	Confident	92	Very high	33 Å²	33	21.9 Å²	21.9	21%	0.214	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-27.8	-176.7	-27.4	34.9	0	0	0	114.3	A151 F152 F154	P84-A151 HydrophobicContact CB-CB 4.1Å; P84-A151 CarbonylContact O-C 3.57Å; P84-A151 WeakPolarHBondContact O-CA 3.31Å; P84-F152 VanDerWaalsContact O-CD2 3.28Å; P84-F152 WeakPolarHBondContact O-CD2 3.28Å; P84-F152 PolarHBondContact O-N 3.1Å; P84-F154 HydrophobicContact CB-CZ 4.21Å; P84-F154 HydrophobicContact CG-CD2 4.39Å; P84-F154 HydrophobicContact CG-CE2 3.62Å; P84-F154 HydrophobicContact CG-CZ 3.72Å
85	Q	85	Confident	91.6	Very high	82 Å²	82	15.9 Å²	15.9	38%	0.383	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	0.7	-177.1	-58.7	-171.4	-76.7	0	0	113.8	S83 K147 M148 G150 A151	S83-Q85 PolarHBondContact O-N 3.43Å; Q85-K147 CarbonylContact O-C 3.28Å; Q85-K147 WeakPolarHBondContact O-CA 3.27Å; Q85-M148 PolarHBondContact O-N 2.8Å; Q85-G150 WeakPolarHBondContact CG-O 3.41Å; Q85-A151 HydrophobicContact CG-CB 3.8Å
86	W	90.6	Very high	90.8	Very high	18 Å²	18	19.3 Å²	19.3	7%	0.068	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.5	-170.1	-68.3	94.9	0	0	0	112.9	V82 S83 I128 L145 L146 K147 H297 I298	V82-W86 HydrophobicContact CG2-CB 3.85Å; V82-W86 WeakPolarHBondContact CG2-O 3.4Å; V82-W86 PolarHBondContact N-O 2.74Å; S83-W86 PolarHBondContact N-O 3.25Å; S83-W86 PolarHBondContact O-N 2.85Å; S83-W86 WeakPolarHBondContact OG-CB 3.48Å; S83-W86 PolarHBondContact OG-N 3.38Å; W86-I128 HydrophobicContact CH2-CD1 4Å; W86-I128 HydrophobicContact CZ3-CD1 4.09Å; W86-L145 HydrophobicContact CE3-CB 4.28Å; W86-L145 HydrophobicContact CZ3-CB 4.06Å; W86-L146 WeakPolarHBondContact CA-O 3.46Å; W86-K147 HydrophobicContact CD2-CB 4.42Å; W86-K147 HydrophobicContact CD2-CG 4.46Å; W86-K147 HydrophobicContact CE3-CB 4.08Å; W86-K147 HydrophobicContact CH2-CB 3.87Å; W86-K147 HydrophobicContact CH2-CD 4.2Å; W86-K147 HydrophobicContact CH2-CG 4.18Å; W86-K147 HydrophobicContact CZ2-CB 4.19Å; W86-K147 HydrophobicContact CZ2-CD 3.95Å; W86-K147 HydrophobicContact CZ2-CG 3.99Å; W86-K147 HydrophobicContact CZ3-CB 3.8Å; W86-K147 HydrophobicContact CZ3-CG 4.46Å; W86-H297 WeakPolarHBondContact CH2-O 3.4Å; W86-H297 VanDerWaalsContact CZ2-O 3.22Å; W86-H297 WeakPolarHBondContact CZ2-O 3.24Å; W86-I298 HydrophobicContact CB-CD1 4.45Å; W86-I298 HydrophobicContact CB-CG2 3.67Å; W86-I298 HydrophobicContact CD2-CB 4.29Å; W86-I298 HydrophobicContact CD2-CG1 4.01Å; W86-I298 HydrophobicContact CD2-CG2 3.88Å; W86-I298 HydrophobicContact CE3-CD1 4.49Å; W86-I298 HydrophobicContact CE3-CG1 3.81Å; W86-I298 HydrophobicContact CG-CB 4.4Å; W86-I298 HydrophobicContact CG-CG1 4.37Å; W86-I298 HydrophobicContact CG-CG2 3.5Å; W86-I298 VanDerWaalsContact CG-CG2 3.5Å; W86-I298 HydrophobicContact CZ3-CG1 4.27Å
87	V	96.7	Very high	89.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	134.9	176.7	170.7	0	0	0	0	109.5	V67 S80 I81 V105 L146 M148 F152	V67-V87 HydrophobicContact CG2-CG1 3.68Å; V67-V87 HydrophobicContact CG2-CG2 4.42Å; S80-V87 CarbonylContact O-C 3.56Å; S80-V87 VanDerWaalsContact O-CA 3.29Å; S80-V87 WeakPolarHBondContact O-CA 3.23Å; I81-V87 HydrophobicContact CG1-CG2 4.18Å; V87-V105 HydrophobicContact CG2-CG1 4.25Å; V87-L146 HydrophobicContact CB-CB 4.34Å; V87-L146 HydrophobicContact CG1-CD1 4.37Å; V87-L146 PolarHBondContact N-O 2.81Å; V87-L146 PolarHBondContact O-N 2.9Å; V87-M148 HydrophobicContact CB-CE 4.4Å; V87-M148 HydrophobicContact CG2-CE 4.45Å; V87-M148 HydrophobicContact CG2-SD 4.44Å; V87-F152 HydrophobicContact CG2-CE2 3.84Å; V87-F152 HydrophobicContact CG2-CZ 4.45Å
88	I	97.6	Very high	87.9	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	136.2	170.4	-55.6	-168.3	0	0	0	108.9	G79 S80 V82 I143 L145 L163 L255 V258 I294 I298	G79-I88 CarbonylContact C-O 3.59Å; G79-I88 VanDerWaalsContact CA-O 3.28Å; G79-I88 WeakPolarHBondContact CA-O 3.39Å; S80-I88 PolarHBondContact N-O 3.49Å; S80-I88 PolarHBondContact O-N 3.48Å; V82-I88 HydrophobicContact CG1-CD1 3.7Å; V82-I88 HydrophobicContact CG1-CG1 3.79Å; V82-I88 HydrophobicContact CG2-CD1 4.27Å; V82-I88 HydrophobicContact CG2-CG1 3.95Å; I88-I143 HydrophobicContact CG2-CD1 3.81Å; I88-I143 HydrophobicContact CG2-CG1 3.86Å; I88-L145 HydrophobicContact CB-CD2 4.44Å; I88-L145 HydrophobicContact CD1-CD2 4.15Å; I88-L145 HydrophobicContact CG1-CD2 3.78Å; I88-L145 HydrophobicContact CG2-CD2 4.36Å; I88-L163 HydrophobicContact CD1-CD2 3.89Å; I88-L255 HydrophobicContact CD1-CD2 4.2Å; I88-V258 HydrophobicContact CG2-CG2 3.75Å; I88-I294 HydrophobicContact CD1-CD1 4.02Å; I88-I294 HydrophobicContact CD1-CG1 4.38Å; I88-I294 HydrophobicContact CD1-CG2 3.86Å; I88-I298 HydrophobicContact CD1-CD1 4Å; I88-I298 HydrophobicContact CG1-CD1 3.94Å
89	T	97.2	Very high	86.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	-179.6	174.3	-169.2	0	0	0	0	110.4	L69 G78 A144 L146	L69-T89 HydrophobicContact CD2-CG2 4.03Å; G78-T89 PolarHBondContact O-OG1 3.01Å; T89-A144 HydrophobicContact CG2-CB 4.3Å; T89-A144 PolarHBondContact N-O 3.01Å; T89-A144 PolarHBondContact O-N 2.91Å; T89-L146 HydrophobicContact CG2-CD1 3.85Å; T89-L146 HydrophobicContact CG2-CD2 4.36Å; T89-L146 HydrophobicContact CG2-CG 4.03Å
90	A	95.5	Very high	85	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.184	C	C	.	.			trans	-80.2	139.6	174.9	0	0	0	0	0	110.7	H92 C93 D142 G241 V258	A90-H92 VanDerWaalsContact C-N 3.3Å; A90-H92 PolarHBondContact O-N 3.35Å; A90-C93 WeakPolarHBondContact O-CB 3.5Å; A90-C93 PolarHBondContact O-N 2.84Å; A90-D142 WeakPolarHBondContact CA-O 3.29Å; A90-G241 VanDerWaalsContact N-CA 3.35Å; A90-V258 HydrophobicContact CB-CG1 4.12Å
91	A	94.6	Very high	83.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-63.3	-36	179.8	0	0	0	0	0	112.3	C93 I94 A95 I129 F133 D142 A144	A91-C93 PolarHBondContact O-N 2.84Å; A91-I94 CarbonylContact O-C 3.53Å; A91-I94 WeakPolarHBondContact O-CG1 3.28Å; A91-I94 PolarHBondContact O-N 3.26Å; A91-A95 WeakPolarHBondContact O-CB 2.87Å; A91-A95 PolarHBondContact O-N 2.87Å; A91-I129 HydrophobicContact CB-CG2 3.89Å; A91-F133 HydrophobicContact CB-CB 4.28Å; A91-F133 HydrophobicContact CB-CD1 3.54Å; A91-F133 HydrophobicContact CB-CD2 3.69Å; A91-F133 HydrophobicContact CB-CE1 3.69Å; A91-F133 HydrophobicContact CB-CE2 3.82Å; A91-F133 HydrophobicContact CB-CG 3.53Å; A91-F133 HydrophobicContact CB-CZ 3.82Å; A91-D142 PolarHBondContact N-OD1 2.75Å; A91-A144 HydrophobicContact CB-CB 4.32Å
92	H	91.8	Very high	83.1	Confident	58 Å²	58	44.7 Å²	44.7	27%	0.269	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-63.5	-24.6	179.8	78	-98.1	0	0	0	113.2	A90 I94 F133 M139 D142 S240 S260	A90-H92 VanDerWaalsContact C-N 3.3Å; A90-H92 PolarHBondContact O-N 3.35Å; H92-I94 PolarHBondContact O-N 2.56Å; H92-F133 HydrophobicContact CB-CZ 3.91Å; H92-M139 HydrophobicContact CB-SD 4.5Å; H92-D142 IonicContact CE1-OD2 2.85Å; H92-D142 PolarHBondContact CE1-OD2 2.84Å; H92-D142 IonicContact CG-OD1 2.6Å; H92-D142 IonicContact CG-OD2 2.64Å; H92-D142 PolarHBondContact N-OD1 3.01Å; H92-D142 IonicContact ND1-OD1 3.29Å; H92-D142 PolarHBondContact ND1-OD1 2.81Å; H92-D142 IonicContact ND1-OD2 2.64Å; H92-D142 PolarHBondContact ND1-OD2 3Å; H92-S240 PolarHBondContact CE1-OG 3.42Å; H92-S240 VanDerWaalsContact NE2-CB 3.25Å; H92-S240 WeakPolarHBondContact NE2-CB 3.32Å; H92-S240 PolarHBondContact NE2-OG 3.31Å; H92-S240 VanDerWaalsContact NE2-OG 3.07Å; H92-S260 PolarHBondContact CE1-O 2.82Å
93	C	91.3	Very high	83.1	Confident	8 Å²	8	44.4 Å²	44.4	5%	0.054	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-66.2	-24.6	176	-69.8	0	0	0	0	112.8	C77 A90 A91	C77-C93 HydrophobicContact CB-CB 3.7Å; C77-C93 WeakPolarHBondContact CB-SG 3.39Å; C77-C93 WeakPolarHBondContact SG-CB 3.33Å; C77-C93 CovalentContact SG-SG 2.04Å; C77-C93 PolarHBondContact SG-SG 3.16Å; A90-C93 WeakPolarHBondContact O-CB 3.5Å; A90-C93 PolarHBondContact O-N 2.84Å; A91-C93 PolarHBondContact O-N 2.84Å
94	I	88.8	Confident	83.6	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.015	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.5	3.2	-170.9	59.7	132.7	0	0	0	113.7	L69 A91 H92 N96 L103 V127 I129 A144 L146	L69-I94 HydrophobicContact CD2-CG2 4.29Å; A91-I94 CarbonylContact O-C 3.53Å; A91-I94 WeakPolarHBondContact O-CG1 3.28Å; A91-I94 PolarHBondContact O-N 3.26Å; H92-I94 PolarHBondContact O-N 2.56Å; I94-N96 PolarHBondContact O-N 2.83Å; I94-L103 HydrophobicContact CG2-CD2 3.89Å; I94-V127 HydrophobicContact CD1-CG1 3.14Å; I94-I129 HydrophobicContact CD1-CD1 3.86Å; I94-I129 HydrophobicContact CD1-CG1 3.52Å; I94-I129 HydrophobicContact CG1-CD1 4.49Å; I94-I129 HydrophobicContact CG1-CG1 4.39Å; I94-A144 HydrophobicContact CD1-CB 3.48Å; I94-A144 VanDerWaalsContact CD1-CB 3.48Å; I94-A144 HydrophobicContact CG1-CB 3.93Å; I94-L146 HydrophobicContact CD1-CD2 4.12Å; I94-L146 HydrophobicContact CG2-CD2 4.49Å
95	A	79.9	Confident	84.4	Confident	37 Å²	37	44.5 Å²	44.5	31%	0.306	23%	0.232	S	C	.	.			trans	-63.1	-22.1	-177.2	0	0	0	0	0	114	A91 R97 F133 T135	A91-A95 WeakPolarHBondContact O-CB 2.87Å; A91-A95 PolarHBondContact O-N 2.87Å; A95-R97 PolarHBondContact O-N 2.93Å; A95-F133 HydrophobicContact CB-CE1 3.92Å; A95-T135 HydrophobicContact CB-CG2 4.34Å
96	N	75.8	Confident	85	Confident	89 Å²	89	40.6 Å²	40.6	48%	0.476	21%	0.214	S	C	.	.	S	Bend	trans	-86.8	108.5	174.7	-174.4	-12.5	0	0	0	110.5	I94 N98 I99	I94-N96 PolarHBondContact O-N 2.83Å; N96-N98 PolarHBondContact O-N 2.86Å; N96-N98 PolarHBondContact OD1-N 2.03Å; N96-I99 HydrophobicContact CB-CD1 3.79Å; N96-I99 HydrophobicContact CB-CG1 4.01Å; N96-I99 WeakPolarHBondContact O-CB 3.04Å; N96-I99 PolarHBondContact O-N 2.85Å
97	R	59.4	Low	85.2	Confident	227 Å²	227	39.8 Å²	39.8	86%	0.857	21%	0.211	S	C	*	.	H	α-helix	trans	-55.5	-25.3	-175.9	-69.5	-173.4	176.5	-176.5	-1.8	114.7	A95 I99	A95-R97 PolarHBondContact O-N 2.93Å; R97-I99 PolarHBondContact O-N 2.81Å
98	N	64.6	Low	85	Confident	132 Å²	132	40 Å²	40	71%	0.706	21%	0.214	S	C	*	.	H	α-helix	trans	-72.1	-13	177.7	-67.9	-21.6	0	0	0	113.6	N96	N96-N98 PolarHBondContact O-N 2.86Å; N96-N98 PolarHBondContact OD1-N 2.03Å
99	I	64.7	Low	84.9	Confident	31 Å²	31	40.5 Å²	40.5	16%	0.159	22%	0.216	C	C	.	.	H	α-helix	trans	-87.2	-35.9	-176.4	-60.5	-176.5	0	0	0	110.9	I76 N96 R97 S101 T102 L103	I76-I99 HydrophobicContact CD1-CG2 4.31Å; N96-I99 HydrophobicContact CB-CD1 3.79Å; N96-I99 HydrophobicContact CB-CG1 4.01Å; N96-I99 WeakPolarHBondContact O-CB 3.04Å; N96-I99 PolarHBondContact O-N 2.85Å; R97-I99 PolarHBondContact O-N 2.81Å; I99-S101 PolarHBondContact O-N 2.8Å; I99-T102 PolarHBondContact O-N 3.21Å; I99-T102 PolarHBondContact O-OG1 3.39Å; I99-L103 HydrophobicContact CG2-CD1 4.04Å; I99-L103 PolarHBondContact O-N 3.27Å
100	V	67.5	Low	84.7	Confident	43 Å²	43	42.3 Å²	42.3	26%	0.261	22%	0.223	S	C	.	.	H	α-helix	trans	-58.4	-42.1	-169.1	-179.9	0	0	0	0	112.8	T102 L103 V127	V100-T102 PolarHBondContact O-N 3.22Å; V100-T102 VanDerWaalsContact O-N 3.16Å; V100-L103 PolarHBondContact O-N 3.41Å; V100-V127 HydrophobicContact CG1-CG2 3.57Å; V100-V127 HydrophobicContact CG2-CG2 4.36Å
101	S	70.4	Confident	84.6	Confident	110 Å²	110	43.6 Å²	43.6	77%	0.769	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-10.2	-179	64.9	0	0	0	0	114.4	I99	I99-S101 PolarHBondContact O-N 2.8Å
102	T	81.2	Confident	84.4	Confident	53 Å²	53	45.4 Å²	45.4	33%	0.325	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	6.2	-178.1	60.5	0	0	0	0	112.7	Q71 I99 V100	Q71-T102 PolarHBondContact NE2-OG1 3.47Å; I99-T102 PolarHBondContact O-N 3.21Å; I99-T102 PolarHBondContact O-OG1 3.39Å; V100-T102 PolarHBondContact O-N 3.22Å; V100-T102 VanDerWaalsContact O-N 3.16Å
103	L	89.3	Confident	84.3	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.9	-173.5	-162.1	76.8	0	0	0	110.3	L69 Q71 I76 I94 I99 V100 I124	L69-L103 HydrophobicContact CB-CD1 4.34Å; L69-L103 HydrophobicContact CB-CD2 4.33Å; L69-L103 HydrophobicContact CD2-CD2 4.11Å; L69-L103 HydrophobicContact CG-CD2 4.21Å; Q71-L103 HydrophobicContact CB-CD1 4.1Å; I76-L103 HydrophobicContact CD1-CD1 3.52Å; I76-L103 HydrophobicContact CG1-CD1 4.09Å; I94-L103 HydrophobicContact CG2-CD2 3.89Å; I99-L103 HydrophobicContact CG2-CD1 4.04Å; I99-L103 PolarHBondContact O-N 3.27Å; V100-L103 PolarHBondContact O-N 3.41Å; L103-I124 HydrophobicContact CB-CD1 4.14Å; L103-I124 HydrophobicContact CD2-CD1 3.72Å; L103-I124 HydrophobicContact CG-CD1 4.19Å
104	N	93.8	Very high	84.3	Confident	40 Å²	40	51.2 Å²	51.2	21%	0.214	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	151.8	172.3	-65.8	-19.1	0	0	0	109.8	K70 T121	K70-N104 PolarHBondContact N-O 2.96Å; K70-N104 PolarHBondContact O-N 3Å; N104-T121 HydrophobicContact CB-CG2 3.67Å
105	V	96.9	Very high	84.3	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.6	175	-176.2	0	0	0	0	108.7	V67 L69 V87 T121 L122 I124 L146 M148 F152	V67-V105 HydrophobicContact CB-CG1 3.72Å; V67-V105 HydrophobicContact CG1-CG1 4.1Å; V67-V105 HydrophobicContact CG2-CG1 3.69Å; L69-V105 HydrophobicContact CD1-CG1 4.49Å; L69-V105 HydrophobicContact CD1-CG2 4.45Å; L69-V105 HydrophobicContact CG-CG2 4.42Å; V87-V105 HydrophobicContact CG2-CG1 4.25Å; V105-T121 CarbonylContact O-C 3.55Å; V105-T121 WeakPolarHBondContact O-CA 3.44Å; V105-L122 PolarHBondContact N-O 2.81Å; V105-L122 PolarHBondContact O-N 2.99Å; V105-I124 HydrophobicContact CG2-CD1 4.09Å; V105-I124 HydrophobicContact CG2-CG1 3.97Å; V105-L146 HydrophobicContact CG2-CD1 4.19Å; V105-M148 HydrophobicContact CB-SD 3.85Å; V105-M148 HydrophobicContact CG1-SD 4.32Å; V105-M148 HydrophobicContact CG2-CE 4.03Å; V105-M148 HydrophobicContact CG2-SD 3.88Å; V105-F152 HydrophobicContact CG1-CZ 4.1Å
106	T	97.3	Very high	84.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	120.7	178.4	-54.8	0	0	0	0	110.1	V67 S68 E109 E119 Q120 T121	V67-T106 WeakPolarHBondContact CA-O 3.13Å; V67-T106 WeakPolarHBondContact CB-O 3.31Å; S68-T106 PolarHBondContact N-O 2.6Å; S68-T106 PolarHBondContact O-N 2.99Å; T106-E109 HydrophobicContact CG2-CB 4.13Å; T106-E119 HydrophobicContact CG2-CB 4.33Å; T106-E119 HydrophobicContact CG2-CG 4.04Å; T106-E119 WeakPolarHBondContact CG2-OE2 3.13Å; T106-Q120 CarbonylContact C-O 3.57Å; T106-Q120 WeakPolarHBondContact CA-O 3.47Å; T106-T121 WeakPolarHBondContact CG2-OG1 3.36Å; T106-T121 PolarHBondContact OG1-OG1 2.88Å
107	A	95.9	Very high	84.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	154.6	172.4	0	0	0	0	0	111.3	V67 I81 E109 E119 Q120 F152 V158	V67-A107 HydrophobicContact CG1-CB 3.82Å; I81-A107 HydrophobicContact CD1-CB 3.7Å; A107-E109 PolarHBondContact O-N 3.07Å; A107-E119 CarbonylContact O-C 3.58Å; A107-E119 VanDerWaalsContact O-CA 3.29Å; A107-E119 WeakPolarHBondContact O-CA 3.44Å; A107-Q120 PolarHBondContact N-O 3.37Å; A107-Q120 PolarHBondContact O-N 3.16Å; A107-F152 HydrophobicContact CB-CD1 3.71Å; A107-F152 HydrophobicContact CB-CE1 3.5Å; A107-F152 VanDerWaalsContact CB-CE1 3.5Å; A107-F152 HydrophobicContact CB-CZ 4.16Å; A107-V158 HydrophobicContact CB-CG1 3.83Å; A107-V158 HydrophobicContact CB-CG2 4Å
108	G	92.4	Very high	86	Confident	6 Å²	6	46.9 Å²	46.9	6%	0.062	28%	0.283	C	S	.	.	S	Bend	trans	75	6	-179	0	0	0	0	0	114.4	F157	G108-F157 WeakPolarHBondContact CA-O 3.49Å
109	E	94.2	Very high	87.4	Confident	9 Å²	9	42.4 Å²	42.4	4%	0.042	26%	0.258	C	S	.	.			trans	-64.3	141.9	172.5	177.9	61.2	-92.1	0	0	110.6	K70 T106 A107 D111 L112 E119 W181	K70-E109 WeakPolarHBondContact CE-OE2 3.09Å; K70-E109 IonicContact NZ-OE2 2.78Å; K70-E109 PolarHBondContact NZ-OE2 3.24Å; T106-E109 HydrophobicContact CG2-CB 4.13Å; A107-E109 PolarHBondContact O-N 3.07Å; E109-D111 VanDerWaalsContact OE1-C 3.23Å; E109-D111 PolarHBondContact OE1-N 3.04Å; E109-L112 HydrophobicContact CG-CD2 3.76Å; E109-E119 HydrophobicContact CB-CG 4.48Å; E109-W181 HydrophobicContact CB-CH2 4.1Å; E109-W181 HydrophobicContact CB-CZ2 3.94Å; E109-W181 HydrophobicContact CG-CH2 4.01Å; E109-W181 HydrophobicContact CG-CZ2 3.56Å; E109-W181 WeakPolarHBondContact O-CZ2 3.24Å
110	Y	93.1	Very high	88.8	Confident	38 Å²	38	43 Å²	43	15%	0.149	26%	0.26	C	S	.	.			trans	-138.6	-49.3	176.4	168.4	-105.2	0	0	0	111.4	Q57 V58 K60 D116 W181 V193 L194	Q57-Y110 PolarHBondContact NE2-OH 2.87Å; V58-Y110 HydrophobicContact CG2-CD2 4.44Å; V58-Y110 HydrophobicContact CG2-CE2 4.15Å; V58-Y110 WeakPolarHBondContact O-CE2 3.33Å; V58-Y110 PolarHBondContact O-OH 3.33Å; K60-Y110 HydrophobicContact CB-CD1 4.05Å; K60-Y110 HydrophobicContact CB-CD2 3.99Å; K60-Y110 HydrophobicContact CB-CE1 4.3Å; K60-Y110 HydrophobicContact CB-CE2 4.27Å; K60-Y110 HydrophobicContact CB-CG 3.86Å; K60-Y110 HydrophobicContact CD-CD1 4.25Å; K60-Y110 HydrophobicContact CD-CG 4.31Å; K60-Y110 HydrophobicContact CG-CD1 4.3Å; K60-Y110 HydrophobicContact CG-CD2 4.42Å; K60-Y110 HydrophobicContact CG-CG 3.96Å; Y110-D116 WeakPolarHBondContact CB-OD2 2.96Å; Y110-D116 PolarHBondContact N-OD2 3.22Å; Y110-W181 PolarHBondContact O-NE1 2.82Å; Y110-V193 HydrophobicContact CD1-CG1 4.38Å; Y110-V193 HydrophobicContact CD2-CG1 4.08Å; Y110-V193 HydrophobicContact CE1-CG1 3.78Å; Y110-V193 HydrophobicContact CE2-CG1 3.41Å; Y110-V193 VanDerWaalsContact CE2-CG1 3.41Å; Y110-V193 WeakPolarHBondContact O-CA 3.39Å; Y110-V193 WeakPolarHBondContact OH-CG1 3.35Å; Y110-L194 HydrophobicContact CD2-CB 4.14Å; Y110-L194 PolarHBondContact O-N 3.38Å
111	D	93.1	Very high	90.1	Very high	28 Å²	28	44 Å²	44	15%	0.15	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-117.2	104.1	176.1	-171.5	-20.4	0	0	0	111.8	E109 S113 Q114 D116 Q192 V193	E109-D111 VanDerWaalsContact OE1-C 3.23Å; E109-D111 PolarHBondContact OE1-N 3.04Å; D111-S113 VanDerWaalsContact CG-OG 3.29Å; D111-S113 PolarHBondContact O-N 2.95Å; D111-S113 VanDerWaalsContact OD1-CB 3.31Å; D111-S113 WeakPolarHBondContact OD1-CB 3.36Å; D111-S113 PolarHBondContact OD1-N 3.06Å; D111-S113 PolarHBondContact OD1-OG 2.86Å; D111-S113 PolarHBondContact OD2-OG 2.74Å; D111-Q114 HydrophobicContact CB-CG 3.9Å; D111-Q114 PolarHBondContact O-N 2.74Å; D111-Q114 VanDerWaalsContact O-O 3.06Å; D111-D116 PolarHBondContact N-OD2 3.36Å; D111-Q192 CarbonylContact C-O 3.57Å; D111-Q192 WeakPolarHBondContact CA-O 3.35Å; D111-V193 HydrophobicContact CB-CG2 4.43Å
112	L	91.3	Very high	91.2	Very high	37 Å²	37	40.4 Å²	40.4	19%	0.194	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-14.6	-178.5	-65.8	177.5	0	0	0	114.6	H75 E109 Q114 W181 Q192	H75-L112 HydrophobicContact CB-CD1 3.78Å; H75-L112 HydrophobicContact CB-CD2 4.12Å; E109-L112 HydrophobicContact CG-CD2 3.76Å; L112-Q114 VanDerWaalsContact C-N 3.34Å; L112-W181 HydrophobicContact CD1-CB 3.59Å; L112-W181 HydrophobicContact CD1-CD2 4.38Å; L112-W181 HydrophobicContact CD1-CG 3.61Å; L112-W181 HydrophobicContact CD2-CD2 4.44Å; L112-W181 HydrophobicContact CD2-CG 4.44Å; L112-W181 HydrophobicContact CG-CB 4.45Å; L112-W181 HydrophobicContact CG-CD2 4.41Å; L112-W181 HydrophobicContact CG-CG 3.94Å; L112-Q192 PolarHBondContact N-O 2.95Å
113	S	89.9	Confident	91.9	Very high	81 Å²	81	41.6 Å²	41.6	57%	0.566	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-11.8	179.7	72.7	0	0	0	0	113.8	D111	D111-S113 VanDerWaalsContact CG-OG 3.29Å; D111-S113 PolarHBondContact O-N 2.95Å; D111-S113 VanDerWaalsContact OD1-CB 3.31Å; D111-S113 WeakPolarHBondContact OD1-CB 3.36Å; D111-S113 PolarHBondContact OD1-N 3.06Å; D111-S113 PolarHBondContact OD1-OG 2.86Å; D111-S113 PolarHBondContact OD2-OG 2.74Å
114	Q	90.9	Very high	92	Very high	108 Å²	108	42.8 Å²	42.8	51%	0.505	25%	0.252	S	S	.	.	S	Bend	trans	-140.3	176.1	-177.6	56.1	177	52.7	0	0	111	D111 L112	D111-Q114 HydrophobicContact CB-CG 3.9Å; D111-Q114 PolarHBondContact O-N 2.74Å; D111-Q114 VanDerWaalsContact O-O 3.06Å; L112-Q114 VanDerWaalsContact C-N 3.34Å
115	T	88.4	Confident	91.7	Very high	118 Å²	118	46.1 Å²	46.1	72%	0.724	27%	0.266	S	S	*	.			trans	-101.3	113.1	169.8	-56.7	0	0	0	0	108.6	E119	T115-E119 WeakPolarHBondContact CA-OE1 3.23Å
116	D	86.6	Confident	91.2	Very high	10 Å²	10	49 Å²	49	5%	0.053	28%	0.283	C	S	.	.			trans	-76.3	138.1	-178.7	-93.7	-60.5	0	0	0	112.2	K60 Y110 D111 G118 E119	K60-D116 VanDerWaalsContact NZ-CB 3.31Å; K60-D116 IonicContact NZ-OD1 3.68Å; K60-D116 PolarHBondContact NZ-OD1 3.14Å; Y110-D116 WeakPolarHBondContact CB-OD2 2.96Å; Y110-D116 PolarHBondContact N-OD2 3.22Å; D111-D116 PolarHBondContact N-OD2 3.36Å; D116-G118 PolarHBondContact O-N 3.23Å; D116-E119 HydrophobicContact CB-CG 3.97Å; D116-E119 WeakPolarHBondContact CB-OE1 3.25Å; D116-E119 PolarHBondContact N-OE1 3.11Å; D116-E119 WeakPolarHBondContact O-CB 3.12Å; D116-E119 PolarHBondContact O-N 2.78Å; D116-E119 VanDerWaalsContact O-N 3.11Å
117	P	81.6	Confident	90.9	Very high	96 Å²	96	51.1 Å²	51.1	62%	0.623	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	125.9	169.7	-25.9	33	0	0	0	110.9	K60	K60-P117 PolarHBondContact NZ-O 3.49Å; K60-P117 VanDerWaalsContact NZ-O 3.1Å
118	G	82.6	Confident	90.5	Very high	41 Å²	41	53 Å²	53	42%	0.423	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	-1.6	-178.2	0	0	0	0	0	115	D116	D116-G118 PolarHBondContact O-N 3.23Å
119	E	93.9	Very high	90.4	Very high	37 Å²	37	55.6 Å²	55.6	17%	0.173	32%	0.318	C	S	.	.			trans	-60	136.7	171.6	-87.4	-176.2	-134.9	0	0	112.2	T106 A107 E109 T115 D116	T106-E119 HydrophobicContact CG2-CB 4.33Å; T106-E119 HydrophobicContact CG2-CG 4.04Å; T106-E119 WeakPolarHBondContact CG2-OE2 3.13Å; A107-E119 CarbonylContact O-C 3.58Å; A107-E119 VanDerWaalsContact O-CA 3.29Å; A107-E119 WeakPolarHBondContact O-CA 3.44Å; E109-E119 HydrophobicContact CB-CG 4.48Å; T115-E119 WeakPolarHBondContact CA-OE1 3.23Å; D116-E119 HydrophobicContact CB-CG 3.97Å; D116-E119 WeakPolarHBondContact CB-OE1 3.25Å; D116-E119 PolarHBondContact N-OE1 3.11Å; D116-E119 WeakPolarHBondContact O-CB 3.12Å; D116-E119 PolarHBondContact O-N 2.78Å; D116-E119 VanDerWaalsContact O-N 3.11Å
120	Q	93.6	Very high	90.1	Very high	43 Å²	43	55.8 Å²	55.8	20%	0.201	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	114.2	176.3	-66.6	176.8	55.8	0	0	108.7	T106 A107 F152 Q153	T106-Q120 CarbonylContact C-O 3.57Å; T106-Q120 WeakPolarHBondContact CA-O 3.47Å; A107-Q120 PolarHBondContact N-O 3.37Å; A107-Q120 PolarHBondContact O-N 3.16Å; Q120-F152 HydrophobicContact CB-CD1 4.04Å; Q120-F152 HydrophobicContact CB-CE1 4.41Å; Q120-Q153 PolarHBondContact NE2-O 2.82Å
121	T	95.7	Very high	89.9	Confident	65 Å²	65	58.7 Å²	58.7	40%	0.399	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	121	178	-62.3	0	0	0	0	109.9	N104 V105 T106	N104-T121 HydrophobicContact CB-CG2 3.67Å; V105-T121 CarbonylContact O-C 3.55Å; V105-T121 WeakPolarHBondContact O-CA 3.44Å; T106-T121 WeakPolarHBondContact CG2-OG1 3.36Å; T106-T121 PolarHBondContact OG1-OG1 2.88Å
122	L	94.6	Very high	89.6	Confident	34 Å²	34	63.4 Å²	63.4	18%	0.178	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	150.3	177.8	-60.8	-177.8	0	0	0	110.9	V105 M148 F152	V105-L122 PolarHBondContact N-O 2.81Å; V105-L122 PolarHBondContact O-N 2.99Å; L122-M148 HydrophobicContact CB-CB 4.28Å; L122-M148 HydrophobicContact CB-CG 4.41Å; L122-M148 HydrophobicContact CB-SD 4.19Å; L122-M148 HydrophobicContact CD1-CB 3.93Å; L122-M148 HydrophobicContact CD1-CG 4.11Å; L122-F152 HydrophobicContact CB-CE1 4.32Å; L122-F152 HydrophobicContact CB-CZ 4.37Å; L122-F152 HydrophobicContact CD1-CD1 3.63Å; L122-F152 HydrophobicContact CD1-CD2 4.1Å; L122-F152 HydrophobicContact CD1-CE1 3.58Å; L122-F152 HydrophobicContact CD1-CE2 4.06Å; L122-F152 HydrophobicContact CD1-CG 3.89Å; L122-F152 HydrophobicContact CD1-CZ 3.8Å; L122-F152 HydrophobicContact CG-CD1 4.11Å; L122-F152 HydrophobicContact CG-CE1 3.76Å; L122-F152 HydrophobicContact CG-CZ 4.19Å
123	T	93.9	Very high	89.5	Confident	79 Å²	79	63.1 Å²	63.1	49%	0.485	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	158.2	169.8	53.7	0	0	0	0	110.5	M148 A149	T123-M148 WeakPolarHBondContact O-CA 3.45Å; T123-A149 PolarHBondContact O-N 2.96Å; T123-A149 WeakPolarHBondContact OG1-CB 3.28Å
124	I	91.8	Very high	89.2	Confident	28 Å²	28	61.8 Å²	61.8	14%	0.144	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	126.4	180	-56.5	164.3	0	0	0	108.7	L103 V105 T126 V127 L146 M148	L103-I124 HydrophobicContact CB-CD1 4.14Å; L103-I124 HydrophobicContact CD2-CD1 3.72Å; L103-I124 HydrophobicContact CG-CD1 4.19Å; V105-I124 HydrophobicContact CG2-CD1 4.09Å; V105-I124 HydrophobicContact CG2-CG1 3.97Å; I124-T126 WeakPolarHBondContact CG2-O 3.29Å; I124-V127 HydrophobicContact CG2-CG2 3.6Å; I124-L146 HydrophobicContact CD1-CD1 4.09Å; I124-L146 HydrophobicContact CD1-CD2 4.45Å; I124-L146 HydrophobicContact CG2-CB 4.35Å; I124-L146 HydrophobicContact CG2-CD2 4.5Å; I124-M148 HydrophobicContact CG1-CE 3.94Å
125	E	87.8	Confident	88.7	Confident	110 Å²	110	61.5 Å²	61.5	51%	0.514	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-52.5	173.3	-177.7	-176.1	-155.3	0	0	110.3	K147 A149	E125-K147 PolarHBondContact N-O 2.83Å; E125-K147 VanDerWaalsContact OE2-CD 3.3Å; E125-K147 WeakPolarHBondContact OE2-CD 3.4Å; E125-K147 WeakPolarHBondContact OE2-CE 3.48Å; E125-K147 IonicContact OE2-NZ 2.69Å; E125-K147 PolarHBondContact OE2-NZ 2.81Å; E125-A149 HydrophobicContact CB-CB 4.02Å
126	T	87.1	Confident	88.2	Confident	60 Å²	60	63.6 Å²	63.6	37%	0.368	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	140.2	-174.2	-51.5	0	0	0	0	110.6	I124 I128 K147	I124-T126 WeakPolarHBondContact CG2-O 3.29Å; T126-I128 HydrophobicContact CG2-CG1 4.1Å; T126-K147 PolarHBondContact N-O 2.87Å; T126-K147 PolarHBondContact O-N 2.78Å
127	V	89.9	Confident	87.5	Confident	46 Å²	46	68.9 Å²	68.9	28%	0.279	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.1	175.6	172.1	0	0	0	0	109.1	I94 V100 I124 I129 L146	I94-V127 HydrophobicContact CD1-CG1 3.14Å; V100-V127 HydrophobicContact CG1-CG2 3.57Å; V100-V127 HydrophobicContact CG2-CG2 4.36Å; I124-V127 HydrophobicContact CG2-CG2 3.6Å; V127-I129 HydrophobicContact CG1-CG1 4.2Å; V127-L146 HydrophobicContact CG1-CD2 4.28Å; V127-L146 HydrophobicContact CG2-CD2 3.92Å
128	I	87.9	Confident	86.9	Confident	38 Å²	38	65.7 Å²	65.7	20%	0.195	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	108.3	179.1	-46	179.7	0	0	0	107.9	W86 T126 A144 L145 W293 H297	W86-I128 HydrophobicContact CH2-CD1 4Å; W86-I128 HydrophobicContact CZ3-CD1 4.09Å; T126-I128 HydrophobicContact CG2-CG1 4.1Å; I128-A144 CarbonylContact O-C 3.39Å; I128-A144 VanDerWaalsContact O-CA 3.24Å; I128-A144 WeakPolarHBondContact O-CA 3.46Å; I128-L145 HydrophobicContact CB-CB 4.24Å; I128-L145 PolarHBondContact N-O 2.82Å; I128-L145 PolarHBondContact O-N 2.73Å; I128-W293 HydrophobicContact CG2-CZ2 3.87Å; I128-H297 HydrophobicContact CD1-CB 4.16Å
129	I	90.1	Very high	86.8	Confident	61 Å²	61	65.3 Å²	65.3	31%	0.313	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	138.2	175.3	-66.4	167.6	0	0	0	108	A91 I94 V127 F133 A144	A91-I129 HydrophobicContact CB-CG2 3.89Å; I94-I129 HydrophobicContact CD1-CD1 3.86Å; I94-I129 HydrophobicContact CD1-CG1 3.52Å; I94-I129 HydrophobicContact CG1-CD1 4.49Å; I94-I129 HydrophobicContact CG1-CG1 4.39Å; V127-I129 HydrophobicContact CG1-CG1 4.2Å; I129-F133 HydrophobicContact CG2-CB 3.91Å; I129-F133 HydrophobicContact CG2-CD1 3.85Å; I129-F133 HydrophobicContact CG2-CG 4.2Å; I129-A144 HydrophobicContact CG1-CB 4.18Å
130	H	88.5	Confident	86.5	Confident	14 Å²	14	65.1 Å²	65.1	7%	0.065	35%	0.345	C	S	.	.			trans	-56.8	131	177	-168.4	-74.7	0	0	0	111.3	H132 F133 Y141 I143 W293	H130-H132 AromaticContact CE1-CD2 3.79Å; H130-H132 PolarHBondContact ND1-N 3.18Å; H130-H132 PolarHBondContact O-N 3.06Å; H130-H132 VanDerWaalsContact O-N 3.14Å; H130-F133 VanDerWaalsContact O-CB 3.22Å; H130-F133 WeakPolarHBondContact O-CB 3.25Å; H130-F133 PolarHBondContact O-N 2.96Å; H130-Y141 AromaticContact CD2-CD1 4Å; H130-Y141 AromaticContact CE1-CD1 3.05Å; H130-Y141 WeakPolarHBondContact CE1-CD1 3.39Å; H130-Y141 AromaticContact CE1-CE1 3.52Å; H130-Y141 AromaticContact CE1-CG 3.65Å; H130-Y141 WeakPolarHBondContact ND1-CB 3.15Å; H130-Y141 AromaticContact ND1-CD1 3.45Å; H130-Y141 WeakPolarHBondContact ND1-CD1 3.35Å; H130-Y141 AromaticContact ND1-CG 3.6Å; H130-Y141 AromaticContact NE2-CD1 3.4Å; H130-Y141 WeakPolarHBondContact NE2-CD1 3.44Å; H130-Y141 AromaticContact NE2-CE1 3.84Å; H130-I143 HydrophobicContact CB-CG2 3.76Å; H130-I143 PolarHBondContact N-O 3.09Å; H130-W293 VanDerWaalsContact CA-CZ2 3.41Å; H130-W293 HydrophobicContact CB-CD2 4.5Å; H130-W293 HydrophobicContact CB-CH2 3.98Å; H130-W293 HydrophobicContact CB-CZ2 3.91Å; H130-W293 HydrophobicContact CB-CZ3 4.34Å; H130-W293 AromaticContact CD2-CD1 3.99Å; H130-W293 AromaticContact CD2-CD2 3.34Å; H130-W293 AromaticContact CD2-CE2 3.7Å; H130-W293 AromaticContact CD2-CE3 3.66Å; H130-W293 AromaticContact CD2-CG 3.53Å; H130-W293 AromaticContact NE2-CG 3.83Å
131	P	87.9	Confident	86.3	Confident	98 Å²	98	66.1 Å²	66.1	64%	0.636	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-27.5	-170.6	23	-34.8	0	0	0	113.9
132	H	86.6	Confident	86.2	Confident	128 Å²	128	63 Å²	63	59%	0.593	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	3.6	177	-63.2	-51.4	0	0	0	114.7	H130 Y141	H130-H132 AromaticContact CE1-CD2 3.79Å; H130-H132 PolarHBondContact ND1-N 3.18Å; H130-H132 PolarHBondContact O-N 3.06Å; H130-H132 VanDerWaalsContact O-N 3.14Å; H132-Y141 HydrophobicContact CB-CD1 4.38Å; H132-Y141 HydrophobicContact CB-CD2 3.49Å; H132-Y141 VanDerWaalsContact CB-CD2 3.49Å; H132-Y141 HydrophobicContact CB-CE2 3.78Å; H132-Y141 HydrophobicContact CB-CG 3.84Å
133	F	89.4	Confident	86.2	Confident	31 Å²	31	61.4 Å²	61.4	14%	0.136	32%	0.32	C	S	.	.			trans	-64.9	139.8	177.7	174.5	-114.9	0	0	0	112	A91 H92 A95 I129 H130 T135 M139 Y141 D142	A91-F133 HydrophobicContact CB-CB 4.28Å; A91-F133 HydrophobicContact CB-CD1 3.54Å; A91-F133 HydrophobicContact CB-CD2 3.69Å; A91-F133 HydrophobicContact CB-CE1 3.69Å; A91-F133 HydrophobicContact CB-CE2 3.82Å; A91-F133 HydrophobicContact CB-CG 3.53Å; A91-F133 HydrophobicContact CB-CZ 3.82Å; H92-F133 HydrophobicContact CB-CZ 3.91Å; A95-F133 HydrophobicContact CB-CE1 3.92Å; I129-F133 HydrophobicContact CG2-CB 3.91Å; I129-F133 HydrophobicContact CG2-CD1 3.85Å; I129-F133 HydrophobicContact CG2-CG 4.2Å; H130-F133 VanDerWaalsContact O-CB 3.22Å; H130-F133 WeakPolarHBondContact O-CB 3.25Å; H130-F133 PolarHBondContact O-N 2.96Å; F133-T135 HydrophobicContact CE1-CG2 3.91Å; F133-T135 HydrophobicContact CZ-CG2 4.08Å; F133-M139 HydrophobicContact CE2-CB 4.49Å; F133-Y141 WeakPolarHBondContact CB-O 3.45Å; F133-Y141 WeakPolarHBondContact CD2-O 3.43Å; F133-D142 HydrophobicContact CD2-CB 4.07Å; F133-D142 HydrophobicContact CE2-CB 3.81Å; F133-D142 VanDerWaalsContact CE2-OD1 3.28Å; F133-D142 WeakPolarHBondContact CE2-OD1 3.38Å
134	S	83.4	Confident	86.3	Confident	52 Å²	52	57.7 Å²	57.7	36%	0.364	30%	0.297	S	S	.	.			trans	-137.4	137.6	173.3	178.6	0	0	0	0	111.4	K136 M139	S134-K136 PolarHBondContact O-N 2.56Å; S134-K136 PolarHBondContact OG-N 3.33Å; S134-M139 WeakPolarHBondContact O-CA 3.35Å
135	T	80.8	Confident	86.5	Confident	102 Å²	102	56.3 Å²	56.3	63%	0.626	29%	0.29	S	S	*	.	S	Bend	trans	-72.9	-7.2	175	54.6	0	0	0	0	113.4	A95 F133	A95-T135 HydrophobicContact CB-CG2 4.34Å; F133-T135 HydrophobicContact CE1-CG2 3.91Å; F133-T135 HydrophobicContact CZ-CG2 4.08Å
136	K	79.4	Confident	86.8	Confident	163 Å²	163	51.1 Å²	51.1	71%	0.709	27%	0.266	S	S	*	.	S	Bend	trans	-84.2	137.8	174.6	-62.9	-178.6	-177.3	175.3	0	109.8	S134 M139	S134-K136 PolarHBondContact O-N 2.56Å; S134-K136 PolarHBondContact OG-N 3.33Å; K136-M139 PolarHBondContact O-N 2.92Å
137	K	71.3	Confident	87	Confident	121 Å²	121	51.2 Å²	51.2	53%	0.526	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	132.3	172.9	-65	-164	177.3	-162.9	0	109.9	M139 I218	K137-M139 VanDerWaalsContact CA-N 3.34Å; K137-I218 HydrophobicContact CB-CD1 4.32Å; K137-I218 HydrophobicContact CD-CD1 3.91Å
138	P	68.1	Low	87	Confident	29 Å²	29	49 Å²	49	19%	0.188	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	cis	-77.2	0.5	18.5	-10.4	23.9	0	0	0	118.9	D140 I218 S219 F223 W261	P138-D140 VanDerWaalsContact C-N 3.28Å; P138-D140 PolarHBondContact O-N 3.45Å; P138-I218 HydrophobicContact CB-CG2 3.38Å; P138-I218 HydrophobicContact CG-CG2 3.67Å; P138-S219 WeakPolarHBondContact CG-O 3.28Å; P138-F223 HydrophobicContact CB-CE1 4.42Å; P138-W261 PolarHBondContact O-NE1 3.28Å
139	M	81.9	Confident	86.9	Confident	32 Å²	32	50 Å²	50	16%	0.158	26%	0.262	C	S	.	.			trans	50.9	49.9	-166	-62.1	-171.7	-65.8	0	0	111.2	H92 F133 S134 K136 K137 D142 W261	H92-M139 HydrophobicContact CB-SD 4.5Å; F133-M139 HydrophobicContact CE2-CB 4.49Å; S134-M139 WeakPolarHBondContact O-CA 3.35Å; K136-M139 PolarHBondContact O-N 2.92Å; K137-M139 VanDerWaalsContact CA-N 3.34Å; M139-D142 HydrophobicContact CB-CB 4.48Å; M139-D142 WeakPolarHBondContact O-CB 3.23Å; M139-W261 HydrophobicContact CE-CB 3.56Å; M139-W261 HydrophobicContact CE-CG 3.66Å
140	D	85.7	Confident	86.5	Confident	33 Å²	33	48.3 Å²	48.3	18%	0.176	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	151.4	171.5	-93.9	-40.6	0	0	0	110.4	P138 D142 G220 K221 T222	P138-D140 VanDerWaalsContact C-N 3.28Å; P138-D140 PolarHBondContact O-N 3.45Å; D140-D142 VanDerWaalsContact C-N 3.27Å; D140-D142 PolarHBondContact O-N 2.8Å; D140-G220 WeakPolarHBondContact OD1-CA 3.14Å; D140-G220 WeakPolarHBondContact OD2-CA 3.42Å; D140-K221 PolarHBondContact OD1-N 3.03Å; D140-K221 PolarHBondContact OD2-N 2.8Å; D140-T222 PolarHBondContact OD1-N 2.89Å; D140-T222 PolarHBondContact OD1-OG1 3.46Å
141	Y	89.5	Confident	86.2	Confident	65 Å²	65	50.1 Å²	50.1	26%	0.255	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	38.6	-177.2	-58.3	-87.1	0	0	0	113.3	H130 H132 F133 I143 T222 V290	H130-Y141 AromaticContact CD2-CD1 4Å; H130-Y141 AromaticContact CE1-CD1 3.05Å; H130-Y141 WeakPolarHBondContact CE1-CD1 3.39Å; H130-Y141 AromaticContact CE1-CE1 3.52Å; H130-Y141 AromaticContact CE1-CG 3.65Å; H130-Y141 WeakPolarHBondContact ND1-CB 3.15Å; H130-Y141 AromaticContact ND1-CD1 3.45Å; H130-Y141 WeakPolarHBondContact ND1-CD1 3.35Å; H130-Y141 AromaticContact ND1-CG 3.6Å; H130-Y141 AromaticContact NE2-CD1 3.4Å; H130-Y141 WeakPolarHBondContact NE2-CD1 3.44Å; H130-Y141 AromaticContact NE2-CE1 3.84Å; H132-Y141 HydrophobicContact CB-CD1 4.38Å; H132-Y141 HydrophobicContact CB-CD2 3.49Å; H132-Y141 VanDerWaalsContact CB-CD2 3.49Å; H132-Y141 HydrophobicContact CB-CE2 3.78Å; H132-Y141 HydrophobicContact CB-CG 3.84Å; F133-Y141 WeakPolarHBondContact CB-O 3.45Å; F133-Y141 WeakPolarHBondContact CD2-O 3.43Å; Y141-I143 PolarHBondContact O-N 2.88Å; Y141-T222 HydrophobicContact CD1-CG2 3.77Å; Y141-T222 HydrophobicContact CD2-CG2 4.02Å; Y141-T222 HydrophobicContact CE1-CG2 3.5Å; Y141-T222 VanDerWaalsContact CE1-CG2 3.5Å; Y141-T222 HydrophobicContact CE2-CG2 3.72Å; Y141-T222 HydrophobicContact CG-CG2 4.03Å; Y141-T222 VanDerWaalsContact CZ-CG2 3.45Å; Y141-T222 PolarHBondContact N-OG1 2.89Å; Y141-V290 HydrophobicContact CD1-CG1 3.84Å; Y141-V290 HydrophobicContact CE1-CG1 4.27Å
142	D	94.4	Very high	85.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.248	C	C	.	.			trans	-76	64.9	179.8	-174.6	28	0	0	0	112.5	A90 A91 H92 F133 M139 D140 S260 T285	A90-D142 WeakPolarHBondContact CA-O 3.29Å; A91-D142 PolarHBondContact N-OD1 2.75Å; H92-D142 IonicContact CE1-OD2 2.85Å; H92-D142 PolarHBondContact CE1-OD2 2.84Å; H92-D142 IonicContact CG-OD1 2.6Å; H92-D142 IonicContact CG-OD2 2.64Å; H92-D142 PolarHBondContact N-OD1 3.01Å; H92-D142 IonicContact ND1-OD1 3.29Å; H92-D142 PolarHBondContact ND1-OD1 2.81Å; H92-D142 IonicContact ND1-OD2 2.64Å; H92-D142 PolarHBondContact ND1-OD2 3Å; F133-D142 HydrophobicContact CD2-CB 4.07Å; F133-D142 HydrophobicContact CE2-CB 3.81Å; F133-D142 VanDerWaalsContact CE2-OD1 3.28Å; F133-D142 WeakPolarHBondContact CE2-OD1 3.38Å; M139-D142 HydrophobicContact CB-CB 4.48Å; M139-D142 WeakPolarHBondContact O-CB 3.23Å; D140-D142 VanDerWaalsContact C-N 3.27Å; D140-D142 PolarHBondContact O-N 2.8Å; D142-S260 WeakPolarHBondContact CB-OG 3.49Å; D142-S260 WeakPolarHBondContact OD2-CB 3.29Å; D142-S260 PolarHBondContact OD2-OG 2.9Å; D142-T285 PolarHBondContact O-OG1 3.01Å
143	I	95.6	Very high	85.6	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.			trans	-139.4	140.8	-178	-169.4	170.9	0	0	0	111.7	I88 H130 Y141 T285 I287 V290 W293 I294	I88-I143 HydrophobicContact CG2-CD1 3.81Å; I88-I143 HydrophobicContact CG2-CG1 3.86Å; H130-I143 HydrophobicContact CB-CG2 3.76Å; H130-I143 PolarHBondContact N-O 3.09Å; Y141-I143 PolarHBondContact O-N 2.88Å; I143-T285 HydrophobicContact CB-CG2 4.24Å; I143-T285 HydrophobicContact CG2-CG2 4.5Å; I143-I287 HydrophobicContact CD1-CD1 3.85Å; I143-V290 HydrophobicContact CD1-CG2 3.69Å; I143-V290 HydrophobicContact CG2-CB 4.44Å; I143-V290 HydrophobicContact CG2-CG1 4.36Å; I143-V290 HydrophobicContact CG2-CG2 4.35Å; I143-W293 HydrophobicContact CD1-CZ3 4.37Å; I143-W293 HydrophobicContact CG1-CZ3 4.17Å; I143-W293 HydrophobicContact CG2-CE3 4.22Å; I143-W293 HydrophobicContact CG2-CH2 4.42Å; I143-W293 HydrophobicContact CG2-CZ3 3.78Å; I143-I294 HydrophobicContact CD1-CD1 3.65Å; I143-I294 HydrophobicContact CD1-CG1 3.98Å
144	A	95.4	Very high	85.2	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	151.2	173.6	0	0	0	0	0	112.1	T89 A91 I94 I128 I129	T89-A144 HydrophobicContact CG2-CB 4.3Å; T89-A144 PolarHBondContact N-O 3.01Å; T89-A144 PolarHBondContact O-N 2.91Å; A91-A144 HydrophobicContact CB-CB 4.32Å; I94-A144 HydrophobicContact CD1-CB 3.48Å; I94-A144 VanDerWaalsContact CD1-CB 3.48Å; I94-A144 HydrophobicContact CG1-CB 3.93Å; I128-A144 CarbonylContact O-C 3.39Å; I128-A144 VanDerWaalsContact O-CA 3.24Å; I128-A144 WeakPolarHBondContact O-CA 3.46Å; I129-A144 HydrophobicContact CG1-CB 4.18Å
145	L	95.4	Very high	84.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.1	177.1	-48.9	179.2	0	0	0	109.2	W86 I88 I128 W293 I294 H297 I298	W86-L145 HydrophobicContact CE3-CB 4.28Å; W86-L145 HydrophobicContact CZ3-CB 4.06Å; I88-L145 HydrophobicContact CB-CD2 4.44Å; I88-L145 HydrophobicContact CD1-CD2 4.15Å; I88-L145 HydrophobicContact CG1-CD2 3.78Å; I88-L145 HydrophobicContact CG2-CD2 4.36Å; I128-L145 HydrophobicContact CB-CB 4.24Å; I128-L145 PolarHBondContact N-O 2.82Å; I128-L145 PolarHBondContact O-N 2.73Å; L145-W293 HydrophobicContact CD1-CE3 4.31Å; L145-W293 HydrophobicContact CD1-CH2 3.9Å; L145-W293 HydrophobicContact CD1-CZ2 4.42Å; L145-W293 HydrophobicContact CD1-CZ3 3.82Å; L145-W293 HydrophobicContact CD2-CH2 4.33Å; L145-W293 HydrophobicContact CD2-CZ3 3.89Å; L145-W293 HydrophobicContact CG-CH2 3.59Å; L145-W293 HydrophobicContact CG-CZ2 4.48Å; L145-W293 HydrophobicContact CG-CZ3 3.59Å; L145-I294 HydrophobicContact CD2-CG1 4.45Å; L145-H297 HydrophobicContact CD1-CB 3.39Å; L145-I298 HydrophobicContact CB-CG1 4.48Å; L145-I298 HydrophobicContact CD1-CD1 3.92Å; L145-I298 HydrophobicContact CD1-CG1 3.57Å; L145-I298 HydrophobicContact CD2-CD1 3.56Å; L145-I298 HydrophobicContact CD2-CG1 4.19Å; L145-I298 HydrophobicContact CG-CD1 4.17Å; L145-I298 HydrophobicContact CG-CG1 4.26Å
146	L	94.4	Very high	84.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.8	178.2	-49	179	0	0	0	108.2	L69 W86 V87 T89 I94 V105 I124 V127 M148	L69-L146 HydrophobicContact CD2-CD1 4.19Å; L69-L146 HydrophobicContact CG-CD1 4.49Å; W86-L146 WeakPolarHBondContact CA-O 3.46Å; V87-L146 HydrophobicContact CB-CB 4.34Å; V87-L146 HydrophobicContact CG1-CD1 4.37Å; V87-L146 PolarHBondContact N-O 2.81Å; V87-L146 PolarHBondContact O-N 2.9Å; T89-L146 HydrophobicContact CG2-CD1 3.85Å; T89-L146 HydrophobicContact CG2-CD2 4.36Å; T89-L146 HydrophobicContact CG2-CG 4.03Å; I94-L146 HydrophobicContact CD1-CD2 4.12Å; I94-L146 HydrophobicContact CG2-CD2 4.49Å; V105-L146 HydrophobicContact CG2-CD1 4.19Å; I124-L146 HydrophobicContact CD1-CD1 4.09Å; I124-L146 HydrophobicContact CD1-CD2 4.45Å; I124-L146 HydrophobicContact CG2-CB 4.35Å; I124-L146 HydrophobicContact CG2-CD2 4.5Å; V127-L146 HydrophobicContact CG1-CD2 4.28Å; V127-L146 HydrophobicContact CG2-CD2 3.92Å; L146-M148 HydrophobicContact CB-CE 3.36Å; L146-M148 WeakPolarHBondContact O-CE 3.1Å
147	K	90.6	Very high	84.7	Confident	62 Å²	62	42.4 Å²	42.4	27%	0.27	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	122.5	168.3	-168.6	-178.6	176.1	-163.4	0	108.6	Q85 W86 E125 T126	Q85-K147 CarbonylContact O-C 3.28Å; Q85-K147 WeakPolarHBondContact O-CA 3.27Å; W86-K147 HydrophobicContact CD2-CB 4.42Å; W86-K147 HydrophobicContact CD2-CG 4.46Å; W86-K147 HydrophobicContact CE3-CB 4.08Å; W86-K147 HydrophobicContact CH2-CB 3.87Å; W86-K147 HydrophobicContact CH2-CD 4.2Å; W86-K147 HydrophobicContact CH2-CG 4.18Å; W86-K147 HydrophobicContact CZ2-CB 4.19Å; W86-K147 HydrophobicContact CZ2-CD 3.95Å; W86-K147 HydrophobicContact CZ2-CG 3.99Å; W86-K147 HydrophobicContact CZ3-CB 3.8Å; W86-K147 HydrophobicContact CZ3-CG 4.46Å; E125-K147 PolarHBondContact N-O 2.83Å; E125-K147 VanDerWaalsContact OE2-CD 3.3Å; E125-K147 WeakPolarHBondContact OE2-CD 3.4Å; E125-K147 WeakPolarHBondContact OE2-CE 3.48Å; E125-K147 IonicContact OE2-NZ 2.69Å; E125-K147 PolarHBondContact OE2-NZ 2.81Å; T126-K147 PolarHBondContact N-O 2.87Å; T126-K147 PolarHBondContact O-N 2.78Å
148	M	90.3	Very high	85.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	143.5	178.8	-57.5	-59.9	94	0	0	110.1	Q85 V87 V105 L122 T123 I124 L146 G150 F152	Q85-M148 PolarHBondContact O-N 2.8Å; V87-M148 HydrophobicContact CB-CE 4.4Å; V87-M148 HydrophobicContact CG2-CE 4.45Å; V87-M148 HydrophobicContact CG2-SD 4.44Å; V105-M148 HydrophobicContact CB-SD 3.85Å; V105-M148 HydrophobicContact CG1-SD 4.32Å; V105-M148 HydrophobicContact CG2-CE 4.03Å; V105-M148 HydrophobicContact CG2-SD 3.88Å; L122-M148 HydrophobicContact CB-CB 4.28Å; L122-M148 HydrophobicContact CB-CG 4.41Å; L122-M148 HydrophobicContact CB-SD 4.19Å; L122-M148 HydrophobicContact CD1-CB 3.93Å; L122-M148 HydrophobicContact CD1-CG 4.11Å; T123-M148 WeakPolarHBondContact O-CA 3.45Å; I124-M148 HydrophobicContact CG1-CE 3.94Å; L146-M148 HydrophobicContact CB-CE 3.36Å; L146-M148 WeakPolarHBondContact O-CE 3.1Å; M148-G150 WeakPolarHBondContact CB-O 3.45Å; M148-G150 PolarHBondContact O-N 2.8Å; M148-G150 VanDerWaalsContact O-N 3.17Å; M148-F152 HydrophobicContact CG-CD2 4.48Å; M148-F152 HydrophobicContact CG-CE2 3.7Å; M148-F152 HydrophobicContact CG-CZ 4.13Å; M148-F152 HydrophobicContact SD-CE2 4.19Å; M148-F152 HydrophobicContact SD-CZ 4.13Å
149	A	85.2	Confident	86.1	Confident	59 Å²	59	35.8 Å²	35.8	49%	0.488	20%	0.203	S	C	.	.	S	Bend	trans	-69.9	-5.6	174.5	0	0	0	0	0	113.8	T123 E125	T123-A149 PolarHBondContact O-N 2.96Å; T123-A149 WeakPolarHBondContact OG1-CB 3.28Å; E125-A149 HydrophobicContact CB-CB 4.02Å
150	G	83.3	Confident	86.4	Confident	25 Å²	25	34.8 Å²	34.8	26%	0.258	20%	0.199	S	C	.	.	S	Bend	trans	-140.1	-164.2	173.1	0	0	0	0	0	110.5	Q85 M148	Q85-G150 WeakPolarHBondContact CG-O 3.41Å; M148-G150 WeakPolarHBondContact CB-O 3.45Å; M148-G150 PolarHBondContact O-N 2.8Å; M148-G150 VanDerWaalsContact O-N 3.17Å
151	A	81.1	Confident	86.7	Confident	52 Å²	52	33.3 Å²	33.3	43%	0.43	19%	0.191	S	C	.	.			trans	-125.6	135.2	177.8	0	0	0	0	0	111.4	P84 Q85	P84-A151 HydrophobicContact CB-CB 4.1Å; P84-A151 CarbonylContact O-C 3.57Å; P84-A151 WeakPolarHBondContact O-CA 3.31Å; Q85-A151 HydrophobicContact CG-CB 3.8Å
152	F	80.8	Confident	86.5	Confident	7 Å²	7	30.9 Å²	30.9	3%	0.031	18%	0.184	C	C	.	.			trans	-66.1	133.9	170	-65.3	-66.8	0	0	0	110.3	I81 P84 V87 V105 A107 Q120 L122 M148 F154 V158	I81-F152 HydrophobicContact CD1-CD2 4.12Å; I81-F152 HydrophobicContact CD1-CE2 4.31Å; I81-F152 HydrophobicContact CD1-CG 4.33Å; I81-F152 HydrophobicContact CG1-CD2 4.35Å; I81-F152 HydrophobicContact CG1-CE2 4.27Å; I81-F152 HydrophobicContact CG2-CD2 4.32Å; P84-F152 VanDerWaalsContact O-CD2 3.28Å; P84-F152 WeakPolarHBondContact O-CD2 3.28Å; P84-F152 PolarHBondContact O-N 3.1Å; V87-F152 HydrophobicContact CG2-CE2 3.84Å; V87-F152 HydrophobicContact CG2-CZ 4.45Å; V105-F152 HydrophobicContact CG1-CZ 4.1Å; A107-F152 HydrophobicContact CB-CD1 3.71Å; A107-F152 HydrophobicContact CB-CE1 3.5Å; A107-F152 VanDerWaalsContact CB-CE1 3.5Å; A107-F152 HydrophobicContact CB-CZ 4.16Å; Q120-F152 HydrophobicContact CB-CD1 4.04Å; Q120-F152 HydrophobicContact CB-CE1 4.41Å; L122-F152 HydrophobicContact CB-CE1 4.32Å; L122-F152 HydrophobicContact CB-CZ 4.37Å; L122-F152 HydrophobicContact CD1-CD1 3.63Å; L122-F152 HydrophobicContact CD1-CD2 4.1Å; L122-F152 HydrophobicContact CD1-CE1 3.58Å; L122-F152 HydrophobicContact CD1-CE2 4.06Å; L122-F152 HydrophobicContact CD1-CG 3.89Å; L122-F152 HydrophobicContact CD1-CZ 3.8Å; L122-F152 HydrophobicContact CG-CD1 4.11Å; L122-F152 HydrophobicContact CG-CE1 3.76Å; L122-F152 HydrophobicContact CG-CZ 4.19Å; M148-F152 HydrophobicContact CG-CD2 4.48Å; M148-F152 HydrophobicContact CG-CE2 3.7Å; M148-F152 HydrophobicContact CG-CZ 4.13Å; M148-F152 HydrophobicContact SD-CE2 4.19Å; M148-F152 HydrophobicContact SD-CZ 4.13Å; F152-F154 HydrophobicContact CB-CD1 4.36Å; F152-F154 HydrophobicContact CB-CE1 4.13Å; F152-F154 PolarHBondContact O-N 3.09Å; F152-V158 HydrophobicContact CB-CG1 3.99Å; F152-V158 HydrophobicContact CD1-CG1 4.4Å; F152-V158 HydrophobicContact CG-CG1 4.36Å
153	Q	82.1	Confident	86.1	Confident	153 Å²	153	32.2 Å²	32.2	72%	0.715	19%	0.191	S	C	*	.			trans	-86.3	110.1	171.3	-62.2	-178.1	13.6	0	0	108.7	Q120	Q120-Q153 PolarHBondContact NE2-O 2.82Å
154	F	81.3	Confident	85.5	Confident	52 Å²	52	32.5 Å²	32.5	23%	0.228	19%	0.193	C	C	.	.			trans	-71.5	141.3	179.8	-62.1	-24.6	0	0	0	112.1	P31 I81 P84 F152 V158 P160	P31-F154 HydrophobicContact CB-CB 4.48Å; P31-F154 HydrophobicContact CG-CB 3.3Å; P31-F154 HydrophobicContact CG-CD2 3.74Å; P31-F154 HydrophobicContact CG-CG 3.97Å; I81-F154 HydrophobicContact CG2-CE1 3.89Å; I81-F154 HydrophobicContact CG2-CZ 4.15Å; P84-F154 HydrophobicContact CB-CZ 4.21Å; P84-F154 HydrophobicContact CG-CD2 4.39Å; P84-F154 HydrophobicContact CG-CE2 3.62Å; P84-F154 HydrophobicContact CG-CZ 3.72Å; F152-F154 HydrophobicContact CB-CD1 4.36Å; F152-F154 HydrophobicContact CB-CE1 4.13Å; F152-F154 PolarHBondContact O-N 3.09Å; F154-V158 CarbonylContact C-O 3.59Å; F154-V158 VanDerWaalsContact CA-O 3.27Å; F154-V158 WeakPolarHBondContact CA-O 3.32Å; F154-V158 HydrophobicContact CD1-CG1 4.26Å; F154-P160 HydrophobicContact CD2-CG 4.25Å; F154-P160 HydrophobicContact CE2-CB 4.24Å; F154-P160 HydrophobicContact CE2-CG 3.55Å; F154-P160 HydrophobicContact CZ-CB 3.88Å; F154-P160 HydrophobicContact CZ-CG 3.69Å
155	G	72.7	Confident	84.4	Confident	44 Å²	44	37.7 Å²	37.7	45%	0.454	22%	0.217	S	C	.	.	S	Bend	trans	-166.9	-147.5	-174.6	0	0	0	0	0	111.4	V158	G155-V158 PolarHBondContact N-O 2.86Å
156	H	76	Confident	82.5	Confident	88 Å²	88	42.6 Å²	42.6	41%	0.407	24%	0.243	S	C	.	.	S	Bend	trans	-69.9	-37.6	-177	-156.7	118.2	0	0	0	113
157	F	83.4	Confident	80.8	Confident	68 Å²	68	53.7 Å²	53.7	30%	0.298	29%	0.285	S	S	.	.	S	Bend	trans	-108.4	-8.6	-171.8	-51.1	-58.6	0	0	0	113.7	K60 P64 G108	K60-F157 HydrophobicContact CD-CE1 4.49Å; K60-F157 HydrophobicContact CG-CD1 4.1Å; K60-F157 HydrophobicContact CG-CE1 4.12Å; P64-F157 WeakPolarHBondContact CA-O 3.29Å; G108-F157 WeakPolarHBondContact CA-O 3.49Å
158	V	85.2	Confident	79.8	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.018	28%	0.279	C	S	.	.			trans	-132.2	125.7	-178.3	-176.6	0	0	0	0	109	P64 I81 A107 F152 F154 G155	P64-V158 WeakPolarHBondContact O-CA 2.96Å; I81-V158 HydrophobicContact CD1-CG1 3.79Å; A107-V158 HydrophobicContact CB-CG1 3.83Å; A107-V158 HydrophobicContact CB-CG2 4Å; F152-V158 HydrophobicContact CB-CG1 3.99Å; F152-V158 HydrophobicContact CD1-CG1 4.4Å; F152-V158 HydrophobicContact CG-CG1 4.36Å; F154-V158 CarbonylContact C-O 3.59Å; F154-V158 VanDerWaalsContact CA-O 3.27Å; F154-V158 WeakPolarHBondContact CA-O 3.32Å; F154-V158 HydrophobicContact CD1-CG1 4.26Å; G155-V158 PolarHBondContact N-O 2.86Å
159	G	83.4	Confident	78.9	Confident	8 Å²	8	59.9 Å²	59.9	8%	0.082	31%	0.314	C	S	.	.			trans	-170.6	166.3	-178.8	0	0	0	0	0	112.3	P64 W65	P64-G159 CarbonylContact C-O 3.57Å; P64-G159 PolarHBondContact O-N 2.8Å; W65-G159 WeakPolarHBondContact CA-O 3.02Å; W65-G159 VanDerWaalsContact CB-O 3.26Å; W65-G159 WeakPolarHBondContact CB-O 3.38Å; W65-G159 PolarHBondContact N-O 2.87Å
160	P	88.3	Confident	78.8	Confident	12 Å²	12	58.7 Å²	58.7	8%	0.078	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-89.7	147.6	-175.6	31.7	-28.4	0	0	0	112.8	C33 G34 I81 F154	C33-P160 CarbonylContact C-O 3.51Å; C33-P160 VanDerWaalsContact CA-O 3.28Å; C33-P160 WeakPolarHBondContact CA-O 3.25Å; C33-P160 HydrophobicContact CB-CB 4.42Å; C33-P160 HydrophobicContact CB-CG 4.14Å; G34-P160 PolarHBondContact N-O 2.9Å; I81-P160 HydrophobicContact CG2-CB 4.37Å; I81-P160 CarbonylContact O-C 3.42Å; I81-P160 VanDerWaalsContact O-CA 3.28Å; I81-P160 WeakPolarHBondContact O-CA 3.43Å; F154-P160 HydrophobicContact CD2-CG 4.25Å; F154-P160 HydrophobicContact CE2-CB 4.24Å; F154-P160 HydrophobicContact CE2-CG 3.55Å; F154-P160 HydrophobicContact CZ-CB 3.88Å; F154-P160 HydrophobicContact CZ-CG 3.69Å
161	I	92.1	Very high	78.6	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-82.9	151.7	163.7	-163.2	167.9	0	0	0	109.7	W65 I81 V82 M245 W253 L255	W65-I161 HydrophobicContact CB-CB 3.84Å; W65-I161 HydrophobicContact CB-CG2 4.41Å; W65-I161 HydrophobicContact CD2-CB 3.77Å; W65-I161 HydrophobicContact CD2-CD1 4.39Å; W65-I161 HydrophobicContact CD2-CG1 4.11Å; W65-I161 HydrophobicContact CE3-CB 4.25Å; W65-I161 HydrophobicContact CG-CB 3.57Å; W65-I161 HydrophobicContact CG-CD1 4.37Å; W65-I161 HydrophobicContact CG-CG1 4.26Å; W65-I161 HydrophobicContact CG-CG2 4.45Å; I81-I161 PolarHBondContact O-N 3.49Å; V82-I161 HydrophobicContact CG1-CG2 4.07Å; I161-M245 HydrophobicContact CD1-CB 3.75Å; I161-W253 WeakPolarHBondContact CG1-O 3.49Å; I161-L255 HydrophobicContact CD1-CB 3.94Å; I161-L255 HydrophobicContact CD1-CD1 4.14Å; I161-L255 HydrophobicContact CG1-CB 4.33Å; I161-L255 HydrophobicContact CG2-CB 3.99Å
162	C	86.4	Confident	78.7	Confident	14 Å²	14	64.3 Å²	64.3	10%	0.095	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-76.8	145.1	173.2	-60.3	0	0	0	0	111.2	C33 W253 T254 L255	C33-C162 HydrophobicContact CB-CB 4.01Å; C33-C162 WeakPolarHBondContact CB-SG 3.48Å; C33-C162 PolarHBondContact O-SG 2.82Å; C33-C162 WeakPolarHBondContact SG-CA 3.47Å; C33-C162 WeakPolarHBondContact SG-CB 3.4Å; C33-C162 CovalentContact SG-SG 2.05Å; C33-C162 PolarHBondContact SG-SG 3.01Å; C162-W253 WeakPolarHBondContact CB-O 3.34Å; C162-W253 PolarHBondContact N-O 3.03Å; C162-T254 CarbonylContact O-C 3.59Å; C162-T254 WeakPolarHBondContact O-CA 3.4Å; C162-L255 PolarHBondContact O-N 3.02Å
163	L	86	Confident	78.7	Confident	29 Å²	29	66.5 Å²	66.5	15%	0.152	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-83.2	150.8	161.5	-69.2	171.4	0	0	0	109.5	V82 I88 L255 I287 L291 I294 T300	V82-L163 HydrophobicContact CG1-CD2 4.09Å; V82-L163 HydrophobicContact CG1-CG 4.3Å; I88-L163 HydrophobicContact CD1-CD2 3.89Å; L163-L255 HydrophobicContact CD2-CD2 4.31Å; L163-I287 HydrophobicContact CD2-CG2 4.36Å; L163-L291 HydrophobicContact CB-CD1 4.21Å; L163-I294 HydrophobicContact CD1-CG2 3.75Å; L163-I294 HydrophobicContact CD2-CG2 4.32Å; L163-T300 HydrophobicContact CD1-CG2 4.36Å
164	P	81.6	Confident	78.8	Confident	6 Å²	6	63.6 Å²	63.6	4%	0.039	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-67.4	147.7	179.3	25.7	-30.8	0	0	0	111.4	E168 F170 T254 L255 I287 L291	P164-E168 HydrophobicContact CB-CB 4.39Å; P164-F170 HydrophobicContact CB-CE2 4.41Å; P164-T254 VanDerWaalsContact CA-CG2 3.46Å; P164-T254 HydrophobicContact CB-CG2 3.8Å; P164-T254 HydrophobicContact CG-CG2 4.46Å; P164-L255 WeakPolarHBondContact CD-O 3.36Å; P164-I287 HydrophobicContact CG-CB 4.33Å; P164-I287 HydrophobicContact CG-CG2 3.56Å; P164-L291 HydrophobicContact CG-CD1 4.18Å; P164-L291 HydrophobicContact CG-CD2 4.3Å; P164-L291 VanDerWaalsContact O-CD2 3.29Å; P164-L291 WeakPolarHBondContact O-CD2 3.31Å
165	E	73.3	Confident	79.1	Confident	109 Å²	109	63.8 Å²	63.8	51%	0.509	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-70.1	153.5	171.1	-59.8	176.3	-174.4	0	0	110.2	R167 E168 K250	E165-R167 PolarHBondContact O-N 2.78Å; E165-E168 HydrophobicContact CB-CB 4.03Å; E165-E168 PolarHBondContact N-OE2 2.01Å; E165-E168 VanDerWaalsContact N-OE2 3.11Å; E165-E168 WeakPolarHBondContact O-CB 3.34Å; E165-E168 PolarHBondContact O-N 3.31Å; E165-K250 IonicContact OE1-NZ 2.81Å; E165-K250 PolarHBondContact OE1-NZ 3.39Å
166	L	56.1	Low	80.1	Confident	103 Å²	103	61.7 Å²	61.7	54%	0.539	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-7.9	-173.5	-96.9	146.3	0	0	0	116.5	L291 H332	L166-L291 HydrophobicContact CG-CD2 4.38Å; L166-H332 WeakPolarHBondContact CD1-CE1 3.46Å
167	R	58.2	Low	80.9	Confident	233 Å²	233	57.7 Å²	57.7	88%	0.879	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	6.7	174.5	-60	-176.6	-175	-179	1.9	112.9	E165 Q169	E165-R167 PolarHBondContact O-N 2.78Å; R167-Q169 PolarHBondContact O-N 3Å
168	E	68.6	Low	81.3	Confident	35 Å²	35	54.6 Å²	54.6	16%	0.164	28%	0.277	C	S	.	.			trans	-77.1	118.1	176	-175.2	170	-158.7	0	0	109	P164 E165 F170 N248	P164-E168 HydrophobicContact CB-CB 4.39Å; E165-E168 HydrophobicContact CB-CB 4.03Å; E165-E168 PolarHBondContact N-OE2 2.01Å; E165-E168 VanDerWaalsContact N-OE2 3.11Å; E165-E168 WeakPolarHBondContact O-CB 3.34Å; E165-E168 PolarHBondContact O-N 3.31Å; E168-F170 HydrophobicContact CG-CE1 4.48Å; E168-F170 HydrophobicContact CG-CZ 4.18Å; E168-N248 WeakPolarHBondContact OE1-CB 3.16Å
169	Q	72.3	Confident	81.6	Confident	157 Å²	157	54.6 Å²	54.6	73%	0.734	28%	0.277	S	S	*	.			trans	-121.1	139.2	178.3	-64.6	-177.1	7.4	0	0	109	R167	R167-Q169 PolarHBondContact O-N 3Å
170	F	82.3	Confident	82	Confident	33 Å²	33	54.3 Å²	54.3	15%	0.145	28%	0.275	C	S	.	.			trans	-98.3	103	171.3	-56.2	-71.2	0	0	0	107.5	P164 E168 F174 I201 C246 T254 A256	P164-F170 HydrophobicContact CB-CE2 4.41Å; E168-F170 HydrophobicContact CG-CE1 4.48Å; E168-F170 HydrophobicContact CG-CZ 4.18Å; F170-F174 HydrophobicContact CD1-CD1 4.32Å; F170-I201 HydrophobicContact CB-CD1 3.43Å; F170-I201 VanDerWaalsContact CB-CD1 3.43Å; F170-I201 HydrophobicContact CG-CD1 4.5Å; F170-C246 HydrophobicContact CD1-CB 3.37Å; F170-C246 HydrophobicContact CD2-CB 4.3Å; F170-C246 HydrophobicContact CE1-CB 3.4Å; F170-C246 HydrophobicContact CE2-CB 4.31Å; F170-C246 HydrophobicContact CG-CB 3.86Å; F170-C246 HydrophobicContact CZ-CB 3.9Å; F170-T254 HydrophobicContact CE2-CG2 4.23Å; F170-T254 HydrophobicContact CZ-CG2 3.77Å; F170-A256 HydrophobicContact CD2-CB 3.45Å; F170-A256 VanDerWaalsContact CD2-CB 3.45Å; F170-A256 HydrophobicContact CE2-CB 3.61Å; F170-A256 HydrophobicContact CG-CB 4.25Å
171	E	79.6	Confident	82.2	Confident	143 Å²	143	53.8 Å²	53.8	67%	0.668	27%	0.271	S	S	*	.			trans	-65.7	157.3	-174.6	-65.6	178.4	-175.8	0	0	112.1	G173 F174	E171-G173 PolarHBondContact O-N 3.13Å; E171-F174 WeakPolarHBondContact O-CB 3.43Å; E171-F174 PolarHBondContact O-N 3.46Å
172	A	83.3	Confident	81.9	Confident	53 Å²	53	53.9 Å²	53.9	44%	0.438	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	139.3	173.8	0	0	0	0	0	111.2	F174 T203	A172-F174 VanDerWaalsContact C-N 3.34Å; A172-T203 HydrophobicContact CB-CG2 3.44Å; A172-T203 VanDerWaalsContact CB-CG2 3.44Å
173	G	80.7	Confident	81.7	Confident	53 Å²	53	57.4 Å²	57.4	55%	0.546	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-9.6	-172.6	0	0	0	0	0	114.8	E171 I175 I201	E171-G173 PolarHBondContact O-N 3.13Å; G173-I175 PolarHBondContact O-N 2.81Å; G173-I201 PolarHBondContact N-O 3.27Å
174	F	85	Confident	81.3	Confident	92 Å²	92	59.8 Å²	59.8	40%	0.404	30%	0.296	S	S	.	.			trans	-61.1	131.3	169.1	-117	-110	0	0	0	110.2	F170 E171 A172 P200 I201	F170-F174 HydrophobicContact CD1-CD1 4.32Å; E171-F174 WeakPolarHBondContact O-CB 3.43Å; E171-F174 PolarHBondContact O-N 3.46Å; A172-F174 VanDerWaalsContact C-N 3.34Å; F174-P200 CarbonylContact O-C 3.53Å; F174-P200 WeakPolarHBondContact O-CA 3.36Å; F174-I201 HydrophobicContact CB-CD1 4.23Å; F174-I201 PolarHBondContact O-N 3.45Å
175	I	88	Confident	81.1	Confident	56 Å²	56	63.7 Å²	63.7	29%	0.287	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	116.7	174.9	-55.8	-60.9	0	0	0	108.3	W43 G173 N198 P200	W43-I175 HydrophobicContact CH2-CB 4.07Å; W43-I175 HydrophobicContact CH2-CG2 4.05Å; G173-I175 PolarHBondContact O-N 2.81Å; I175-N198 HydrophobicContact CG2-CB 3.79Å; I175-P200 HydrophobicContact CD1-CB 3.7Å
176	C	92.4	Very high	81.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	157.9	176.4	-57.3	0	0	0	0	109.9	N198 L199 L244 M245 C246	C176-N198 CarbonylContact O-C 3.56Å; C176-N198 WeakPolarHBondContact O-CA 3.45Å; C176-L199 PolarHBondContact N-O 3.03Å; C176-L199 PolarHBondContact O-N 3.23Å; C176-L244 HydrophobicContact CB-CD1 3.88Å; C176-L244 HydrophobicContact CB-CG 4.07Å; C176-M245 CarbonylContact C-O 3.52Å; C176-M245 WeakPolarHBondContact CA-O 3.32Å; C176-M245 WeakPolarHBondContact CB-O 3.47Å; C176-C246 HydrophobicContact CB-CB 4.1Å; C176-C246 WeakPolarHBondContact CB-SG 3.42Å; C176-C246 WeakPolarHBondContact SG-CB 3.41Å; C176-C246 CovalentContact SG-SG 2.02Å; C176-C246 PolarHBondContact SG-SG 3.29Å
177	T	92.8	Very high	82.2	Confident	4 Å²	4	60.6 Å²	60.6	3%	0.025	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	142.8	-177.3	-50.7	0	0	0	0	108.8	E196 V197 N198 M245	T177-E196 HydrophobicContact CG2-CB 3.9Å; T177-V197 CarbonylContact C-O 3.57Å; T177-V197 WeakPolarHBondContact CA-O 2.88Å; T177-N198 PolarHBondContact OG1-OD1 2.78Å; T177-M245 PolarHBondContact N-O 2.83Å; T177-M245 WeakPolarHBondContact O-CG 3.43Å; T177-M245 PolarHBondContact O-N 2.78Å
178	T	92.1	Very high	83.2	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.018	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	148.3	164.6	-173.2	0	0	0	0	109	E196 V197 L199 A235 S243	T178-E196 CarbonylContact O-C 3.59Å; T178-E196 VanDerWaalsContact O-CA 3.29Å; T178-E196 WeakPolarHBondContact O-CA 3.16Å; T178-V197 HydrophobicContact CG2-CG1 3.36Å; T178-V197 PolarHBondContact N-O 3.4Å; T178-V197 PolarHBondContact O-N 2.85Å; T178-L199 HydrophobicContact CG2-CD1 3.77Å; T178-A235 HydrophobicContact CG2-CB 4.25Å; T178-S243 VanDerWaalsContact CA-O 3.3Å; T178-S243 WeakPolarHBondContact CA-O 3.32Å; T178-S243 VanDerWaalsContact CB-O 3.3Å; T178-S243 WeakPolarHBondContact CB-O 3.47Å; T178-S243 PolarHBondContact OG1-O 2.82Å
179	A	91.8	Very high	83.9	Confident	2 Å²	2	55 Å²	55	2%	0.017	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	144.7	-176.9	0	0	0	0	0	111.2	Y63 Q66 L194 Q195 M245	Y63-A179 HydrophobicContact CD2-CB 3.75Å; Y63-A179 HydrophobicContact CE2-CB 4.09Å; Y63-A179 HydrophobicContact CG-CB 4.28Å; Q66-A179 PolarHBondContact NE2-O 3.38Å; Q66-A179 VanDerWaalsContact NE2-O 3.13Å; Q66-A179 PolarHBondContact OE1-O 2.84Å; A179-L194 HydrophobicContact CB-CD1 4.28Å; A179-Q195 CarbonylContact C-O 3.48Å; A179-Q195 WeakPolarHBondContact CA-O 3.48Å; A179-Q195 VanDerWaalsContact CB-O 3.31Å; A179-Q195 WeakPolarHBondContact CB-O 3.22Å; A179-M245 HydrophobicContact CB-CE 3.8Å
180	G	92.5	Very high	84.4	Confident	3 Å²	3	50.2 Å²	50.2	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.2	-178.3	-179.1	0	0	0	0	0	114	Q195 D239	G180-Q195 PolarHBondContact N-O 2.64Å; G180-Q195 PolarHBondContact O-N 3.29Å; G180-D239 VanDerWaalsContact CA-OD1 3.24Å; G180-D239 WeakPolarHBondContact CA-OD1 3.29Å
181	W	92.2	Very high	84.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.294	C	S	.	.	S	Bend	trans	-107.6	15.8	179.5	-62.3	-89.6	0	0	0	112	Q66 H75 E109 Y110 L112 L190 S191 L194 D239	Q66-W181 HydrophobicContact CG-CH2 3.83Å; Q66-W181 HydrophobicContact CG-CZ3 3.78Å; H75-W181 AromaticContact CE1-CE3 3.61Å; E109-W181 HydrophobicContact CB-CH2 4.1Å; E109-W181 HydrophobicContact CB-CZ2 3.94Å; E109-W181 HydrophobicContact CG-CH2 4.01Å; E109-W181 HydrophobicContact CG-CZ2 3.56Å; E109-W181 WeakPolarHBondContact O-CZ2 3.24Å; Y110-W181 PolarHBondContact O-NE1 2.82Å; L112-W181 HydrophobicContact CD1-CB 3.59Å; L112-W181 HydrophobicContact CD1-CD2 4.38Å; L112-W181 HydrophobicContact CD1-CG 3.61Å; L112-W181 HydrophobicContact CD2-CD2 4.44Å; L112-W181 HydrophobicContact CD2-CG 4.44Å; L112-W181 HydrophobicContact CG-CB 4.45Å; L112-W181 HydrophobicContact CG-CD2 4.41Å; L112-W181 HydrophobicContact CG-CG 3.94Å; W181-L190 WeakPolarHBondContact O-CD2 3.48Å; W181-S191 PolarHBondContact O-N 2.82Å; W181-S191 VanDerWaalsContact O-N 3.1Å; W181-L194 HydrophobicContact CD2-CD1 4Å; W181-L194 HydrophobicContact CE3-CD1 4.21Å; W181-L194 HydrophobicContact CH2-CD1 4.06Å; W181-L194 HydrophobicContact CZ2-CB 4.06Å; W181-L194 HydrophobicContact CZ2-CD1 3.82Å; W181-L194 HydrophobicContact CZ2-CD2 4.35Å; W181-L194 HydrophobicContact CZ2-CG 4.3Å; W181-L194 HydrophobicContact CZ3-CD1 4.25Å; W181-D239 PolarHBondContact N-OD1 3.37Å
182	G	85.6	Confident	85.2	Confident	3 Å²	3	46.8 Å²	46.8	3%	0.031	28%	0.283	C	S	.	.			trans	-58.6	171.4	176.9	0	0	0	0	0	112.8	L184 S191 Q237 D239	G182-L184 PolarHBondContact O-N 2.79Å; G182-S191 PolarHBondContact O-N 2.66Å; G182-Q237 CarbonylContact C-O 3.58Å; G182-Q237 WeakPolarHBondContact CA-O 3.41Å; G182-D239 VanDerWaalsContact CA-OD1 3.23Å; G182-D239 WeakPolarHBondContact CA-OD1 3.45Å; G182-D239 PolarHBondContact N-OD1 2.95Å
183	R	82.6	Confident	85.6	Confident	89 Å²	89	45.4 Å²	45.4	34%	0.336	27%	0.269	S	S	.	.	B	Isolated β-bridge	trans	-67.5	133.1	-178.4	-60.9	174.5	170.4	122.3	7.6	110.5	T185 G188 V189 L190 C236 Q237	R183-T185 VanDerWaalsContact CB-O 3.3Å; R183-T185 WeakPolarHBondContact CB-O 3.1Å; R183-T185 PolarHBondContact O-N 2.8Å; R183-G188 WeakPolarHBondContact CD-O 3.49Å; R183-G188 WeakPolarHBondContact CG-O 3.34Å; R183-G188 PolarHBondContact NE-O 2.91Å; R183-V189 WeakPolarHBondContact CA-O 3.46Å; R183-L190 HydrophobicContact CG-CD2 4.17Å; R183-C236 WeakPolarHBondContact O-CB 3.44Å; R183-C236 PolarHBondContact O-SG 2.8Å; R183-C236 VanDerWaalsContact O-SG 3.41Å; R183-Q237 PolarHBondContact N-O 2.97Å; R183-Q237 VanDerWaalsContact NH1-CB 3.26Å
184	L	77.4	Confident	86.1	Confident	78 Å²	78	43.2 Å²	43.2	41%	0.408	25%	0.245	S	C	.	.	S	Bend	trans	-69.9	-20.2	175.8	-48.4	-179.6	0	0	0	112.6	G54 G182 Q195	G54-L184 WeakPolarHBondContact CA-O 3.38Å; G54-L184 WeakPolarHBondContact O-CD2 3.47Å; G182-L184 PolarHBondContact O-N 2.79Å; L184-Q195 HydrophobicContact CD2-CG 3.63Å
185	T	75.9	Confident	86.4	Confident	88 Å²	88	40.1 Å²	40.1	54%	0.54	23%	0.232	S	C	.	.	S	Bend	trans	-139.9	148.6	179.5	52.3	0	0	0	0	110	R183 G187 G188	R183-T185 VanDerWaalsContact CB-O 3.3Å; R183-T185 WeakPolarHBondContact CB-O 3.1Å; R183-T185 PolarHBondContact O-N 2.8Å; T185-G187 PolarHBondContact O-N 3.39Å; T185-G188 PolarHBondContact O-N 2.88Å
186	E	77.3	Confident	86.5	Confident	84 Å²	84	39.4 Å²	39.4	39%	0.393	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	124.9	178.5	-171	-177.9	171	0	0	111.1	G188 C265 R267	E186-G188 PolarHBondContact O-N 2.9Å; E186-C265 HydrophobicContact CB-CB 4.18Å; E186-R267 IonicContact OE1-CZ 3.62Å; E186-R267 IonicContact OE1-NE 2.78Å; E186-R267 IonicContact OE1-NH2 3.52Å; E186-R267 PolarHBondContact OE1-NH2 3.01Å; E186-R267 IonicContact OE2-CZ 3.35Å; E186-R267 VanDerWaalsContact OE2-CZ 3.23Å; E186-R267 IonicContact OE2-NE 3.31Å; E186-R267 PolarHBondContact OE2-NE 3.17Å; E186-R267 IonicContact OE2-NH2 3.02Å; E186-R267 PolarHBondContact OE2-NH2 2.82Å
187	G	74.9	Confident	86.3	Confident	64 Å²	64	40.1 Å²	40.1	66%	0.66	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.2	3.4	-176.4	0	0	0	0	0	115.2	T185	T185-G187 PolarHBondContact O-N 3.39Å
188	G	79.5	Confident	86.2	Confident	24 Å²	24	42.7 Å²	42.7	25%	0.247	25%	0.245	C	C	.	.			trans	-74	-167.5	176.3	0	0	0	0	0	114.6	R183 T185 E186	R183-G188 WeakPolarHBondContact CD-O 3.49Å; R183-G188 WeakPolarHBondContact CG-O 3.34Å; R183-G188 PolarHBondContact NE-O 2.91Å; T185-G188 PolarHBondContact O-N 2.88Å; E186-G188 PolarHBondContact O-N 2.9Å
189	V	83.6	Confident	86.1	Confident	125 Å²	125	42.5 Å²	42.5	76%	0.758	24%	0.244	S	C	*	.	P	Polyproline II helix	trans	-87.9	153.2	173.7	-65.3	0	0	0	0	111	R183	R183-V189 WeakPolarHBondContact CA-O 3.46Å
190	L	83.6	Confident	86.1	Confident	57 Å²	57	43.3 Å²	43.3	30%	0.298	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-62.5	141.9	171.9	-69.7	171.7	0	0	0	109.8	W181 R183 Q192	W181-L190 WeakPolarHBondContact O-CD2 3.48Å; R183-L190 HydrophobicContact CG-CD2 4.17Å; L190-Q192 PolarHBondContact O-N 3.25Å; L190-Q192 PolarHBondContact O-NE2 2.78Å
191	S	88.6	Confident	86.1	Confident	11 Å²	11	43.5 Å²	43.5	8%	0.077	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-67.3	132	171.7	-170.1	0	0	0	0	109.6	W181 G182 V193 Q195	W181-S191 PolarHBondContact O-N 2.82Å; W181-S191 VanDerWaalsContact O-N 3.1Å; G182-S191 PolarHBondContact O-N 2.66Å; S191-V193 WeakPolarHBondContact CB-O 3.28Å; S191-V193 PolarHBondContact OG-O 2.78Å; S191-Q195 PolarHBondContact OG-NE2 2.65Å
192	Q	89.6	Confident	86.1	Confident	94 Å²	94	44.3 Å²	44.3	44%	0.439	25%	0.254	S	S	.	.	S	Bend	trans	-73.3	-36.1	173.6	-58.8	-51.5	-65.8	0	0	110.6	D111 L112 L190	D111-Q192 CarbonylContact C-O 3.57Å; D111-Q192 WeakPolarHBondContact CA-O 3.35Å; L112-Q192 PolarHBondContact N-O 2.95Å; L190-Q192 PolarHBondContact O-N 3.25Å; L190-Q192 PolarHBondContact O-NE2 2.78Å
193	V	91.9	Very high	86.3	Confident	23 Å²	23	46.2 Å²	46.2	14%	0.139	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-102.3	141	-178.5	-172.6	0	0	0	0	111	Q57 Y110 D111 S191 Q195	Q57-V193 HydrophobicContact CG-CB 4.43Å; Q57-V193 HydrophobicContact CG-CG1 3.72Å; Y110-V193 HydrophobicContact CD1-CG1 4.38Å; Y110-V193 HydrophobicContact CD2-CG1 4.08Å; Y110-V193 HydrophobicContact CE1-CG1 3.78Å; Y110-V193 HydrophobicContact CE2-CG1 3.41Å; Y110-V193 VanDerWaalsContact CE2-CG1 3.41Å; Y110-V193 WeakPolarHBondContact O-CA 3.39Å; Y110-V193 WeakPolarHBondContact OH-CG1 3.35Å; D111-V193 HydrophobicContact CB-CG2 4.43Å; S191-V193 WeakPolarHBondContact CB-O 3.28Å; S191-V193 PolarHBondContact OG-O 2.78Å; V193-Q195 PolarHBondContact O-N 3.2Å; V193-Q195 PolarHBondContact O-NE2 3.34Å
194	L	91.2	Very high	86.4	Confident	7 Å²	7	48 Å²	48	4%	0.037	27%	0.271	C	S	.	.			trans	-54.7	131.4	177.4	-175.3	62.3	0	0	0	111.7	V58 Y63 Q66 Y110 A179 W181	V58-L194 HydrophobicContact CG2-CB 3.84Å; V58-L194 HydrophobicContact CG2-CD2 3.76Å; V58-L194 HydrophobicContact CG2-CG 3.71Å; V58-L194 PolarHBondContact N-O 2.88Å; Y63-L194 HydrophobicContact CD2-CD2 4.47Å; Q66-L194 HydrophobicContact CG-CD1 4.04Å; Q66-L194 HydrophobicContact CG-CD2 4.5Å; Y110-L194 HydrophobicContact CD2-CB 4.14Å; Y110-L194 PolarHBondContact O-N 3.38Å; A179-L194 HydrophobicContact CB-CD1 4.28Å; W181-L194 HydrophobicContact CD2-CD1 4Å; W181-L194 HydrophobicContact CE3-CD1 4.21Å; W181-L194 HydrophobicContact CH2-CD1 4.06Å; W181-L194 HydrophobicContact CZ2-CB 4.06Å; W181-L194 HydrophobicContact CZ2-CD1 3.82Å; W181-L194 HydrophobicContact CZ2-CD2 4.35Å; W181-L194 HydrophobicContact CZ2-CG 4.3Å; W181-L194 HydrophobicContact CZ3-CD1 4.25Å
195	Q	91.1	Very high	86.9	Confident	27 Å²	27	50.3 Å²	50.3	13%	0.126	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	160	178.1	-55.2	-63	-53.3	0	0	110.8	S56 A179 G180 L184 S191 V193	S56-Q195 CarbonylContact O-C 3.56Å; S56-Q195 WeakPolarHBondContact O-CA 2.91Å; S56-Q195 PolarHBondContact O-OE1 2.77Å; A179-Q195 CarbonylContact C-O 3.48Å; A179-Q195 WeakPolarHBondContact CA-O 3.48Å; A179-Q195 VanDerWaalsContact CB-O 3.31Å; A179-Q195 WeakPolarHBondContact CB-O 3.22Å; G180-Q195 PolarHBondContact N-O 2.64Å; G180-Q195 PolarHBondContact O-N 3.29Å; L184-Q195 HydrophobicContact CD2-CG 3.63Å; S191-Q195 PolarHBondContact OG-NE2 2.65Å; V193-Q195 PolarHBondContact O-N 3.2Å; V193-Q195 PolarHBondContact O-NE2 3.34Å
196	E	89.9	Confident	87.6	Confident	41 Å²	41	51.2 Å²	51.2	19%	0.192	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	153.3	167.7	69.7	-177.4	-149.4	0	0	112.1	G55 S56 V58 Y63 T177 T178	G55-E196 CarbonylContact C-O 3.45Å; G55-E196 WeakPolarHBondContact CA-O 3.06Å; S56-E196 PolarHBondContact N-O 2.83Å; S56-E196 PolarHBondContact O-N 2.87Å; S56-E196 WeakPolarHBondContact OG-CG 3.23Å; V58-E196 HydrophobicContact CG1-CB 3.59Å; V58-E196 HydrophobicContact CG1-CG 3.68Å; V58-E196 WeakPolarHBondContact CG1-OE2 3.29Å; Y63-E196 HydrophobicContact CE2-CB 3.94Å; Y63-E196 WeakPolarHBondContact CE2-OE2 3.33Å; Y63-E196 VanDerWaalsContact CZ-OE2 3.23Å; Y63-E196 PolarHBondContact OH-OE2 3.35Å; T177-E196 HydrophobicContact CG2-CB 3.9Å; T178-E196 CarbonylContact O-C 3.59Å; T178-E196 VanDerWaalsContact O-CA 3.29Å; T178-E196 WeakPolarHBondContact O-CA 3.16Å
197	V	88.8	Confident	88.2	Confident	15 Å²	15	47.4 Å²	47.4	9%	0.091	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	140.8	168.1	66.7	0	0	0	0	110.8	T177 T178 L199 R233	T177-V197 CarbonylContact C-O 3.57Å; T177-V197 WeakPolarHBondContact CA-O 2.88Å; T178-V197 HydrophobicContact CG2-CG1 3.36Å; T178-V197 PolarHBondContact N-O 3.4Å; T178-V197 PolarHBondContact O-N 2.85Å; V197-L199 HydrophobicContact CG1-CD1 4.21Å; V197-L199 HydrophobicContact CG1-CD2 4.44Å; V197-L199 HydrophobicContact CG1-CG 4.22Å; V197-L199 HydrophobicContact CG2-CD2 4.17Å; V197-R233 HydrophobicContact CG2-CB 3.77Å; V197-R233 HydrophobicContact CG2-CG 4.04Å
198	N	89.3	Confident	88.8	Confident	58 Å²	58	46.2 Å²	46.2	31%	0.31	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	127.7	177.9	-68	-42.7	0	0	0	110.6	I175 C176 T177	I175-N198 HydrophobicContact CG2-CB 3.79Å; C176-N198 CarbonylContact O-C 3.56Å; C176-N198 WeakPolarHBondContact O-CA 3.45Å; T177-N198 PolarHBondContact OG1-OD1 2.78Å
199	L	90	Very high	89.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	129.6	-174.2	-57.1	172.6	0	0	0	110	C176 T178 V197 T226 R233 F284	C176-L199 PolarHBondContact N-O 3.03Å; C176-L199 PolarHBondContact O-N 3.23Å; T178-L199 HydrophobicContact CG2-CD1 3.77Å; V197-L199 HydrophobicContact CG1-CD1 4.21Å; V197-L199 HydrophobicContact CG1-CD2 4.44Å; V197-L199 HydrophobicContact CG1-CG 4.22Å; V197-L199 HydrophobicContact CG2-CD2 4.17Å; L199-T226 WeakPolarHBondContact CD1-OG1 3.28Å; L199-R233 HydrophobicContact CD2-CB 4.09Å; L199-F284 HydrophobicContact CD1-CE2 4.5Å; L199-F284 HydrophobicContact CD1-CZ 4.23Å
200	P	92.1	Very high	89.4	Confident	19 Å²	19	41.8 Å²	41.8	12%	0.123	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	142.9	172	29.5	-33	0	0	0	110.6	F174 I175 T226 G227 F228	F174-P200 CarbonylContact O-C 3.53Å; F174-P200 WeakPolarHBondContact O-CA 3.36Å; I175-P200 HydrophobicContact CD1-CB 3.7Å; P200-T226 CarbonylContact O-C 3.58Å; P200-T226 WeakPolarHBondContact O-CA 3.42Å; P200-T226 VanDerWaalsContact O-CB 3.3Å; P200-T226 WeakPolarHBondContact O-CB 3.31Å; P200-G227 WeakPolarHBondContact CG-O 3.28Å; P200-G227 PolarHBondContact O-N 3.17Å; P200-F228 HydrophobicContact CG-CD1 4.2Å; P200-F228 HydrophobicContact CG-CE1 3.92Å; P200-F228 HydrophobicContact CG-CE2 4.32Å; P200-F228 HydrophobicContact CG-CZ 3.99Å
201	I	92.8	Very high	89.6	Confident	6 Å²	6	39.1 Å²	39.1	3%	0.031	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-73	130.7	166.4	-66.3	174.9	0	0	0	109.2	F170 G173 F174 L224 T226	F170-I201 HydrophobicContact CB-CD1 3.43Å; F170-I201 VanDerWaalsContact CB-CD1 3.43Å; F170-I201 HydrophobicContact CG-CD1 4.5Å; G173-I201 PolarHBondContact N-O 3.27Å; F174-I201 HydrophobicContact CB-CD1 4.23Å; F174-I201 PolarHBondContact O-N 3.45Å; I201-L224 HydrophobicContact CD1-CD1 4.5Å; I201-L224 HydrophobicContact CD1-CD2 4.32Å; I201-L224 HydrophobicContact CG1-CD1 4.49Å; I201-L224 HydrophobicContact CG1-CD2 4.41Å; I201-L224 HydrophobicContact CG2-CD1 3.65Å; I201-T226 HydrophobicContact CG1-CG2 4.23Å
202	L	91.6	Very high	89.5	Confident	17 Å²	17	43.7 Å²	43.7	9%	0.089	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-85.1	156.9	174.5	-74.3	77	0	0	0	110.7	E206 C225 G227 W269 P281	L202-E206 HydrophobicContact CB-CB 4.18Å; L202-E206 HydrophobicContact CD2-CB 4.13Å; L202-E206 HydrophobicContact CG-CB 4.5Å; L202-C225 HydrophobicContact CB-CB 4.05Å; L202-C225 HydrophobicContact CD1-CB 4.21Å; L202-C225 WeakPolarHBondContact CD1-O 3.47Å; L202-C225 HydrophobicContact CD2-CB 4.24Å; L202-C225 HydrophobicContact CG-CB 4.42Å; L202-C225 PolarHBondContact N-O 3.48Å; L202-G227 WeakPolarHBondContact CD1-O 2.95Å; L202-W269 HydrophobicContact CD2-CH2 4.28Å; L202-W269 HydrophobicContact CD2-CZ2 3.7Å; L202-P281 HydrophobicContact CD2-CB 4.22Å; L202-P281 HydrophobicContact CD2-CG 3.9Å
203	T	90.4	Very high	89.1	Confident	43 Å²	43	41.9 Å²	41.9	26%	0.264	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-67.2	161.6	165	85.9	0	0	0	0	110.8	A172 E205 E206 C207	A172-T203 HydrophobicContact CB-CG2 3.44Å; A172-T203 VanDerWaalsContact CB-CG2 3.44Å; T203-E205 VanDerWaalsContact C-N 3.25Å; T203-E205 WeakPolarHBondContact CB-OE2 3.38Å; T203-E205 PolarHBondContact O-N 3.27Å; T203-E205 PolarHBondContact OG1-N 2.77Å; T203-E205 PolarHBondContact OG1-OE2 3.14Å; T203-E206 HydrophobicContact CG2-CG 4.45Å; T203-E206 PolarHBondContact N-OE2 3.22Å; T203-E206 PolarHBondContact O-N 2.86Å; T203-E206 WeakPolarHBondContact OG1-CG 3.46Å; T203-E206 PolarHBondContact OG1-N 2.95Å; T203-E206 VanDerWaalsContact OG1-N 3.12Å; T203-C207 VanDerWaalsContact O-CB 3.28Å; T203-C207 WeakPolarHBondContact O-CB 3.4Å; T203-C207 PolarHBondContact O-N 2.88Å
204	W	85.9	Confident	88.6	Confident	126 Å²	126	41.4 Å²	41.4	48%	0.477	22%	0.216	S	C	.	.	H	α-helix	trans	-57.8	-41.7	174	-179.4	-107.9	0	0	0	111.7	C207 V208 G220 F223	W204-C207 PolarHBondContact O-N 3.22Å; W204-V208 HydrophobicContact CD2-CG2 4.11Å; W204-V208 HydrophobicContact CH2-CG2 4.41Å; W204-V208 HydrophobicContact CZ2-CG2 3.78Å; W204-V208 WeakPolarHBondContact O-CB 3.5Å; W204-V208 VanDerWaalsContact O-CG2 3.31Å; W204-V208 WeakPolarHBondContact O-CG2 3.04Å; W204-V208 PolarHBondContact O-N 3.23Å; W204-G220 VanDerWaalsContact CH2-O 3.26Å; W204-G220 WeakPolarHBondContact CH2-O 3.47Å; W204-F223 HydrophobicContact CH2-CD2 4.24Å; W204-F223 AromaticContact CH2-CE2 3.57Å; W204-F223 HydrophobicContact CH2-CE2 3.57Å; W204-F223 AromaticContact CH2-CZ 3.95Å; W204-F223 HydrophobicContact CH2-CZ 3.95Å; W204-F223 AromaticContact CZ3-CD2 3.83Å; W204-F223 HydrophobicContact CZ3-CD2 3.83Å; W204-F223 AromaticContact CZ3-CE2 3.51Å; W204-F223 HydrophobicContact CZ3-CE2 3.51Å; W204-F223 HydrophobicContact CZ3-CZ 4.34Å
205	E	87.6	Confident	87.9	Confident	128 Å²	128	48.5 Å²	48.5	60%	0.598	25%	0.247	S	C	*	.	H	α-helix	trans	-65.4	-44.5	-180	-57.1	72	-154.3	0	0	111.4	T203 A209	T203-E205 VanDerWaalsContact C-N 3.25Å; T203-E205 WeakPolarHBondContact CB-OE2 3.38Å; T203-E205 PolarHBondContact O-N 3.27Å; T203-E205 PolarHBondContact OG1-N 2.77Å; T203-E205 PolarHBondContact OG1-OE2 3.14Å; E205-A209 WeakPolarHBondContact O-CB 3.35Å; E205-A209 PolarHBondContact O-N 3.24Å
206	E	89.8	Confident	87.1	Confident	107 Å²	107	57.2 Å²	57.2	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-43	177.1	-69.1	177	143.7	0	0	111.7	L202 T203 A209 A210	L202-E206 HydrophobicContact CB-CB 4.18Å; L202-E206 HydrophobicContact CD2-CB 4.13Å; L202-E206 HydrophobicContact CG-CB 4.5Å; T203-E206 HydrophobicContact CG2-CG 4.45Å; T203-E206 PolarHBondContact N-OE2 3.22Å; T203-E206 PolarHBondContact O-N 2.86Å; T203-E206 WeakPolarHBondContact OG1-CG 3.46Å; T203-E206 PolarHBondContact OG1-N 2.95Å; T203-E206 VanDerWaalsContact OG1-N 3.12Å; E206-A209 PolarHBondContact O-N 2.74Å; E206-A210 WeakPolarHBondContact O-CB 3Å; E206-A210 PolarHBondContact O-N 2.86Å
207	C	89.5	Confident	86.2	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.02	30%	0.296	C	S	.	.	H	α-helix	trans	-59.4	-53.4	176.1	178.9	0	0	0	0	111	T203 W204 A209 A210 L211 C225	T203-C207 VanDerWaalsContact O-CB 3.28Å; T203-C207 WeakPolarHBondContact O-CB 3.4Å; T203-C207 PolarHBondContact O-N 2.88Å; W204-C207 PolarHBondContact O-N 3.22Å; C207-A209 PolarHBondContact O-N 2.79Å; C207-A210 WeakPolarHBondContact O-CB 3.37Å; C207-A210 PolarHBondContact O-N 3.25Å; C207-L211 WeakPolarHBondContact O-CG 3.3Å; C207-L211 PolarHBondContact O-N 3.38Å; C207-C225 HydrophobicContact CB-CB 3.45Å; C207-C225 VanDerWaalsContact CB-CB 3.45Å; C207-C225 WeakPolarHBondContact CB-SG 3.28Å; C207-C225 WeakPolarHBondContact SG-CB 3.32Å; C207-C225 CovalentContact SG-SG 2.03Å; C207-C225 PolarHBondContact SG-SG 2.84Å
208	V	87.9	Confident	85.5	Confident	39 Å²	39	59.6 Å²	59.6	24%	0.236	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-46.2	178.8	171.6	0	0	0	0	110.7	W204 A210 L211 L212	W204-V208 HydrophobicContact CD2-CG2 4.11Å; W204-V208 HydrophobicContact CH2-CG2 4.41Å; W204-V208 HydrophobicContact CZ2-CG2 3.78Å; W204-V208 WeakPolarHBondContact O-CB 3.5Å; W204-V208 VanDerWaalsContact O-CG2 3.31Å; W204-V208 WeakPolarHBondContact O-CG2 3.04Å; W204-V208 PolarHBondContact O-N 3.23Å; V208-A210 VanDerWaalsContact C-N 3.28Å; V208-A210 PolarHBondContact O-N 3.37Å; V208-L211 PolarHBondContact O-N 3.28Å; V208-L211 VanDerWaalsContact O-N 3.11Å; V208-L212 HydrophobicContact CG1-CD1 4.05Å; V208-L212 HydrophobicContact CG1-CG 4.17Å; V208-L212 VanDerWaalsContact O-CG 3.28Å; V208-L212 WeakPolarHBondContact O-CG 3.38Å; V208-L212 PolarHBondContact O-N 3.02Å
209	A	87.9	Confident	84.6	Confident	54 Å²	54	61.3 Å²	61.3	45%	0.446	31%	0.313	S	S	.	.	H	α-helix	trans	-57	-42.9	177.7	0	0	0	0	0	111.7	E205 E206 C207 L212 T213	E205-A209 WeakPolarHBondContact O-CB 3.35Å; E205-A209 PolarHBondContact O-N 3.24Å; E206-A209 PolarHBondContact O-N 2.74Å; C207-A209 PolarHBondContact O-N 2.79Å; A209-L212 PolarHBondContact O-N 2.95Å; A209-T213 WeakPolarHBondContact O-CG2 3.49Å
210	A	87.8	Confident	83.7	Confident	3 Å²	3	61.4 Å²	61.4	3%	0.025	31%	0.314	C	S	.	.	H	α-helix	trans	-62.4	-45.1	175.5	0	0	0	0	0	112	E206 C207 V208 L212 T213 W269 P281	E206-A210 WeakPolarHBondContact O-CB 3Å; E206-A210 PolarHBondContact O-N 2.86Å; C207-A210 WeakPolarHBondContact O-CB 3.37Å; C207-A210 PolarHBondContact O-N 3.25Å; V208-A210 VanDerWaalsContact C-N 3.28Å; V208-A210 PolarHBondContact O-N 3.37Å; A210-L212 VanDerWaalsContact C-N 3.33Å; A210-L212 PolarHBondContact O-N 3.31Å; A210-T213 WeakPolarHBondContact O-CB 3.43Å; A210-T213 PolarHBondContact O-N 3.04Å; A210-T213 VanDerWaalsContact O-N 3.16Å; A210-T213 PolarHBondContact O-OG1 3.26Å; A210-W269 HydrophobicContact CB-CD2 4.32Å; A210-W269 HydrophobicContact CB-CG 3.92Å; A210-P281 HydrophobicContact CB-CG 3.65Å
211	L	87.7	Confident	82.8	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-70	-27.5	-179.7	-63.1	177.5	0	0	0	113.7	C207 V208 T213 L214 F223 W261 I283	C207-L211 WeakPolarHBondContact O-CG 3.3Å; C207-L211 PolarHBondContact O-N 3.38Å; V208-L211 PolarHBondContact O-N 3.28Å; V208-L211 VanDerWaalsContact O-N 3.11Å; L211-T213 PolarHBondContact O-N 3.27Å; L211-L214 HydrophobicContact CD2-CD1 3.92Å; L211-L214 WeakPolarHBondContact O-CB 3.41Å; L211-L214 WeakPolarHBondContact O-CG 3.3Å; L211-L214 PolarHBondContact O-N 2.85Å; L211-F223 HydrophobicContact CD1-CE2 3.95Å; L211-F223 HydrophobicContact CD1-CZ 3.87Å; L211-W261 HydrophobicContact CD2-CH2 4.22Å; L211-I283 HydrophobicContact CD1-CD1 4.07Å; L211-I283 HydrophobicContact CD2-CD1 3.83Å
212	L	85.9	Confident	82.3	Confident	107 Å²	107	68.4 Å²	68.4	56%	0.56	34%	0.343	S	S	*	.	H	α-helix	trans	-66	-22.5	172.6	-71.4	177	0	0	0	112.7	V208 A209 A210 L214 P217	V208-L212 HydrophobicContact CG1-CD1 4.05Å; V208-L212 HydrophobicContact CG1-CG 4.17Å; V208-L212 VanDerWaalsContact O-CG 3.28Å; V208-L212 WeakPolarHBondContact O-CG 3.38Å; V208-L212 PolarHBondContact O-N 3.02Å; A209-L212 PolarHBondContact O-N 2.95Å; A210-L212 VanDerWaalsContact C-N 3.33Å; A210-L212 PolarHBondContact O-N 3.31Å; L212-L214 PolarHBondContact O-N 3.19Å; L212-P217 HydrophobicContact CD2-CB 3.98Å
213	T	82.3	Confident	82.1	Confident	57 Å²	57	68.2 Å²	68.2	35%	0.35	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-12.2	176.5	71.6	0	0	0	0	113.6	A209 A210 L211 N272 Q278	A209-T213 WeakPolarHBondContact O-CG2 3.49Å; A210-T213 WeakPolarHBondContact O-CB 3.43Å; A210-T213 PolarHBondContact O-N 3.04Å; A210-T213 VanDerWaalsContact O-N 3.16Å; A210-T213 PolarHBondContact O-OG1 3.26Å; L211-T213 PolarHBondContact O-N 3.27Å; T213-N272 PolarHBondContact OG1-ND2 3.35Å; T213-Q278 PolarHBondContact O-NE2 3.06Å; T213-Q278 VanDerWaalsContact O-NE2 3.15Å
214	L	82.1	Confident	82.1	Confident	12 Å²	12	67.2 Å²	67.2	6%	0.063	34%	0.335	C	S	.	.	S	Bend	trans	-73.3	148.1	179.1	-59.2	-176.5	0	0	0	110.9	L211 L212 R216 I218 L263 G279	L211-L214 HydrophobicContact CD2-CD1 3.92Å; L211-L214 WeakPolarHBondContact O-CB 3.41Å; L211-L214 WeakPolarHBondContact O-CG 3.3Å; L211-L214 PolarHBondContact O-N 2.85Å; L212-L214 PolarHBondContact O-N 3.19Å; L214-R216 PolarHBondContact O-N 2.67Å; L214-I218 HydrophobicContact CD1-CD1 4.33Å; L214-L263 HydrophobicContact CD2-CD2 3.58Å; L214-G279 WeakPolarHBondContact CD2-O 3.18Å
215	K	74.4	Confident	82.4	Confident	156 Å²	156	61.4 Å²	61.4	68%	0.678	31%	0.313	S	S	*	.	S	Bend	trans	-51.3	-31.1	177.6	-176.6	-179	176.6	-172.7	0	113.8
216	R	74.5	Confident	82.6	Confident	210 Å²	210	55.3 Å²	55.3	79%	0.792	28%	0.284	S	S	*	.	S	Bend	trans	-122.8	106.5	170.2	-70.9	-175.1	176	178.1	-1	107	L214 I218	L214-R216 PolarHBondContact O-N 2.67Å; R216-I218 WeakPolarHBondContact O-CG1 3.39Å; R216-I218 PolarHBondContact O-N 3.22Å
217	P	71.1	Confident	82.6	Confident	86 Å²	86	50.3 Å²	50.3	56%	0.558	26%	0.262	S	S	*	.			trans	-56	136.5	176.2	-27.4	36	0	0	0	110.8	L212	L212-P217 HydrophobicContact CD2-CB 3.98Å
218	I	75.8	Confident	82.4	Confident	20 Å²	20	52.6 Å²	52.6	10%	0.103	27%	0.272	C	S	.	.			trans	-118.1	130.3	180	-62.1	173.2	0	0	0	107.3	K137 P138 L214 R216 W261	K137-I218 HydrophobicContact CB-CD1 4.32Å; K137-I218 HydrophobicContact CD-CD1 3.91Å; P138-I218 HydrophobicContact CB-CG2 3.38Å; P138-I218 HydrophobicContact CG-CG2 3.67Å; L214-I218 HydrophobicContact CD1-CD1 4.33Å; R216-I218 WeakPolarHBondContact O-CG1 3.39Å; R216-I218 PolarHBondContact O-N 3.22Å; I218-W261 HydrophobicContact CB-CH2 4.25Å; I218-W261 HydrophobicContact CD1-CH2 3.32Å; I218-W261 HydrophobicContact CD1-CZ2 4.09Å; I218-W261 HydrophobicContact CD1-CZ3 3.85Å; I218-W261 HydrophobicContact CG1-CH2 4.34Å; I218-W261 HydrophobicContact CG2-CH2 3.93Å; I218-W261 HydrophobicContact CG2-CZ2 3.84Å
219	S	70.5	Confident	82.4	Confident	94 Å²	94	52.8 Å²	52.8	66%	0.657	27%	0.274	S	S	*	.			trans	-135.2	129.8	173.6	-179.2	0	0	0	0	107.8	P138	P138-S219 WeakPolarHBondContact CG-O 3.28Å
220	G	70	Confident	82.2	Confident	3 Å²	3	55.5 Å²	55.5	3%	0.031	28%	0.28	C	S	.	.			trans	-145.2	-178.8	178.7	0	0	0	0	0	108	D140 W204 F223	D140-G220 WeakPolarHBondContact OD1-CA 3.14Å; D140-G220 WeakPolarHBondContact OD2-CA 3.42Å; W204-G220 VanDerWaalsContact CH2-O 3.26Å; W204-G220 WeakPolarHBondContact CH2-O 3.47Å; G220-F223 VanDerWaalsContact N-CZ 3.33Å
221	K	73.1	Confident	82	Confident	167 Å²	167	56 Å²	56	73%	0.726	29%	0.286	S	S	*	.	S	Bend	trans	-123.4	-8.4	-168.7	-64.2	-178.1	-179.4	179.7	0	113.7	D140	D140-K221 PolarHBondContact OD1-N 3.03Å; D140-K221 PolarHBondContact OD2-N 2.8Å
222	T	82.9	Confident	81.5	Confident	5 Å²	5	57.2 Å²	57.2	3%	0.031	30%	0.299	C	S	.	.	S	Bend	trans	-122.5	11.8	-167	60.5	0	0	0	0	113.5	D140 Y141 D286	D140-T222 PolarHBondContact OD1-N 2.89Å; D140-T222 PolarHBondContact OD1-OG1 3.46Å; Y141-T222 HydrophobicContact CD1-CG2 3.77Å; Y141-T222 HydrophobicContact CD2-CG2 4.02Å; Y141-T222 HydrophobicContact CE1-CG2 3.5Å; Y141-T222 VanDerWaalsContact CE1-CG2 3.5Å; Y141-T222 HydrophobicContact CE2-CG2 3.72Å; Y141-T222 HydrophobicContact CG-CG2 4.03Å; Y141-T222 VanDerWaalsContact CZ-CG2 3.45Å; Y141-T222 PolarHBondContact N-OG1 2.89Å; T222-D286 PolarHBondContact O-N 2.86Å
223	F	86.4	Confident	81.1	Confident	12 Å²	12	54.9 Å²	54.9	5%	0.053	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	147.3	-178.7	50.5	-111.6	0	0	0	114.2	P138 W204 L211 G220 I283 F284	P138-F223 HydrophobicContact CB-CE1 4.42Å; W204-F223 HydrophobicContact CH2-CD2 4.24Å; W204-F223 AromaticContact CH2-CE2 3.57Å; W204-F223 HydrophobicContact CH2-CE2 3.57Å; W204-F223 AromaticContact CH2-CZ 3.95Å; W204-F223 HydrophobicContact CH2-CZ 3.95Å; W204-F223 AromaticContact CZ3-CD2 3.83Å; W204-F223 HydrophobicContact CZ3-CD2 3.83Å; W204-F223 AromaticContact CZ3-CE2 3.51Å; W204-F223 HydrophobicContact CZ3-CE2 3.51Å; W204-F223 HydrophobicContact CZ3-CZ 4.34Å; L211-F223 HydrophobicContact CD1-CE2 3.95Å; L211-F223 HydrophobicContact CD1-CZ 3.87Å; G220-F223 VanDerWaalsContact N-CZ 3.33Å; F223-I283 HydrophobicContact CB-CG2 3.61Å; F223-I283 HydrophobicContact CG-CG2 4.36Å; F223-F284 CarbonylContact C-O 3.5Å; F223-F284 WeakPolarHBondContact CA-O 3.22Å
224	L	90.5	Very high	80.9	Confident	23 Å²	23	53.3 Å²	53.3	12%	0.12	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.8	167.9	-178.7	72	0	0	0	108.1	I201 L244 F284 D286	I201-L224 HydrophobicContact CD1-CD1 4.5Å; I201-L224 HydrophobicContact CD1-CD2 4.32Å; I201-L224 HydrophobicContact CG1-CD1 4.49Å; I201-L224 HydrophobicContact CG1-CD2 4.41Å; I201-L224 HydrophobicContact CG2-CD1 3.65Å; L224-L244 HydrophobicContact CD2-CD2 3.49Å; L224-L244 VanDerWaalsContact CD2-CD2 3.49Å; L224-F284 HydrophobicContact CB-CB 4.43Å; L224-F284 PolarHBondContact N-O 3.19Å; L224-F284 PolarHBondContact O-N 2.04Å; L224-D286 HydrophobicContact CB-CB 4.06Å
225	C	92	Very high	80.7	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.02	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	137.4	174.6	-80.2	0	0	0	0	110.7	L202 C207 P281 G282	L202-C225 HydrophobicContact CB-CB 4.05Å; L202-C225 HydrophobicContact CD1-CB 4.21Å; L202-C225 WeakPolarHBondContact CD1-O 3.47Å; L202-C225 HydrophobicContact CD2-CB 4.24Å; L202-C225 HydrophobicContact CG-CB 4.42Å; L202-C225 PolarHBondContact N-O 3.48Å; C207-C225 HydrophobicContact CB-CB 3.45Å; C207-C225 VanDerWaalsContact CB-CB 3.45Å; C207-C225 WeakPolarHBondContact CB-SG 3.28Å; C207-C225 WeakPolarHBondContact SG-CB 3.32Å; C207-C225 CovalentContact SG-SG 2.03Å; C207-C225 PolarHBondContact SG-SG 2.84Å; C225-P281 HydrophobicContact CB-CB 3.96Å; C225-P281 HydrophobicContact CB-CG 4.47Å; C225-G282 WeakPolarHBondContact CA-O 3.45Å
226	T	92.3	Very high	81	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	158.8	169.4	72.6	0	0	0	0	112.5	L199 P200 I201 L244 P281 G282 F284	L199-T226 WeakPolarHBondContact CD1-OG1 3.28Å; P200-T226 CarbonylContact O-C 3.58Å; P200-T226 WeakPolarHBondContact O-CA 3.42Å; P200-T226 VanDerWaalsContact O-CB 3.3Å; P200-T226 WeakPolarHBondContact O-CB 3.31Å; I201-T226 HydrophobicContact CG1-CG2 4.23Å; T226-L244 HydrophobicContact CG2-CD1 4.21Å; T226-L244 HydrophobicContact CG2-CD2 3.64Å; T226-P281 WeakPolarHBondContact O-CB 2.94Å; T226-G282 PolarHBondContact N-O 3.03Å; T226-G282 PolarHBondContact O-N 3.22Å; T226-F284 HydrophobicContact CG2-CD2 4.11Å; T226-F284 HydrophobicContact CG2-CE2 4.21Å; T226-F284 WeakPolarHBondContact OG1-CE2 3.39Å
227	G	89.3	Confident	81.1	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.031	22%	0.223	C	C	.	.	S	Bend	trans	122.7	-179.4	171.3	0	0	0	0	0	114.7	P200 L202	P200-G227 WeakPolarHBondContact CG-O 3.28Å; P200-G227 PolarHBondContact O-N 3.17Å; L202-G227 WeakPolarHBondContact CD1-O 2.95Å
228	F	87.1	Confident	81.4	Confident	51 Å²	51	36.2 Å²	36.2	22%	0.224	20%	0.202	C	C	.	.			trans	-102.4	135.6	-176.2	-63.1	-86.7	0	0	0	111	P200 D230 G231 R233 W269	P200-F228 HydrophobicContact CG-CD1 4.2Å; P200-F228 HydrophobicContact CG-CE1 3.92Å; P200-F228 HydrophobicContact CG-CE2 4.32Å; P200-F228 HydrophobicContact CG-CZ 3.99Å; F228-D230 PolarHBondContact O-N 2.9Å; F228-D230 VanDerWaalsContact O-N 3.09Å; F228-G231 WeakPolarHBondContact O-CA 3.18Å; F228-G231 PolarHBondContact O-N 2.82Å; F228-R233 HydrophobicContact CD2-CB 4.16Å; F228-R233 HydrophobicContact CE2-CB 4.32Å; F228-W269 WeakPolarHBondContact O-CH2 3.3Å; F228-W269 WeakPolarHBondContact O-CZ3 3.31Å
229	P	85.8	Confident	81.8	Confident	43 Å²	43	36 Å²	36	28%	0.279	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-28.1	179.9	-27.1	34	0	0	0	115.8	G231 G268 W269 R270	P229-G231 VanDerWaalsContact C-N 3.29Å; P229-G268 CarbonylContact O-C 3.45Å; P229-G268 WeakPolarHBondContact O-CA 3.17Å; P229-W269 VanDerWaalsContact CA-CE2 3.44Å; P229-W269 HydrophobicContact CB-CZ2 3.92Å; P229-W269 HydrophobicContact CG-CZ2 3.73Å; P229-W269 PolarHBondContact O-N 2.88Å; P229-R270 HydrophobicContact CB-CG 3.54Å; P229-R270 PolarHBondContact O-N 3.02Å
230	D	84.4	Confident	82.8	Confident	110 Å²	110	32.7 Å²	32.7	59%	0.588	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-5.6	175.9	-60.3	-46.1	0	0	0	113.1	F228 G268 R270	F228-D230 PolarHBondContact O-N 2.9Å; F228-D230 VanDerWaalsContact O-N 3.09Å; D230-G268 VanDerWaalsContact C-CA 3.44Å; D230-R270 VanDerWaalsContact OD1-CD 3.28Å; D230-R270 WeakPolarHBondContact OD1-CD 3.27Å; D230-R270 IonicContact OD1-CZ 2.7Å; D230-R270 IonicContact OD1-NE 3.79Å; D230-R270 IonicContact OD1-NH1 3.81Å; D230-R270 PolarHBondContact OD1-NH1 3.38Å; D230-R270 IonicContact OD2-CZ 3.83Å; D230-R270 IonicContact OD2-NH1 3.18Å; D230-R270 PolarHBondContact OD2-NH1 3.09Å
231	G	83.3	Confident	83.9	Confident	13 Å²	13	32.5 Å²	32.5	13%	0.134	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	77.4	-148.6	-176	0	0	0	0	0	113.2	F228 P229 R233 G266	F228-G231 WeakPolarHBondContact O-CA 3.18Å; F228-G231 PolarHBondContact O-N 2.82Å; P229-G231 VanDerWaalsContact C-N 3.29Å; G231-R233 VanDerWaalsContact C-N 3.29Å; G231-R233 PolarHBondContact O-N 2.89Å; G231-G266 CarbonylContact C-O 3.54Å; G231-G266 WeakPolarHBondContact CA-O 3.35Å
232	G	77.1	Confident	84.9	Confident	27 Å²	27	24.6 Å²	24.6	28%	0.278	14%	0.142	S	C	.	.	S	Bend	trans	85.6	-23.6	176.2	0	0	0	0	0	115.8	L53 G266	L53-G232 VanDerWaalsContact CD2-O 3.31Å; L53-G232 WeakPolarHBondContact CD2-O 3.41Å; G232-G266 PolarHBondContact N-O 2.9Å
233	R	79.3	Confident	85.4	Confident	57 Å²	57	24.3 Å²	24.3	22%	0.215	14%	0.14	C	C	.	.			trans	-137.2	128.3	176.7	-71.4	-173.1	-76.3	-150.5	-3.9	109.9	I48 V197 L199 F228 G231	I48-R233 PolarHBondContact O-NH1 3.21Å; I48-R233 PolarHBondContact O-NH2 3.08Å; I48-R233 VanDerWaalsContact O-NH2 3.14Å; V197-R233 HydrophobicContact CG2-CB 3.77Å; V197-R233 HydrophobicContact CG2-CG 4.04Å; L199-R233 HydrophobicContact CD2-CB 4.09Å; F228-R233 HydrophobicContact CD2-CB 4.16Å; F228-R233 HydrophobicContact CE2-CB 4.32Å; G231-R233 VanDerWaalsContact C-N 3.29Å; G231-R233 PolarHBondContact O-N 2.89Å
234	D	77.1	Confident	85.8	Confident	24 Å²	24	23.8 Å²	23.8	13%	0.128	14%	0.138	C	C	.	.			trans	-166.4	162.4	-176	-159.1	2.7	0	0	0	110.8	G266 G282	D234-G266 PolarHBondContact OD2-N 3.02Å; D234-G266 VanDerWaalsContact OD2-N 3.08Å; D234-G282 WeakPolarHBondContact OD1-CA 3.42Å
235	A	78	Confident	86	Confident	11 Å²	11	22.7 Å²	22.7	9%	0.091	13%	0.132	C	C	.	.			trans	-75.1	149	159.8	0	0	0	0	0	109.1	T178 D239 T259 F284	T178-A235 HydrophobicContact CG2-CB 4.25Å; A235-D239 HydrophobicContact CB-CB 4.19Å; A235-T259 HydrophobicContact CB-CG2 3.84Å; A235-F284 HydrophobicContact CB-CZ 4.15Å
236	C	81.3	Confident	86.1	Confident	13 Å²	13	22.5 Å²	22.5	9%	0.088	13%	0.131	C	C	.	.			trans	-131.3	-176.7	-176.6	-163.5	0	0	0	0	112.3	R183 G238 D239 C265	R183-C236 WeakPolarHBondContact O-CB 3.44Å; R183-C236 PolarHBondContact O-SG 2.8Å; R183-C236 VanDerWaalsContact O-SG 3.41Å; C236-G238 PolarHBondContact O-N 2.7Å; C236-D239 PolarHBondContact N-OD2 2.85Å; C236-D239 WeakPolarHBondContact O-CB 3.48Å; C236-D239 PolarHBondContact O-N 3.2Å; C236-C265 WeakPolarHBondContact CA-SG 3.26Å; C236-C265 HydrophobicContact CB-CB 3.67Å; C236-C265 WeakPolarHBondContact CB-SG 3.45Å; C236-C265 WeakPolarHBondContact SG-CB 3.43Å; C236-C265 CovalentContact SG-SG 2.03Å; C236-C265 PolarHBondContact SG-SG 3.16Å
237	Q	76.4	Confident	85.8	Confident	70 Å²	70	26.4 Å²	26.4	33%	0.327	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	129	-178.1	-58.2	94.2	21.6	0	0	110.6	G182 R183 C265	G182-Q237 CarbonylContact C-O 3.58Å; G182-Q237 WeakPolarHBondContact CA-O 3.41Å; R183-Q237 PolarHBondContact N-O 2.97Å; R183-Q237 VanDerWaalsContact NH1-CB 3.26Å; Q237-C265 VanDerWaalsContact CD-SG 3.53Å; Q237-C265 PolarHBondContact NE2-SG 2.86Å; Q237-C265 PolarHBondContact OE1-SG 3.31Å
238	G	75.9	Confident	85.4	Confident	11 Å²	11	27.4 Å²	27.4	11%	0.113	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	105.1	-21.3	-171.3	0	0	0	0	0	113	H75 C236 S240	H75-G238 PolarHBondContact NE2-O 3.18Å; C236-G238 PolarHBondContact O-N 2.7Å; G238-S240 VanDerWaalsContact C-N 3.34Å
239	D	85.4	Confident	84.8	Confident	16 Å²	16	35.5 Å²	35.5	9%	0.086	19%	0.185	C	C	.	.			trans	-84.4	-10.2	176.1	-58.1	-46.6	0	0	0	113.1	G180 W181 G182 A235 C236 G241 G242 T259	G180-D239 VanDerWaalsContact CA-OD1 3.24Å; G180-D239 WeakPolarHBondContact CA-OD1 3.29Å; W181-D239 PolarHBondContact N-OD1 3.37Å; G182-D239 VanDerWaalsContact CA-OD1 3.23Å; G182-D239 WeakPolarHBondContact CA-OD1 3.45Å; G182-D239 PolarHBondContact N-OD1 2.95Å; A235-D239 HydrophobicContact CB-CB 4.19Å; C236-D239 PolarHBondContact N-OD2 2.85Å; C236-D239 WeakPolarHBondContact O-CB 3.48Å; C236-D239 PolarHBondContact O-N 3.2Å; D239-G241 PolarHBondContact O-N 2.75Å; D239-G242 WeakPolarHBondContact O-CA 3.11Å; D239-G242 PolarHBondContact O-N 3.5Å; D239-T259 HydrophobicContact CB-CG2 4.27Å; D239-T259 VanDerWaalsContact O-CB 3.31Å; D239-T259 WeakPolarHBondContact O-CB 3.32Å
240	S	91.4	Very high	84.2	Confident	24 Å²	24	40.4 Å²	40.4	17%	0.168	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.2	133.2	177.3	-72.9	0	0	0	0	112.2	C77 G78 H92 G238 G242	C77-S240 CarbonylContact C-O 3.54Å; C77-S240 WeakPolarHBondContact CA-O 3.32Å; C77-S240 WeakPolarHBondContact CB-O 3.42Å; G78-S240 PolarHBondContact N-O 3.03Å; H92-S240 PolarHBondContact CE1-OG 3.42Å; H92-S240 VanDerWaalsContact NE2-CB 3.25Å; H92-S240 WeakPolarHBondContact NE2-CB 3.32Å; H92-S240 PolarHBondContact NE2-OG 3.31Å; H92-S240 VanDerWaalsContact NE2-OG 3.07Å; G238-S240 VanDerWaalsContact C-N 3.34Å; S240-G242 PolarHBondContact O-N 3.32Å
241	G	93.5	Very high	84	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	-12.6	-175.2	0	0	0	0	0	115.2	G78 G79 A90 D239 T259	G78-G241 VanDerWaalsContact C-C 3.48Å; G78-G241 CarbonylContact C-O 3.53Å; G78-G241 CarbonylContact O-C 3.5Å; G78-G241 VanDerWaalsContact O-C 3.28Å; G78-G241 WeakPolarHBondContact O-CA 3.02Å; G79-G241 WeakPolarHBondContact CA-O 3.2Å; A90-G241 VanDerWaalsContact N-CA 3.35Å; D239-G241 PolarHBondContact O-N 2.75Å; G241-T259 PolarHBondContact N-O 3.34Å
242	G	92.9	Very high	83.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.195	C	C	.	.			trans	-67.4	164.9	174.6	0	0	0	0	0	113.4	D239 S240 T259	D239-G242 WeakPolarHBondContact O-CA 3.11Å; D239-G242 PolarHBondContact O-N 3.5Å; S240-G242 PolarHBondContact O-N 3.32Å; G242-T259 PolarHBondContact O-N 2.8Å; G242-T259 PolarHBondContact O-OG1 2.82Å
243	S	94.4	Very high	84.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	138.7	-175.6	52.4	0	0	0	0	113.5	Q66 S80 T178 L255	Q66-S243 PolarHBondContact OE1-OG 3.01Å; S80-S243 VanDerWaalsContact OG-CB 3.31Å; S80-S243 WeakPolarHBondContact OG-CB 3.42Å; T178-S243 VanDerWaalsContact CA-O 3.3Å; T178-S243 WeakPolarHBondContact CA-O 3.32Å; T178-S243 VanDerWaalsContact CB-O 3.3Å; T178-S243 WeakPolarHBondContact CB-O 3.47Å; T178-S243 PolarHBondContact OG1-O 2.82Å; S243-L255 VanDerWaalsContact CB-CD1 3.47Å
244	L	95.2	Very high	85.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	112.8	150.8	-178.6	75.6	0	0	0	107.7	C176 L224 T226 A256 G257 F284	C176-L244 HydrophobicContact CB-CD1 3.88Å; C176-L244 HydrophobicContact CB-CG 4.07Å; L224-L244 HydrophobicContact CD2-CD2 3.49Å; L224-L244 VanDerWaalsContact CD2-CD2 3.49Å; T226-L244 HydrophobicContact CG2-CD1 4.21Å; T226-L244 HydrophobicContact CG2-CD2 3.64Å; L244-A256 HydrophobicContact CD2-CB 4.48Å; L244-A256 PolarHBondContact O-N 2.96Å; L244-G257 PolarHBondContact N-O 2.87Å; L244-G257 PolarHBondContact O-N 2.91Å; L244-F284 HydrophobicContact CB-CD1 3.49Å; L244-F284 VanDerWaalsContact CB-CD1 3.49Å; L244-F284 HydrophobicContact CB-CE1 3.68Å; L244-F284 HydrophobicContact CB-CG 4.19Å; L244-F284 HydrophobicContact CD1-CE1 4.12Å; L244-F284 HydrophobicContact CD1-CZ 4.19Å; L244-F284 HydrophobicContact CD2-CB 4.4Å; L244-F284 HydrophobicContact CD2-CD1 4.15Å; L244-F284 HydrophobicContact CD2-CD2 4.28Å; L244-F284 HydrophobicContact CD2-CG 4.01Å; L244-F284 HydrophobicContact CG-CD1 4.26Å; L244-F284 HydrophobicContact CG-CE1 4.33Å
245	M	94.1	Very high	86	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.1	-172.7	56.7	-176.6	121.2	0	0	111.3	Y63 W65 I161 C176 T177 A179 W253 T254	Y63-M245 HydrophobicContact CD1-CE 3.31Å; Y63-M245 HydrophobicContact CD1-SD 3.31Å; Y63-M245 WeakPolarHBondContact CD1-SD 3.43Å; Y63-M245 HydrophobicContact CD2-CE 4.28Å; Y63-M245 HydrophobicContact CE1-CE 3.51Å; Y63-M245 HydrophobicContact CE1-SD 3.31Å; Y63-M245 WeakPolarHBondContact CE1-SD 3.22Å; Y63-M245 HydrophobicContact CE2-CE 4.45Å; Y63-M245 HydrophobicContact CG-CE 3.72Å; Y63-M245 HydrophobicContact CG-SD 4.29Å; W65-M245 HydrophobicContact CZ2-SD 3.65Å; I161-M245 HydrophobicContact CD1-CB 3.75Å; C176-M245 CarbonylContact C-O 3.52Å; C176-M245 WeakPolarHBondContact CA-O 3.32Å; C176-M245 WeakPolarHBondContact CB-O 3.47Å; T177-M245 PolarHBondContact N-O 2.83Å; T177-M245 WeakPolarHBondContact O-CG 3.43Å; T177-M245 PolarHBondContact O-N 2.78Å; A179-M245 HydrophobicContact CB-CE 3.8Å; M245-W253 HydrophobicContact CB-CE3 3.85Å; M245-W253 HydrophobicContact CB-CZ3 4.4Å; M245-W253 HydrophobicContact CG-CD2 4.49Å; M245-W253 HydrophobicContact CG-CE3 3.64Å; M245-W253 HydrophobicContact CG-CZ3 3.8Å; M245-W253 HydrophobicContact SD-CD2 4.17Å; M245-W253 HydrophobicContact SD-CE3 3.87Å; M245-W253 HydrophobicContact SD-CZ3 4.17Å; M245-T254 WeakPolarHBondContact CA-O 3.21Å
246	C	92.9	Very high	86.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	149.1	175.9	-53.3	0	0	0	0	109.1	F170 C176 T254 A256	F170-C246 HydrophobicContact CD1-CB 3.37Å; F170-C246 HydrophobicContact CD2-CB 4.3Å; F170-C246 HydrophobicContact CE1-CB 3.4Å; F170-C246 HydrophobicContact CE2-CB 4.31Å; F170-C246 HydrophobicContact CG-CB 3.86Å; F170-C246 HydrophobicContact CZ-CB 3.9Å; C176-C246 HydrophobicContact CB-CB 4.1Å; C176-C246 WeakPolarHBondContact CB-SG 3.42Å; C176-C246 WeakPolarHBondContact SG-CB 3.41Å; C176-C246 CovalentContact SG-SG 2.02Å; C176-C246 PolarHBondContact SG-SG 3.29Å; C246-T254 PolarHBondContact N-O 2.78Å; C246-T254 PolarHBondContact O-N 2.86Å; C246-A256 HydrophobicContact CB-CB 4.26Å; C246-A256 WeakPolarHBondContact SG-CB 3.03Å
247	R	87.1	Confident	87.4	Confident	82 Å²	82	32 Å²	32	31%	0.309	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	123.8	173.3	-71.1	-172.4	175.8	-164.2	-1.5	110	A252 W253	R247-A252 WeakPolarHBondContact CA-O 3.29Å; R247-W253 HydrophobicContact CG-CD2 4.02Å; R247-W253 HydrophobicContact CG-CE3 3.82Å; R247-W253 HydrophobicContact CG-CH2 4.18Å; R247-W253 HydrophobicContact CG-CZ2 4.33Å; R247-W253 HydrophobicContact CG-CZ3 3.9Å
248	N	80.6	Confident	88.4	Confident	23 Å²	23	28.6 Å²	28.6	12%	0.123	15%	0.145	C	C	.	.			trans	-74.1	173.5	174	69.4	17.1	0	0	0	112.7	E168 K250 G251 A252 T254	E168-N248 WeakPolarHBondContact OE1-CB 3.16Å; N248-K250 PolarHBondContact O-N 3.25Å; N248-K250 VanDerWaalsContact OD1-C 3.25Å; N248-K250 VanDerWaalsContact OD1-CA 3.29Å; N248-K250 WeakPolarHBondContact OD1-CA 3.46Å; N248-K250 WeakPolarHBondContact OD1-CB 3.41Å; N248-K250 PolarHBondContact OD1-N 3.38Å; N248-G251 WeakPolarHBondContact O-CA 3.38Å; N248-G251 PolarHBondContact O-N 2.97Å; N248-G251 PolarHBondContact OD1-N 2.8Å; N248-A252 PolarHBondContact N-O 2.85Å; N248-A252 PolarHBondContact OD1-N 3.45Å; N248-A252 PolarHBondContact OD1-O 2.86Å; N248-T254 PolarHBondContact ND2-OG1 3.36Å
249	K	74.7	Confident	89.3	Confident	222 Å²	222	28.5 Å²	28.5	97%	0.965	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.6	176.6	-63.9	-177.2	-179	177.8	0	113.5	G251	K249-G251 VanDerWaalsContact C-N 3.34Å
250	K	73.7	Confident	89.6	Confident	146 Å²	146	28 Å²	28	64%	0.635	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	1.6	177.8	-57.7	168.7	-176.1	162.7	0	112.3	E165 N248 A252	E165-K250 IonicContact OE1-NZ 2.81Å; E165-K250 PolarHBondContact OE1-NZ 3.39Å; N248-K250 PolarHBondContact O-N 3.25Å; N248-K250 VanDerWaalsContact OD1-C 3.25Å; N248-K250 VanDerWaalsContact OD1-CA 3.29Å; N248-K250 WeakPolarHBondContact OD1-CA 3.46Å; N248-K250 WeakPolarHBondContact OD1-CB 3.41Å; N248-K250 PolarHBondContact OD1-N 3.38Å; K250-A252 VanDerWaalsContact C-N 3.29Å; K250-A252 PolarHBondContact O-N 2.88Å
251	G	79	Confident	89.3	Confident	47 Å²	47	28.1 Å²	28.1	49%	0.485	14%	0.137	S	C	.	.	S	Bend	trans	76.8	6.2	-179.5	0	0	0	0	0	115.3	N248 K249	N248-G251 WeakPolarHBondContact O-CA 3.38Å; N248-G251 PolarHBondContact O-N 2.97Å; N248-G251 PolarHBondContact OD1-N 2.8Å; K249-G251 VanDerWaalsContact C-N 3.34Å
252	A	83	Confident	88.8	Confident	9 Å²	9	29.5 Å²	29.5	7%	0.074	15%	0.151	C	C	.	.			trans	-85	148.6	175.7	0	0	0	0	0	111	R247 N248 K250	R247-A252 WeakPolarHBondContact CA-O 3.29Å; N248-A252 PolarHBondContact N-O 2.85Å; N248-A252 PolarHBondContact OD1-N 3.45Å; N248-A252 PolarHBondContact OD1-O 2.86Å; K250-A252 VanDerWaalsContact C-N 3.29Å; K250-A252 PolarHBondContact O-N 2.88Å
253	W	89.1	Confident	88.2	Confident	18 Å²	18	32.1 Å²	32.1	7%	0.068	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	124.7	173.4	-66.8	101.3	0	0	0	111	G34 Y63 W65 I161 C162 M245 R247	G34-W253 WeakPolarHBondContact CA-O 3.46Å; G34-W253 PolarHBondContact O-N 2.78Å; Y63-W253 HydrophobicContact CE1-CZ2 4.24Å; W65-W253 HydrophobicContact CH2-CB 3.52Å; W65-W253 AromaticContact CH2-CD1 3.37Å; W65-W253 AromaticContact CH2-CG 3.56Å; W65-W253 HydrophobicContact CH2-CG 3.56Å; W65-W253 HydrophobicContact CZ2-CB 3.55Å; W65-W253 AromaticContact CZ2-CD1 3.86Å; W65-W253 HydrophobicContact CZ2-CD2 4.32Å; W65-W253 AromaticContact CZ2-CG 3.64Å; W65-W253 HydrophobicContact CZ2-CG 3.64Å; W65-W253 HydrophobicContact CZ3-CB 4.39Å; I161-W253 WeakPolarHBondContact CG1-O 3.49Å; C162-W253 WeakPolarHBondContact CB-O 3.34Å; C162-W253 PolarHBondContact N-O 3.03Å; M245-W253 HydrophobicContact CB-CE3 3.85Å; M245-W253 HydrophobicContact CB-CZ3 4.4Å; M245-W253 HydrophobicContact CG-CD2 4.49Å; M245-W253 HydrophobicContact CG-CE3 3.64Å; M245-W253 HydrophobicContact CG-CZ3 3.8Å; M245-W253 HydrophobicContact SD-CD2 4.17Å; M245-W253 HydrophobicContact SD-CE3 3.87Å; M245-W253 HydrophobicContact SD-CZ3 4.17Å; R247-W253 HydrophobicContact CG-CD2 4.02Å; R247-W253 HydrophobicContact CG-CE3 3.82Å; R247-W253 HydrophobicContact CG-CH2 4.18Å; R247-W253 HydrophobicContact CG-CZ2 4.33Å; R247-W253 HydrophobicContact CG-CZ3 3.9Å
254	T	92.7	Very high	87.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138	-177.5	-59.9	0	0	0	0	109.8	C162 P164 F170 M245 C246 N248 A256	C162-T254 CarbonylContact O-C 3.59Å; C162-T254 WeakPolarHBondContact O-CA 3.4Å; P164-T254 VanDerWaalsContact CA-CG2 3.46Å; P164-T254 HydrophobicContact CB-CG2 3.8Å; P164-T254 HydrophobicContact CG-CG2 4.46Å; F170-T254 HydrophobicContact CE2-CG2 4.23Å; F170-T254 HydrophobicContact CZ-CG2 3.77Å; M245-T254 WeakPolarHBondContact CA-O 3.21Å; C246-T254 PolarHBondContact N-O 2.78Å; C246-T254 PolarHBondContact O-N 2.86Å; N248-T254 PolarHBondContact ND2-OG1 3.36Å; T254-A256 PolarHBondContact O-N 2.85Å
255	L	94.9	Very high	86.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	102.1	178.9	-170.7	68.6	0	0	0	110.1	I88 I161 C162 L163 P164 S243 G257 V258 I287	I88-L255 HydrophobicContact CD1-CD2 4.2Å; I161-L255 HydrophobicContact CD1-CB 3.94Å; I161-L255 HydrophobicContact CD1-CD1 4.14Å; I161-L255 HydrophobicContact CG1-CB 4.33Å; I161-L255 HydrophobicContact CG2-CB 3.99Å; C162-L255 PolarHBondContact O-N 3.02Å; L163-L255 HydrophobicContact CD2-CD2 4.31Å; P164-L255 WeakPolarHBondContact CD-O 3.36Å; S243-L255 VanDerWaalsContact CB-CD1 3.47Å; L255-G257 WeakPolarHBondContact CD1-O 2.93Å; L255-V258 HydrophobicContact CD2-CG2 4.45Å; L255-I287 HydrophobicContact CD2-CD1 3.97Å; L255-I287 HydrophobicContact CD2-CG1 4.03Å; L255-I287 HydrophobicContact CG-CD1 4.37Å; L255-I287 HydrophobicContact CG-CG1 3.9Å
256	A	94.4	Very high	85.6	Confident	3 Å²	3	34.8 Å²	34.8	3%	0.025	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	-32	177.7	0	0	0	0	0	112.2	F170 L244 C246 T254 I287	F170-A256 HydrophobicContact CD2-CB 3.45Å; F170-A256 VanDerWaalsContact CD2-CB 3.45Å; F170-A256 HydrophobicContact CE2-CB 3.61Å; F170-A256 HydrophobicContact CG-CB 4.25Å; L244-A256 HydrophobicContact CD2-CB 4.48Å; L244-A256 PolarHBondContact O-N 2.96Å; C246-A256 HydrophobicContact CB-CB 4.26Å; C246-A256 WeakPolarHBondContact SG-CB 3.03Å; T254-A256 PolarHBondContact O-N 2.85Å; A256-I287 PolarHBondContact O-N 3.47Å; A256-I287 VanDerWaalsContact O-N 3.12Å
257	G	95	Very high	85.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	163.2	-178.7	0	0	0	0	0	114.2	L244 L255 T285	L244-G257 PolarHBondContact N-O 2.87Å; L244-G257 PolarHBondContact O-N 2.91Å; L255-G257 WeakPolarHBondContact CD1-O 2.93Å; G257-T285 CarbonylContact C-O 3.58Å; G257-T285 WeakPolarHBondContact CA-O 3.4Å
258	V	96.4	Very high	85	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126	172.8	175.4	0	0	0	0	108.8	I88 A90 L255 S260 F284 T285 I287	I88-V258 HydrophobicContact CG2-CG2 3.75Å; A90-V258 HydrophobicContact CB-CG1 4.12Å; L255-V258 HydrophobicContact CD2-CG2 4.45Å; V258-S260 PolarHBondContact O-N 2.96Å; V258-F284 CarbonylContact O-C 3.59Å; V258-F284 WeakPolarHBondContact O-CA 3.33Å; V258-T285 PolarHBondContact N-O 3.38Å; V258-T285 PolarHBondContact O-N 3.24Å; V258-I287 HydrophobicContact CG2-CD1 3.69Å
259	T	94.4	Very high	85.4	Confident	9 Å²	9	35.5 Å²	35.5	6%	0.055	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	120.8	-177.4	-50.7	0	0	0	0	110.5	A235 D239 G241 G242 F284	A235-T259 HydrophobicContact CB-CG2 3.84Å; D239-T259 HydrophobicContact CB-CG2 4.27Å; D239-T259 VanDerWaalsContact O-CB 3.31Å; D239-T259 WeakPolarHBondContact O-CB 3.32Å; G241-T259 PolarHBondContact N-O 3.34Å; G242-T259 PolarHBondContact O-N 2.8Å; G242-T259 PolarHBondContact O-OG1 2.82Å; T259-F284 VanDerWaalsContact CA-CD1 3.44Å; T259-F284 HydrophobicContact CG2-CE1 4.07Å; T259-F284 HydrophobicContact CG2-CZ 4.47Å; T259-F284 WeakPolarHBondContact OG1-CE1 3.31Å
260	S	91.4	Very high	85.8	Confident	4 Å²	4	32.3 Å²	32.3	3%	0.028	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-68.9	-171.7	179.7	0	0	0	0	111.8	H92 D142 V258 I283	H92-S260 PolarHBondContact CE1-O 2.82Å; D142-S260 WeakPolarHBondContact CB-OG 3.49Å; D142-S260 WeakPolarHBondContact OD2-CB 3.29Å; D142-S260 PolarHBondContact OD2-OG 2.9Å; V258-S260 PolarHBondContact O-N 2.96Å; S260-I283 WeakPolarHBondContact CB-O 3.22Å; S260-I283 PolarHBondContact N-O 3.42Å
261	W	86.2	Confident	85.9	Confident	27 Å²	27	31.9 Å²	31.9	10%	0.102	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	172.1	-179.6	63.1	-87.9	0	0	0	113.6	P138 M139 L211 I218 I283	P138-W261 PolarHBondContact O-NE1 3.28Å; M139-W261 HydrophobicContact CE-CB 3.56Å; M139-W261 HydrophobicContact CE-CG 3.66Å; L211-W261 HydrophobicContact CD2-CH2 4.22Å; I218-W261 HydrophobicContact CB-CH2 4.25Å; I218-W261 HydrophobicContact CD1-CH2 3.32Å; I218-W261 HydrophobicContact CD1-CZ2 4.09Å; I218-W261 HydrophobicContact CD1-CZ3 3.85Å; I218-W261 HydrophobicContact CG1-CH2 4.34Å; I218-W261 HydrophobicContact CG2-CH2 3.93Å; I218-W261 HydrophobicContact CG2-CZ2 3.84Å; W261-I283 HydrophobicContact CD2-CB 4.27Å; W261-I283 HydrophobicContact CD2-CD1 3.95Å; W261-I283 HydrophobicContact CD2-CG2 4.44Å; W261-I283 HydrophobicContact CE3-CD1 3.99Å; W261-I283 HydrophobicContact CG-CB 4.45Å; W261-I283 HydrophobicContact CG-CG2 4.46Å; W261-I283 HydrophobicContact CH2-CD1 3.18Å; W261-I283 HydrophobicContact CZ2-CD1 3.15Å; W261-I283 HydrophobicContact CZ2-CG1 4.43Å; W261-I283 HydrophobicContact CZ2-CG2 4.44Å; W261-I283 HydrophobicContact CZ3-CD1 3.63Å; W261-I283 PolarHBondContact N-O 2.92Å; W261-I283 VanDerWaalsContact N-O 3.14Å; W261-I283 WeakPolarHBondContact O-CA 3.42Å; W261-I283 VanDerWaalsContact O-CB 3.28Å; W261-I283 WeakPolarHBondContact O-CB 3.47Å; W261-I283 PolarHBondContact O-N 3.33Å
262	G	82	Confident	86	Confident	30 Å²	30	30.7 Å²	30.7	31%	0.309	17%	0.166	S	C	.	.			trans	-162.4	164.4	172.6	0	0	0	0	0	110.1
263	L	80.8	Confident	85.3	Confident	55 Å²	55	36.3 Å²	36.3	29%	0.288	20%	0.2	S	C	.	.	S	Bend	trans	-100.5	104.2	170.6	-168.8	73.6	0	0	0	109.8	L214 Q278 G279 S280	L214-L263 HydrophobicContact CD2-CD2 3.58Å; L263-Q278 HydrophobicContact CD2-CB 3.86Å; L263-G279 WeakPolarHBondContact O-CA 3.24Å; L263-S280 PolarHBondContact N-OG 3.07Å; L263-S280 PolarHBondContact O-N 3.26Å
264	G	75.8	Confident	84.4	Confident	13 Å²	13	44 Å²	44	13%	0.134	23%	0.229	C	C	.	.	S	Bend	trans	79.1	-172.3	-168.6	0	0	0	0	0	111.6
265	C	77.9	Confident	82.9	Confident	22 Å²	22	52 Å²	52	15%	0.149	26%	0.263	C	S	.	.	S	Bend	trans	-128.3	117.3	169.9	-58.8	0	0	0	0	108.9	E186 C236 Q237 R267	E186-C265 HydrophobicContact CB-CB 4.18Å; C236-C265 WeakPolarHBondContact CA-SG 3.26Å; C236-C265 HydrophobicContact CB-CB 3.67Å; C236-C265 WeakPolarHBondContact CB-SG 3.45Å; C236-C265 WeakPolarHBondContact SG-CB 3.43Å; C236-C265 CovalentContact SG-SG 2.03Å; C236-C265 PolarHBondContact SG-SG 3.16Å; Q237-C265 VanDerWaalsContact CD-SG 3.53Å; Q237-C265 PolarHBondContact NE2-SG 2.86Å; Q237-C265 PolarHBondContact OE1-SG 3.31Å; C265-R267 PolarHBondContact O-N 2.81Å
266	G	75	Confident	81.7	Confident	21 Å²	21	55.9 Å²	55.9	22%	0.216	29%	0.291	C	S	.	.	S	Bend	trans	67.8	23.3	178.3	0	0	0	0	0	113.6	G231 G232 D234	G231-G266 CarbonylContact C-O 3.54Å; G231-G266 WeakPolarHBondContact CA-O 3.35Å; G232-G266 PolarHBondContact N-O 2.9Å; D234-G266 PolarHBondContact OD2-N 3.02Å; D234-G266 VanDerWaalsContact OD2-N 3.08Å
267	R	83.8	Confident	80.7	Confident	70 Å²	70	59.9 Å²	59.9	26%	0.264	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-81.9	129.3	171.8	-66.9	-174.3	-175.7	-163.8	-4	109.7	E186 C265 S276 Q278 G279	E186-R267 IonicContact OE1-CZ 3.62Å; E186-R267 IonicContact OE1-NE 2.78Å; E186-R267 IonicContact OE1-NH2 3.52Å; E186-R267 PolarHBondContact OE1-NH2 3.01Å; E186-R267 IonicContact OE2-CZ 3.35Å; E186-R267 VanDerWaalsContact OE2-CZ 3.23Å; E186-R267 IonicContact OE2-NE 3.31Å; E186-R267 PolarHBondContact OE2-NE 3.17Å; E186-R267 IonicContact OE2-NH2 3.02Å; E186-R267 PolarHBondContact OE2-NH2 2.82Å; C265-R267 PolarHBondContact O-N 2.81Å; R267-S276 PolarHBondContact NH1-O 3.19Å; R267-Q278 VanDerWaalsContact CD-O 3.32Å; R267-Q278 WeakPolarHBondContact CD-O 3.41Å; R267-Q278 PolarHBondContact NH1-O 3.18Å; R267-G279 VanDerWaalsContact CB-CA 3.43Å
268	G	85.2	Confident	80	Confident	25 Å²	25	60.8 Å²	60.8	26%	0.258	32%	0.316	S	S	.	.			trans	-68.8	147.4	173	0	0	0	0	0	111.8	P229 D230	P229-G268 CarbonylContact O-C 3.45Å; P229-G268 WeakPolarHBondContact O-CA 3.17Å; D230-G268 VanDerWaalsContact C-CA 3.44Å
269	W	88.1	Confident	79.5	Confident	25 Å²	25	60.8 Å²	60.8	10%	0.095	32%	0.316	C	S	.	.	S	Bend	trans	-109	-3.4	177.8	61.2	88.5	0	0	0	113.5	L202 A210 F228 P229 N271 P281	L202-W269 HydrophobicContact CD2-CH2 4.28Å; L202-W269 HydrophobicContact CD2-CZ2 3.7Å; A210-W269 HydrophobicContact CB-CD2 4.32Å; A210-W269 HydrophobicContact CB-CG 3.92Å; F228-W269 WeakPolarHBondContact O-CH2 3.3Å; F228-W269 WeakPolarHBondContact O-CZ3 3.31Å; P229-W269 VanDerWaalsContact CA-CE2 3.44Å; P229-W269 HydrophobicContact CB-CZ2 3.92Å; P229-W269 HydrophobicContact CG-CZ2 3.73Å; P229-W269 PolarHBondContact O-N 2.88Å; W269-N271 PolarHBondContact O-N 3.07Å; W269-P281 HydrophobicContact CD2-CG 4.01Å; W269-P281 HydrophobicContact CE3-CG 4.09Å; W269-P281 HydrophobicContact CH2-CB 3.94Å; W269-P281 HydrophobicContact CH2-CG 3.84Å; W269-P281 HydrophobicContact CZ2-CB 4.37Å; W269-P281 HydrophobicContact CZ2-CG 3.81Å; W269-P281 HydrophobicContact CZ3-CB 4.06Å; W269-P281 HydrophobicContact CZ3-CG 4Å
270	R	81.9	Confident	79.2	Confident	155 Å²	155	60.4 Å²	60.4	59%	0.585	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-35.3	175	-80.1	-162.5	179	149.6	-5.9	113.2	P229 D230	P229-R270 HydrophobicContact CB-CG 3.54Å; P229-R270 PolarHBondContact O-N 3.02Å; D230-R270 VanDerWaalsContact OD1-CD 3.28Å; D230-R270 WeakPolarHBondContact OD1-CD 3.27Å; D230-R270 IonicContact OD1-CZ 2.7Å; D230-R270 IonicContact OD1-NE 3.79Å; D230-R270 IonicContact OD1-NH1 3.81Å; D230-R270 PolarHBondContact OD1-NH1 3.38Å; D230-R270 IonicContact OD2-CZ 3.83Å; D230-R270 IonicContact OD2-NH1 3.18Å; D230-R270 PolarHBondContact OD2-NH1 3.09Å
271	N	76.1	Confident	79.2	Confident	137 Å²	137	60.2 Å²	60.2	73%	0.733	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.8	53.3	-173.9	-67.6	-30.4	0	0	0	111.6	W269 V273	W269-N271 PolarHBondContact O-N 3.07Å; N271-V273 PolarHBondContact O-N 2.66Å
272	N	80.9	Confident	79.4	Confident	21 Å²	21	59.1 Å²	59.1	11%	0.112	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	44.6	177.1	-89.4	-6.7	0	0	0	114.1	T213 Q278 G279	T213-N272 PolarHBondContact OG1-ND2 3.35Å; N272-Q278 HydrophobicContact CB-CG 4.34Å; N272-Q278 PolarHBondContact O-NE2 3.34Å; N272-Q278 VanDerWaalsContact OD1-CA 3.26Å; N272-Q278 WeakPolarHBondContact OD1-CA 3.28Å; N272-G279 PolarHBondContact ND2-O 2.98Å; N272-G279 PolarHBondContact OD1-N 2.86Å
273	V	70.1	Confident	79.8	Confident	127 Å²	127	57.9 Å²	57.9	77%	0.77	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-36.2	-173.4	-172.6	0	0	0	0	112.1	N271	N271-V273 PolarHBondContact O-N 2.66Å
274	R	68.8	Low	80.4	Confident	180 Å²	180	55.3 Å²	55.3	68%	0.679	28%	0.282	S	S	*	.	S	Bend	trans	-98.1	130.4	-179.8	-68.8	-175.8	179.3	-176.9	0.1	111.2	S276 D277 Q278	R274-S276 VanDerWaalsContact C-N 3.29Å; R274-S276 PolarHBondContact O-N 2.93Å; R274-D277 PolarHBondContact O-N 3.42Å; R274-Q278 VanDerWaalsContact O-CG 3.29Å; R274-Q278 WeakPolarHBondContact O-CG 3.34Å; R274-Q278 PolarHBondContact O-N 3.06Å
275	K	62.5	Low	81.3	Confident	167 Å²	167	54.8 Å²	54.8	73%	0.726	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-25.5	-176.2	-71.9	178.7	-179.7	169.3	0	114.7
276	S	68.5	Low	82	Confident	82 Å²	82	55 Å²	55	57%	0.573	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-23.6	-179.7	55.7	0	0	0	0	113.6	R267 R274	R267-S276 PolarHBondContact NH1-O 3.19Å; R274-S276 VanDerWaalsContact C-N 3.29Å; R274-S276 PolarHBondContact O-N 2.93Å
277	D	73.1	Confident	82.9	Confident	87 Å²	87	54 Å²	54	47%	0.465	27%	0.265	S	S	.	.	S	Bend	trans	-118.8	13.6	-164.5	-55	-11.1	0	0	0	111.9	R274 G279	R274-D277 PolarHBondContact O-N 3.42Å; D277-G279 PolarHBondContact O-N 2.89Å
278	Q	81.8	Confident	83.1	Confident	20 Å²	20	53.2 Å²	53.2	9%	0.093	27%	0.271	C	S	.	.			trans	-61.4	136.9	179.1	-61.2	-166.4	-54.6	0	0	110.6	T213 L263 R267 N272 R274	T213-Q278 PolarHBondContact O-NE2 3.06Å; T213-Q278 VanDerWaalsContact O-NE2 3.15Å; L263-Q278 HydrophobicContact CD2-CB 3.86Å; R267-Q278 VanDerWaalsContact CD-O 3.32Å; R267-Q278 WeakPolarHBondContact CD-O 3.41Å; R267-Q278 PolarHBondContact NH1-O 3.18Å; N272-Q278 HydrophobicContact CB-CG 4.34Å; N272-Q278 PolarHBondContact O-NE2 3.34Å; N272-Q278 VanDerWaalsContact OD1-CA 3.26Å; N272-Q278 WeakPolarHBondContact OD1-CA 3.28Å; R274-Q278 VanDerWaalsContact O-CG 3.29Å; R274-Q278 WeakPolarHBondContact O-CG 3.34Å; R274-Q278 PolarHBondContact O-N 3.06Å
279	G	85.9	Confident	83.2	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.285	C	S	.	.			trans	-113	165	173.1	0	0	0	0	0	112.6	L214 L263 R267 N272 D277	L214-G279 WeakPolarHBondContact CD2-O 3.18Å; L263-G279 WeakPolarHBondContact O-CA 3.24Å; R267-G279 VanDerWaalsContact CB-CA 3.43Å; N272-G279 PolarHBondContact ND2-O 2.98Å; N272-G279 PolarHBondContact OD1-N 2.86Å; D277-G279 PolarHBondContact O-N 2.89Å
280	S	87.9	Confident	83.2	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.007	28%	0.281	C	S	.	.			trans	-134.3	165	166.8	73.3	0	0	0	0	110.1	L263	L263-S280 PolarHBondContact N-OG 3.07Å; L263-S280 PolarHBondContact O-N 3.26Å
281	P	90.6	Very high	83.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.254	C	S	.	.			trans	-56.6	157.5	159.5	-17.9	30.1	0	0	0	110.6	L202 A210 C225 T226 W269	L202-P281 HydrophobicContact CD2-CB 4.22Å; L202-P281 HydrophobicContact CD2-CG 3.9Å; A210-P281 HydrophobicContact CB-CG 3.65Å; C225-P281 HydrophobicContact CB-CB 3.96Å; C225-P281 HydrophobicContact CB-CG 4.47Å; T226-P281 WeakPolarHBondContact O-CB 2.94Å; W269-P281 HydrophobicContact CD2-CG 4.01Å; W269-P281 HydrophobicContact CE3-CG 4.09Å; W269-P281 HydrophobicContact CH2-CB 3.94Å; W269-P281 HydrophobicContact CH2-CG 3.84Å; W269-P281 HydrophobicContact CZ2-CB 4.37Å; W269-P281 HydrophobicContact CZ2-CG 3.81Å; W269-P281 HydrophobicContact CZ3-CB 4.06Å; W269-P281 HydrophobicContact CZ3-CG 4Å
282	G	89.8	Confident	83.6	Confident	4 Å²	4	47.2 Å²	47.2	4%	0.041	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	129.5	167.9	0	0	0	0	0	109.5	C225 T226 D234	C225-G282 WeakPolarHBondContact CA-O 3.45Å; T226-G282 PolarHBondContact N-O 3.03Å; T226-G282 PolarHBondContact O-N 3.22Å; D234-G282 WeakPolarHBondContact OD1-CA 3.42Å
283	I	91.8	Very high	83.7	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.015	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129.1	-177.6	-72.2	168.8	0	0	0	110.6	L211 F223 S260 W261	L211-I283 HydrophobicContact CD1-CD1 4.07Å; L211-I283 HydrophobicContact CD2-CD1 3.83Å; F223-I283 HydrophobicContact CB-CG2 3.61Å; F223-I283 HydrophobicContact CG-CG2 4.36Å; S260-I283 WeakPolarHBondContact CB-O 3.22Å; S260-I283 PolarHBondContact N-O 3.42Å; W261-I283 HydrophobicContact CD2-CB 4.27Å; W261-I283 HydrophobicContact CD2-CD1 3.95Å; W261-I283 HydrophobicContact CD2-CG2 4.44Å; W261-I283 HydrophobicContact CE3-CD1 3.99Å; W261-I283 HydrophobicContact CG-CB 4.45Å; W261-I283 HydrophobicContact CG-CG2 4.46Å; W261-I283 HydrophobicContact CH2-CD1 3.18Å; W261-I283 HydrophobicContact CZ2-CD1 3.15Å; W261-I283 HydrophobicContact CZ2-CG1 4.43Å; W261-I283 HydrophobicContact CZ2-CG2 4.44Å; W261-I283 HydrophobicContact CZ3-CD1 3.63Å; W261-I283 PolarHBondContact N-O 2.92Å; W261-I283 VanDerWaalsContact N-O 3.14Å; W261-I283 WeakPolarHBondContact O-CA 3.42Å; W261-I283 VanDerWaalsContact O-CB 3.28Å; W261-I283 WeakPolarHBondContact O-CB 3.47Å; W261-I283 PolarHBondContact O-N 3.33Å
284	F	93.7	Very high	84.3	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	146.7	179.2	-61.5	-103	0	0	0	108.6	L199 F223 L224 T226 A235 L244 V258 T259 D286	L199-F284 HydrophobicContact CD1-CE2 4.5Å; L199-F284 HydrophobicContact CD1-CZ 4.23Å; F223-F284 CarbonylContact C-O 3.5Å; F223-F284 WeakPolarHBondContact CA-O 3.22Å; L224-F284 HydrophobicContact CB-CB 4.43Å; L224-F284 PolarHBondContact N-O 3.19Å; L224-F284 PolarHBondContact O-N 2.04Å; T226-F284 HydrophobicContact CG2-CD2 4.11Å; T226-F284 HydrophobicContact CG2-CE2 4.21Å; T226-F284 WeakPolarHBondContact OG1-CE2 3.39Å; A235-F284 HydrophobicContact CB-CZ 4.15Å; L244-F284 HydrophobicContact CB-CD1 3.49Å; L244-F284 VanDerWaalsContact CB-CD1 3.49Å; L244-F284 HydrophobicContact CB-CE1 3.68Å; L244-F284 HydrophobicContact CB-CG 4.19Å; L244-F284 HydrophobicContact CD1-CE1 4.12Å; L244-F284 HydrophobicContact CD1-CZ 4.19Å; L244-F284 HydrophobicContact CD2-CB 4.4Å; L244-F284 HydrophobicContact CD2-CD1 4.15Å; L244-F284 HydrophobicContact CD2-CD2 4.28Å; L244-F284 HydrophobicContact CD2-CG 4.01Å; L244-F284 HydrophobicContact CG-CD1 4.26Å; L244-F284 HydrophobicContact CG-CE1 4.33Å; V258-F284 CarbonylContact O-C 3.59Å; V258-F284 WeakPolarHBondContact O-CA 3.33Å; T259-F284 VanDerWaalsContact CA-CD1 3.44Å; T259-F284 HydrophobicContact CG2-CE1 4.07Å; T259-F284 HydrophobicContact CG2-CZ 4.47Å; T259-F284 WeakPolarHBondContact OG1-CE1 3.31Å; F284-D286 PolarHBondContact O-N 2.96Å
285	T	94.4	Very high	84.6	Confident	3 Å²	3	36 Å²	36	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	122.1	165.7	-64.2	0	0	0	0	108.1	D142 I143 G257 V258 I287 V290	D142-T285 PolarHBondContact O-OG1 3.01Å; I143-T285 HydrophobicContact CB-CG2 4.24Å; I143-T285 HydrophobicContact CG2-CG2 4.5Å; G257-T285 CarbonylContact C-O 3.58Å; G257-T285 WeakPolarHBondContact CA-O 3.4Å; V258-T285 PolarHBondContact N-O 3.38Å; V258-T285 PolarHBondContact O-N 3.24Å; T285-I287 PolarHBondContact O-N 2.81Å; T285-V290 HydrophobicContact CG2-CG1 4.38Å; T285-V290 HydrophobicContact CG2-CG2 4.11Å
286	D	92.7	Very high	84.9	Confident	25 Å²	25	35 Å²	35	13%	0.134	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	109.5	179.4	-179	-9.9	0	0	0	109.4	T222 L224 F284 S288 K289	T222-D286 PolarHBondContact O-N 2.86Å; L224-D286 HydrophobicContact CB-CB 4.06Å; F284-D286 PolarHBondContact O-N 2.96Å; D286-S288 PolarHBondContact O-N 2.98Å; D286-S288 VanDerWaalsContact OD1-CB 3.31Å; D286-S288 WeakPolarHBondContact OD1-CB 3.05Å; D286-S288 PolarHBondContact OD1-N 3.28Å; D286-S288 PolarHBondContact OD1-OG 3.25Å; D286-S288 PolarHBondContact OD2-OG 2.99Å; D286-K289 HydrophobicContact CB-CB 4.43Å; D286-K289 HydrophobicContact CB-CG 3.83Å; D286-K289 PolarHBondContact O-N 2.98Å; D286-K289 WeakPolarHBondContact OD2-CG 3.45Å
287	I	92.5	Very high	85.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-58.7	-34.9	-178	-69.6	-58.6	0	0	0	111	I143 L163 P164 L255 A256 V258 T285 K289 V290 L291 I294	I143-I287 HydrophobicContact CD1-CD1 3.85Å; L163-I287 HydrophobicContact CD2-CG2 4.36Å; P164-I287 HydrophobicContact CG-CB 4.33Å; P164-I287 HydrophobicContact CG-CG2 3.56Å; L255-I287 HydrophobicContact CD2-CD1 3.97Å; L255-I287 HydrophobicContact CD2-CG1 4.03Å; L255-I287 HydrophobicContact CG-CD1 4.37Å; L255-I287 HydrophobicContact CG-CG1 3.9Å; A256-I287 PolarHBondContact O-N 3.47Å; A256-I287 VanDerWaalsContact O-N 3.12Å; V258-I287 HydrophobicContact CG2-CD1 3.69Å; T285-I287 PolarHBondContact O-N 2.81Å; I287-K289 PolarHBondContact O-N 2.98Å; I287-K289 VanDerWaalsContact O-N 3.14Å; I287-V290 HydrophobicContact CD1-CG2 4.42Å; I287-V290 CarbonylContact O-C 3.58Å; I287-V290 PolarHBondContact O-N 2.95Å; I287-V290 VanDerWaalsContact O-N 3.09Å; I287-L291 HydrophobicContact CG2-CD1 4.02Å; I287-L291 WeakPolarHBondContact O-CA 3.47Å; I287-L291 VanDerWaalsContact O-CB 3.3Å; I287-L291 WeakPolarHBondContact O-CB 3.45Å; I287-L291 PolarHBondContact O-N 2.57Å; I287-I294 HydrophobicContact CD1-CD1 3.83Å; I287-I294 HydrophobicContact CG2-CD1 4.04Å
288	S	88.5	Confident	84.9	Confident	54 Å²	54	29.6 Å²	29.6	38%	0.378	15%	0.151	S	C	.	.	H	α-helix	trans	-61.1	-27.2	-179.4	75.8	0	0	0	0	113	D286	D286-S288 PolarHBondContact O-N 2.98Å; D286-S288 VanDerWaalsContact OD1-CB 3.31Å; D286-S288 WeakPolarHBondContact OD1-CB 3.05Å; D286-S288 PolarHBondContact OD1-N 3.28Å; D286-S288 PolarHBondContact OD1-OG 3.25Å; D286-S288 PolarHBondContact OD2-OG 2.99Å
289	K	87.9	Confident	83.5	Confident	126 Å²	126	36 Å²	36	55%	0.548	18%	0.181	S	C	.	.	H	α-helix	trans	-81.3	-23.2	179.2	-57.6	-60.1	-179.7	-174.1	0	113.5	D286 I287	D286-K289 HydrophobicContact CB-CB 4.43Å; D286-K289 HydrophobicContact CB-CG 3.83Å; D286-K289 PolarHBondContact O-N 2.98Å; D286-K289 WeakPolarHBondContact OD2-CG 3.45Å; I287-K289 PolarHBondContact O-N 2.98Å; I287-K289 VanDerWaalsContact O-N 3.14Å
290	V	87.6	Confident	81.3	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-116.3	3.5	-177.3	-64.3	0	0	0	0	112.6	Y141 I143 T285 I287 P292 W293 I294	Y141-V290 HydrophobicContact CD1-CG1 3.84Å; Y141-V290 HydrophobicContact CE1-CG1 4.27Å; I143-V290 HydrophobicContact CD1-CG2 3.69Å; I143-V290 HydrophobicContact CG2-CB 4.44Å; I143-V290 HydrophobicContact CG2-CG1 4.36Å; I143-V290 HydrophobicContact CG2-CG2 4.35Å; T285-V290 HydrophobicContact CG2-CG1 4.38Å; T285-V290 HydrophobicContact CG2-CG2 4.11Å; I287-V290 HydrophobicContact CD1-CG2 4.42Å; I287-V290 CarbonylContact O-C 3.58Å; I287-V290 PolarHBondContact O-N 2.95Å; I287-V290 VanDerWaalsContact O-N 3.09Å; V290-P292 VanDerWaalsContact C-CD 3.5Å; V290-W293 WeakPolarHBondContact O-CB 3.31Å; V290-W293 PolarHBondContact O-N 3.24Å; V290-W293 VanDerWaalsContact O-N 3.13Å; V290-I294 HydrophobicContact CG2-CD1 3.99Å; V290-I294 WeakPolarHBondContact O-CG1 3.33Å; V290-I294 PolarHBondContact O-N 3.27Å
291	L	85.3	Confident	78.8	Confident	5 Å²	5	40.5 Å²	40.5	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-56.4	-42.1	-178.6	-170.1	66.8	0	0	0	113.5	L163 P164 L166 I287 W293 I294 H295	L163-L291 HydrophobicContact CB-CD1 4.21Å; P164-L291 HydrophobicContact CG-CD1 4.18Å; P164-L291 HydrophobicContact CG-CD2 4.3Å; P164-L291 VanDerWaalsContact O-CD2 3.29Å; P164-L291 WeakPolarHBondContact O-CD2 3.31Å; L166-L291 HydrophobicContact CG-CD2 4.38Å; I287-L291 HydrophobicContact CG2-CD1 4.02Å; I287-L291 WeakPolarHBondContact O-CA 3.47Å; I287-L291 VanDerWaalsContact O-CB 3.3Å; I287-L291 WeakPolarHBondContact O-CB 3.45Å; I287-L291 PolarHBondContact O-N 2.57Å; L291-W293 VanDerWaalsContact C-N 3.32Å; L291-W293 PolarHBondContact O-N 3.41Å; L291-I294 PolarHBondContact O-N 2.89Å; L291-H295 WeakPolarHBondContact CD1-NE2 3.26Å; L291-H295 PolarHBondContact O-CD2 2.83Å; L291-H295 VanDerWaalsContact O-CD2 3.26Å; L291-H295 PolarHBondContact O-N 2.85Å
292	P	80.7	Confident	76.1	Confident	83 Å²	83	45.9 Å²	45.9	54%	0.539	25%	0.247	S	C	.	.	H	α-helix	trans	-58.9	-43.3	175.4	-24.8	35.9	0	0	0	112.7	V290 H295 E296	V290-P292 VanDerWaalsContact C-CD 3.5Å; P292-H295 PolarHBondContact O-N 2.84Å; P292-E296 PolarHBondContact O-N 3.47Å
293	W	82.8	Confident	73.3	Confident	21 Å²	21	51.8 Å²	51.8	8%	0.08	27%	0.268	C	S	.	.	H	α-helix	trans	-67.2	-37.4	177.9	175.6	80.8	0	0	0	112.3	I128 H130 I143 L145 V290 L291 H295 E296 H297	I128-W293 HydrophobicContact CG2-CZ2 3.87Å; H130-W293 VanDerWaalsContact CA-CZ2 3.41Å; H130-W293 HydrophobicContact CB-CD2 4.5Å; H130-W293 HydrophobicContact CB-CH2 3.98Å; H130-W293 HydrophobicContact CB-CZ2 3.91Å; H130-W293 HydrophobicContact CB-CZ3 4.34Å; H130-W293 AromaticContact CD2-CD1 3.99Å; H130-W293 AromaticContact CD2-CD2 3.34Å; H130-W293 AromaticContact CD2-CE2 3.7Å; H130-W293 AromaticContact CD2-CE3 3.66Å; H130-W293 AromaticContact CD2-CG 3.53Å; H130-W293 AromaticContact NE2-CG 3.83Å; I143-W293 HydrophobicContact CD1-CZ3 4.37Å; I143-W293 HydrophobicContact CG1-CZ3 4.17Å; I143-W293 HydrophobicContact CG2-CE3 4.22Å; I143-W293 HydrophobicContact CG2-CH2 4.42Å; I143-W293 HydrophobicContact CG2-CZ3 3.78Å; L145-W293 HydrophobicContact CD1-CE3 4.31Å; L145-W293 HydrophobicContact CD1-CH2 3.9Å; L145-W293 HydrophobicContact CD1-CZ2 4.42Å; L145-W293 HydrophobicContact CD1-CZ3 3.82Å; L145-W293 HydrophobicContact CD2-CH2 4.33Å; L145-W293 HydrophobicContact CD2-CZ3 3.89Å; L145-W293 HydrophobicContact CG-CH2 3.59Å; L145-W293 HydrophobicContact CG-CZ2 4.48Å; L145-W293 HydrophobicContact CG-CZ3 3.59Å; V290-W293 WeakPolarHBondContact O-CB 3.31Å; V290-W293 PolarHBondContact O-N 3.24Å; V290-W293 VanDerWaalsContact O-N 3.13Å; L291-W293 VanDerWaalsContact C-N 3.32Å; L291-W293 PolarHBondContact O-N 3.41Å; W293-H295 VanDerWaalsContact C-N 3.33Å; W293-E296 PolarHBondContact O-N 3.13Å; W293-H297 AromaticContact CD1-CE1 3.43Å; W293-H297 VanDerWaalsContact CD1-CE1 3.43Å; W293-H297 AromaticContact CD1-ND1 3.63Å; W293-H297 AromaticContact CE2-ND1 3.9Å; W293-H297 AromaticContact NE1-CE1 3.2Å; W293-H297 PolarHBondContact NE1-CE1 2.79Å; W293-H297 AromaticContact NE1-ND1 3.5Å; W293-H297 PolarHBondContact NE1-ND1 3.26Å; W293-H297 AromaticContact NE1-NE2 3.91Å; W293-H297 PolarHBondContact O-N 2.78Å; W293-H297 PolarHBondContact O-ND1 3.23Å
294	I	83.4	Confident	70.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.6	-45.4	173.6	-67.3	169.2	0	0	0	110.3	I88 I143 L145 L163 I287 V290 L291 H297 I298	I88-I294 HydrophobicContact CD1-CD1 4.02Å; I88-I294 HydrophobicContact CD1-CG1 4.38Å; I88-I294 HydrophobicContact CD1-CG2 3.86Å; I143-I294 HydrophobicContact CD1-CD1 3.65Å; I143-I294 HydrophobicContact CD1-CG1 3.98Å; L145-I294 HydrophobicContact CD2-CG1 4.45Å; L163-I294 HydrophobicContact CD1-CG2 3.75Å; L163-I294 HydrophobicContact CD2-CG2 4.32Å; I287-I294 HydrophobicContact CD1-CD1 3.83Å; I287-I294 HydrophobicContact CG2-CD1 4.04Å; V290-I294 HydrophobicContact CG2-CD1 3.99Å; V290-I294 WeakPolarHBondContact O-CG1 3.33Å; V290-I294 PolarHBondContact O-N 3.27Å; L291-I294 PolarHBondContact O-N 2.89Å; I294-H297 PolarHBondContact O-N 2.93Å; I294-I298 HydrophobicContact CG2-CD1 3.68Å; I294-I298 HydrophobicContact CG2-CG1 4.35Å; I294-I298 WeakPolarHBondContact O-CB 3.4Å; I294-I298 WeakPolarHBondContact O-CG1 3.15Å; I294-I298 PolarHBondContact O-N 2.98Å
295	H	74.7	Confident	67.2	Low	72 Å²	72	68.7 Å²	68.7	33%	0.333	34%	0.337	S	S	.	.	H	α-helix	trans	-69.3	-34.5	-179.1	-76.8	-50.7	0	0	0	113.6	L291 P292 W293 H297	L291-H295 WeakPolarHBondContact CD1-NE2 3.26Å; L291-H295 PolarHBondContact O-CD2 2.83Å; L291-H295 VanDerWaalsContact O-CD2 3.26Å; L291-H295 PolarHBondContact O-N 2.85Å; P292-H295 PolarHBondContact O-N 2.84Å; W293-H295 VanDerWaalsContact C-N 3.33Å; H295-H297 PolarHBondContact O-N 2.77Å
296	E	70.3	Confident	64.2	Low	147 Å²	147	71.9 Å²	71.9	69%	0.687	36%	0.36	S	S	*	.	H	α-helix	trans	-58.2	-33.9	173.5	-178.1	-173.6	-177.6	0	0	112.2	P292 W293	P292-E296 PolarHBondContact O-N 3.47Å; W293-E296 PolarHBondContact O-N 3.13Å
297	H	71.7	Confident	61.5	Low	52 Å²	52	76.6 Å²	76.6	24%	0.241	40%	0.395	C	S	.	.	H	α-helix	trans	-107.9	-24.6	-170.6	-66.9	83.8	0	0	0	114.3	W86 I128 L145 W293 I294 H295	W86-H297 WeakPolarHBondContact CH2-O 3.4Å; W86-H297 VanDerWaalsContact CZ2-O 3.22Å; W86-H297 WeakPolarHBondContact CZ2-O 3.24Å; I128-H297 HydrophobicContact CD1-CB 4.16Å; L145-H297 HydrophobicContact CD1-CB 3.39Å; W293-H297 AromaticContact CD1-CE1 3.43Å; W293-H297 VanDerWaalsContact CD1-CE1 3.43Å; W293-H297 AromaticContact CD1-ND1 3.63Å; W293-H297 AromaticContact CE2-ND1 3.9Å; W293-H297 AromaticContact NE1-CE1 3.2Å; W293-H297 PolarHBondContact NE1-CE1 2.79Å; W293-H297 AromaticContact NE1-ND1 3.5Å; W293-H297 PolarHBondContact NE1-ND1 3.26Å; W293-H297 AromaticContact NE1-NE2 3.91Å; W293-H297 PolarHBondContact O-N 2.78Å; W293-H297 PolarHBondContact O-ND1 3.23Å; I294-H297 PolarHBondContact O-N 2.93Å; H295-H297 PolarHBondContact O-N 2.77Å
298	I	68.3	Low	58.9	Low	2 Å²	2	86 Å²	86	1%	0.01	43%	0.431	C	S	.	.			trans	-104.6	111.5	-178.8	-57.2	179	0	0	0	110.9	V82 W86 I88 L145 I294 T300	V82-I298 HydrophobicContact CG2-CD1 3.72Å; V82-I298 HydrophobicContact CG2-CG2 4.16Å; W86-I298 HydrophobicContact CB-CD1 4.45Å; W86-I298 HydrophobicContact CB-CG2 3.67Å; W86-I298 HydrophobicContact CD2-CB 4.29Å; W86-I298 HydrophobicContact CD2-CG1 4.01Å; W86-I298 HydrophobicContact CD2-CG2 3.88Å; W86-I298 HydrophobicContact CE3-CD1 4.49Å; W86-I298 HydrophobicContact CE3-CG1 3.81Å; W86-I298 HydrophobicContact CG-CB 4.4Å; W86-I298 HydrophobicContact CG-CG1 4.37Å; W86-I298 HydrophobicContact CG-CG2 3.5Å; W86-I298 VanDerWaalsContact CG-CG2 3.5Å; W86-I298 HydrophobicContact CZ3-CG1 4.27Å; I88-I298 HydrophobicContact CD1-CD1 4Å; I88-I298 HydrophobicContact CG1-CD1 3.94Å; L145-I298 HydrophobicContact CB-CG1 4.48Å; L145-I298 HydrophobicContact CD1-CD1 3.92Å; L145-I298 HydrophobicContact CD1-CG1 3.57Å; L145-I298 HydrophobicContact CD2-CD1 3.56Å; L145-I298 HydrophobicContact CD2-CG1 4.19Å; L145-I298 HydrophobicContact CG-CD1 4.17Å; L145-I298 HydrophobicContact CG-CG1 4.26Å; I294-I298 HydrophobicContact CG2-CD1 3.68Å; I294-I298 HydrophobicContact CG2-CG1 4.35Å; I294-I298 WeakPolarHBondContact O-CB 3.4Å; I294-I298 WeakPolarHBondContact O-CG1 3.15Å; I294-I298 PolarHBondContact O-N 2.98Å; I298-T300 VanDerWaalsContact C-N 3.3Å; I298-T300 HydrophobicContact CB-CG2 4.34Å; I298-T300 HydrophobicContact CG2-CG2 3.29Å; I298-T300 PolarHBondContact O-N 3.1Å
299	Q	53.1	Low	56.5	Low	154 Å²	154	86 Å²	86	72%	0.72	43%	0.433	S	S	*	.			trans	-74.3	78	163.5	-63.9	176	-10.5	0	0	110	G301	Q299-G301 PolarHBondContact O-N 3.46Å; Q299-G301 VanDerWaalsContact O-N 3.12Å
300	T	40.7	Very low	54.2	Low	48 Å²	48	90.5 Å²	90.5	29%	0.294	45%	0.447	S	S	.	.			trans	-77.1	92.8	175.7	50.9	0	0	0	0	111.2	V82 L163 I298	V82-T300 HydrophobicContact CB-CG2 4.28Å; V82-T300 HydrophobicContact CG2-CG2 4.22Å; L163-T300 HydrophobicContact CD1-CG2 4.36Å; I298-T300 VanDerWaalsContact C-N 3.3Å; I298-T300 HydrophobicContact CB-CG2 4.34Å; I298-T300 HydrophobicContact CG2-CG2 3.29Å; I298-T300 PolarHBondContact O-N 3.1Å
301	G	33.9	Very low	52.7	Low	49 Å²	49	92.4 Å²	92.4	51%	0.505	46%	0.46	S	S	.	.			trans	-85.2	110.8	170.7	0	0	0	0	0	113.6	Q299	Q299-G301 PolarHBondContact O-N 3.46Å; Q299-G301 VanDerWaalsContact O-N 3.12Å
302	N	33.5	Very low	50.9	Low	113 Å²	113	94.8 Å²	94.8	60%	0.604	48%	0.477	S	S	*	.				176.6	102.6	119.4	-104	-29.5	0	0	0	113.7	R304	N302-R304 PolarHBondContact O-N 2.99Å
303	R	32.7	Very low	49.5	Very low	127 Å²	127	98.4 Å²	98.4	48%	0.479	49%	0.487	S	S	.	.				19.3	94.2	126.5	-61.8	-177.5	-174.9	175.6	9	116.7	E336 N410	R303-E336 WeakPolarHBondContact CD-OE1 3.4Å; R303-E336 VanDerWaalsContact CZ-CD 3.44Å; R303-E336 VanDerWaalsContact CZ-CG 3.48Å; R303-E336 IonicContact CZ-OE1 3.8Å; R303-E336 IonicContact NE-OE1 3.14Å; R303-E336 PolarHBondContact NE-OE1 3.24Å; R303-E336 IonicContact NH1-OE1 2.81Å; R303-E336 PolarHBondContact NH1-OE1 3.22Å; R303-E336 IonicContact NH1-OE2 2.83Å; R303-E336 VanDerWaalsContact NH2-CB 3.33Å; R303-N410 PolarHBondContact NH2-OD1 2.98Å
304	R	27	Very low	48.2	Very low	150 Å²	150	105 Å²	105	57%	0.566	52%	0.519	S	S	*	.			trans	-77.1	125.6	134.8	-84.7	-173.9	179.7	166	6.7	106.6	S32 Q35 N302 S306	S32-R304 VanDerWaalsContact CB-NH2 3.26Å; S32-R304 PolarHBondContact OG-NH2 2.81Å; Q35-R304 VanDerWaalsContact NE2-NH2 3.12Å; N302-R304 PolarHBondContact O-N 2.99Å; R304-S306 VanDerWaalsContact C-N 3.3Å; R304-S306 PolarHBondContact O-N 2.97Å
305	K	30.4	Very low	47.4	Very low	209 Å²	209	108.8 Å²	108.8	91%	0.909	54%	0.539	S	S	*	.			trans	-44	96.4	163.8	-78.4	178.2	171.4	-177.9	0	108.8	S307	K305-S307 PolarHBondContact O-N 2.98Å
306	S	31.4	Very low	47.7	Very low	70 Å²	70	108.9 Å²	108.9	49%	0.49	54%	0.544	S	S	.	.			trans	-63.4	119.9	152.2	177	0	0	0	0	104.4	R304 R308 A309	R304-S306 VanDerWaalsContact C-N 3.3Å; R304-S306 PolarHBondContact O-N 2.97Å; S306-R308 PolarHBondContact O-N 2.89Å; S306-R308 PolarHBondContact OG-N 2.92Å; S306-A309 PolarHBondContact O-N 2.88Å
307	S	35.6	Very low	48.4	Very low	125 Å²	125	107.3 Å²	107.3	87%	0.874	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	28.7	171.1	46.8	0	0	0	0	112.9	K305	K305-S307 PolarHBondContact O-N 2.98Å
308	R	37.3	Very low	49.1	Very low	198 Å²	198	106.4 Å²	106.4	75%	0.747	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.4	3.8	177.3	-77.2	-165.5	179.9	165.9	-0.8	116.5	S306 W310	S306-R308 PolarHBondContact O-N 2.89Å; S306-R308 PolarHBondContact OG-N 2.92Å; R308-W310 PolarHBondContact O-N 2.84Å
309	A	37.9	Very low	50.1	Low	52 Å²	52	110.8 Å²	110.8	43%	0.43	57%	0.568	S	S	.	*			trans	-84.5	64.2	168.4	0	0	0	0	0	110.1	S306	S306-A309 PolarHBondContact O-N 2.88Å
310	W	40.1	Very low	51.9	Low	221 Å²	221	104.8 Å²	104.8	84%	0.837	55%	0.547	S	S	*	.			trans	-119.3	90.9	168.8	-128.5	-34.3	0	0	0	107.7	R308 S312	R308-W310 PolarHBondContact O-N 2.84Å; W310-S312 VanDerWaalsContact CD1-CB 3.43Å; W310-S312 PolarHBondContact O-N 3.49Å
311	C	57.1	Low	54.3	Low	43 Å²	43	105.3 Å²	105.3	29%	0.291	56%	0.557	S	S	.	*			trans	-81	83.9	150.3	-68.8	0	0	0	0	106.5	R340 C341	C311-R340 WeakPolarHBondContact CB-O 3.05Å; C311-C341 HydrophobicContact CB-CB 3.76Å; C311-C341 WeakPolarHBondContact CB-SG 3.3Å; C311-C341 WeakPolarHBondContact SG-CB 3.11Å; C311-C341 CovalentContact SG-SG 2.04Å; C311-C341 PolarHBondContact SG-SG 3.4Å
312	S	47	Very low	57.1	Low	54 Å²	54	109.4 Å²	109.4	38%	0.378	56%	0.563	S	S	.	*	B	Isolated β-bridge	trans	-106.4	92.4	168.4	37.1	0	0	0	0	107.6	W310 Q314	W310-S312 VanDerWaalsContact CD1-CB 3.43Å; W310-S312 PolarHBondContact O-N 3.49Å; S312-Q314 PolarHBondContact O-N 3.19Å
313	E	51.2	Low	59.8	Low	159 Å²	159	105 Å²	105	74%	0.743	54%	0.544	S	S	*	.	S	Bend	trans	52.9	4.1	163	-61.1	-167.1	159.4	0	0	118.7
314	Q	55.4	Low	62.6	Low	161 Å²	161	107.1 Å²	107.1	75%	0.752	56%	0.557	S	S	*	*			trans	-92.9	118.5	178.5	-76.9	170.2	-15.4	0	0	110.3	S312 V316	S312-Q314 PolarHBondContact O-N 3.19Å; Q314-V316 PolarHBondContact O-N 3.44Å
315	D	66.6	Low	65.4	Low	79 Å²	79	100.7 Å²	100.7	42%	0.422	53%	0.534	S	S	.	.			trans	-58.5	114.7	172.3	-79	8.2	0	0	0	109.9	V342	D315-V342 WeakPolarHBondContact OD1-CB 3.42Å; D315-V342 WeakPolarHBondContact OD1-CG1 3.49Å
316	V	81.7	Confident	67.7	Low	74 Å²	74	93.9 Å²	93.9	45%	0.448	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	114.1	174.3	178.8	0	0	0	0	108.5	Q314 V318 V342 W343 T344	Q314-V316 PolarHBondContact O-N 3.44Å; V316-V318 HydrophobicContact CG1-CG2 4.11Å; V316-V342 PolarHBondContact N-O 2.99Å; V316-W343 HydrophobicContact CB-CG 4.5Å; V316-W343 CarbonylContact O-C 3.56Å; V316-W343 VanDerWaalsContact O-CA 3.29Å; V316-W343 WeakPolarHBondContact O-CA 3Å; V316-T344 PolarHBondContact O-N 3.12Å
317	I	83.2	Confident	69.8	Low	113 Å²	113	91.3 Å²	91.3	58%	0.579	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	122.3	174.2	-58.5	175.4	0	0	0	108.7	T344 L346	I317-T344 WeakPolarHBondContact CA-O 3.25Å; I317-L346 HydrophobicContact CG2-CD1 3.55Å; I317-L346 HydrophobicContact CG2-CG 4.14Å
318	V	87.1	Confident	71.1	Confident	33 Å²	33	86 Å²	86	20%	0.2	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	108.4	175.9	-169.7	0	0	0	0	107.5	V316 T344 L345 L346 Y418	V316-V318 HydrophobicContact CG1-CG2 4.11Å; V318-T344 PolarHBondContact N-O 3.3Å; V318-L345 HydrophobicContact CB-CD2 3.74Å; V318-L345 HydrophobicContact CG1-CD2 4.3Å; V318-L345 HydrophobicContact CG2-CD2 4.09Å; V318-L345 CarbonylContact O-C 3.52Å; V318-L345 WeakPolarHBondContact O-CA 3.2Å; V318-L346 PolarHBondContact O-N 2.75Å; V318-Y418 HydrophobicContact CG1-CE1 3.88Å; V318-Y418 WeakPolarHBondContact CG1-OH 3.41Å
319	S	89.9	Confident	71.9	Confident	94 Å²	94	83.2 Å²	83.2	66%	0.657	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	142	-178	59.8	0	0	0	0	112.3	L346	S319-L346 VanDerWaalsContact CA-O 3.26Å; S319-L346 WeakPolarHBondContact CA-O 3.41Å
320	G	90.1	Very high	72.4	Confident	28 Å²	28	82.9 Å²	82.9	29%	0.289	44%	0.438	S	S	.	.	S	Bend	trans	157.1	164.3	176.7	0	0	0	0	0	112.7	E322 L346	G320-E322 VanDerWaalsContact C-N 3.29Å; G320-L346 PolarHBondContact N-O 3.07Å; G320-L346 VanDerWaalsContact N-O 3.1Å
321	A	90.6	Very high	72.4	Confident	59 Å²	59	77.8 Å²	77.8	49%	0.488	43%	0.426	S	S	.	.	S	Bend	trans	-73.8	-22.5	175.1	0	0	0	0	0	112.7	P348 K419 A420	A321-P348 HydrophobicContact CB-CG 4.45Å; A321-K419 CarbonylContact O-C 3.58Å; A321-A420 HydrophobicContact CB-CB 4.32Å; A321-A420 VanDerWaalsContact O-CB 3.24Å; A321-A420 WeakPolarHBondContact O-CB 3.35Å; A321-A420 PolarHBondContact O-N 2.88Å
322	E	94.1	Very high	71.7	Confident	135 Å²	135	81.6 Å²	81.6	63%	0.631	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.8	157.3	170.7	59.6	175.8	-168.5	0	0	109.7	G320 Y418 K419	G320-E322 VanDerWaalsContact C-N 3.29Å; E322-Y418 CarbonylContact C-O 3.49Å; E322-Y418 VanDerWaalsContact CA-O 3.23Å; E322-Y418 WeakPolarHBondContact CA-O 3.35Å; E322-K419 HydrophobicContact CB-CG 4.05Å
323	G	90.6	Very high	71.6	Confident	21 Å²	21	82.6 Å²	82.6	22%	0.216	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	173.6	177.3	0	0	0	0	0	113.3	T417 Y418	G323-T417 WeakPolarHBondContact O-CA 3.39Å; G323-Y418 VanDerWaalsContact CA-CE1 3.42Å; G323-Y418 PolarHBondContact N-O 2.69Å; G323-Y418 PolarHBondContact O-N 3.11Å
324	K	89.5	Confident	71.7	Confident	172 Å²	172	80 Å²	80	75%	0.748	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.2	175.8	-54.3	-167.2	177.2	178.3	0	108.5	L416 T417	K324-L416 WeakPolarHBondContact CA-O 3.46Å; K324-T417 HydrophobicContact CB-CG2 4.41Å; K324-T417 HydrophobicContact CD-CG2 4.16Å; K324-T417 HydrophobicContact CG-CG2 3.83Å
325	L	87.3	Confident	71.7	Confident	15 Å²	15	72.4 Å²	72.4	8%	0.079	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.2	171.7	-176.3	67.1	0	0	0	107.5	W343 L345 L401 F414 L416	L325-W343 HydrophobicContact CD1-CD2 4.37Å; L325-W343 HydrophobicContact CD1-CG 4.05Å; L325-W343 HydrophobicContact CD2-CB 4.01Å; L325-W343 HydrophobicContact CD2-CD2 3.94Å; L325-W343 HydrophobicContact CD2-CE3 4.35Å; L325-W343 HydrophobicContact CD2-CG 3.78Å; L325-L345 HydrophobicContact CD2-CD2 4.45Å; L325-L401 HydrophobicContact CD2-CD1 3.57Å; L325-F414 HydrophobicContact CD2-CE2 4.02Å; L325-F414 HydrophobicContact CD2-CZ 4.48Å; L325-F414 HydrophobicContact CG-CE2 4.24Å; L325-L416 HydrophobicContact CB-CD1 3.68Å; L325-L416 HydrophobicContact CB-CG 3.99Å; L325-L416 HydrophobicContact CD2-CD1 4.43Å; L325-L416 HydrophobicContact CD2-CD2 4.44Å; L325-L416 PolarHBondContact N-O 2.86Å; L325-L416 PolarHBondContact O-N 3.2Å
326	H	79.1	Confident	71.3	Confident	66 Å²	66	71.7 Å²	71.7	31%	0.306	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.4	172.7	56.1	-68.7	0	0	0	107.5	P328 E329 F414 N415	H326-P328 CarbonylContact C-O 3.58Å; H326-P328 PolarHBondContact CD2-O 3.01Å; H326-P328 VanDerWaalsContact CD2-O 3.27Å; H326-E329 VanDerWaalsContact NE2-C 3.34Å; H326-E329 PolarHBondContact NE2-O 3.2Å; H326-F414 CarbonylContact C-O 3.55Å; H326-F414 WeakPolarHBondContact CA-O 3.45Å; H326-N415 WeakPolarHBondContact CB-OD1 3.28Å
327	F	73.9	Confident	70.3	Confident	15 Å²	15	70.1 Å²	70.1	7%	0.066	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	124.9	175.4	179.3	-102.1	0	0	0	108.9	Y335 C341 W343 F403 G413 F414	F327-Y335 VanDerWaalsContact CE1-CB 3.45Å; F327-Y335 HydrophobicContact CE1-CG 4.36Å; F327-C341 WeakPolarHBondContact CE2-SG 3.45Å; F327-C341 WeakPolarHBondContact CZ-SG 3.45Å; F327-W343 HydrophobicContact CB-CH2 3.71Å; F327-W343 HydrophobicContact CB-CZ2 3.89Å; F327-W343 HydrophobicContact CD1-CH2 4.04Å; F327-W343 AromaticContact CD2-CH2 3.57Å; F327-W343 HydrophobicContact CD2-CH2 3.57Å; F327-W343 AromaticContact CD2-CZ2 3.48Å; F327-W343 HydrophobicContact CD2-CZ2 3.48Å; F327-W343 VanDerWaalsContact CD2-CZ2 3.48Å; F327-W343 HydrophobicContact CE2-CH2 4.2Å; F327-W343 HydrophobicContact CE2-CZ2 4.23Å; F327-W343 AromaticContact CG-CH2 3.46Å; F327-W343 HydrophobicContact CG-CH2 3.46Å; F327-W343 VanDerWaalsContact CG-CH2 3.46Å; F327-W343 AromaticContact CG-CZ2 3.78Å; F327-W343 HydrophobicContact CG-CZ2 3.78Å; F327-F403 AromaticContact CD1-CD1 3.96Å; F327-F403 HydrophobicContact CD1-CD1 3.96Å; F327-F403 HydrophobicContact CD1-CE1 4.28Å; F327-F403 HydrophobicContact CD1-CG 4.1Å; F327-F403 AromaticContact CE1-CD1 3.3Å; F327-F403 HydrophobicContact CE1-CD1 3.3Å; F327-F403 AromaticContact CE1-CE1 3.44Å; F327-F403 HydrophobicContact CE1-CE1 3.44Å; F327-F403 VanDerWaalsContact CE1-CE1 3.44Å; F327-F403 AromaticContact CE1-CG 3.91Å; F327-F403 HydrophobicContact CE1-CG 3.91Å; F327-F403 HydrophobicContact CE1-CZ 4.13Å; F327-F403 AromaticContact CZ-CD1 3.99Å; F327-F403 HydrophobicContact CZ-CD1 3.99Å; F327-F403 HydrophobicContact CZ-CE1 4.22Å; F327-G413 CarbonylContact O-C 3.6Å; F327-G413 VanDerWaalsContact O-CA 3.27Å; F327-G413 WeakPolarHBondContact O-CA 3.31Å; F327-F414 HydrophobicContact CB-CD1 4.14Å; F327-F414 HydrophobicContact CB-CE1 3.6Å; F327-F414 HydrophobicContact CB-CE2 4.16Å; F327-F414 HydrophobicContact CB-CZ 3.62Å; F327-F414 HydrophobicContact CD1-CD1 4.4Å; F327-F414 AromaticContact CD1-CE1 3.91Å; F327-F414 HydrophobicContact CD1-CE1 3.91Å; F327-F414 HydrophobicContact CG-CE1 4.12Å; F327-F414 HydrophobicContact CG-CZ 4.44Å; F327-F414 PolarHBondContact N-O 3.46Å; F327-F414 PolarHBondContact O-N 3.4Å
328	P	63.2	Low	69.6	Low	13 Å²	13	72.6 Å²	72.6	8%	0.084	38%	0.381	C	S	.	.	S	Bend	cis	-63.7	161.3	-1.2	-26.9	39.7	0	0	0	115.4	H326 S330 L333	H326-P328 CarbonylContact C-O 3.58Å; H326-P328 PolarHBondContact CD2-O 3.01Å; H326-P328 VanDerWaalsContact CD2-O 3.27Å; P328-S330 CarbonylContact O-C 3.53Å; P328-S330 PolarHBondContact O-N 3.49Å; P328-L333 HydrophobicContact CB-CB 3.83Å; P328-L333 VanDerWaalsContact CD-O 3.32Å; P328-L333 WeakPolarHBondContact CD-O 3.23Å; P328-L333 HydrophobicContact CG-CB 4.14Å; P328-L333 VanDerWaalsContact CG-O 3.23Å; P328-L333 WeakPolarHBondContact CG-O 3.26Å
329	E	54.3	Low	68.9	Low	141 Å²	141	72 Å²	72	66%	0.659	38%	0.377	S	S	*	.	S	Bend	trans	-61.7	-2.6	179.8	-157.9	-173.4	-174	0	0	113.7	H326	H326-E329 VanDerWaalsContact NE2-C 3.34Å; H326-E329 PolarHBondContact NE2-O 3.2Å
330	S	49.1	Very low	68.4	Low	45 Å²	45	74.6 Å²	74.6	32%	0.315	37%	0.372	S	S	.	.	S	Bend	trans	-127.1	127.1	169	175	0	0	0	0	107.9	P328 H332 L333	P328-S330 CarbonylContact O-C 3.53Å; P328-S330 PolarHBondContact O-N 3.49Å; S330-H332 PolarHBondContact O-N 2.04Å; S330-L333 PolarHBondContact O-N 2.8Å; S330-L333 VanDerWaalsContact O-N 3.07Å
331	L	40.4	Very low	68.1	Low	114 Å²	114	73.4 Å²	73.4	60%	0.597	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	3.7	176.9	-73.2	151	0	0	0	114.4	N415	L331-N415 VanDerWaalsContact CD2-ND2 3.26Å; L331-N415 WeakPolarHBondContact CD2-ND2 3.34Å
332	H	41.7	Very low	67.8	Low	122 Å²	122	71.8 Å²	71.8	57%	0.565	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.9	15.3	-176.1	-50.4	-38.3	0	0	0	112.1	L166 S330	L166-H332 WeakPolarHBondContact CD1-CE1 3.46Å; S330-H332 PolarHBondContact O-N 2.04Å
333	L	45.1	Very low	67.6	Low	76 Å²	76	66.2 Å²	66.2	40%	0.398	32%	0.316	S	S	.	.			trans	-116.6	137.1	174.9	-65.6	176.7	0	0	0	108.6	P328 S330	P328-L333 HydrophobicContact CB-CB 3.83Å; P328-L333 VanDerWaalsContact CD-O 3.32Å; P328-L333 WeakPolarHBondContact CD-O 3.23Å; P328-L333 HydrophobicContact CG-CB 4.14Å; P328-L333 VanDerWaalsContact CG-O 3.23Å; P328-L333 WeakPolarHBondContact CG-O 3.26Å; S330-L333 PolarHBondContact O-N 2.8Å; S330-L333 VanDerWaalsContact O-N 3.07Å
334	Y	53.5	Low	67.6	Low	104 Å²	104	65.8 Å²	65.8	41%	0.408	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-78.9	149	161.9	-61.2	-96.4	0	0	0	108.4	N410 A411 A412	Y334-N410 WeakPolarHBondContact CD1-O 3.24Å; Y334-N410 HydrophobicContact CG-CB 4.37Å; Y334-A411 VanDerWaalsContact CA-O 3.28Å; Y334-A411 WeakPolarHBondContact CA-O 3.07Å; Y334-A411 WeakPolarHBondContact CB-O 3.28Å; Y334-A412 HydrophobicContact CD1-CB 4.39Å; Y334-A412 HydrophobicContact CE1-CB 4.3Å
335	Y	55.6	Low	67.7	Low	1 Å²	1	57.6 Å²	57.6	0%	0.004	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-63.6	145.6	172.1	60.5	-107	0	0	0	109.6	F327 V362 E363 S368 F403 S405 N410 A411	F327-Y335 VanDerWaalsContact CE1-CB 3.45Å; F327-Y335 HydrophobicContact CE1-CG 4.36Å; Y335-V362 HydrophobicContact CE1-CG2 4.35Å; Y335-E363 PolarHBondContact OH-N 3.07Å; Y335-E363 PolarHBondContact OH-OE2 2.99Å; Y335-S368 VanDerWaalsContact OH-CB 3.31Å; Y335-S368 WeakPolarHBondContact OH-CB 2.83Å; Y335-S368 PolarHBondContact OH-OG 2.83Å; Y335-F403 HydrophobicContact CD1-CE1 4.1Å; Y335-F403 HydrophobicContact CD1-CE2 4.03Å; Y335-F403 AromaticContact CD1-CZ 3.36Å; Y335-F403 HydrophobicContact CD1-CZ 3.36Å; Y335-F403 AromaticContact CD2-CE1 3.9Å; Y335-F403 HydrophobicContact CD2-CE1 3.9Å; Y335-F403 AromaticContact CD2-CZ 3.61Å; Y335-F403 HydrophobicContact CD2-CZ 3.61Å; Y335-F403 HydrophobicContact CE1-CE2 4.01Å; Y335-F403 AromaticContact CE1-CZ 3.54Å; Y335-F403 HydrophobicContact CE1-CZ 3.54Å; Y335-F403 HydrophobicContact CE2-CE1 4.47Å; Y335-F403 AromaticContact CE2-CZ 3.82Å; Y335-F403 HydrophobicContact CE2-CZ 3.82Å; Y335-F403 AromaticContact CG-CE1 3.7Å; Y335-F403 HydrophobicContact CG-CE1 3.7Å; Y335-F403 HydrophobicContact CG-CE2 4.45Å; Y335-F403 AromaticContact CG-CZ 3.39Å; Y335-F403 HydrophobicContact CG-CZ 3.39Å; Y335-F403 AromaticContact CZ-CZ 3.77Å; Y335-S405 VanDerWaalsContact CE2-CB 3.48Å; Y335-N410 WeakPolarHBondContact O-CB 3.46Å; Y335-N410 PolarHBondContact O-OD1 3.26Å; Y335-N410 VanDerWaalsContact O-OD1 3.09Å; Y335-A411 WeakPolarHBondContact CD1-O 3.22Å; Y335-A411 HydrophobicContact CE1-CB 3.62Å; Y335-A411 WeakPolarHBondContact CE1-O 3.48Å; Y335-A411 PolarHBondContact N-O 2.94Å; Y335-A411 VanDerWaalsContact N-O 3.07Å
336	E	56.7	Low	67.9	Low	65 Å²	65	59.5 Å²	59.5	30%	0.304	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-80.4	153.1	176.6	-51.5	-167	152.3	0	0	110.6	R303 Q339 S405	R303-E336 WeakPolarHBondContact CD-OE1 3.4Å; R303-E336 VanDerWaalsContact CZ-CD 3.44Å; R303-E336 VanDerWaalsContact CZ-CG 3.48Å; R303-E336 IonicContact CZ-OE1 3.8Å; R303-E336 IonicContact NE-OE1 3.14Å; R303-E336 PolarHBondContact NE-OE1 3.24Å; R303-E336 IonicContact NH1-OE1 2.81Å; R303-E336 PolarHBondContact NH1-OE1 3.22Å; R303-E336 IonicContact NH1-OE2 2.83Å; R303-E336 VanDerWaalsContact NH2-CB 3.33Å; E336-Q339 HydrophobicContact CB-CG 3.95Å; E336-Q339 VanDerWaalsContact N-CD 3.27Å; E336-Q339 VanDerWaalsContact O-CG 3.25Å; E336-Q339 WeakPolarHBondContact O-CG 3.5Å; E336-Q339 PolarHBondContact O-OE1 2.83Å; E336-S405 PolarHBondContact O-OG 2.85Å
337	S	62.1	Low	68.5	Low	41 Å²	41	56.7 Å²	56.7	29%	0.287	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	142.6	167.6	60.6	0	0	0	0	112.9	D406	S337-D406 CarbonylContact C-O 3.51Å; S337-D406 WeakPolarHBondContact CA-O 3.44Å; S337-D406 WeakPolarHBondContact CB-O 3.41Å
338	K	68.6	Low	69.5	Low	164 Å²	164	59 Å²	59	71%	0.713	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	32.1	178.7	-52.9	-179.7	-179.7	178.9	0	114.7	S405 D406	K338-S405 WeakPolarHBondContact CA-O 3.25Å; K338-S405 PolarHBondContact N-O 2.87Å; K338-S405 PolarHBondContact N-OG 3.39Å; K338-D406 PolarHBondContact N-O 3.48Å; K338-D406 VanDerWaalsContact N-O 3.07Å
339	Q	72.3	Confident	70.8	Confident	21 Å²	21	66.2 Å²	66.2	10%	0.098	32%	0.32	C	S	.	.			trans	-89.6	140.2	174.7	-72.8	-176.5	-31	0	0	111.1	E336 V404 S405	E336-Q339 HydrophobicContact CB-CG 3.95Å; E336-Q339 VanDerWaalsContact N-CD 3.27Å; E336-Q339 VanDerWaalsContact O-CG 3.25Å; E336-Q339 WeakPolarHBondContact O-CG 3.5Å; E336-Q339 PolarHBondContact O-OE1 2.83Å; Q339-V404 WeakPolarHBondContact O-CA 3.46Å; Q339-S405 PolarHBondContact N-OG 3.01Å; Q339-S405 PolarHBondContact O-N 3.46Å
340	R	78.6	Confident	72.3	Confident	149 Å²	149	67.8 Å²	67.8	56%	0.562	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	110.1	169	-70.7	-171.5	-179.7	124.9	1.5	108.4	C311 F403 V404	C311-R340 WeakPolarHBondContact CB-O 3.05Å; R340-F403 WeakPolarHBondContact CA-O 3.32Å; R340-V404 HydrophobicContact CG-CG2 4.48Å
341	C	83.1	Confident	74.2	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.014	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.6	177.8	-55.2	0	0	0	0	109.1	C311 F327 W343 K402 F403	C311-C341 HydrophobicContact CB-CB 3.76Å; C311-C341 WeakPolarHBondContact CB-SG 3.3Å; C311-C341 WeakPolarHBondContact SG-CB 3.11Å; C311-C341 CovalentContact SG-SG 2.04Å; C311-C341 PolarHBondContact SG-SG 3.4Å; F327-C341 WeakPolarHBondContact CE2-SG 3.45Å; F327-C341 WeakPolarHBondContact CZ-SG 3.45Å; C341-W343 HydrophobicContact CB-CE3 4.18Å; C341-W343 HydrophobicContact CB-CH2 3.07Å; C341-W343 HydrophobicContact CB-CZ2 3.48Å; C341-W343 VanDerWaalsContact CB-CZ2 3.48Å; C341-W343 HydrophobicContact CB-CZ3 3.45Å; C341-W343 VanDerWaalsContact CB-CZ3 3.45Å; C341-K402 CarbonylContact O-C 3.52Å; C341-K402 WeakPolarHBondContact O-CA 3.47Å; C341-F403 HydrophobicContact CB-CB 4.35Å; C341-F403 PolarHBondContact N-O 3.07Å; C341-F403 PolarHBondContact O-N 3.04Å
342	V	85.5	Confident	76.5	Confident	25 Å²	25	63.6 Å²	63.6	15%	0.152	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	128.4	175.7	-174.8	0	0	0	0	108.7	D315 V316 R400 L401 K402	D315-V342 WeakPolarHBondContact OD1-CB 3.42Å; D315-V342 WeakPolarHBondContact OD1-CG1 3.49Å; V316-V342 PolarHBondContact N-O 2.99Å; V342-R400 HydrophobicContact CG1-CG 3.69Å; V342-L401 CarbonylContact C-O 3.56Å; V342-L401 VanDerWaalsContact CA-O 3.28Å; V342-L401 WeakPolarHBondContact CA-O 3.29Å; V342-K402 HydrophobicContact CG2-CG 4.21Å
343	W	90.2	Very high	78.9	Confident	19 Å²	19	57.8 Å²	57.8	7%	0.072	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	135.2	173.8	-57.4	-91.5	0	0	0	109.4	V316 L325 F327 C341 R400 L401 F403 F414	V316-W343 HydrophobicContact CB-CG 4.5Å; V316-W343 CarbonylContact O-C 3.56Å; V316-W343 VanDerWaalsContact O-CA 3.29Å; V316-W343 WeakPolarHBondContact O-CA 3Å; L325-W343 HydrophobicContact CD1-CD2 4.37Å; L325-W343 HydrophobicContact CD1-CG 4.05Å; L325-W343 HydrophobicContact CD2-CB 4.01Å; L325-W343 HydrophobicContact CD2-CD2 3.94Å; L325-W343 HydrophobicContact CD2-CE3 4.35Å; L325-W343 HydrophobicContact CD2-CG 3.78Å; F327-W343 HydrophobicContact CB-CH2 3.71Å; F327-W343 HydrophobicContact CB-CZ2 3.89Å; F327-W343 HydrophobicContact CD1-CH2 4.04Å; F327-W343 AromaticContact CD2-CH2 3.57Å; F327-W343 HydrophobicContact CD2-CH2 3.57Å; F327-W343 AromaticContact CD2-CZ2 3.48Å; F327-W343 HydrophobicContact CD2-CZ2 3.48Å; F327-W343 VanDerWaalsContact CD2-CZ2 3.48Å; F327-W343 HydrophobicContact CE2-CH2 4.2Å; F327-W343 HydrophobicContact CE2-CZ2 4.23Å; F327-W343 AromaticContact CG-CH2 3.46Å; F327-W343 HydrophobicContact CG-CH2 3.46Å; F327-W343 VanDerWaalsContact CG-CH2 3.46Å; F327-W343 AromaticContact CG-CZ2 3.78Å; F327-W343 HydrophobicContact CG-CZ2 3.78Å; C341-W343 HydrophobicContact CB-CE3 4.18Å; C341-W343 HydrophobicContact CB-CH2 3.07Å; C341-W343 HydrophobicContact CB-CZ2 3.48Å; C341-W343 VanDerWaalsContact CB-CZ2 3.48Å; C341-W343 HydrophobicContact CB-CZ3 3.45Å; C341-W343 VanDerWaalsContact CB-CZ3 3.45Å; W343-R400 CarbonylContact O-C 3.59Å; W343-R400 WeakPolarHBondContact O-CA 2.99Å; W343-L401 HydrophobicContact CB-CB 4.38Å; W343-L401 HydrophobicContact CE3-CB 4.16Å; W343-L401 PolarHBondContact N-O 3.06Å; W343-L401 PolarHBondContact O-N 2.76Å; W343-F403 HydrophobicContact CH2-CB 4.09Å; W343-F403 HydrophobicContact CZ3-CB 3.71Å; W343-F414 HydrophobicContact CE3-CZ 4.21Å; W343-F414 HydrophobicContact CH2-CE1 4.19Å; W343-F414 AromaticContact CH2-CZ 3.83Å; W343-F414 HydrophobicContact CH2-CZ 3.83Å; W343-F414 HydrophobicContact CZ3-CE1 4.1Å; W343-F414 AromaticContact CZ3-CZ 3.6Å; W343-F414 HydrophobicContact CZ3-CZ 3.6Å
344	T	89.1	Confident	81.1	Confident	11 Å²	11	54.9 Å²	54.9	7%	0.067	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	110.2	170.7	-63.6	0	0	0	0	108.4	V316 I317 V318 L346 L375 L399	V316-T344 PolarHBondContact O-N 3.12Å; I317-T344 WeakPolarHBondContact CA-O 3.25Å; V318-T344 PolarHBondContact N-O 3.3Å; T344-L346 HydrophobicContact CG2-CD2 3.87Å; T344-L346 HydrophobicContact CG2-CG 4.11Å; T344-L375 HydrophobicContact CG2-CD2 3.63Å; T344-L399 CarbonylContact C-O 3.26Å; T344-L399 WeakPolarHBondContact CA-O 3.49Å
345	L	91.9	Very high	82.9	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	127.6	174.6	-52.8	-174.5	0	0	0	108.7	V318 L325 L355 S398 L399 L401 Y418	V318-L345 HydrophobicContact CB-CD2 3.74Å; V318-L345 HydrophobicContact CG1-CD2 4.3Å; V318-L345 HydrophobicContact CG2-CD2 4.09Å; V318-L345 CarbonylContact O-C 3.52Å; V318-L345 WeakPolarHBondContact O-CA 3.2Å; L325-L345 HydrophobicContact CD2-CD2 4.45Å; L345-L355 HydrophobicContact CD1-CD2 3.86Å; L345-S398 VanDerWaalsContact O-CA 3.24Å; L345-S398 WeakPolarHBondContact O-CA 3.19Å; L345-L399 HydrophobicContact CB-CB 4.43Å; L345-L399 HydrophobicContact CD1-CD2 4.09Å; L345-L399 PolarHBondContact N-O 3Å; L345-L399 PolarHBondContact O-N 2.92Å; L345-L401 HydrophobicContact CD1-CD1 3.94Å; L345-L401 HydrophobicContact CG-CD1 4.27Å; L345-Y418 HydrophobicContact CD1-CD1 4.05Å; L345-Y418 HydrophobicContact CD1-CG 4.14Å; L345-Y418 HydrophobicContact CD2-CD1 4.2Å; L345-Y418 HydrophobicContact CD2-CE1 4.15Å
346	L	91.3	Very high	84.6	Confident	55 Å²	55	51.2 Å²	51.2	29%	0.288	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	114.9	176.7	-60.6	178.9	0	0	0	109.5	I317 V318 S319 G320 T344 L375	I317-L346 HydrophobicContact CG2-CD1 3.55Å; I317-L346 HydrophobicContact CG2-CG 4.14Å; V318-L346 PolarHBondContact O-N 2.75Å; S319-L346 VanDerWaalsContact CA-O 3.26Å; S319-L346 WeakPolarHBondContact CA-O 3.41Å; G320-L346 PolarHBondContact N-O 3.07Å; G320-L346 VanDerWaalsContact N-O 3.1Å; T344-L346 HydrophobicContact CG2-CD2 3.87Å; T344-L346 HydrophobicContact CG2-CG 4.11Å; L346-L375 HydrophobicContact CD2-CD1 4.47Å
347	V	92.9	Very high	86	Confident	8 Å²	8	49 Å²	49	5%	0.048	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-97.3	167.4	169	-61.6	0	0	0	0	109.5	M351 V353 N397 Y418 A420	V347-M351 HydrophobicContact CG2-CB 3.97Å; V347-V353 HydrophobicContact CB-CG2 4.32Å; V347-V353 HydrophobicContact CG1-CG2 3.85Å; V347-V353 HydrophobicContact CG2-CG2 3.51Å; V347-N397 HydrophobicContact CG2-CB 3.94Å; V347-N397 VanDerWaalsContact CG2-O 3.26Å; V347-N397 WeakPolarHBondContact CG2-O 3.36Å; V347-N397 PolarHBondContact N-O 2.82Å; V347-Y418 HydrophobicContact CG1-CD2 3.89Å; V347-Y418 HydrophobicContact CG1-CE2 4.03Å; V347-A420 HydrophobicContact CB-CB 3.78Å; V347-A420 HydrophobicContact CG1-CB 3.97Å; V347-A420 HydrophobicContact CG2-CB 4.34Å
348	P	94	Very high	87.2	Confident	64 Å²	64	50.9 Å²	50.9	42%	0.416	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-51.9	151.1	177	-26.8	35.8	0	0	0	112.6	A321 M351	A321-P348 HydrophobicContact CB-CG 4.45Å; P348-M351 HydrophobicContact CB-CG 3.98Å; P348-M351 VanDerWaalsContact O-CB 3.29Å; P348-M351 WeakPolarHBondContact O-CB 3.49Å; P348-M351 WeakPolarHBondContact O-CG 3.4Å; P348-M351 PolarHBondContact O-N 3.47Å
349	E	89.9	Confident	87.6	Confident	163 Å²	163	46.3 Å²	46.3	76%	0.762	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	151.7	175.2	-64.5	-179.3	179	0	0	111	M351	E349-M351 PolarHBondContact O-N 3.41Å
350	E	86.1	Confident	87.9	Confident	174 Å²	174	45.6 Å²	45.6	81%	0.813	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	21.8	-177.6	-49.8	179.4	175	0	0	114.6	P423	E350-P423 WeakPolarHBondContact O-CD 3.35Å; E350-P423 VanDerWaalsContact O-CG 3.28Å; E350-P423 WeakPolarHBondContact O-CG 3.23Å
351	M	89.5	Confident	87.7	Confident	33 Å²	33	40 Å²	40	16%	0.163	21%	0.21	C	C	.	.			trans	-116.4	153.8	175.6	-55.7	-71	-73.7	0	0	111.6	V347 P348 E349 S396 N397 A420 L421 K422	V347-M351 HydrophobicContact CG2-CB 3.97Å; P348-M351 HydrophobicContact CB-CG 3.98Å; P348-M351 VanDerWaalsContact O-CB 3.29Å; P348-M351 WeakPolarHBondContact O-CB 3.49Å; P348-M351 WeakPolarHBondContact O-CG 3.4Å; P348-M351 PolarHBondContact O-N 3.47Å; E349-M351 PolarHBondContact O-N 3.41Å; M351-S396 CarbonylContact O-C 3.57Å; M351-N397 WeakPolarHBondContact O-CA 3.28Å; M351-N397 WeakPolarHBondContact O-CB 3.01Å; M351-N397 PolarHBondContact O-N 2.94Å; M351-A420 HydrophobicContact CB-CB 4.12Å; M351-A420 HydrophobicContact CE-CB 3.66Å; M351-A420 WeakPolarHBondContact CE-O 3.25Å; M351-A420 HydrophobicContact CG-CB 4.33Å; M351-L421 CarbonylContact C-O 3.19Å; M351-L421 WeakPolarHBondContact CA-O 3.44Å; M351-K422 HydrophobicContact CE-CG 3.81Å; M351-K422 HydrophobicContact SD-CB 4.3Å; M351-K422 HydrophobicContact SD-CG 3.49Å; M351-K422 WeakPolarHBondContact SD-CG 3.35Å
352	H	89.7	Confident	87.2	Confident	38 Å²	38	40 Å²	40	18%	0.176	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	149.8	169.5	-67.8	177.2	0	0	0	110.9	L393 I394 A420 L421	H352-L393 HydrophobicContact CB-CD1 3.95Å; H352-I394 WeakPolarHBondContact CA-O 3.48Å; H352-I394 VanDerWaalsContact CB-O 3.31Å; H352-I394 WeakPolarHBondContact CB-O 3.28Å; H352-A420 WeakPolarHBondContact O-CA 3.47Å; H352-L421 PolarHBondContact N-O 3.42Å; H352-L421 PolarHBondContact O-N 2.98Å
353	V	91.3	Very high	86.4	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	112.9	177.6	-177.2	0	0	0	0	109.7	V347 L355 I394 S396	V347-V353 HydrophobicContact CB-CG2 4.32Å; V347-V353 HydrophobicContact CG1-CG2 3.85Å; V347-V353 HydrophobicContact CG2-CG2 3.51Å; V353-L355 HydrophobicContact CG1-CD1 4.48Å; V353-L355 HydrophobicContact CG1-CD2 4.46Å; V353-L355 HydrophobicContact CG1-CG 4.06Å; V353-I394 HydrophobicContact CB-CB 4.25Å; V353-I394 PolarHBondContact N-O 3.5Å; V353-I394 PolarHBondContact O-N 2.84Å; V353-S396 WeakPolarHBondContact CG2-O 3.42Å; V353-S396 PolarHBondContact N-O 3.46Å
354	L	91.1	Very high	85.4	Confident	15 Å²	15	42.6 Å²	42.6	8%	0.079	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.9	166.1	176.7	65.9	0	0	0	109.7	L393 Y418 K419 L421 Y433	L354-L393 HydrophobicContact CB-CD1 4.13Å; L354-L393 HydrophobicContact CD1-CB 4.41Å; L354-L393 HydrophobicContact CD1-CD1 4.49Å; L354-Y418 CarbonylContact O-C 3.44Å; L354-Y418 WeakPolarHBondContact O-CA 3.22Å; L354-K419 PolarHBondContact N-O 2.81Å; L354-K419 PolarHBondContact O-N 3.17Å; L354-L421 HydrophobicContact CB-CD1 3.76Å; L354-L421 HydrophobicContact CB-CG 4.03Å; L354-L421 HydrophobicContact CD2-CD1 3.91Å; L354-L421 HydrophobicContact CG-CD1 4.34Å; L354-Y433 HydrophobicContact CD1-CD1 3.54Å; L354-Y433 HydrophobicContact CD1-CD2 4.14Å; L354-Y433 HydrophobicContact CD1-CE1 3.7Å; L354-Y433 HydrophobicContact CD1-CE2 4.29Å; L354-Y433 HydrophobicContact CD1-CG 3.77Å; L354-Y433 HydrophobicContact CD2-CE1 3.97Å
355	L	91.4	Very high	84.5	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	144.4	175.6	-72	154	0	0	0	111.2	L345 V353 M372 S391 I392 I394 L399 L416 T417	L345-L355 HydrophobicContact CD1-CD2 3.86Å; V353-L355 HydrophobicContact CG1-CD1 4.48Å; V353-L355 HydrophobicContact CG1-CD2 4.46Å; V353-L355 HydrophobicContact CG1-CG 4.06Å; L355-M372 HydrophobicContact CD1-SD 3.54Å; L355-M372 VanDerWaalsContact CD1-SD 3.54Å; L355-S391 CarbonylContact O-C 3.57Å; L355-S391 VanDerWaalsContact O-CA 3.28Å; L355-S391 WeakPolarHBondContact O-CA 3.47Å; L355-S391 WeakPolarHBondContact O-CB 3Å; L355-I392 HydrophobicContact CB-CB 4.49Å; L355-I392 PolarHBondContact N-O 2.88Å; L355-I392 PolarHBondContact O-N 3.43Å; L355-I394 HydrophobicContact CD1-CG1 4.02Å; L355-L399 HydrophobicContact CD1-CD2 3.29Å; L355-L399 HydrophobicContact CD2-CD2 4.3Å; L355-L399 HydrophobicContact CG-CD2 4.32Å; L355-L416 HydrophobicContact CD2-CD1 3.82Å; L355-T417 WeakPolarHBondContact CA-O 3.4Å
356	S	90.4	Very high	83.5	Confident	28 Å²	28	50.1 Å²	50.1	20%	0.196	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	128.1	173.2	-59.2	0	0	0	0	110.3	S391 L416 T417	S356-S391 WeakPolarHBondContact OG-CB 3.26Å; S356-S391 PolarHBondContact OG-OG 2.92Å; S356-L416 CarbonylContact O-C 3.55Å; S356-L416 VanDerWaalsContact O-CA 3.31Å; S356-L416 WeakPolarHBondContact O-CA 3.31Å; S356-T417 PolarHBondContact N-O 3.18Å; S356-T417 PolarHBondContact O-N 3.49Å
357	F	87.5	Confident	82.5	Confident	19 Å²	19	52.2 Å²	52.2	8%	0.083	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	129.8	176.4	-70.3	-97.9	0	0	0	109.7	L360 L370 F383 L388 P389 I392 N415 L416	F357-L360 HydrophobicContact CD1-CD1 4.49Å; F357-L360 HydrophobicContact CE1-CD1 4.41Å; F357-L370 HydrophobicContact CE1-CD2 3.68Å; F357-L370 HydrophobicContact CZ-CD2 3.97Å; F357-F383 HydrophobicContact CZ-CD2 4.27Å; F357-F383 HydrophobicContact CZ-CE2 4.49Å; F357-F383 HydrophobicContact CZ-CG 4.47Å; F357-L388 HydrophobicContact CB-CD2 4.08Å; F357-P389 HydrophobicContact CB-CG 4.37Å; F357-P389 HydrophobicContact CD2-CG 3.35Å; F357-P389 HydrophobicContact CE2-CG 3.69Å; F357-P389 HydrophobicContact CG-CG 3.9Å; F357-P389 HydrophobicContact CZ-CG 4.48Å; F357-I392 HydrophobicContact CE2-CD1 4.5Å; F357-N415 WeakPolarHBondContact CA-O 3.11Å; F357-L416 HydrophobicContact CD1-CB 4.11Å; F357-L416 HydrophobicContact CE1-CB 4.26Å; F357-L416 HydrophobicContact CE1-CD2 4.01Å; F357-L416 HydrophobicContact CG-CB 4.42Å; F357-L416 HydrophobicContact CZ-CD2 4.2Å
358	S	85.8	Confident	81.7	Confident	80 Å²	80	51.9 Å²	51.9	56%	0.559	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	-13.5	168.8	58.4	0	0	0	0	112.4	N415	S358-N415 PolarHBondContact N-O 3.29Å; S358-N415 VanDerWaalsContact OG-CB 3.31Å; S358-N415 WeakPolarHBondContact OG-CB 3.37Å; S358-N415 PolarHBondContact OG-O 2.85Å
359	H	78.8	Confident	81.2	Confident	67 Å²	67	51.3 Å²	51.3	31%	0.31	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	137.5	176.2	-175.3	-90.4	0	0	0	109.3	G413 F414 N415	H359-G413 PolarHBondContact ND1-O 2.9Å; H359-F414 CarbonylContact O-C 3.52Å; H359-F414 VanDerWaalsContact O-CA 3.31Å; H359-F414 WeakPolarHBondContact O-CA 3.42Å; H359-N415 HydrophobicContact CB-CB 3.74Å; H359-N415 WeakPolarHBondContact CB-ND2 3.05Å; H359-N415 PolarHBondContact N-O 2.71Å; H359-N415 PolarHBondContact O-N 2.75Å
360	L	77.8	Confident	81.2	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.031	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	127.8	168.5	-175.9	69.8	0	0	0	106.2	F357 V362 F383 C384 G385 E386 S387 L388 G413 F414	F357-L360 HydrophobicContact CD1-CD1 4.49Å; F357-L360 HydrophobicContact CE1-CD1 4.41Å; L360-V362 HydrophobicContact CD1-CG2 3.98Å; L360-F383 HydrophobicContact CD1-CB 4.23Å; L360-F383 HydrophobicContact CD2-CB 3.93Å; L360-C384 WeakPolarHBondContact CD2-O 3.42Å; L360-G385 CarbonylContact C-O 3.54Å; L360-E386 VanDerWaalsContact O-CA 3.29Å; L360-E386 WeakPolarHBondContact O-CA 3.48Å; L360-S387 VanDerWaalsContact CD2-O 3.3Å; L360-S387 WeakPolarHBondContact CD2-O 3.43Å; L360-L388 HydrophobicContact CB-CD2 3.97Å; L360-G413 CarbonylContact C-O 3.51Å; L360-F414 HydrophobicContact CD1-CB 3.9Å
361	D	74.1	Confident	81.2	Confident	33 Å²	33	35.2 Å²	35.2	18%	0.176	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	93.8	173.5	177.6	17.7	0	0	0	107.2	G385 A411 A412 G413	D361-G385 VanDerWaalsContact CA-O 3.32Å; D361-G385 WeakPolarHBondContact CA-O 3.43Å; D361-A411 VanDerWaalsContact O-CB 3.26Å; D361-A411 WeakPolarHBondContact O-CB 3.3Å; D361-A411 WeakPolarHBondContact OD1-CB 3.29Å; D361-A412 HydrophobicContact CB-CB 4.02Å; D361-A412 WeakPolarHBondContact OD2-CB 3.46Å; D361-A412 PolarHBondContact OD2-N 2.86Å; D361-G413 PolarHBondContact N-O 2.81Å; D361-G413 VanDerWaalsContact O-CA 3.3Å; D361-G413 WeakPolarHBondContact O-CA 3.48Å; D361-G413 PolarHBondContact O-N 2.91Å
362	V	72.9	Confident	81.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-138.3	118.4	-176.5	175.1	0	0	0	0	108.2	Y335 L360 S364 S368 C384 G385 F403	Y335-V362 HydrophobicContact CE1-CG2 4.35Å; L360-V362 HydrophobicContact CD1-CG2 3.98Å; V362-S364 PolarHBondContact O-N 3.05Å; V362-S368 VanDerWaalsContact CG1-C 3.49Å; V362-S368 VanDerWaalsContact CG1-O 3.28Å; V362-S368 WeakPolarHBondContact CG1-O 3.22Å; V362-C384 HydrophobicContact CB-CB 4.5Å; V362-C384 HydrophobicContact CG1-CB 4.29Å; V362-C384 CarbonylContact O-C 3.49Å; V362-G385 PolarHBondContact N-O 3.25Å; V362-G385 VanDerWaalsContact N-O 3.08Å; V362-G385 WeakPolarHBondContact O-CA 3.07Å; V362-G385 PolarHBondContact O-N 3.49Å; V362-F403 HydrophobicContact CG1-CE2 3.97Å; V362-F403 HydrophobicContact CG2-CE2 3.98Å
363	E	68	Low	81	Confident	61 Å²	61	33.3 Å²	33.3	29%	0.285	17%	0.171	S	C	.	.			trans	-52.1	-62.9	-158.1	-70.1	141.2	173.6	0	0	117.5	Y335 S368 D409 N410 A411	Y335-E363 PolarHBondContact OH-N 3.07Å; Y335-E363 PolarHBondContact OH-OE2 2.99Å; E363-S368 PolarHBondContact OE2-OG 3.22Å; E363-D409 HydrophobicContact CG-CB 4.21Å; E363-D409 WeakPolarHBondContact OE1-CA 3.45Å; E363-D409 WeakPolarHBondContact OE1-CB 3.13Å; E363-N410 WeakPolarHBondContact OE1-CA 3.28Å; E363-N410 PolarHBondContact OE1-N 3.18Å; E363-A411 HydrophobicContact CG-CB 3.83Å; E363-A411 PolarHBondContact OE1-N 3.14Å
364	S	70	Confident	80.7	Confident	39 Å²	39	33.7 Å²	33.7	27%	0.273	17%	0.173	S	C	.	.			trans	-148.9	121.6	-165.7	177.2	0	0	0	0	109.5	V362 H366 H367 S368	V362-S364 PolarHBondContact O-N 3.05Å; S364-H366 PolarHBondContact O-N 3.14Å; S364-H367 PolarHBondContact O-N 3.09Å; S364-S368 CarbonylContact C-O 3.5Å; S364-S368 VanDerWaalsContact C-O 3.26Å; S364-S368 CarbonylContact O-C 3.53Å; S364-S368 PolarHBondContact O-N 3.25Å
365	C	70	Confident	80.1	Confident	12 Å²	12	36.2 Å²	36.2	8%	0.081	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-17.6	178.9	-82.9	0	0	0	0	113.7	K382 C384	C365-K382 WeakPolarHBondContact O-CE 3.35Å; C365-K382 PolarHBondContact O-NZ 2.9Å; C365-C384 VanDerWaalsContact CA-SG 3.51Å; C365-C384 HydrophobicContact CB-CB 3.95Å; C365-C384 WeakPolarHBondContact CB-SG 3.13Å; C365-C384 PolarHBondContact N-SG 2.82Å; C365-C384 WeakPolarHBondContact SG-CB 3.35Å; C365-C384 CovalentContact SG-SG 2.01Å; C365-C384 PolarHBondContact SG-SG 3.49Å
366	H	70.6	Confident	79.6	Confident	156 Å²	156	42.3 Å²	42.3	72%	0.722	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-25.9	175.2	-63.3	-62.4	0	0	0	113.7	S364	S364-H366 PolarHBondContact O-N 3.14Å
367	H	70	Confident	78.9	Confident	100 Å²	100	45.7 Å²	45.7	46%	0.463	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-45.2	-162	-70	115	0	0	0	112.1	S364 D406	S364-H367 PolarHBondContact O-N 3.09Å; H367-D406 HydrophobicContact CB-CB 4.28Å; H367-D406 VanDerWaalsContact CB-CG 3.42Å; H367-D406 WeakPolarHBondContact CB-OD2 3.13Å; H367-D406 IonicContact CD2-OD2 2.69Å; H367-D406 PolarHBondContact CD2-OD2 2.81Å; H367-D406 IonicContact CG-OD2 3.93Å
368	S	75.9	Confident	78.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.234	C	C	.	.	S	Bend	trans	-127.6	125.1	179.9	-64.5	0	0	0	0	109.7	Y335 V362 E363 S364 V404	Y335-S368 VanDerWaalsContact OH-CB 3.31Å; Y335-S368 WeakPolarHBondContact OH-CB 2.83Å; Y335-S368 PolarHBondContact OH-OG 2.83Å; V362-S368 VanDerWaalsContact CG1-C 3.49Å; V362-S368 VanDerWaalsContact CG1-O 3.28Å; V362-S368 WeakPolarHBondContact CG1-O 3.22Å; E363-S368 PolarHBondContact OE2-OG 3.22Å; S364-S368 CarbonylContact C-O 3.5Å; S364-S368 VanDerWaalsContact C-O 3.26Å; S364-S368 CarbonylContact O-C 3.53Å; S364-S368 PolarHBondContact O-N 3.25Å; S368-V404 CarbonylContact C-O 3.42Å; S368-V404 VanDerWaalsContact CA-O 3.22Å; S368-V404 WeakPolarHBondContact CA-O 3.38Å
369	Y	85.1	Confident	78.2	Confident	52 Å²	52	43.8 Å²	43.8	20%	0.204	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	150.6	-178.3	58.5	-93.1	0	0	0	113.1	S371 K382 V404	Y369-S371 WeakPolarHBondContact CD2-OG 3.33Å; Y369-S371 WeakPolarHBondContact CE2-OG 3.41Å; Y369-K382 VanDerWaalsContact CD1-CE 3.44Å; Y369-K382 HydrophobicContact CD2-CD 4.17Å; Y369-K382 HydrophobicContact CD2-CG 3.85Å; Y369-K382 HydrophobicContact CG-CD 4.11Å; Y369-K382 HydrophobicContact CG-CG 3.91Å; Y369-V404 HydrophobicContact CE1-CB 4.33Å; Y369-V404 HydrophobicContact CE2-CB 4.42Å; Y369-V404 HydrophobicContact CE2-CG2 4.27Å; Y369-V404 PolarHBondContact N-O 2.89Å; Y369-V404 PolarHBondContact O-N 3.43Å
370	L	88.6	Confident	78.5	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	111.5	165.7	175.4	64.5	0	0	0	108.8	F357 K382 F383 L401 F403 F414	F357-L370 HydrophobicContact CE1-CD2 3.68Å; F357-L370 HydrophobicContact CZ-CD2 3.97Å; L370-K382 CarbonylContact O-C 3.59Å; L370-K382 WeakPolarHBondContact O-CA 3.4Å; L370-F383 HydrophobicContact CB-CB 4.36Å; L370-F383 HydrophobicContact CG-CD2 4.47Å; L370-F383 PolarHBondContact N-O 3.11Å; L370-F383 WeakPolarHBondContact O-CD2 3.32Å; L370-F383 PolarHBondContact O-N 3.01Å; L370-L401 HydrophobicContact CD1-CB 4.28Å; L370-L401 HydrophobicContact CD1-CD2 4.44Å; L370-F403 HydrophobicContact CB-CD2 4.37Å; L370-F403 HydrophobicContact CD1-CB 4.22Å; L370-F414 HydrophobicContact CD1-CD1 4.31Å; L370-F414 HydrophobicContact CD1-CE1 3.68Å; L370-F414 HydrophobicContact CD1-CE2 4.47Å; L370-F414 HydrophobicContact CD1-CZ 3.77Å; L370-F414 HydrophobicContact CD2-CB 4.43Å; L370-F414 HydrophobicContact CD2-CD1 3.82Å; L370-F414 HydrophobicContact CD2-CD2 3.97Å; L370-F414 HydrophobicContact CD2-CE1 3.98Å; L370-F414 HydrophobicContact CD2-CE2 4.13Å; L370-F414 HydrophobicContact CD2-CG 3.81Å; L370-F414 HydrophobicContact CD2-CZ 4.13Å; L370-F414 HydrophobicContact CG-CD1 4.45Å; L370-F414 HydrophobicContact CG-CE1 4.3Å
371	S	87.4	Confident	78.5	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	145.5	172.5	-71.8	0	0	0	0	111.8	Y369 G381 L401 K402	Y369-S371 WeakPolarHBondContact CD2-OG 3.33Å; Y369-S371 WeakPolarHBondContact CE2-OG 3.41Å; S371-G381 CarbonylContact C-O 3.59Å; S371-G381 WeakPolarHBondContact CA-O 3.23Å; S371-L401 CarbonylContact O-C 3.55Å; S371-K402 PolarHBondContact N-O 2.98Å; S371-K402 PolarHBondContact O-N 3.36Å
372	M	89.6	Confident	78.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	133.8	179.8	-171.9	168.1	73	0	0	109.3	L355 I380 G381 F383 I392 I394 L399 R400 L401	L355-M372 HydrophobicContact CD1-SD 3.54Å; L355-M372 VanDerWaalsContact CD1-SD 3.54Å; M372-I380 HydrophobicContact CB-CB 4.37Å; M372-I380 HydrophobicContact CE-CB 3.87Å; M372-I380 HydrophobicContact CE-CD1 4.3Å; M372-I380 HydrophobicContact CE-CG2 3.41Å; M372-I380 VanDerWaalsContact CE-CG2 3.41Å; M372-I380 HydrophobicContact CG-CB 4.32Å; M372-I380 HydrophobicContact CG-CD1 4.13Å; M372-I380 WeakPolarHBondContact O-CB 3.28Å; M372-I380 PolarHBondContact O-N 3.16Å; M372-G381 PolarHBondContact N-O 3.43Å; M372-G381 PolarHBondContact O-N 3.44Å; M372-F383 HydrophobicContact CB-CE2 4Å; M372-F383 HydrophobicContact CE-CE2 4.17Å; M372-F383 HydrophobicContact CE-CZ 4.16Å; M372-F383 HydrophobicContact SD-CE2 4.41Å; M372-I392 HydrophobicContact CE-CD1 3.8Å; M372-I392 HydrophobicContact CE-CG2 4.15Å; M372-I394 HydrophobicContact CE-CD1 3.95Å; M372-L399 HydrophobicContact CG-CD1 3.31Å; M372-L399 HydrophobicContact CG-CD2 3.78Å; M372-L399 HydrophobicContact CG-CG 3.81Å; M372-L399 HydrophobicContact SD-CD1 3.83Å; M372-L399 HydrophobicContact SD-CD2 3.65Å; M372-L399 HydrophobicContact SD-CG 4.24Å; M372-R400 CarbonylContact C-O 3.52Å; M372-R400 WeakPolarHBondContact CA-O 3.1Å; M372-L401 HydrophobicContact CB-CD2 4.01Å; M372-L401 HydrophobicContact CG-CD2 3.77Å; M372-L401 HydrophobicContact SD-CD2 4.05Å
373	Y	84.9	Confident	79.5	Confident	31 Å²	31	40.4 Å²	40.4	12%	0.122	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	154.4	-175	-58.2	-93.2	0	0	0	111.1	R378 P379 L399 R400 K402	Y373-R378 CarbonylContact C-O 3.54Å; Y373-R378 WeakPolarHBondContact CA-O 3.12Å; Y373-P379 HydrophobicContact CD1-CB 3.91Å; Y373-P379 HydrophobicContact CE1-CB 3.79Å; Y373-L399 VanDerWaalsContact O-CD1 3.32Å; Y373-L399 WeakPolarHBondContact O-CD1 3.29Å; Y373-R400 PolarHBondContact N-O 2.84Å; Y373-R400 PolarHBondContact O-N 2.81Å; Y373-K402 HydrophobicContact CD2-CB 4.32Å; Y373-K402 HydrophobicContact CE2-CB 3.93Å; Y373-K402 HydrophobicContact CE2-CD 4.12Å
374	S	84	Confident	80.2	Confident	7 Å²	7	38.3 Å²	38.3	5%	0.049	19%	0.188	C	C	.	.			trans	-69.3	168.3	159	81.1	0	0	0	0	110.7	E376 D377 R378	S374-E376 PolarHBondContact O-N 3.12Å; S374-E376 PolarHBondContact OG-N 3.16Å; S374-D377 PolarHBondContact O-N 2.94Å; S374-R378 PolarHBondContact N-O 3.27Å; S374-R378 VanDerWaalsContact OG-CB 3.3Å; S374-R378 WeakPolarHBondContact OG-CB 3.17Å; S374-R378 WeakPolarHBondContact OG-CG 3.34Å; S374-R378 PolarHBondContact OG-N 2.03Å
375	L	80.3	Confident	80.3	Confident	68 Å²	68	37.5 Å²	37.5	36%	0.356	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.9	174.3	-74.7	-172.7	0	0	0	114.1	T344 L346 D377 S398	T344-L375 HydrophobicContact CG2-CD2 3.63Å; L346-L375 HydrophobicContact CD2-CD1 4.47Å; L375-D377 PolarHBondContact O-N 3.06Å; L375-S398 VanDerWaalsContact CD1-CB 3.49Å; L375-S398 WeakPolarHBondContact CD1-OG 3.28Å; L375-S398 WeakPolarHBondContact CG-OG 2.99Å
376	E	79.7	Confident	80.4	Confident	129 Å²	129	44.4 Å²	44.4	60%	0.603	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	17.7	174	-62.6	176.4	-165.7	0	0	112.5	S374 R378	S374-E376 PolarHBondContact O-N 3.12Å; S374-E376 PolarHBondContact OG-N 3.16Å; E376-R378 HydrophobicContact CB-CG 4.27Å; E376-R378 VanDerWaalsContact CD-NH2 3.27Å; E376-R378 PolarHBondContact O-N 2.64Å; E376-R378 IonicContact OE1-NH2 3.98Å; E376-R378 PolarHBondContact OE1-NH2 3.24Å; E376-R378 IonicContact OE2-CZ 3.9Å; E376-R378 IonicContact OE2-NE 3.29Å; E376-R378 PolarHBondContact OE2-NE 3.15Å; E376-R378 IonicContact OE2-NH2 3.35Å; E376-R378 PolarHBondContact OE2-NH2 3.36Å
377	D	76.9	Confident	80.5	Confident	99 Å²	99	39.2 Å²	39.2	53%	0.529	20%	0.198	S	C	.	.			trans	58	29	-178.3	-66.3	-52.7	0	0	0	113.7	S374 L375 R400	S374-D377 PolarHBondContact O-N 2.94Å; L375-D377 PolarHBondContact O-N 3.06Å; D377-R400 VanDerWaalsContact CG-NH1 3.33Å; D377-R400 IonicContact OD1-CZ 2.98Å; D377-R400 IonicContact OD1-NH1 2.64Å; D377-R400 PolarHBondContact OD1-NH1 3.21Å; D377-R400 IonicContact OD2-NH1 3.23Å; D377-R400 PolarHBondContact OD2-NH1 2.83Å
378	R	79.4	Confident	80.7	Confident	42 Å²	42	39 Å²	39	16%	0.158	20%	0.2	C	C	.	.			trans	-78.4	120.7	169.3	-51.6	-175.6	-151.2	171.3	11.1	108.5	Y373 S374 E376 F438 Q463	Y373-R378 CarbonylContact C-O 3.54Å; Y373-R378 WeakPolarHBondContact CA-O 3.12Å; S374-R378 PolarHBondContact N-O 3.27Å; S374-R378 VanDerWaalsContact OG-CB 3.3Å; S374-R378 WeakPolarHBondContact OG-CB 3.17Å; S374-R378 WeakPolarHBondContact OG-CG 3.34Å; S374-R378 PolarHBondContact OG-N 2.03Å; E376-R378 HydrophobicContact CB-CG 4.27Å; E376-R378 VanDerWaalsContact CD-NH2 3.27Å; E376-R378 PolarHBondContact O-N 2.64Å; E376-R378 IonicContact OE1-NH2 3.98Å; E376-R378 PolarHBondContact OE1-NH2 3.24Å; E376-R378 IonicContact OE2-CZ 3.9Å; E376-R378 IonicContact OE2-NE 3.29Å; E376-R378 PolarHBondContact OE2-NE 3.15Å; E376-R378 IonicContact OE2-NH2 3.35Å; E376-R378 PolarHBondContact OE2-NH2 3.36Å; R378-F438 PolarHBondContact NH1-O 3.4Å; R378-Q463 PolarHBondContact NH1-O 2.82Å
379	P	78.6	Confident	80.9	Confident	18 Å²	18	39.9 Å²	39.9	12%	0.117	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	135.1	-176.3	23.9	-25.1	0	0	0	111.1	Y373 Q463 M561 F562	Y373-P379 HydrophobicContact CD1-CB 3.91Å; Y373-P379 HydrophobicContact CE1-CB 3.79Å; P379-Q463 PolarHBondContact O-NE2 2.85Å; P379-Q463 PolarHBondContact O-OE1 3.05Å; P379-Q463 VanDerWaalsContact O-OE1 3.13Å; P379-M561 HydrophobicContact CG-CE 3.28Å; P379-M561 HydrophobicContact CG-CG 4.16Å; P379-M561 HydrophobicContact CG-SD 3.93Å; P379-F562 HydrophobicContact CB-CD1 4.25Å; P379-F562 HydrophobicContact CB-CE1 3.92Å
380	I	83.8	Confident	80.8	Confident	8 Å²	8	41.9 Å²	41.9	4%	0.041	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-48.6	-179.3	-53	178	0	0	0	110.5	M372 I394 L399 V436 F438 L563	M372-I380 HydrophobicContact CB-CB 4.37Å; M372-I380 HydrophobicContact CE-CB 3.87Å; M372-I380 HydrophobicContact CE-CD1 4.3Å; M372-I380 HydrophobicContact CE-CG2 3.41Å; M372-I380 VanDerWaalsContact CE-CG2 3.41Å; M372-I380 HydrophobicContact CG-CB 4.32Å; M372-I380 HydrophobicContact CG-CD1 4.13Å; M372-I380 WeakPolarHBondContact O-CB 3.28Å; M372-I380 PolarHBondContact O-N 3.16Å; I380-I394 HydrophobicContact CD1-CD1 4.02Å; I380-I394 HydrophobicContact CG2-CD1 4.33Å; I380-L399 HydrophobicContact CD1-CD1 3.41Å; I380-L399 VanDerWaalsContact CD1-CD1 3.41Å; I380-V436 HydrophobicContact CG2-CB 4.27Å; I380-V436 HydrophobicContact CG2-CG1 3.9Å; I380-V436 HydrophobicContact CG2-CG2 3.74Å; I380-F438 HydrophobicContact CD1-CE2 4.38Å; I380-F438 HydrophobicContact CD1-CZ 3.6Å; I380-F438 HydrophobicContact CG1-CE1 4.41Å; I380-F438 HydrophobicContact CG1-CZ 3.91Å; I380-L563 WeakPolarHBondContact O-CD1 3.48Å
381	G	79.2	Confident	80.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	162.8	-175.3	0	0	0	0	0	113.6	S371 M372	S371-G381 CarbonylContact C-O 3.59Å; S371-G381 WeakPolarHBondContact CA-O 3.23Å; M372-G381 PolarHBondContact N-O 3.43Å; M372-G381 PolarHBondContact O-N 3.44Å
382	K	82.8	Confident	80.7	Confident	24 Å²	24	43.8 Å²	43.8	10%	0.104	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	111.3	179	-177.1	-177.4	178.7	-168.7	0	109.4	C365 Y369 L370 F562 L563	C365-K382 WeakPolarHBondContact O-CE 3.35Å; C365-K382 PolarHBondContact O-NZ 2.9Å; Y369-K382 VanDerWaalsContact CD1-CE 3.44Å; Y369-K382 HydrophobicContact CD2-CD 4.17Å; Y369-K382 HydrophobicContact CD2-CG 3.85Å; Y369-K382 HydrophobicContact CG-CD 4.11Å; Y369-K382 HydrophobicContact CG-CG 3.91Å; L370-K382 CarbonylContact O-C 3.59Å; L370-K382 WeakPolarHBondContact O-CA 3.4Å; K382-F562 HydrophobicContact CB-CB 3.32Å; K382-F562 HydrophobicContact CB-CD1 3.48Å; K382-F562 VanDerWaalsContact CB-CD1 3.48Å; K382-F562 HydrophobicContact CB-CD2 4.07Å; K382-F562 HydrophobicContact CB-CE1 4.23Å; K382-F562 HydrophobicContact CB-CG 3.36Å; K382-F562 HydrophobicContact CD-CB 4.32Å; K382-F562 HydrophobicContact CD-CD1 4.41Å; K382-F562 HydrophobicContact CD-CD2 3.74Å; K382-F562 HydrophobicContact CD-CE2 4.09Å; K382-F562 HydrophobicContact CD-CG 3.92Å; K382-F562 HydrophobicContact CG-CD1 4.46Å; K382-F562 HydrophobicContact CG-CG 4.29Å; K382-L563 CarbonylContact C-O 3.59Å; K382-L563 PolarHBondContact N-O 3.19Å
383	F	85.3	Confident	80.7	Confident	2 Å²	2	44 Å²	44	1%	0.009	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	130	-172.4	-51.1	-80.4	0	0	0	109.4	F357 L360 L370 M372 P389 I392	F357-F383 HydrophobicContact CZ-CD2 4.27Å; F357-F383 HydrophobicContact CZ-CE2 4.49Å; F357-F383 HydrophobicContact CZ-CG 4.47Å; L360-F383 HydrophobicContact CD1-CB 4.23Å; L360-F383 HydrophobicContact CD2-CB 3.93Å; L370-F383 HydrophobicContact CB-CB 4.36Å; L370-F383 HydrophobicContact CG-CD2 4.47Å; L370-F383 PolarHBondContact N-O 3.11Å; L370-F383 WeakPolarHBondContact O-CD2 3.32Å; L370-F383 PolarHBondContact O-N 3.01Å; M372-F383 HydrophobicContact CB-CE2 4Å; M372-F383 HydrophobicContact CE-CE2 4.17Å; M372-F383 HydrophobicContact CE-CZ 4.16Å; M372-F383 HydrophobicContact SD-CE2 4.41Å; F383-P389 HydrophobicContact CD1-CB 4.08Å; F383-P389 HydrophobicContact CD1-CG 3.85Å; F383-P389 HydrophobicContact CE1-CB 3.87Å; F383-P389 HydrophobicContact CE1-CG 3.91Å; F383-I392 HydrophobicContact CE1-CD1 3.98Å; F383-I392 HydrophobicContact CE2-CD1 4.49Å; F383-I392 HydrophobicContact CZ-CD1 3.52Å
384	C	81.3	Confident	80.9	Confident	17 Å²	17	42.5 Å²	42.5	12%	0.115	24%	0.236	C	C	.	.			trans	-144.4	-174.8	168.8	68.7	0	0	0	0	109.4	L360 V362 C365	L360-C384 WeakPolarHBondContact CD2-O 3.42Å; V362-C384 HydrophobicContact CB-CB 4.5Å; V362-C384 HydrophobicContact CG1-CB 4.29Å; V362-C384 CarbonylContact O-C 3.49Å; C365-C384 VanDerWaalsContact CA-SG 3.51Å; C365-C384 HydrophobicContact CB-CB 3.95Å; C365-C384 WeakPolarHBondContact CB-SG 3.13Å; C365-C384 PolarHBondContact N-SG 2.82Å; C365-C384 WeakPolarHBondContact SG-CB 3.35Å; C365-C384 CovalentContact SG-SG 2.01Å; C365-C384 PolarHBondContact SG-SG 3.49Å
385	G	73.6	Confident	81.1	Confident	23 Å²	23	42.8 Å²	42.8	24%	0.237	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	69.6	-161.9	-174.6	0	0	0	0	0	113.7	L360 D361 V362	L360-G385 CarbonylContact C-O 3.54Å; D361-G385 VanDerWaalsContact CA-O 3.32Å; D361-G385 WeakPolarHBondContact CA-O 3.43Å; V362-G385 PolarHBondContact N-O 3.25Å; V362-G385 VanDerWaalsContact N-O 3.08Å; V362-G385 WeakPolarHBondContact O-CA 3.07Å; V362-G385 PolarHBondContact O-N 3.49Å
386	E	70.8	Confident	81.5	Confident	156 Å²	156	40.7 Å²	40.7	73%	0.729	23%	0.231	S	C	*	.	S	Bend	trans	-105.6	-2.4	176.4	-63.7	177.2	-160.5	0	0	112.5	L360 L388	L360-E386 VanDerWaalsContact O-CA 3.29Å; L360-E386 WeakPolarHBondContact O-CA 3.48Å; E386-L388 PolarHBondContact O-N 2.84Å
387	S	72.4	Confident	81.9	Confident	47 Å²	47	37.1 Å²	37.1	33%	0.329	22%	0.216	S	C	.	.			trans	-72.8	115.4	-178.1	38.2	0	0	0	0	110.8	L360 P389 T565	L360-S387 VanDerWaalsContact CD2-O 3.3Å; L360-S387 WeakPolarHBondContact CD2-O 3.43Å; S387-P389 WeakPolarHBondContact O-CD 3.26Å; S387-T565 VanDerWaalsContact OG-C 3.28Å; S387-T565 PolarHBondContact OG-O 3.29Å; S387-T565 PolarHBondContact OG-OXT 3.41Å
388	L	75.6	Confident	82.5	Confident	96 Å²	96	32.9 Å²	32.9	50%	0.503	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-72.4	123.1	174.8	-63.4	178.6	0	0	0	110.1	F357 L360 E386	F357-L388 HydrophobicContact CB-CD2 4.08Å; L360-L388 HydrophobicContact CB-CD2 3.97Å; E386-L388 PolarHBondContact O-N 2.84Å
389	P	80.6	Confident	83.1	Confident	19 Å²	19	30.9 Å²	30.9	12%	0.123	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-72.4	154.2	173.8	31.6	-36.2	0	0	0	110.6	F357 F383 S387	F357-P389 HydrophobicContact CB-CG 4.37Å; F357-P389 HydrophobicContact CD2-CG 3.35Å; F357-P389 HydrophobicContact CE2-CG 3.69Å; F357-P389 HydrophobicContact CG-CG 3.9Å; F357-P389 HydrophobicContact CZ-CG 4.48Å; F383-P389 HydrophobicContact CD1-CB 4.08Å; F383-P389 HydrophobicContact CD1-CG 3.85Å; F383-P389 HydrophobicContact CE1-CB 3.87Å; F383-P389 HydrophobicContact CE1-CG 3.91Å; S387-P389 WeakPolarHBondContact O-CD 3.26Å
390	S	82.1	Confident	83.6	Confident	94 Å²	94	32.5 Å²	32.5	66%	0.657	19%	0.19	S	C	*	.	P	Polyproline II helix	trans	-55.3	149.6	168.6	-62.9	0	0	0	0	110.9	I392	S390-I392 WeakPolarHBondContact O-CG1 3.33Å; S390-I392 PolarHBondContact O-N 3.33Å
391	S	85.4	Confident	84	Confident	39 Å²	39	32.1 Å²	32.1	27%	0.273	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-54.5	133.9	175.1	-67.2	0	0	0	0	111	L355 S356 Y433 L434	L355-S391 CarbonylContact O-C 3.57Å; L355-S391 VanDerWaalsContact O-CA 3.28Å; L355-S391 WeakPolarHBondContact O-CA 3.47Å; L355-S391 WeakPolarHBondContact O-CB 3Å; S356-S391 WeakPolarHBondContact OG-CB 3.26Å; S356-S391 PolarHBondContact OG-OG 2.92Å; S391-Y433 WeakPolarHBondContact O-CA 3.33Å; S391-Y433 WeakPolarHBondContact O-CB 3.48Å; S391-L434 PolarHBondContact O-N 2.86Å
392	I	88.1	Confident	84.4	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.2	-170.1	-46.5	177.3	0	0	0	108.9	L355 F357 M372 F383 S390 I394 L434 V436	L355-I392 HydrophobicContact CB-CB 4.49Å; L355-I392 PolarHBondContact N-O 2.88Å; L355-I392 PolarHBondContact O-N 3.43Å; F357-I392 HydrophobicContact CE2-CD1 4.5Å; M372-I392 HydrophobicContact CE-CD1 3.8Å; M372-I392 HydrophobicContact CE-CG2 4.15Å; F383-I392 HydrophobicContact CE1-CD1 3.98Å; F383-I392 HydrophobicContact CE2-CD1 4.49Å; F383-I392 HydrophobicContact CZ-CD1 3.52Å; S390-I392 WeakPolarHBondContact O-CG1 3.33Å; S390-I392 PolarHBondContact O-N 3.33Å; I392-I394 HydrophobicContact CG2-CD1 3.6Å; I392-L434 CarbonylContact C-O 3.58Å; I392-L434 VanDerWaalsContact CA-O 3.32Å; I392-L434 WeakPolarHBondContact CA-O 3.37Å; I392-L434 WeakPolarHBondContact CG2-O 3.34Å; I392-V436 HydrophobicContact CG2-CG2 4Å
393	L	89.1	Confident	84.6	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117.7	174.9	-178.1	65	0	0	0	109.5	H352 L354 L421 D428 Y433 L434 T435 V436	H352-L393 HydrophobicContact CB-CD1 3.95Å; L354-L393 HydrophobicContact CB-CD1 4.13Å; L354-L393 HydrophobicContact CD1-CB 4.41Å; L354-L393 HydrophobicContact CD1-CD1 4.49Å; L393-L421 HydrophobicContact CD1-CD1 4.03Å; L393-D428 HydrophobicContact CD2-CB 4.35Å; L393-Y433 HydrophobicContact CB-CD2 4.34Å; L393-Y433 HydrophobicContact CB-CG 4.37Å; L393-Y433 HydrophobicContact CD2-CD2 4.34Å; L393-L434 PolarHBondContact N-O 2.92Å; L393-T435 HydrophobicContact CB-CG2 4.42Å; L393-T435 HydrophobicContact CD2-CG2 4.18Å; L393-T435 HydrophobicContact CG-CG2 4.45Å; L393-T435 CarbonylContact O-C 3.54Å; L393-T435 WeakPolarHBondContact O-CA 3.28Å; L393-V436 PolarHBondContact O-N 2.76Å
394	I	89.7	Confident	84.5	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121.6	178.8	-50.3	-58.4	0	0	0	109.3	H352 V353 L355 M372 I380 I392 S396 L399 V436 F438	H352-I394 WeakPolarHBondContact CA-O 3.48Å; H352-I394 VanDerWaalsContact CB-O 3.31Å; H352-I394 WeakPolarHBondContact CB-O 3.28Å; V353-I394 HydrophobicContact CB-CB 4.25Å; V353-I394 PolarHBondContact N-O 3.5Å; V353-I394 PolarHBondContact O-N 2.84Å; L355-I394 HydrophobicContact CD1-CG1 4.02Å; M372-I394 HydrophobicContact CE-CD1 3.95Å; I380-I394 HydrophobicContact CD1-CD1 4.02Å; I380-I394 HydrophobicContact CG2-CD1 4.33Å; I392-I394 HydrophobicContact CG2-CD1 3.6Å; I394-S396 VanDerWaalsContact CG2-OG 3.28Å; I394-S396 WeakPolarHBondContact CG2-OG 3.23Å; I394-S396 PolarHBondContact O-N 2.77Å; I394-L399 HydrophobicContact CD1-CD1 4.46Å; I394-L399 HydrophobicContact CG1-CD1 4.17Å; I394-L399 HydrophobicContact CG2-CD1 4.45Å; I394-V436 HydrophobicContact CD1-CB 3.96Å; I394-V436 HydrophobicContact CD1-CG2 4.08Å; I394-F438 HydrophobicContact CG2-CE2 3.64Å; I394-F438 HydrophobicContact CG2-CZ 4.4Å
395	G	87.7	Confident	84.4	Confident	13 Å²	13	34.6 Å²	34.6	13%	0.134	20%	0.2	C	C	.	.	S	Bend	trans	-73.2	33.7	177.9	0	0	0	0	0	114.8	V436	G395-V436 PolarHBondContact N-O 2.78Å
396	S	88.5	Confident	84.1	Confident	24 Å²	24	35.4 Å²	35.4	17%	0.168	20%	0.199	C	C	.	.	S	Bend	trans	-139.9	158.2	173.6	56.4	0	0	0	0	109.4	M351 V353 I394 S398	M351-S396 CarbonylContact O-C 3.57Å; V353-S396 WeakPolarHBondContact CG2-O 3.42Å; V353-S396 PolarHBondContact N-O 3.46Å; I394-S396 VanDerWaalsContact CG2-OG 3.28Å; I394-S396 WeakPolarHBondContact CG2-OG 3.23Å; I394-S396 PolarHBondContact O-N 2.77Å; S396-S398 PolarHBondContact O-N 2.83Å; S396-S398 PolarHBondContact OG-O 2.94Å
397	N	89.7	Confident	83.1	Confident	55 Å²	55	30.8 Å²	30.8	29%	0.294	19%	0.187	S	C	.	.	S	Bend	trans	-79	6.8	176.2	74	-40.6	0	0	0	113.4	V347 M351	V347-N397 HydrophobicContact CG2-CB 3.94Å; V347-N397 VanDerWaalsContact CG2-O 3.26Å; V347-N397 WeakPolarHBondContact CG2-O 3.36Å; V347-N397 PolarHBondContact N-O 2.82Å; M351-N397 WeakPolarHBondContact O-CA 3.28Å; M351-N397 WeakPolarHBondContact O-CB 3.01Å; M351-N397 PolarHBondContact O-N 2.94Å
398	S	89.4	Confident	82.1	Confident	10 Å²	10	33.4 Å²	33.4	7%	0.07	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	151.2	-171.2	56.5	0	0	0	0	112.4	L345 L375 S396	L345-S398 VanDerWaalsContact O-CA 3.24Å; L345-S398 WeakPolarHBondContact O-CA 3.19Å; L375-S398 VanDerWaalsContact CD1-CB 3.49Å; L375-S398 WeakPolarHBondContact CD1-OG 3.28Å; L375-S398 WeakPolarHBondContact CG-OG 2.99Å; S396-S398 PolarHBondContact O-N 2.83Å; S396-S398 PolarHBondContact OG-O 2.94Å
399	L	91.1	Very high	80.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	143.4	-178.9	-178.8	80.6	0	0	0	110.2	T344 L345 L355 M372 Y373 I380 I394 L401	T344-L399 CarbonylContact C-O 3.26Å; T344-L399 WeakPolarHBondContact CA-O 3.49Å; L345-L399 HydrophobicContact CB-CB 4.43Å; L345-L399 HydrophobicContact CD1-CD2 4.09Å; L345-L399 PolarHBondContact N-O 3Å; L345-L399 PolarHBondContact O-N 2.92Å; L355-L399 HydrophobicContact CD1-CD2 3.29Å; L355-L399 HydrophobicContact CD2-CD2 4.3Å; L355-L399 HydrophobicContact CG-CD2 4.32Å; M372-L399 HydrophobicContact CG-CD1 3.31Å; M372-L399 HydrophobicContact CG-CD2 3.78Å; M372-L399 HydrophobicContact CG-CG 3.81Å; M372-L399 HydrophobicContact SD-CD1 3.83Å; M372-L399 HydrophobicContact SD-CD2 3.65Å; M372-L399 HydrophobicContact SD-CG 4.24Å; Y373-L399 VanDerWaalsContact O-CD1 3.32Å; Y373-L399 WeakPolarHBondContact O-CD1 3.29Å; I380-L399 HydrophobicContact CD1-CD1 3.41Å; I380-L399 VanDerWaalsContact CD1-CD1 3.41Å; I394-L399 HydrophobicContact CD1-CD1 4.46Å; I394-L399 HydrophobicContact CG1-CD1 4.17Å; I394-L399 HydrophobicContact CG2-CD1 4.45Å; L399-L401 HydrophobicContact CD2-CD2 3.93Å; L399-L401 HydrophobicContact CD2-CG 4Å
400	R	89.4	Confident	79.6	Confident	51 Å²	51	35.9 Å²	35.9	19%	0.192	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.7	169.9	-175.3	178.4	-69.9	161.2	-2.1	111.1	V342 W343 M372 Y373 D377	V342-R400 HydrophobicContact CG1-CG 3.69Å; W343-R400 CarbonylContact O-C 3.59Å; W343-R400 WeakPolarHBondContact O-CA 2.99Å; M372-R400 CarbonylContact C-O 3.52Å; M372-R400 WeakPolarHBondContact CA-O 3.1Å; Y373-R400 PolarHBondContact N-O 2.84Å; Y373-R400 PolarHBondContact O-N 2.81Å; D377-R400 VanDerWaalsContact CG-NH1 3.33Å; D377-R400 IonicContact OD1-CZ 2.98Å; D377-R400 IonicContact OD1-NH1 2.64Å; D377-R400 PolarHBondContact OD1-NH1 3.21Å; D377-R400 IonicContact OD2-NH1 3.23Å; D377-R400 PolarHBondContact OD2-NH1 2.83Å
401	L	91.1	Very high	78.4	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	132.5	172.2	-65.7	168.8	0	0	0	108.8	L325 V342 W343 L345 L370 S371 M372 L399 L416	L325-L401 HydrophobicContact CD2-CD1 3.57Å; V342-L401 CarbonylContact C-O 3.56Å; V342-L401 VanDerWaalsContact CA-O 3.28Å; V342-L401 WeakPolarHBondContact CA-O 3.29Å; W343-L401 HydrophobicContact CB-CB 4.38Å; W343-L401 HydrophobicContact CE3-CB 4.16Å; W343-L401 PolarHBondContact N-O 3.06Å; W343-L401 PolarHBondContact O-N 2.76Å; L345-L401 HydrophobicContact CD1-CD1 3.94Å; L345-L401 HydrophobicContact CG-CD1 4.27Å; L370-L401 HydrophobicContact CD1-CB 4.28Å; L370-L401 HydrophobicContact CD1-CD2 4.44Å; S371-L401 CarbonylContact O-C 3.55Å; M372-L401 HydrophobicContact CB-CD2 4.01Å; M372-L401 HydrophobicContact CG-CD2 3.77Å; M372-L401 HydrophobicContact SD-CD2 4.05Å; L399-L401 HydrophobicContact CD2-CD2 3.93Å; L399-L401 HydrophobicContact CD2-CG 4Å; L401-L416 HydrophobicContact CD1-CD1 4.45Å; L401-L416 HydrophobicContact CD1-CD2 3.64Å
402	K	88.4	Confident	77.4	Confident	72 Å²	72	31.2 Å²	31.2	31%	0.313	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	114.4	179.9	178.9	179.6	179.9	180	0	109.5	C341 V342 S371 Y373 V404	C341-K402 CarbonylContact O-C 3.52Å; C341-K402 WeakPolarHBondContact O-CA 3.47Å; V342-K402 HydrophobicContact CG2-CG 4.21Å; S371-K402 PolarHBondContact N-O 2.98Å; S371-K402 PolarHBondContact O-N 3.36Å; Y373-K402 HydrophobicContact CD2-CB 4.32Å; Y373-K402 HydrophobicContact CE2-CB 3.93Å; Y373-K402 HydrophobicContact CE2-CD 4.12Å; K402-V404 HydrophobicContact CG-CG2 4.19Å
403	F	87.6	Confident	77	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.8	173.4	178.6	-96.2	0	0	0	110.4	F327 Y335 R340 C341 W343 V362 L370 F414	F327-F403 AromaticContact CD1-CD1 3.96Å; F327-F403 HydrophobicContact CD1-CD1 3.96Å; F327-F403 HydrophobicContact CD1-CE1 4.28Å; F327-F403 HydrophobicContact CD1-CG 4.1Å; F327-F403 AromaticContact CE1-CD1 3.3Å; F327-F403 HydrophobicContact CE1-CD1 3.3Å; F327-F403 AromaticContact CE1-CE1 3.44Å; F327-F403 HydrophobicContact CE1-CE1 3.44Å; F327-F403 VanDerWaalsContact CE1-CE1 3.44Å; F327-F403 AromaticContact CE1-CG 3.91Å; F327-F403 HydrophobicContact CE1-CG 3.91Å; F327-F403 HydrophobicContact CE1-CZ 4.13Å; F327-F403 AromaticContact CZ-CD1 3.99Å; F327-F403 HydrophobicContact CZ-CD1 3.99Å; F327-F403 HydrophobicContact CZ-CE1 4.22Å; Y335-F403 HydrophobicContact CD1-CE1 4.1Å; Y335-F403 HydrophobicContact CD1-CE2 4.03Å; Y335-F403 AromaticContact CD1-CZ 3.36Å; Y335-F403 HydrophobicContact CD1-CZ 3.36Å; Y335-F403 AromaticContact CD2-CE1 3.9Å; Y335-F403 HydrophobicContact CD2-CE1 3.9Å; Y335-F403 AromaticContact CD2-CZ 3.61Å; Y335-F403 HydrophobicContact CD2-CZ 3.61Å; Y335-F403 HydrophobicContact CE1-CE2 4.01Å; Y335-F403 AromaticContact CE1-CZ 3.54Å; Y335-F403 HydrophobicContact CE1-CZ 3.54Å; Y335-F403 HydrophobicContact CE2-CE1 4.47Å; Y335-F403 AromaticContact CE2-CZ 3.82Å; Y335-F403 HydrophobicContact CE2-CZ 3.82Å; Y335-F403 AromaticContact CG-CE1 3.7Å; Y335-F403 HydrophobicContact CG-CE1 3.7Å; Y335-F403 HydrophobicContact CG-CE2 4.45Å; Y335-F403 AromaticContact CG-CZ 3.39Å; Y335-F403 HydrophobicContact CG-CZ 3.39Å; Y335-F403 AromaticContact CZ-CZ 3.77Å; R340-F403 WeakPolarHBondContact CA-O 3.32Å; C341-F403 HydrophobicContact CB-CB 4.35Å; C341-F403 PolarHBondContact N-O 3.07Å; C341-F403 PolarHBondContact O-N 3.04Å; W343-F403 HydrophobicContact CH2-CB 4.09Å; W343-F403 HydrophobicContact CZ3-CB 3.71Å; V362-F403 HydrophobicContact CG1-CE2 3.97Å; V362-F403 HydrophobicContact CG2-CE2 3.98Å; L370-F403 HydrophobicContact CB-CD2 4.37Å; L370-F403 HydrophobicContact CD1-CB 4.22Å; F403-F414 HydrophobicContact CB-CE1 4.17Å; F403-F414 HydrophobicContact CD2-CD1 4.43Å; F403-F414 HydrophobicContact CD2-CE1 4.13Å; F403-F414 HydrophobicContact CG-CE1 4.33Å
404	V	83.7	Confident	76.7	Confident	18 Å²	18	31 Å²	31	11%	0.109	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	132.5	175.7	-176.9	0	0	0	0	108.5	Q339 R340 S368 Y369 K402	Q339-V404 WeakPolarHBondContact O-CA 3.46Å; R340-V404 HydrophobicContact CG-CG2 4.48Å; S368-V404 CarbonylContact C-O 3.42Å; S368-V404 VanDerWaalsContact CA-O 3.22Å; S368-V404 WeakPolarHBondContact CA-O 3.38Å; Y369-V404 HydrophobicContact CE1-CB 4.33Å; Y369-V404 HydrophobicContact CE2-CB 4.42Å; Y369-V404 HydrophobicContact CE2-CG2 4.27Å; Y369-V404 PolarHBondContact N-O 2.89Å; Y369-V404 PolarHBondContact O-N 3.43Å; K402-V404 HydrophobicContact CG-CG2 4.19Å
405	S	77.7	Confident	76.6	Confident	5 Å²	5	32.5 Å²	32.5	4%	0.035	19%	0.19	C	C	.	.			trans	-125.3	150.3	169.8	62.1	0	0	0	0	111.8	Y335 E336 K338 Q339	Y335-S405 VanDerWaalsContact CE2-CB 3.48Å; E336-S405 PolarHBondContact O-OG 2.85Å; K338-S405 WeakPolarHBondContact CA-O 3.25Å; K338-S405 PolarHBondContact N-O 2.87Å; K338-S405 PolarHBondContact N-OG 3.39Å; Q339-S405 PolarHBondContact N-OG 3.01Å; Q339-S405 PolarHBondContact O-N 3.46Å
406	D	68.1	Low	76.7	Confident	40 Å²	40	32 Å²	32	21%	0.214	18%	0.184	C	C	.	.			trans	-106.2	-158.6	178	85.3	-24.8	0	0	0	113.1	S337 K338 H367	S337-D406 CarbonylContact C-O 3.51Å; S337-D406 WeakPolarHBondContact CA-O 3.44Å; S337-D406 WeakPolarHBondContact CB-O 3.41Å; K338-D406 PolarHBondContact N-O 3.48Å; K338-D406 VanDerWaalsContact N-O 3.07Å; H367-D406 HydrophobicContact CB-CB 4.28Å; H367-D406 VanDerWaalsContact CB-CG 3.42Å; H367-D406 WeakPolarHBondContact CB-OD2 3.13Å; H367-D406 IonicContact CD2-OD2 2.69Å; H367-D406 PolarHBondContact CD2-OD2 2.81Å; H367-D406 IonicContact CG-OD2 3.93Å
407	A	50.5	Low	77	Confident	58 Å²	58	32.7 Å²	32.7	48%	0.479	19%	0.188	S	C	.	.	S	Bend	trans	-95.2	-7.5	-155.6	0	0	0	0	0	116.9
408	T	51.6	Low	77.1	Confident	103 Å²	103	30.3 Å²	30.3	63%	0.632	18%	0.175	S	C	*	.	S	Bend	trans	-114.6	-26.8	-163.6	55.2	0	0	0	0	116.1
409	D	49.5	Very low	77.3	Confident	93 Å²	93	34.9 Å²	34.9	50%	0.497	19%	0.193	S	C	.	.			trans	-136.9	162.4	-173.8	-61.5	-65.8	0	0	0	111.9	E363	E363-D409 HydrophobicContact CG-CB 4.21Å; E363-D409 WeakPolarHBondContact OE1-CA 3.45Å; E363-D409 WeakPolarHBondContact OE1-CB 3.13Å
410	N	54.1	Low	77.4	Confident	73 Å²	73	35.7 Å²	35.7	39%	0.39	20%	0.2	S	C	.	.			trans	-128.6	132	170.6	-41.7	-96.7	0	0	0	111.7	R303 Y334 Y335 E363	R303-N410 PolarHBondContact NH2-OD1 2.98Å; Y334-N410 WeakPolarHBondContact CD1-O 3.24Å; Y334-N410 HydrophobicContact CG-CB 4.37Å; Y335-N410 WeakPolarHBondContact O-CB 3.46Å; Y335-N410 PolarHBondContact O-OD1 3.26Å; Y335-N410 VanDerWaalsContact O-OD1 3.09Å; E363-N410 WeakPolarHBondContact OE1-CA 3.28Å; E363-N410 PolarHBondContact OE1-N 3.18Å
411	A	56.7	Low	77.3	Confident	4 Å²	4	35.8 Å²	35.8	3%	0.033	20%	0.204	C	C	.	.			trans	-118.2	166.9	172.6	0	0	0	0	0	113	Y334 Y335 D361 E363 G413	Y334-A411 VanDerWaalsContact CA-O 3.28Å; Y334-A411 WeakPolarHBondContact CA-O 3.07Å; Y334-A411 WeakPolarHBondContact CB-O 3.28Å; Y335-A411 WeakPolarHBondContact CD1-O 3.22Å; Y335-A411 HydrophobicContact CE1-CB 3.62Å; Y335-A411 WeakPolarHBondContact CE1-O 3.48Å; Y335-A411 PolarHBondContact N-O 2.94Å; Y335-A411 VanDerWaalsContact N-O 3.07Å; D361-A411 VanDerWaalsContact O-CB 3.26Å; D361-A411 WeakPolarHBondContact O-CB 3.3Å; D361-A411 WeakPolarHBondContact OD1-CB 3.29Å; E363-A411 HydrophobicContact CG-CB 3.83Å; E363-A411 PolarHBondContact OE1-N 3.14Å; A411-G413 PolarHBondContact O-N 3.29Å
412	A	64.6	Low	77.1	Confident	31 Å²	31	43.4 Å²	43.4	26%	0.256	24%	0.237	S	C	.	.			trans	-74.7	-4.2	-168.1	0	0	0	0	0	114.3	Y334 D361	Y334-A412 HydrophobicContact CD1-CB 4.39Å; Y334-A412 HydrophobicContact CE1-CB 4.3Å; D361-A412 HydrophobicContact CB-CB 4.02Å; D361-A412 WeakPolarHBondContact OD2-CB 3.46Å; D361-A412 PolarHBondContact OD2-N 2.86Å
413	G	78.3	Confident	76.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.5	-143.4	173.6	0	0	0	0	0	112.6	F327 H359 L360 D361 A411	F327-G413 CarbonylContact O-C 3.6Å; F327-G413 VanDerWaalsContact O-CA 3.27Å; F327-G413 WeakPolarHBondContact O-CA 3.31Å; H359-G413 PolarHBondContact ND1-O 2.9Å; L360-G413 CarbonylContact C-O 3.51Å; D361-G413 PolarHBondContact N-O 2.81Å; D361-G413 VanDerWaalsContact O-CA 3.3Å; D361-G413 WeakPolarHBondContact O-CA 3.48Å; D361-G413 PolarHBondContact O-N 2.91Å; A411-G413 PolarHBondContact O-N 3.29Å
414	F	83.6	Confident	75.4	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	147.3	-172.7	64.3	-91.4	0	0	0	112.9	L325 H326 F327 W343 H359 L360 L370 F403 L416	L325-F414 HydrophobicContact CD2-CE2 4.02Å; L325-F414 HydrophobicContact CD2-CZ 4.48Å; L325-F414 HydrophobicContact CG-CE2 4.24Å; H326-F414 CarbonylContact C-O 3.55Å; H326-F414 WeakPolarHBondContact CA-O 3.45Å; F327-F414 HydrophobicContact CB-CD1 4.14Å; F327-F414 HydrophobicContact CB-CE1 3.6Å; F327-F414 HydrophobicContact CB-CE2 4.16Å; F327-F414 HydrophobicContact CB-CZ 3.62Å; F327-F414 HydrophobicContact CD1-CD1 4.4Å; F327-F414 AromaticContact CD1-CE1 3.91Å; F327-F414 HydrophobicContact CD1-CE1 3.91Å; F327-F414 HydrophobicContact CG-CE1 4.12Å; F327-F414 HydrophobicContact CG-CZ 4.44Å; F327-F414 PolarHBondContact N-O 3.46Å; F327-F414 PolarHBondContact O-N 3.4Å; W343-F414 HydrophobicContact CE3-CZ 4.21Å; W343-F414 HydrophobicContact CH2-CE1 4.19Å; W343-F414 AromaticContact CH2-CZ 3.83Å; W343-F414 HydrophobicContact CH2-CZ 3.83Å; W343-F414 HydrophobicContact CZ3-CE1 4.1Å; W343-F414 AromaticContact CZ3-CZ 3.6Å; W343-F414 HydrophobicContact CZ3-CZ 3.6Å; H359-F414 CarbonylContact O-C 3.52Å; H359-F414 VanDerWaalsContact O-CA 3.31Å; H359-F414 WeakPolarHBondContact O-CA 3.42Å; L360-F414 HydrophobicContact CD1-CB 3.9Å; L370-F414 HydrophobicContact CD1-CD1 4.31Å; L370-F414 HydrophobicContact CD1-CE1 3.68Å; L370-F414 HydrophobicContact CD1-CE2 4.47Å; L370-F414 HydrophobicContact CD1-CZ 3.77Å; L370-F414 HydrophobicContact CD2-CB 4.43Å; L370-F414 HydrophobicContact CD2-CD1 3.82Å; L370-F414 HydrophobicContact CD2-CD2 3.97Å; L370-F414 HydrophobicContact CD2-CE1 3.98Å; L370-F414 HydrophobicContact CD2-CE2 4.13Å; L370-F414 HydrophobicContact CD2-CG 3.81Å; L370-F414 HydrophobicContact CD2-CZ 4.13Å; L370-F414 HydrophobicContact CG-CD1 4.45Å; L370-F414 HydrophobicContact CG-CE1 4.3Å; F403-F414 HydrophobicContact CB-CE1 4.17Å; F403-F414 HydrophobicContact CD2-CD1 4.43Å; F403-F414 HydrophobicContact CD2-CE1 4.13Å; F403-F414 HydrophobicContact CG-CE1 4.33Å; F414-L416 HydrophobicContact CD2-CD2 3.76Å; F414-L416 HydrophobicContact CD2-CG 4.22Å; F414-L416 HydrophobicContact CE2-CD2 3.71Å; F414-L416 HydrophobicContact CE2-CG 4.3Å
415	N	86.8	Confident	73.9	Confident	31 Å²	31	57.3 Å²	57.3	17%	0.166	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124.4	167.1	-59.9	-31.6	0	0	0	108.3	H326 L331 F357 S358 H359	H326-N415 WeakPolarHBondContact CB-OD1 3.28Å; L331-N415 VanDerWaalsContact CD2-ND2 3.26Å; L331-N415 WeakPolarHBondContact CD2-ND2 3.34Å; F357-N415 WeakPolarHBondContact CA-O 3.11Å; S358-N415 PolarHBondContact N-O 3.29Å; S358-N415 VanDerWaalsContact OG-CB 3.31Å; S358-N415 WeakPolarHBondContact OG-CB 3.37Å; S358-N415 PolarHBondContact OG-O 2.85Å; H359-N415 HydrophobicContact CB-CB 3.74Å; H359-N415 WeakPolarHBondContact CB-ND2 3.05Å; H359-N415 PolarHBondContact N-O 2.71Å; H359-N415 PolarHBondContact O-N 2.75Å
416	L	90.8	Very high	72.9	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	155.5	174.7	67.8	83.1	0	0	0	111.5	K324 L325 L355 S356 F357 L401 F414	K324-L416 WeakPolarHBondContact CA-O 3.46Å; L325-L416 HydrophobicContact CB-CD1 3.68Å; L325-L416 HydrophobicContact CB-CG 3.99Å; L325-L416 HydrophobicContact CD2-CD1 4.43Å; L325-L416 HydrophobicContact CD2-CD2 4.44Å; L325-L416 PolarHBondContact N-O 2.86Å; L325-L416 PolarHBondContact O-N 3.2Å; L355-L416 HydrophobicContact CD2-CD1 3.82Å; S356-L416 CarbonylContact O-C 3.55Å; S356-L416 VanDerWaalsContact O-CA 3.31Å; S356-L416 WeakPolarHBondContact O-CA 3.31Å; F357-L416 HydrophobicContact CD1-CB 4.11Å; F357-L416 HydrophobicContact CE1-CB 4.26Å; F357-L416 HydrophobicContact CE1-CD2 4.01Å; F357-L416 HydrophobicContact CG-CB 4.42Å; F357-L416 HydrophobicContact CZ-CD2 4.2Å; L401-L416 HydrophobicContact CD1-CD1 4.45Å; L401-L416 HydrophobicContact CD1-CD2 3.64Å; F414-L416 HydrophobicContact CD2-CD2 3.76Å; F414-L416 HydrophobicContact CD2-CG 4.22Å; F414-L416 HydrophobicContact CE2-CD2 3.71Å; F414-L416 HydrophobicContact CE2-CG 4.3Å
417	T	93.6	Very high	72.2	Confident	40 Å²	40	59.6 Å²	59.6	25%	0.245	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	145	171.9	63.7	0	0	0	0	108.7	G323 K324 L355 S356	G323-T417 WeakPolarHBondContact O-CA 3.39Å; K324-T417 HydrophobicContact CB-CG2 4.41Å; K324-T417 HydrophobicContact CD-CG2 4.16Å; K324-T417 HydrophobicContact CG-CG2 3.83Å; L355-T417 WeakPolarHBondContact CA-O 3.4Å; S356-T417 PolarHBondContact N-O 3.18Å; S356-T417 PolarHBondContact O-N 3.49Å
418	Y	93.7	Very high	72.5	Confident	5 Å²	5	59 Å²	59	2%	0.02	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.9	174.6	72.7	-90.2	0	0	0	110.5	V318 E322 G323 L345 V347 L354	V318-Y418 HydrophobicContact CG1-CE1 3.88Å; V318-Y418 WeakPolarHBondContact CG1-OH 3.41Å; E322-Y418 CarbonylContact C-O 3.49Å; E322-Y418 VanDerWaalsContact CA-O 3.23Å; E322-Y418 WeakPolarHBondContact CA-O 3.35Å; G323-Y418 VanDerWaalsContact CA-CE1 3.42Å; G323-Y418 PolarHBondContact N-O 2.69Å; G323-Y418 PolarHBondContact O-N 3.11Å; L345-Y418 HydrophobicContact CD1-CD1 4.05Å; L345-Y418 HydrophobicContact CD1-CG 4.14Å; L345-Y418 HydrophobicContact CD2-CD1 4.2Å; L345-Y418 HydrophobicContact CD2-CE1 4.15Å; V347-Y418 HydrophobicContact CG1-CD2 3.89Å; V347-Y418 HydrophobicContact CG1-CE2 4.03Å; L354-Y418 CarbonylContact O-C 3.44Å; L354-Y418 WeakPolarHBondContact O-CA 3.22Å
419	K	92.8	Very high	72.9	Confident	105 Å²	105	55 Å²	55	46%	0.457	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	140.4	176.7	-69.4	-174.1	174.2	-178.1	0	110.7	A321 E322 L354	A321-K419 CarbonylContact O-C 3.58Å; E322-K419 HydrophobicContact CB-CG 4.05Å; L354-K419 PolarHBondContact N-O 2.81Å; L354-K419 PolarHBondContact O-N 3.17Å
420	A	92.1	Very high	73.5	Confident	18 Å²	18	50.8 Å²	50.8	15%	0.149	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	119.4	172.8	0	0	0	0	0	109.1	A321 V347 M351 H352	A321-A420 HydrophobicContact CB-CB 4.32Å; A321-A420 VanDerWaalsContact O-CB 3.24Å; A321-A420 WeakPolarHBondContact O-CB 3.35Å; A321-A420 PolarHBondContact O-N 2.88Å; V347-A420 HydrophobicContact CB-CB 3.78Å; V347-A420 HydrophobicContact CG1-CB 3.97Å; V347-A420 HydrophobicContact CG2-CB 4.34Å; M351-A420 HydrophobicContact CB-CB 4.12Å; M351-A420 HydrophobicContact CE-CB 3.66Å; M351-A420 WeakPolarHBondContact CE-O 3.25Å; M351-A420 HydrophobicContact CG-CB 4.33Å; H352-A420 WeakPolarHBondContact O-CA 3.47Å
421	L	88.1	Confident	74.6	Confident	52 Å²	52	49 Å²	49	27%	0.272	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.1	172.3	-61.9	-174.1	0	0	0	109.3	M351 H352 L354 L393	M351-L421 CarbonylContact C-O 3.19Å; M351-L421 WeakPolarHBondContact CA-O 3.44Å; H352-L421 PolarHBondContact N-O 3.42Å; H352-L421 PolarHBondContact O-N 2.98Å; L354-L421 HydrophobicContact CB-CD1 3.76Å; L354-L421 HydrophobicContact CB-CG 4.03Å; L354-L421 HydrophobicContact CD2-CD1 3.91Å; L354-L421 HydrophobicContact CG-CD1 4.34Å; L393-L421 HydrophobicContact CD1-CD1 4.03Å
422	K	86.5	Confident	75.4	Confident	161 Å²	161	52.8 Å²	52.8	70%	0.7	28%	0.276	S	S	*	.			trans	-65.5	134.6	169.1	-75.8	-175.8	176.3	-173.2	0	107.7	M351 N424	M351-K422 HydrophobicContact CE-CG 3.81Å; M351-K422 HydrophobicContact SD-CB 4.3Å; M351-K422 HydrophobicContact SD-CG 3.49Å; M351-K422 WeakPolarHBondContact SD-CG 3.35Å; K422-N424 PolarHBondContact O-N 3.41Å
423	P	74.8	Confident	76	Confident	51 Å²	51	54.7 Å²	54.7	33%	0.331	28%	0.277	S	S	.	.			trans	-57	114.6	168.9	-17.4	29	0	0	0	106.8	E350 Y425	E350-P423 WeakPolarHBondContact O-CD 3.35Å; E350-P423 VanDerWaalsContact O-CG 3.28Å; E350-P423 WeakPolarHBondContact O-CG 3.23Å; P423-Y425 PolarHBondContact O-N 2.86Å
424	N	66.5	Low	76.2	Confident	96 Å²	96	56 Å²	56	51%	0.513	28%	0.284	S	S	.	.			trans	-65.1	129.3	155.7	-69.3	-29.4	0	0	0	104.6	K422 I426 D428	K422-N424 PolarHBondContact O-N 3.41Å; N424-I426 CarbonylContact C-O 3.55Å; N424-I426 WeakPolarHBondContact CB-O 3.31Å; N424-I426 CarbonylContact O-C 3.51Å; N424-I426 PolarHBondContact O-N 2.86Å; N424-D428 PolarHBondContact ND2-OD1 2.88Å
425	Y	51.3	Low	76.3	Confident	236 Å²	236	56 Å²	56	93%	0.925	28%	0.284	S	S	*	.	S	Bend	trans	-60	-5.9	-174.3	-142.4	-96.3	0	0	0	113.4	P423	P423-Y425 PolarHBondContact O-N 2.86Å
426	I	56.9	Low	76.4	Confident	72 Å²	72	54.6 Å²	54.6	37%	0.369	28%	0.276	S	S	.	.	S	Bend	trans	-114.5	117	167.1	-52.1	173.1	0	0	0	103.7	N424 D428 Q444	N424-I426 CarbonylContact C-O 3.55Å; N424-I426 WeakPolarHBondContact CB-O 3.31Å; N424-I426 CarbonylContact O-C 3.51Å; N424-I426 PolarHBondContact O-N 2.86Å; I426-D428 PolarHBondContact O-N 2.94Å; I426-Q444 HydrophobicContact CG2-CG 3.65Å
427	P	53.3	Low	76.2	Confident	21 Å²	21	55.2 Å²	55.2	14%	0.136	28%	0.279	C	S	.	.			trans	-42.6	121.6	171.5	-24.6	33.5	0	0	0	107.3	S429 L437 L442	P427-S429 PolarHBondContact O-N 2.9Å; P427-L437 HydrophobicContact CB-CD1 4.13Å; P427-L437 HydrophobicContact CG-CD1 4.25Å; P427-L442 WeakPolarHBondContact CD-O 3.18Å; P427-L442 WeakPolarHBondContact CG-O 3.37Å
428	D	56.8	Low	75.9	Confident	45 Å²	45	54.2 Å²	54.2	24%	0.241	27%	0.272	C	S	.	.			trans	-40.4	137.3	175.7	-78.2	-34.7	0	0	0	107.3	L393 N424 I426 G430 W460	L393-D428 HydrophobicContact CD2-CB 4.35Å; N424-D428 PolarHBondContact ND2-OD1 2.88Å; I426-D428 PolarHBondContact O-N 2.94Å; D428-G430 PolarHBondContact O-N 2.85Å; D428-W460 PolarHBondContact O-NE1 2.88Å
429	S	59.3	Low	75.6	Confident	19 Å²	19	61 Å²	61	13%	0.133	30%	0.304	C	S	.	.			trans	-47.2	9.6	-169.8	51.3	0	0	0	0	117.9	P427 C431 L446 C458 W460	P427-S429 PolarHBondContact O-N 2.9Å; S429-C431 PolarHBondContact O-N 3.48Å; S429-C431 PolarHBondContact O-SG 3.29Å; S429-L446 VanDerWaalsContact OG-CD1 3.29Å; S429-L446 WeakPolarHBondContact OG-CD1 3.44Å; S429-C458 WeakPolarHBondContact O-CB 3.43Å; S429-W460 VanDerWaalsContact O-CH2 3.27Å; S429-W460 WeakPolarHBondContact O-CH2 3.47Å; S429-W460 WeakPolarHBondContact O-CZ2 3.25Å
430	G	64	Low	75.4	Confident	4 Å²	4	61.4 Å²	61.4	4%	0.041	31%	0.307	C	S	.	.	S	Bend	trans	75.1	-15.2	179	0	0	0	0	0	111.6	D428 C458 D459	D428-G430 PolarHBondContact O-N 2.85Å; G430-C458 VanDerWaalsContact C-CA 3.44Å; G430-C458 VanDerWaalsContact O-CA 3.28Å; G430-C458 WeakPolarHBondContact O-CA 3.39Å; G430-D459 PolarHBondContact O-N 3.26Å
431	C	75.4	Confident	75.3	Confident	36 Å²	36	61.8 Å²	61.8	24%	0.243	31%	0.313	C	S	.	.	S	Bend	trans	-83.5	-18.6	-166.8	-44.1	0	0	0	0	114.4	S429 N457 C458	S429-C431 PolarHBondContact O-N 3.48Å; S429-C431 PolarHBondContact O-SG 3.29Å; C431-N457 WeakPolarHBondContact CA-O 3.2Å; C431-C458 HydrophobicContact CB-CB 3.95Å; C431-C458 WeakPolarHBondContact CB-SG 3.07Å; C431-C458 WeakPolarHBondContact SG-CB 3.4Å; C431-C458 CovalentContact SG-SG 2.03Å; C431-C458 PolarHBondContact SG-SG 2.64Å
432	S	73.3	Confident	75.3	Confident	84 Å²	84	61.5 Å²	61.5	59%	0.587	31%	0.311	S	S	*	.	S	Bend	trans	-95.1	-29.4	179.7	-60.2	0	0	0	0	112.7
433	Y	78.5	Confident	75.5	Confident	71 Å²	71	53.8 Å²	53.8	28%	0.278	28%	0.278	S	S	.	.	S	Bend	trans	-148.1	146.3	-168.9	-48.3	-60.8	0	0	0	109.6	L354 S391 L393 T435	L354-Y433 HydrophobicContact CD1-CD1 3.54Å; L354-Y433 HydrophobicContact CD1-CD2 4.14Å; L354-Y433 HydrophobicContact CD1-CE1 3.7Å; L354-Y433 HydrophobicContact CD1-CE2 4.29Å; L354-Y433 HydrophobicContact CD1-CG 3.77Å; L354-Y433 HydrophobicContact CD2-CE1 3.97Å; S391-Y433 WeakPolarHBondContact O-CA 3.33Å; S391-Y433 WeakPolarHBondContact O-CB 3.48Å; L393-Y433 HydrophobicContact CB-CD2 4.34Å; L393-Y433 HydrophobicContact CB-CG 4.37Å; L393-Y433 HydrophobicContact CD2-CD2 4.34Å; Y433-T435 PolarHBondContact O-N 3.46Å; Y433-T435 VanDerWaalsContact O-N 3.09Å; Y433-T435 PolarHBondContact O-OG1 3.43Å; Y433-T435 VanDerWaalsContact O-OG1 3.1Å
434	L	82.8	Confident	76.2	Confident	26 Å²	26	52.6 Å²	52.6	14%	0.136	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	110.5	165.7	-179.1	62.6	0	0	0	108.4	S391 I392 L393 D459 I461 L563	S391-L434 PolarHBondContact O-N 2.86Å; I392-L434 CarbonylContact C-O 3.58Å; I392-L434 VanDerWaalsContact CA-O 3.32Å; I392-L434 WeakPolarHBondContact CA-O 3.37Å; I392-L434 WeakPolarHBondContact CG2-O 3.34Å; L393-L434 PolarHBondContact N-O 2.92Å; L434-D459 HydrophobicContact CD1-CB 3.53Å; L434-I461 HydrophobicContact CD1-CD1 3.75Å; L434-I461 HydrophobicContact CD1-CG1 4.3Å; L434-I461 HydrophobicContact CD2-CD1 4.18Å; L434-I461 HydrophobicContact CG-CD1 4.07Å; L434-L563 HydrophobicContact CD2-CD1 3.7Å; L434-L563 HydrophobicContact CD2-CD2 3.92Å; L434-L563 HydrophobicContact CD2-CG 4.5Å
435	T	86.1	Confident	77.3	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.2	-170.1	-58	0	0	0	0	110.9	L393 Y433 L437 D459 W460 I461	L393-T435 HydrophobicContact CB-CG2 4.42Å; L393-T435 HydrophobicContact CD2-CG2 4.18Å; L393-T435 HydrophobicContact CG-CG2 4.45Å; L393-T435 CarbonylContact O-C 3.54Å; L393-T435 WeakPolarHBondContact O-CA 3.28Å; Y433-T435 PolarHBondContact O-N 3.46Å; Y433-T435 VanDerWaalsContact O-N 3.09Å; Y433-T435 PolarHBondContact O-OG1 3.43Å; Y433-T435 VanDerWaalsContact O-OG1 3.1Å; T435-L437 HydrophobicContact CG2-CD1 4.3Å; T435-L437 HydrophobicContact CG2-CD2 4.05Å; T435-L437 HydrophobicContact CG2-CG 4.01Å; T435-D459 PolarHBondContact N-O 3.25Å; T435-W460 CarbonylContact O-C 3.57Å; T435-W460 WeakPolarHBondContact O-CA 3.45Å; T435-I461 PolarHBondContact O-N 3Å
436	V	87.4	Confident	79	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	121.5	-179.9	-173.6	0	0	0	0	109.8	I380 I392 L393 I394 G395 F438 I461	I380-V436 HydrophobicContact CG2-CB 4.27Å; I380-V436 HydrophobicContact CG2-CG1 3.9Å; I380-V436 HydrophobicContact CG2-CG2 3.74Å; I392-V436 HydrophobicContact CG2-CG2 4Å; L393-V436 PolarHBondContact O-N 2.76Å; I394-V436 HydrophobicContact CD1-CB 3.96Å; I394-V436 HydrophobicContact CD1-CG2 4.08Å; G395-V436 PolarHBondContact N-O 2.78Å; V436-F438 HydrophobicContact CG1-CE1 4.29Å; V436-F438 HydrophobicContact CG1-CZ 4.05Å; V436-I461 CarbonylContact C-O 3.57Å; V436-I461 WeakPolarHBondContact CA-O 3.37Å; V436-I461 HydrophobicContact CG1-CG2 4.42Å; V436-I461 HydrophobicContact CG2-CB 4.3Å; V436-I461 HydrophobicContact CG2-CD1 4.18Å
437	L	87.5	Confident	80.4	Confident	15 Å²	15	40.3 Å²	40.3	8%	0.079	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135.1	-172.4	-61.7	169.2	0	0	0	110.9	P427 T435 I461 F462 Q463	P427-L437 HydrophobicContact CB-CD1 4.13Å; P427-L437 HydrophobicContact CG-CD1 4.25Å; T435-L437 HydrophobicContact CG2-CD1 4.3Å; T435-L437 HydrophobicContact CG2-CD2 4.05Å; T435-L437 HydrophobicContact CG2-CG 4.01Å; L437-I461 PolarHBondContact N-O 3.11Å; L437-F462 HydrophobicContact CB-CD1 3.81Å; L437-F462 HydrophobicContact CB-CE1 3.79Å; L437-F462 HydrophobicContact CB-CG 4.37Å; L437-F462 HydrophobicContact CB-CZ 4.33Å; L437-F462 HydrophobicContact CD1-CD1 4.33Å; L437-F462 HydrophobicContact CD1-CE1 3.59Å; L437-F462 HydrophobicContact CD1-CE2 3.85Å; L437-F462 HydrophobicContact CD1-CZ 3.31Å; L437-F462 HydrophobicContact CG-CE1 4.33Å; L437-F462 HydrophobicContact CG-CZ 4.43Å; L437-F462 WeakPolarHBondContact O-CA 3.29Å; L437-Q463 PolarHBondContact O-N 3.34Å
438	F	86.4	Confident	82	Confident	19 Å²	19	41.8 Å²	41.8	8%	0.083	22%	0.222	C	C	.	.	S	Bend	trans	-108.8	0.5	-177.7	-60.3	-67.9	0	0	0	114.1	R378 I380 I394 V436 Q463 F542	R378-F438 PolarHBondContact NH1-O 3.4Å; I380-F438 HydrophobicContact CD1-CE2 4.38Å; I380-F438 HydrophobicContact CD1-CZ 3.6Å; I380-F438 HydrophobicContact CG1-CE1 4.41Å; I380-F438 HydrophobicContact CG1-CZ 3.91Å; I394-F438 HydrophobicContact CG2-CE2 3.64Å; I394-F438 HydrophobicContact CG2-CZ 4.4Å; V436-F438 HydrophobicContact CG1-CE1 4.29Å; V436-F438 HydrophobicContact CG1-CZ 4.05Å; F438-Q463 HydrophobicContact CD1-CB 4.12Å; F438-Q463 HydrophobicContact CE1-CB 4.23Å; F438-F542 WeakPolarHBondContact O-CE2 3.39Å
439	E	87.4	Confident	83.6	Confident	147 Å²	147	43.4 Å²	43.4	69%	0.687	24%	0.235	S	C	*	.	S	Bend	trans	-128.6	161.8	-177.1	-62.2	-171.5	165.8	0	0	109.7	F462	E439-F462 WeakPolarHBondContact O-CE1 3.26Å
440	E	89.9	Confident	85.1	Confident	114 Å²	114	49.1 Å²	49.1	53%	0.533	26%	0.259	S	S	.	.			trans	-64.9	153.8	172.9	-56.5	-172.7	148.5	0	0	110.5	V540 S541 F542	E440-V540 WeakPolarHBondContact CA-O 3.45Å; E440-V540 WeakPolarHBondContact CB-O 3.49Å; E440-S541 WeakPolarHBondContact OE1-CA 3.29Å; E440-F542 HydrophobicContact CG-CB 4.29Å; E440-F542 HydrophobicContact CG-CD1 4.42Å; E440-F542 HydrophobicContact CG-CD2 4.13Å; E440-F542 HydrophobicContact CG-CG 4.04Å; E440-F542 PolarHBondContact OE1-N 2.99Å
441	G	88.4	Confident	86.5	Confident	26 Å²	26	52.3 Å²	52.3	27%	0.268	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	179.3	-176.7	0	0	0	0	0	114.9	T539 V540	G441-T539 WeakPolarHBondContact O-CA 3.37Å; G441-V540 PolarHBondContact N-O 3.38Å; G441-V540 VanDerWaalsContact N-O 3.09Å; G441-V540 PolarHBondContact O-N 3.25Å
442	L	88.4	Confident	87.2	Confident	46 Å²	46	50.8 Å²	50.8	24%	0.241	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135.1	173.8	-178.3	71.8	0	0	0	108.4	P427 Q537 A538 T539	P427-L442 WeakPolarHBondContact CD-O 3.18Å; P427-L442 WeakPolarHBondContact CG-O 3.37Å; L442-Q537 HydrophobicContact CD1-CG 3.46Å; L442-Q537 VanDerWaalsContact CD1-CG 3.46Å; L442-Q537 HydrophobicContact CD2-CG 4.24Å; L442-Q537 HydrophobicContact CG-CG 4.09Å; L442-A538 CarbonylContact C-O 3.6Å; L442-A538 WeakPolarHBondContact CA-O 3.33Å; L442-A538 VanDerWaalsContact CD1-O 3.31Å; L442-A538 WeakPolarHBondContact CD1-O 3.39Å; L442-T539 HydrophobicContact CD1-CG2 3.84Å
443	I	90.1	Very high	88	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	152.3	168	60.2	171.4	0	0	0	109.5	W460 F462 L472 I523 F536 Q537 A538 V540	I443-W460 HydrophobicContact CB-CD2 4.49Å; I443-W460 HydrophobicContact CB-CZ2 4.47Å; I443-W460 HydrophobicContact CD1-CD2 4.4Å; I443-W460 HydrophobicContact CD1-CE3 4.37Å; I443-W460 HydrophobicContact CG2-CD2 4.34Å; I443-W460 HydrophobicContact CG2-CG 4.05Å; I443-F462 HydrophobicContact CG2-CE2 3.82Å; I443-F462 HydrophobicContact CG2-CZ 3.74Å; I443-L472 HydrophobicContact CD1-CD1 4.17Å; I443-I523 HydrophobicContact CD1-CB 4.43Å; I443-I523 HydrophobicContact CD1-CD1 3.63Å; I443-I523 HydrophobicContact CD1-CG2 3.96Å; I443-F536 HydrophobicContact CD1-CE2 4.16Å; I443-F536 HydrophobicContact CG1-CE2 4.2Å; I443-Q537 WeakPolarHBondContact O-CA 3.37Å; I443-A538 HydrophobicContact CG1-CB 4.07Å; I443-A538 PolarHBondContact N-O 2.9Å; I443-A538 PolarHBondContact O-N 2.62Å; I443-V540 HydrophobicContact CD1-CG2 4.45Å
444	Q	90.3	Very high	88.5	Confident	26 Å²	26	49.5 Å²	49.5	12%	0.121	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	156.9	176.9	60.9	-177.7	31.6	0	0	111.1	I426 Y448 F536 Q537	I426-Q444 HydrophobicContact CG2-CG 3.65Å; Q444-Y448 HydrophobicContact CB-CD1 4.45Å; Q444-Y448 HydrophobicContact CB-CG 4.3Å; Q444-F536 CarbonylContact C-O 3.47Å; Q444-F536 WeakPolarHBondContact CA-O 3.31Å; Q444-F536 VanDerWaalsContact CB-O 3.25Å; Q444-F536 WeakPolarHBondContact CB-O 3.31Å; Q444-Q537 HydrophobicContact CB-CB 4.34Å; Q444-Q537 HydrophobicContact CB-CG 4.39Å
445	S	90.4	Very high	88.7	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.007	28%	0.28	C	S	.	.			trans	-61.7	152.1	171.2	53	0	0	0	0	111.3	N447 Y448 G535 F536	S445-N447 PolarHBondContact O-N 3.27Å; S445-Y448 WeakPolarHBondContact O-CB 3.31Å; S445-Y448 PolarHBondContact O-N 2.92Å; S445-G535 WeakPolarHBondContact OG-CA 3.41Å; S445-F536 PolarHBondContact N-O 2.81Å; S445-F536 PolarHBondContact OG-N 2.96Å
446	L	86.6	Confident	88.8	Confident	61 Å²	61	54.9 Å²	54.9	32%	0.319	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	140	174.2	-176.2	64.1	0	0	0	110.1	S429 Y448	S429-L446 VanDerWaalsContact OG-CD1 3.29Å; S429-L446 WeakPolarHBondContact OG-CD1 3.44Å; L446-Y448 PolarHBondContact O-N 3.12Å
447	N	86.3	Confident	88.9	Confident	83 Å²	83	59.3 Å²	59.3	44%	0.444	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	-2.4	-176.8	-47.1	-41	0	0	0	117	S445 E450 N451 S453	S445-N447 PolarHBondContact O-N 3.27Å; N447-E450 HydrophobicContact CB-CB 4.18Å; N447-E450 WeakPolarHBondContact O-CA 3.31Å; N447-E450 VanDerWaalsContact O-CB 3.29Å; N447-E450 WeakPolarHBondContact O-CB 3.38Å; N447-E450 PolarHBondContact O-N 3.35Å; N447-N451 PolarHBondContact ND2-O 3.28Å; N447-S453 PolarHBondContact ND2-OG 2.75Å
448	Y	87.3	Confident	89	Confident	53 Å²	53	58.6 Å²	58.6	21%	0.208	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	130	179.5	-174.7	-89.5	0	0	0	111.6	Q444 S445 L446 S476 R534 Q537	Q444-Y448 HydrophobicContact CB-CD1 4.45Å; Q444-Y448 HydrophobicContact CB-CG 4.3Å; S445-Y448 WeakPolarHBondContact O-CB 3.31Å; S445-Y448 PolarHBondContact O-N 2.92Å; L446-Y448 PolarHBondContact O-N 3.12Å; Y448-S476 WeakPolarHBondContact CE2-OG 3.39Å; Y448-S476 PolarHBondContact OH-OG 3.13Å; Y448-R534 WeakPolarHBondContact CD2-O 3.31Å; Y448-Q537 HydrophobicContact CD1-CB 4.28Å; Y448-Q537 HydrophobicContact CE1-CB 3.82Å; Y448-Q537 HydrophobicContact CE1-CG 4.38Å; Y448-Q537 HydrophobicContact CE2-CB 4.3Å
449	P	90.2	Very high	89.2	Confident	79 Å²	79	58.9 Å²	58.9	51%	0.513	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90	3.4	14.9	37.2	-38	0	0	0	116.2
450	E	90.4	Very high	89.3	Confident	138 Å²	138	51.9 Å²	51.9	65%	0.645	27%	0.274	S	S	*	.	S	Bend	trans	-73	168.5	171.8	-57.4	-60.9	146.4	0	0	110.8	N447 Y452	N447-E450 HydrophobicContact CB-CB 4.18Å; N447-E450 WeakPolarHBondContact O-CA 3.31Å; N447-E450 VanDerWaalsContact O-CB 3.29Å; N447-E450 WeakPolarHBondContact O-CB 3.38Å; N447-E450 PolarHBondContact O-N 3.35Å; E450-Y452 PolarHBondContact O-N 3.38Å
451	N	92.6	Very high	89.4	Confident	71 Å²	71	46.8 Å²	46.8	38%	0.38	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-59.9	140.1	-179.2	-73.2	12.5	0	0	0	112.4	N447 T532 C533	N447-N451 PolarHBondContact ND2-O 3.28Å; N451-T532 PolarHBondContact ND2-O 2.78Å; N451-T532 VanDerWaalsContact ND2-O 3.07Å; N451-T532 PolarHBondContact ND2-OG1 3.29Å; N451-C533 CarbonylContact C-O 3.53Å; N451-C533 WeakPolarHBondContact CA-O 3.32Å; N451-C533 WeakPolarHBondContact CB-O 3.15Å
452	Y	91.2	Very high	89.5	Confident	4 Å²	4	45.5 Å²	45.5	2%	0.016	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-65.9	159.8	172	57.3	-99.8	0	0	0	111.1	E450 E480 D488 F525 G531 T532 C533 G535	E450-Y452 PolarHBondContact O-N 3.38Å; Y452-E480 PolarHBondContact OH-N 3.24Å; Y452-E480 VanDerWaalsContact OH-N 3.17Å; Y452-D488 WeakPolarHBondContact CE2-OD2 3.01Å; Y452-D488 PolarHBondContact OH-OD2 3.29Å; Y452-F525 HydrophobicContact CD1-CE1 4.38Å; Y452-F525 AromaticContact CD1-CZ 3.79Å; Y452-F525 HydrophobicContact CD1-CZ 3.79Å; Y452-F525 HydrophobicContact CD2-CE1 4.15Å; Y452-F525 AromaticContact CD2-CZ 3.73Å; Y452-F525 HydrophobicContact CD2-CZ 3.73Å; Y452-F525 HydrophobicContact CE1-CZ 4.02Å; Y452-F525 AromaticContact CE2-CZ 3.98Å; Y452-F525 HydrophobicContact CE2-CZ 3.98Å; Y452-F525 AromaticContact CG-CE1 3.93Å; Y452-F525 HydrophobicContact CG-CE1 3.93Å; Y452-F525 AromaticContact CG-CZ 3.64Å; Y452-F525 HydrophobicContact CG-CZ 3.64Å; Y452-G531 PolarHBondContact OH-O 3.06Å; Y452-T532 HydrophobicContact CD2-CG2 3.98Å; Y452-T532 HydrophobicContact CE2-CG2 3.92Å; Y452-T532 WeakPolarHBondContact O-CB 3.48Å; Y452-T532 WeakPolarHBondContact O-CG2 3.39Å; Y452-C533 WeakPolarHBondContact CD1-O 3.09Å; Y452-C533 HydrophobicContact CE1-CB 3.82Å; Y452-C533 VanDerWaalsContact CE1-N 3.28Å; Y452-C533 VanDerWaalsContact CE1-O 3.23Å; Y452-C533 WeakPolarHBondContact CE1-O 3.29Å; Y452-C533 VanDerWaalsContact CZ-N 3.32Å; Y452-C533 PolarHBondContact N-O 2.79Å; Y452-C533 PolarHBondContact OH-N 2.92Å; Y452-G535 VanDerWaalsContact CD1-CA 3.48Å
453	S	89.3	Confident	89.6	Confident	47 Å²	47	43.8 Å²	43.8	33%	0.329	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-77.7	147.7	177.3	-55.5	0	0	0	0	111.7	N447 A456 S527	N447-S453 PolarHBondContact ND2-OG 2.75Å; S453-A456 WeakPolarHBondContact O-CB 3.36Å; S453-S527 PolarHBondContact O-OG 3.44Å
454	D	89.4	Confident	89.6	Confident	81 Å²	81	44 Å²	44	43%	0.433	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	151.2	165	-56.7	-53.8	0	0	0	110.5	A456 D528 T532	D454-A456 PolarHBondContact O-N 2.72Å; D454-D528 CarbonylContact C-O 3.59Å; D454-T532 WeakPolarHBondContact OD1-CG2 3.46Å
455	K	87.9	Confident	89.4	Confident	131 Å²	131	44.6 Å²	44.6	57%	0.57	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	30.1	179	-56.3	176.2	176.5	-178.7	0	113.7	S527 D528 E529	K455-S527 VanDerWaalsContact CA-O 3.29Å; K455-S527 WeakPolarHBondContact CA-O 3.39Å; K455-S527 PolarHBondContact N-OG 3.01Å; K455-D528 PolarHBondContact N-O 3Å; K455-E529 WeakPolarHBondContact CE-OE1 3.44Å; K455-E529 HydrophobicContact CG-CG 4.43Å; K455-E529 VanDerWaalsContact NZ-CD 3.31Å; K455-E529 IonicContact NZ-OE1 2.75Å; K455-E529 PolarHBondContact NZ-OE1 2.96Å; K455-E529 IonicContact NZ-OE2 3.35Å
456	A	88.1	Confident	88.9	Confident	11 Å²	11	52.6 Å²	52.6	9%	0.091	27%	0.271	C	S	.	.			trans	-65	138.4	172.6	0	0	0	0	0	109	S453 D454 F525 Q526 S527	S453-A456 WeakPolarHBondContact O-CB 3.36Å; D454-A456 PolarHBondContact O-N 2.72Å; A456-F525 HydrophobicContact CB-CD1 4.19Å; A456-F525 HydrophobicContact CB-CE1 3.91Å; A456-Q526 VanDerWaalsContact O-CA 3.29Å; A456-Q526 WeakPolarHBondContact O-CA 3.39Å; A456-S527 VanDerWaalsContact CB-OG 3.31Å; A456-S527 WeakPolarHBondContact CB-OG 3.36Å; A456-S527 PolarHBondContact N-OG 2.85Å; A456-S527 PolarHBondContact O-N 3.36Å
457	N	88.8	Confident	88.8	Confident	92 Å²	92	56.5 Å²	56.5	49%	0.492	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	100.9	173.8	179.9	16.8	0	0	0	108.1	C431 F525	C431-N457 WeakPolarHBondContact CA-O 3.2Å; N457-F525 WeakPolarHBondContact CA-O 3.31Å
458	C	89.4	Confident	88.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	126.8	-164.1	-38.1	0	0	0	0	110.8	S429 G430 C431 W460 S524 F525	S429-C458 WeakPolarHBondContact O-CB 3.43Å; G430-C458 VanDerWaalsContact C-CA 3.44Å; G430-C458 VanDerWaalsContact O-CA 3.28Å; G430-C458 WeakPolarHBondContact O-CA 3.39Å; C431-C458 HydrophobicContact CB-CB 3.95Å; C431-C458 WeakPolarHBondContact CB-SG 3.07Å; C431-C458 WeakPolarHBondContact SG-CB 3.4Å; C431-C458 CovalentContact SG-SG 2.03Å; C431-C458 PolarHBondContact SG-SG 2.64Å; C458-W460 HydrophobicContact CB-CH2 3.71Å; C458-W460 HydrophobicContact CB-CZ2 4.38Å; C458-W460 HydrophobicContact CB-CZ3 3.87Å; C458-S524 CarbonylContact O-C 3.56Å; C458-S524 VanDerWaalsContact O-CA 3.23Å; C458-S524 WeakPolarHBondContact O-CA 3.33Å; C458-F525 HydrophobicContact CB-CB 4.23Å; C458-F525 PolarHBondContact N-O 2.7Å; C458-F525 PolarHBondContact O-N 2.92Å
459	D	89.6	Confident	89.1	Confident	26 Å²	26	52.9 Å²	52.9	14%	0.139	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	128.7	-175.7	-72.5	-34.2	0	0	0	112.3	G430 L434 T435 R498 L522 S524	G430-D459 PolarHBondContact O-N 3.26Å; L434-D459 HydrophobicContact CD1-CB 3.53Å; T435-D459 PolarHBondContact N-O 3.25Å; D459-R498 IonicContact OD1-CZ 3.46Å; D459-R498 IonicContact OD1-NH2 2.78Å; D459-R498 PolarHBondContact OD1-NH2 3.31Å; D459-R498 IonicContact OD2-NH2 3.98Å; D459-R498 PolarHBondContact OD2-NH2 3.08Å; D459-L522 HydrophobicContact CB-CD1 4.32Å; D459-S524 WeakPolarHBondContact OD1-CB 3.48Å; D459-S524 PolarHBondContact OD1-OG 2.88Å
460	W	91.4	Very high	89.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.2	171.3	-55.9	-91.8	0	0	0	110.6	D428 S429 T435 I443 C458 F462 L522 I523 F525 F536	D428-W460 PolarHBondContact O-NE1 2.88Å; S429-W460 VanDerWaalsContact O-CH2 3.27Å; S429-W460 WeakPolarHBondContact O-CH2 3.47Å; S429-W460 WeakPolarHBondContact O-CZ2 3.25Å; T435-W460 CarbonylContact O-C 3.57Å; T435-W460 WeakPolarHBondContact O-CA 3.45Å; I443-W460 HydrophobicContact CB-CD2 4.49Å; I443-W460 HydrophobicContact CB-CZ2 4.47Å; I443-W460 HydrophobicContact CD1-CD2 4.4Å; I443-W460 HydrophobicContact CD1-CE3 4.37Å; I443-W460 HydrophobicContact CG2-CD2 4.34Å; I443-W460 HydrophobicContact CG2-CG 4.05Å; C458-W460 HydrophobicContact CB-CH2 3.71Å; C458-W460 HydrophobicContact CB-CZ2 4.38Å; C458-W460 HydrophobicContact CB-CZ3 3.87Å; W460-F462 HydrophobicContact CB-CD2 4.36Å; W460-F462 HydrophobicContact CB-CE2 3.99Å; W460-L522 WeakPolarHBondContact O-CA 3.41Å; W460-I523 HydrophobicContact CE3-CB 4.36Å; W460-I523 HydrophobicContact CE3-CG2 4.21Å; W460-I523 PolarHBondContact N-O 2.85Å; W460-I523 PolarHBondContact O-N 2.84Å; W460-F525 HydrophobicContact CH2-CB 4.4Å; W460-F525 HydrophobicContact CZ3-CB 4.03Å; W460-F536 HydrophobicContact CH2-CE2 4.44Å; W460-F536 AromaticContact CH2-CZ 3.68Å; W460-F536 HydrophobicContact CH2-CZ 3.68Å; W460-F536 AromaticContact CZ3-CZ 3.85Å; W460-F536 HydrophobicContact CZ3-CZ 3.85Å
461	I	90.7	Very high	89.6	Confident	6 Å²	6	45.7 Å²	45.7	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115.2	173	-61.5	165.4	0	0	0	107.8	L434 T435 V436 L437 V496 M521 L522 L563	L434-I461 HydrophobicContact CD1-CD1 3.75Å; L434-I461 HydrophobicContact CD1-CG1 4.3Å; L434-I461 HydrophobicContact CD2-CD1 4.18Å; L434-I461 HydrophobicContact CG-CD1 4.07Å; T435-I461 PolarHBondContact O-N 3Å; V436-I461 CarbonylContact C-O 3.57Å; V436-I461 WeakPolarHBondContact CA-O 3.37Å; V436-I461 HydrophobicContact CG1-CG2 4.42Å; V436-I461 HydrophobicContact CG2-CB 4.3Å; V436-I461 HydrophobicContact CG2-CD1 4.18Å; L437-I461 PolarHBondContact N-O 3.11Å; I461-V496 HydrophobicContact CD1-CG1 3.49Å; I461-V496 VanDerWaalsContact CD1-CG1 3.49Å; I461-V496 HydrophobicContact CG1-CG1 4.14Å; I461-V496 HydrophobicContact CG2-CG2 4.43Å; I461-M521 WeakPolarHBondContact CA-O 3.02Å; I461-L522 HydrophobicContact CG1-CD1 3.75Å; I461-L563 HydrophobicContact CD1-CD1 4.12Å; I461-L563 HydrophobicContact CD1-CD2 4.37Å
462	F	91.6	Very high	89.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	134	169.4	-75	-96.1	0	0	0	110	L437 E439 I443 W460 I470 I520 M521 I523 V540 F542	L437-F462 HydrophobicContact CB-CD1 3.81Å; L437-F462 HydrophobicContact CB-CE1 3.79Å; L437-F462 HydrophobicContact CB-CG 4.37Å; L437-F462 HydrophobicContact CB-CZ 4.33Å; L437-F462 HydrophobicContact CD1-CD1 4.33Å; L437-F462 HydrophobicContact CD1-CE1 3.59Å; L437-F462 HydrophobicContact CD1-CE2 3.85Å; L437-F462 HydrophobicContact CD1-CZ 3.31Å; L437-F462 HydrophobicContact CG-CE1 4.33Å; L437-F462 HydrophobicContact CG-CZ 4.43Å; L437-F462 WeakPolarHBondContact O-CA 3.29Å; E439-F462 WeakPolarHBondContact O-CE1 3.26Å; I443-F462 HydrophobicContact CG2-CE2 3.82Å; I443-F462 HydrophobicContact CG2-CZ 3.74Å; W460-F462 HydrophobicContact CB-CD2 4.36Å; W460-F462 HydrophobicContact CB-CE2 3.99Å; F462-I470 HydrophobicContact CB-CD1 3.85Å; F462-I470 HydrophobicContact CB-CG2 4.27Å; F462-I470 WeakPolarHBondContact O-CD1 3.28Å; F462-I520 WeakPolarHBondContact O-CA 3.21Å; F462-M521 PolarHBondContact N-O 2.87Å; F462-M521 PolarHBondContact O-N 3.19Å; F462-I523 HydrophobicContact CD2-CD1 4.14Å; F462-I523 HydrophobicContact CE2-CD1 4.21Å; F462-V540 HydrophobicContact CB-CG1 4.18Å; F462-V540 HydrophobicContact CD1-CB 4.03Å; F462-V540 HydrophobicContact CD1-CG1 3.61Å; F462-V540 HydrophobicContact CD2-CB 4.36Å; F462-V540 HydrophobicContact CD2-CG1 4Å; F462-V540 HydrophobicContact CD2-CG2 4.04Å; F462-V540 HydrophobicContact CE1-CB 3.75Å; F462-V540 HydrophobicContact CE1-CG1 3.89Å; F462-V540 HydrophobicContact CE1-CG2 4.15Å; F462-V540 HydrophobicContact CE2-CB 4.11Å; F462-V540 HydrophobicContact CE2-CG1 4.25Å; F462-V540 HydrophobicContact CE2-CG2 3.59Å; F462-V540 HydrophobicContact CG-CB 4.32Å; F462-V540 HydrophobicContact CG-CG1 3.66Å; F462-V540 HydrophobicContact CG-CG2 4.49Å; F462-V540 HydrophobicContact CZ-CB 3.77Å; F462-V540 HydrophobicContact CZ-CG1 4.19Å; F462-V540 HydrophobicContact CZ-CG2 3.64Å; F462-F542 HydrophobicContact CB-CE1 4.36Å; F462-F542 HydrophobicContact CD1-CE1 4.32Å; F462-F542 HydrophobicContact CD1-CZ 4.43Å
463	Q	90.2	Very high	90	Very high	10 Å²	10	43.1 Å²	43.1	5%	0.047	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	103.4	178.7	-170	170.2	22.8	0	0	111.4	R378 P379 L437 F438 I520	R378-Q463 PolarHBondContact NH1-O 2.82Å; P379-Q463 PolarHBondContact O-NE2 2.85Å; P379-Q463 PolarHBondContact O-OE1 3.05Å; P379-Q463 VanDerWaalsContact O-OE1 3.13Å; L437-Q463 PolarHBondContact O-N 3.34Å; F438-Q463 HydrophobicContact CD1-CB 4.12Å; F438-Q463 HydrophobicContact CE1-CB 4.23Å; Q463-I520 HydrophobicContact CG-CG1 4.19Å
464	A	88.9	Confident	90.4	Very high	3 Å²	3	41.7 Å²	41.7	3%	0.025	20%	0.204	C	C	.	.			trans	-82.1	168	176.9	0	0	0	0	0	111.6	H468 I470 S519 F542	A464-H468 HydrophobicContact CB-CB 3.86Å; A464-I470 HydrophobicContact CB-CD1 4.09Å; A464-I470 HydrophobicContact CB-CG1 3.77Å; A464-S519 PolarHBondContact N-O 3.25Å; A464-F542 HydrophobicContact CB-CB 4.37Å; A464-F542 HydrophobicContact CB-CD1 3.73Å; A464-F542 HydrophobicContact CB-CD2 3.79Å; A464-F542 HydrophobicContact CB-CE1 3.91Å; A464-F542 HydrophobicContact CB-CE2 3.95Å; A464-F542 HydrophobicContact CB-CG 3.69Å; A464-F542 HydrophobicContact CB-CZ 4.01Å
465	S	86.2	Confident	90.6	Very high	39 Å²	39	43 Å²	43	27%	0.273	21%	0.208	S	C	.	.			trans	-66.5	158.6	171.3	66.2	0	0	0	0	111.2	H467 H468	S465-H467 PolarHBondContact O-N 3.48Å; S465-H468 PolarHBondContact O-N 3.1Å; S465-H468 PolarHBondContact OG-ND1 2.99Å
466	K	80.4	Confident	91	Very high	170 Å²	170	37.5 Å²	37.5	74%	0.739	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-19.4	-174.9	-67.2	-176.6	178	-177	0	114.6	K545	K466-K545 WeakPolarHBondContact O-CE 3.43Å; K466-K545 PolarHBondContact O-NZ 3.14Å
467	H	83.7	Confident	91.3	Very high	142 Å²	142	37.1 Å²	37.1	66%	0.657	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	5.3	-179.4	-56.7	-61.4	0	0	0	114.3	S465 K545	S465-H467 PolarHBondContact O-N 3.48Å; H467-K545 WeakPolarHBondContact O-CB 3.28Å; H467-K545 PolarHBondContact O-N 3.26Å
468	H	89.5	Confident	91.6	Very high	55 Å²	55	34.5 Å²	34.5	26%	0.255	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	151.4	179	-67.8	76.8	0	0	0	111.4	A464 S465 S519 F542 I543 K545	A464-H468 HydrophobicContact CB-CB 3.86Å; S465-H468 PolarHBondContact O-N 3.1Å; S465-H468 PolarHBondContact OG-ND1 2.99Å; H468-S519 WeakPolarHBondContact O-CB 3.09Å; H468-F542 HydrophobicContact CB-CB 4.09Å; H468-I543 CarbonylContact C-O 3.6Å; H468-I543 VanDerWaalsContact CA-O 3.24Å; H468-I543 WeakPolarHBondContact CA-O 3.31Å; H468-K545 WeakPolarHBondContact O-CE 3.19Å
469	L	91.6	Very high	91.9	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	158.7	166.2	-60.4	178.4	0	0	0	108.5	L515 F542 I543 K545 Y548	L469-L515 HydrophobicContact CB-CD1 4.14Å; L469-L515 HydrophobicContact CD1-CD2 4.32Å; L469-F542 CarbonylContact O-C 3.46Å; L469-F542 WeakPolarHBondContact O-CA 3.34Å; L469-I543 PolarHBondContact N-O 3.36Å; L469-I543 PolarHBondContact O-N 3.03Å; L469-K545 HydrophobicContact CD1-CG 4.46Å; L469-K545 HydrophobicContact CD2-CD 4.3Å; L469-K545 HydrophobicContact CD2-CG 3.84Å; L469-K545 HydrophobicContact CG-CG 3.73Å; L469-Y548 HydrophobicContact CD1-CD2 4.42Å
470	I	94.8	Very high	92.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.8	-179.2	-55.5	-179.6	0	0	0	109.3	F462 A464 S516 S519 M521 V540 F542	F462-I470 HydrophobicContact CB-CD1 3.85Å; F462-I470 HydrophobicContact CB-CG2 4.27Å; F462-I470 WeakPolarHBondContact O-CD1 3.28Å; A464-I470 HydrophobicContact CB-CD1 4.09Å; A464-I470 HydrophobicContact CB-CG1 3.77Å; I470-S516 PolarHBondContact O-N 2.86Å; I470-S519 WeakPolarHBondContact CD1-O 3.47Å; I470-M521 HydrophobicContact CB-CB 4.03Å; I470-M521 HydrophobicContact CB-CE 4.04Å; I470-M521 HydrophobicContact CB-SD 4.49Å; I470-M521 HydrophobicContact CD1-CB 3.95Å; I470-M521 HydrophobicContact CG2-CB 3.83Å; I470-M521 HydrophobicContact CG2-CE 3.84Å; I470-M521 HydrophobicContact CG2-CG 4.43Å; I470-M521 HydrophobicContact CG2-SD 3.76Å; I470-M521 WeakPolarHBondContact O-CE 3.19Å; I470-V540 HydrophobicContact CG2-CG1 3.44Å; I470-V540 VanDerWaalsContact CG2-CG1 3.44Å; I470-F542 HydrophobicContact CD1-CE1 4.14Å; I470-F542 HydrophobicContact CG1-CD1 3.96Å; I470-F542 HydrophobicContact CG1-CE1 3.97Å; I470-F542 HydrophobicContact CG2-CD1 4.36Å; I470-F542 HydrophobicContact CG2-CE1 4.27Å
471	K	95.5	Very high	91.9	Very high	66 Å²	66	41.7 Å²	41.7	29%	0.287	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.9	177.1	-177.5	-174.8	176.6	-173.5	0	109.8	S473 P513 V514 L515 V540 S541 I543	K471-S473 WeakPolarHBondContact CE-OG 3.33Å; K471-P513 HydrophobicContact CD-CB 4.36Å; K471-P513 HydrophobicContact CG-CB 4.16Å; K471-V514 CarbonylContact C-O 3.51Å; K471-V514 WeakPolarHBondContact CA-O 3.05Å; K471-L515 HydrophobicContact CB-CD1 3.99Å; K471-V540 WeakPolarHBondContact O-CA 3.43Å; K471-S541 PolarHBondContact N-O 2.78Å; K471-S541 PolarHBondContact O-N 3.38Å; K471-I543 HydrophobicContact CB-CG1 3.99Å; K471-I543 HydrophobicContact CD-CG1 4.42Å
472	L	97	Very high	91.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	126	171.2	175.3	64.6	0	0	0	109.6	I443 F474 V492 P513 V514 M521 I523 A538 V540	I443-L472 HydrophobicContact CD1-CD1 4.17Å; L472-F474 HydrophobicContact CD1-CE2 4.49Å; L472-F474 HydrophobicContact CD2-CE2 3.53Å; L472-F474 HydrophobicContact CD2-CZ 3.78Å; L472-F474 HydrophobicContact CG-CD2 4.31Å; L472-F474 HydrophobicContact CG-CE2 3.78Å; L472-F474 HydrophobicContact CG-CZ 4.29Å; L472-V492 HydrophobicContact CD2-CG2 3.7Å; L472-P513 CarbonylContact O-C 3.53Å; L472-P513 VanDerWaalsContact O-CA 3.23Å; L472-P513 WeakPolarHBondContact O-CA 3.3Å; L472-V514 HydrophobicContact CB-CB 4.34Å; L472-V514 PolarHBondContact N-O 3.23Å; L472-V514 PolarHBondContact O-N 3.42Å; L472-M521 HydrophobicContact CB-CE 4.22Å; L472-M521 HydrophobicContact CB-SD 3.77Å; L472-I523 HydrophobicContact CD1-CD1 3.81Å; L472-I523 HydrophobicContact CD2-CD1 3.89Å; L472-I523 HydrophobicContact CD2-CG1 4.16Å; L472-I523 HydrophobicContact CD2-CG2 4.4Å; L472-I523 HydrophobicContact CG-CD1 4.32Å; L472-A538 HydrophobicContact CD1-CB 3.61Å; L472-V540 HydrophobicContact CD1-CG2 3.76Å
473	S	96.8	Very high	91.2	Very high	22 Å²	22	47 Å²	47	15%	0.154	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	116.2	179.1	-52	0	0	0	0	110.1	K471 A538 T539	K471-S473 WeakPolarHBondContact CE-OG 3.33Å; S473-A538 CarbonylContact O-C 3.58Å; S473-A538 VanDerWaalsContact O-CA 3.28Å; S473-A538 WeakPolarHBondContact O-CA 3.46Å; S473-A538 WeakPolarHBondContact O-CB 3.49Å; S473-T539 PolarHBondContact N-O 3.16Å; S473-T539 PolarHBondContact O-N 2.99Å; S473-T539 PolarHBondContact O-OG1 3.24Å
474	F	96.4	Very high	91	Very high	16 Å²	16	51.5 Å²	51.5	7%	0.07	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	134.2	176.9	-71.1	-94.5	0	0	0	110.4	L472 L477 V490 L505 V510 P511 F536 A538	L472-F474 HydrophobicContact CD1-CE2 4.49Å; L472-F474 HydrophobicContact CD2-CE2 3.53Å; L472-F474 HydrophobicContact CD2-CZ 3.78Å; L472-F474 HydrophobicContact CG-CD2 4.31Å; L472-F474 HydrophobicContact CG-CE2 3.78Å; L472-F474 HydrophobicContact CG-CZ 4.29Å; F474-L477 HydrophobicContact CD1-CB 4.3Å; F474-L477 HydrophobicContact CD1-CD1 3.85Å; F474-L477 HydrophobicContact CE1-CD1 3.71Å; F474-L477 HydrophobicContact CZ-CD1 4.45Å; F474-V490 HydrophobicContact CZ-CG1 4.05Å; F474-L505 HydrophobicContact CD2-CD1 4.31Å; F474-L505 HydrophobicContact CE2-CD1 3.42Å; F474-L505 VanDerWaalsContact CE2-CD1 3.42Å; F474-L505 HydrophobicContact CZ-CD1 3.73Å; F474-V510 HydrophobicContact CB-CG1 3.99Å; F474-V510 VanDerWaalsContact O-CG1 3.31Å; F474-V510 WeakPolarHBondContact O-CG1 3.46Å; F474-P511 HydrophobicContact CB-CG 4.39Å; F474-P511 HydrophobicContact CD2-CG 3.64Å; F474-P511 HydrophobicContact CE2-CG 4.17Å; F474-P511 HydrophobicContact CG-CG 4.12Å; F474-F536 HydrophobicContact CD1-CB 4.2Å; F474-F536 HydrophobicContact CD1-CD2 4.33Å; F474-F536 HydrophobicContact CE1-CB 4.19Å; F474-F536 AromaticContact CE1-CD2 3.85Å; F474-F536 HydrophobicContact CE1-CD2 3.85Å; F474-F536 HydrophobicContact CE1-CG 4.13Å; F474-A538 HydrophobicContact CD1-CB 3.75Å; F474-A538 HydrophobicContact CE1-CB 4.02Å; F474-A538 HydrophobicContact CG-CB 4.05Å
475	Q	94.8	Very high	91	Very high	108 Å²	108	52.5 Å²	52.5	51%	0.505	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-36.2	168.8	-65.2	174.4	-27.4	0	0	110.1	Q537	Q475-Q537 PolarHBondContact N-O 2.93Å
476	S	94.7	Very high	91.2	Very high	16 Å²	16	54 Å²	54	11%	0.112	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	145.7	172.2	58.9	0	0	0	0	110	Y448 F536 Q537	Y448-S476 WeakPolarHBondContact CE2-OG 3.39Å; Y448-S476 PolarHBondContact OH-OG 3.13Å; S476-F536 WeakPolarHBondContact O-CA 3.15Å; S476-F536 VanDerWaalsContact O-CB 3.32Å; S476-F536 WeakPolarHBondContact O-CB 3.17Å; S476-Q537 PolarHBondContact N-O 3.1Å; S476-Q537 PolarHBondContact O-N 3.35Å; S476-Q537 VanDerWaalsContact O-N 3.13Å; S476-Q537 PolarHBondContact OG-N 2.78Å
477	L	95.3	Very high	91.7	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	115	173.6	-176.3	81.4	0	0	0	108	F474 I479 L505 Y508 P511 F536	F474-L477 HydrophobicContact CD1-CB 4.3Å; F474-L477 HydrophobicContact CD1-CD1 3.85Å; F474-L477 HydrophobicContact CE1-CD1 3.71Å; F474-L477 HydrophobicContact CZ-CD1 4.45Å; L477-I479 HydrophobicContact CD1-CD1 3.57Å; L477-I479 HydrophobicContact CD1-CG1 4.07Å; L477-I479 HydrophobicContact CG-CD1 4.45Å; L477-L505 HydrophobicContact CD2-CB 4.32Å; L477-Y508 CarbonylContact O-C 3.58Å; L477-Y508 WeakPolarHBondContact O-CA 3.41Å; L477-P511 HydrophobicContact CD2-CG 4.26Å; L477-F536 HydrophobicContact CD1-CB 3.95Å
478	E	95.4	Very high	92.2	Very high	38 Å²	38	40.6 Å²	40.6	18%	0.178	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	88.4	176.3	-65.2	-179.8	-127.2	0	0	108.4	G507 Y508 C533 R534 G535	E478-G507 WeakPolarHBondContact CA-O 3.32Å; E478-Y508 HydrophobicContact CB-CD1 4.07Å; E478-Y508 HydrophobicContact CB-CE1 4.41Å; E478-Y508 HydrophobicContact CG-CD1 4.03Å; E478-C533 HydrophobicContact CB-CB 4.39Å; E478-C533 WeakPolarHBondContact O-CB 3.41Å; E478-R534 HydrophobicContact CB-CB 4.29Å; E478-R534 VanDerWaalsContact CD-CZ 3.41Å; E478-R534 VanDerWaalsContact CD-NE 3.29Å; E478-R534 IonicContact OE1-CZ 3.2Å; E478-R534 IonicContact OE1-NE 3.25Å; E478-R534 PolarHBondContact OE1-NE 3.23Å; E478-R534 VanDerWaalsContact OE1-NE 3.16Å; E478-R534 IonicContact OE1-NH1 2.71Å; E478-R534 IonicContact OE1-NH2 3.49Å; E478-R534 PolarHBondContact OE1-NH2 2.84Å; E478-R534 IonicContact OE2-CZ 3.38Å; E478-R534 IonicContact OE2-NE 3.49Å; E478-R534 PolarHBondContact OE2-NE 2.77Å; E478-R534 IonicContact OE2-NH2 3.71Å; E478-R534 PolarHBondContact OE2-NH2 3.29Å; E478-G535 WeakPolarHBondContact CA-O 3.45Å; E478-G535 PolarHBondContact N-O 3.05Å; E478-G535 WeakPolarHBondContact O-CA 3.21Å; E478-G535 PolarHBondContact O-N 3.05Å
479	I	94.9	Very high	92.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-122.9	146.1	-178	-62.8	179.9	0	0	0	107.5	L477 E481 D488 V490 C506 G507 F525 F536	L477-I479 HydrophobicContact CD1-CD1 3.57Å; L477-I479 HydrophobicContact CD1-CG1 4.07Å; L477-I479 HydrophobicContact CG-CD1 4.45Å; I479-E481 PolarHBondContact O-N 3.29Å; I479-D488 VanDerWaalsContact CG2-C 3.44Å; I479-D488 HydrophobicContact CG2-CB 3.37Å; I479-D488 WeakPolarHBondContact CG2-O 3.39Å; I479-V490 HydrophobicContact CD1-CB 4.41Å; I479-V490 HydrophobicContact CD1-CG2 3.52Å; I479-C506 HydrophobicContact CG2-CB 4.23Å; I479-G507 PolarHBondContact N-O 2.95Å; I479-G507 CarbonylContact O-C 3.52Å; I479-G507 WeakPolarHBondContact O-CA 2.82Å; I479-G507 PolarHBondContact O-N 3.32Å; I479-F525 HydrophobicContact CD1-CD2 4.06Å; I479-F525 HydrophobicContact CD1-CE2 3.79Å; I479-F525 HydrophobicContact CG1-CE2 4.19Å; I479-F525 HydrophobicContact CG2-CE2 4.27Å; I479-F536 HydrophobicContact CD1-CD1 4.12Å
480	E	93.8	Very high	92.7	Very high	43 Å²	43	39.5 Å²	39.5	20%	0.201	23%	0.228	C	C	.	.			trans	-48.4	126.8	177.4	-163.4	-159.8	-172	0	0	111.2	Y452 S487 D488	Y452-E480 PolarHBondContact OH-N 3.24Å; Y452-E480 VanDerWaalsContact OH-N 3.17Å; E480-S487 WeakPolarHBondContact OE2-CB 3.37Å; E480-D488 HydrophobicContact CB-CB 3.95Å
481	E	88.7	Confident	92.7	Very high	134 Å²	134	39.7 Å²	39.7	63%	0.626	23%	0.229	S	C	*	.			trans	-89.3	119.5	-178.9	-163.3	176.1	171.6	0	0	110.2	I479 Y508	I479-E481 PolarHBondContact O-N 3.29Å; E481-Y508 HydrophobicContact CB-CE2 4.37Å
482	S	87.2	Confident	92.8	Very high	20 Å²	20	36.5 Å²	36.5	14%	0.14	22%	0.216	C	C	.	.			trans	-120.3	151.7	168	49	0	0	0	0	108.9	D484 C485 T486 S487	S482-D484 PolarHBondContact O-N 2.74Å; S482-C485 PolarHBondContact O-N 3.41Å; S482-C485 VanDerWaalsContact OG-CA 3.23Å; S482-C485 WeakPolarHBondContact OG-CA 3.38Å; S482-C485 PolarHBondContact OG-N 2.83Å; S482-T486 PolarHBondContact OG-N 3.46Å; S482-S487 WeakPolarHBondContact CB-OG 3.44Å; S482-S487 PolarHBondContact OG-N 3.06Å
483	G	80.4	Confident	92.7	Very high	96 Å²	96	37 Å²	37	99%	0.99	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-25.2	-170.9	0	0	0	0	0	114.9
484	D	84.8	Confident	92.4	Very high	105 Å²	105	36.5 Å²	36.5	56%	0.561	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.7	13.5	177.8	55.9	-17.7	0	0	0	113.6	S482 T486	S482-D484 PolarHBondContact O-N 2.74Å; D484-T486 VanDerWaalsContact C-N 3.32Å; D484-T486 HydrophobicContact CB-CG2 4.16Å; D484-T486 PolarHBondContact O-N 3.21Å; D484-T486 PolarHBondContact OD1-OG1 2.05Å; D484-T486 VanDerWaalsContact OD1-OG1 3.04Å; D484-T486 WeakPolarHBondContact OD2-CG2 3.43Å
485	C	90.2	Very high	91.8	Very high	24 Å²	24	37.3 Å²	37.3	16%	0.162	22%	0.219	C	C	.	.	S	Bend	trans	49.9	49	-175.8	-62.6	0	0	0	0	112.7	S482 Y489 R504 C506	S482-C485 PolarHBondContact O-N 3.41Å; S482-C485 VanDerWaalsContact OG-CA 3.23Å; S482-C485 WeakPolarHBondContact OG-CA 3.38Å; S482-C485 PolarHBondContact OG-N 2.83Å; C485-Y489 WeakPolarHBondContact O-CB 3.44Å; C485-Y489 WeakPolarHBondContact O-CD1 3.44Å; C485-R504 HydrophobicContact CB-CG 4.02Å; C485-C506 WeakPolarHBondContact CA-SG 3.29Å; C485-C506 HydrophobicContact CB-CB 3.62Å; C485-C506 WeakPolarHBondContact CB-SG 3.27Å; C485-C506 WeakPolarHBondContact SG-CB 3.37Å; C485-C506 PolarHBondContact SG-N 2.92Å; C485-C506 VanDerWaalsContact SG-N 3.42Å; C485-C506 CovalentContact SG-SG 2.03Å; C485-C506 PolarHBondContact SG-SG 2.85Å
486	T	89.1	Confident	91.1	Very high	71 Å²	71	33.2 Å²	33.2	44%	0.436	20%	0.202	S	C	.	.			trans	-103.1	-18.1	178.7	57.3	0	0	0	0	114.4	S482 D484	S482-T486 PolarHBondContact OG-N 3.46Å; D484-T486 VanDerWaalsContact C-N 3.32Å; D484-T486 HydrophobicContact CB-CG2 4.16Å; D484-T486 PolarHBondContact O-N 3.21Å; D484-T486 PolarHBondContact OD1-OG1 2.05Å; D484-T486 VanDerWaalsContact OD1-OG1 3.04Å; D484-T486 WeakPolarHBondContact OD2-CG2 3.43Å
487	S	90.5	Very high	90.4	Very high	30 Å²	30	34.7 Å²	34.7	21%	0.21	21%	0.207	C	C	.	.	S	Bend	trans	-72.7	-80.9	174.9	-53.4	0	0	0	0	109.4	E480 S482	E480-S487 WeakPolarHBondContact OE2-CB 3.37Å; S482-S487 WeakPolarHBondContact CB-OG 3.44Å; S482-S487 PolarHBondContact OG-N 3.06Å
488	D	94.4	Very high	90	Very high	1 Å²	1	39 Å²	39	1%	0.005	22%	0.223	C	C	.	.	S	Bend	trans	-113.7	136.9	175.2	-61	-11.3	0	0	0	110.2	Y452 I479 E480 C506 Q526 S527 D528	Y452-D488 WeakPolarHBondContact CE2-OD2 3.01Å; Y452-D488 PolarHBondContact OH-OD2 3.29Å; I479-D488 VanDerWaalsContact CG2-C 3.44Å; I479-D488 HydrophobicContact CG2-CB 3.37Å; I479-D488 WeakPolarHBondContact CG2-O 3.39Å; E480-D488 HydrophobicContact CB-CB 3.95Å; D488-C506 VanDerWaalsContact O-CB 3.25Å; D488-C506 WeakPolarHBondContact O-CB 3.34Å; D488-Q526 WeakPolarHBondContact CA-O 3.48Å; D488-S527 WeakPolarHBondContact OD1-CA 3.41Å; D488-S527 VanDerWaalsContact OD1-CB 3.27Å; D488-S527 WeakPolarHBondContact OD1-CB 3.26Å; D488-D528 PolarHBondContact OD1-N 3.22Å
489	Y	95.4	Very high	89.6	Confident	37 Å²	37	44.6 Å²	44.6	15%	0.145	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	153.8	-176	55.3	-95.9	0	0	0	113.8	C485 T491 L505 F525 Q526	C485-Y489 WeakPolarHBondContact O-CB 3.44Å; C485-Y489 WeakPolarHBondContact O-CD1 3.44Å; Y489-T491 HydrophobicContact CD2-CG2 3.59Å; Y489-T491 HydrophobicContact CE2-CG2 3.81Å; Y489-L505 CarbonylContact C-O 3.52Å; Y489-L505 WeakPolarHBondContact CA-O 3.43Å; Y489-F525 WeakPolarHBondContact O-CA 3.28Å; Y489-F525 WeakPolarHBondContact O-CD2 3.06Å; Y489-Q526 HydrophobicContact CE1-CB 4.42Å; Y489-Q526 HydrophobicContact CE2-CB 3.98Å; Y489-Q526 HydrophobicContact CE2-CG 4.39Å; Y489-Q526 PolarHBondContact N-O 2.91Å; Y489-Q526 PolarHBondContact O-N 2.78Å; Y489-Q526 PolarHBondContact OH-NE2 2.03Å; Y489-Q526 PolarHBondContact OH-OE1 2.9Å
490	V	96	Very high	89.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.3	160.6	176	0	0	0	0	109	F474 I479 R504 L505 I523 S524 F525 F536	F474-V490 HydrophobicContact CZ-CG1 4.05Å; I479-V490 HydrophobicContact CD1-CB 4.41Å; I479-V490 HydrophobicContact CD1-CG2 3.52Å; V490-R504 CarbonylContact O-C 3.57Å; V490-R504 WeakPolarHBondContact O-CA 2.96Å; V490-L505 HydrophobicContact CB-CB 4.46Å; V490-L505 PolarHBondContact N-O 2.97Å; V490-L505 PolarHBondContact O-N 2.63Å; V490-I523 HydrophobicContact CG1-CG2 3.83Å; V490-S524 CarbonylContact C-O 3.6Å; V490-S524 VanDerWaalsContact CA-O 3.28Å; V490-S524 WeakPolarHBondContact CA-O 3.45Å; V490-F525 HydrophobicContact CG2-CB 4.14Å; V490-F525 HydrophobicContact CG2-CD2 3.73Å; V490-F525 HydrophobicContact CG2-CG 4.31Å; V490-F536 HydrophobicContact CG2-CD1 3.86Å; V490-F536 HydrophobicContact CG2-CE1 3.64Å; V490-F536 HydrophobicContact CG2-CZ 4.1Å
491	T	96.2	Very high	89.3	Confident	3 Å²	3	52 Å²	52	2%	0.018	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	144	169.8	50.6	0	0	0	0	110.8	Y489 A503 R504 I523 S524	Y489-T491 HydrophobicContact CD2-CG2 3.59Å; Y489-T491 HydrophobicContact CE2-CG2 3.81Å; T491-A503 CarbonylContact C-O 3.38Å; T491-A503 WeakPolarHBondContact CA-O 3.38Å; T491-R504 HydrophobicContact CG2-CB 4.12Å; T491-R504 HydrophobicContact CG2-CG 3.94Å; T491-I523 WeakPolarHBondContact O-CA 3.41Å; T491-S524 PolarHBondContact N-O 2.78Å; T491-S524 PolarHBondContact O-N 2.9Å
492	V	96.8	Very high	89.6	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.8	174.4	-169.4	0	0	0	0	108.1	L472 I502 A503 V514 M521 L522 I523	L472-V492 HydrophobicContact CD2-CG2 3.7Å; V492-I502 HydrophobicContact CB-CD1 4.44Å; V492-I502 HydrophobicContact CB-CG1 3.92Å; V492-I502 HydrophobicContact CG1-CD1 3.75Å; V492-I502 HydrophobicContact CG1-CG1 3.75Å; V492-I502 VanDerWaalsContact O-CG1 3.25Å; V492-I502 WeakPolarHBondContact O-CG1 3.05Å; V492-I502 PolarHBondContact O-N 3.06Å; V492-A503 HydrophobicContact CB-CB 4.12Å; V492-A503 HydrophobicContact CG2-CB 4.14Å; V492-A503 PolarHBondContact N-O 3.21Å; V492-A503 PolarHBondContact O-N 3.23Å; V492-V514 HydrophobicContact CB-CG1 4.25Å; V492-V514 HydrophobicContact CG1-CG1 4.05Å; V492-V514 HydrophobicContact CG2-CG1 4.42Å; V492-M521 HydrophobicContact CG1-CE 4.24Å; V492-M521 HydrophobicContact CG1-CG 3.59Å; V492-M521 HydrophobicContact CG1-SD 3.87Å; V492-L522 CarbonylContact C-O 3.53Å; V492-L522 WeakPolarHBondContact CA-O 3.47Å; V492-I523 HydrophobicContact CG1-CG1 4.44Å
493	H	94.7	Very high	90	Very high	11 Å²	11	47.8 Å²	47.8	5%	0.051	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	145.5	176.8	-59.2	80.3	0	0	0	110.1	D495 R498 K500 E501 L522	H493-D495 VanDerWaalsContact C-N 3.28Å; H493-D495 WeakPolarHBondContact CB-O 3.11Å; H493-R498 VanDerWaalsContact CD2-CA 3.44Å; H493-R498 WeakPolarHBondContact CD2-CA 3.3Å; H493-K500 WeakPolarHBondContact CA-O 3.18Å; H493-E501 VanDerWaalsContact CD2-CA 3.46Å; H493-E501 WeakPolarHBondContact CD2-CA 3.11Å; H493-E501 PolarHBondContact CD2-N 3.44Å; H493-E501 IonicContact NE2-OE2 3.51Å; H493-L522 HydrophobicContact CB-CB 4.27Å; H493-L522 PolarHBondContact N-O 3.44Å; H493-L522 PolarHBondContact O-N 2.93Å
494	S	90.1	Very high	90.7	Very high	11 Å²	11	48 Å²	48	8%	0.077	23%	0.232	C	C	.	.	S	Bend	trans	-86.6	0.1	177.4	63.1	0	0	0	0	114.1	K500 S518	S494-K500 PolarHBondContact N-O 2.81Å; S494-K500 VanDerWaalsContact OG-CD 3.29Å; S494-K500 WeakPolarHBondContact OG-CD 3.1Å; S494-K500 WeakPolarHBondContact OG-CG 3.5Å; S494-K500 PolarHBondContact OG-O 2.9Å; S494-S518 PolarHBondContact O-OG 2.97Å
495	D	83.8	Confident	91.2	Very high	33 Å²	33	44.2 Å²	44.2	18%	0.176	21%	0.212	C	C	.	.	S	Bend	trans	-139.9	162.2	178.1	67.5	100.3	0	0	0	109.6	H493 E497 R498 K499 K500	H493-D495 VanDerWaalsContact C-N 3.28Å; H493-D495 WeakPolarHBondContact CB-O 3.11Å; D495-E497 VanDerWaalsContact OD1-C 3.29Å; D495-E497 WeakPolarHBondContact OD1-CA 3.23Å; D495-E497 WeakPolarHBondContact OD1-CB 3.24Å; D495-E497 PolarHBondContact OD1-N 2.83Å; D495-R498 PolarHBondContact OD1-N 3.48Å; D495-K499 PolarHBondContact OD1-N 2.02Å; D495-K499 PolarHBondContact OD2-N 2.95Å; D495-K500 WeakPolarHBondContact OD2-CA 3.12Å; D495-K500 VanDerWaalsContact OD2-CB 3.28Å; D495-K500 WeakPolarHBondContact OD2-CB 3.42Å; D495-K500 PolarHBondContact OD2-N 3.02Å
496	V	81.8	Confident	91.4	Very high	22 Å²	22	44 Å²	44	13%	0.133	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-19.2	-177.2	-159.6	0	0	0	0	112.5	I461 R498 I520 L563	I461-V496 HydrophobicContact CD1-CG1 3.49Å; I461-V496 VanDerWaalsContact CD1-CG1 3.49Å; I461-V496 HydrophobicContact CG1-CG1 4.14Å; I461-V496 HydrophobicContact CG2-CG2 4.43Å; V496-R498 PolarHBondContact O-N 2.86Å; V496-I520 HydrophobicContact CG2-CG2 3.64Å; V496-L563 HydrophobicContact CB-CD2 4.49Å; V496-L563 HydrophobicContact CB-CG 4.5Å; V496-L563 HydrophobicContact CG1-CD1 4.38Å; V496-L563 HydrophobicContact CG1-CD2 3.34Å; V496-L563 HydrophobicContact CG1-CG 3.57Å
497	E	79.5	Confident	91.6	Very high	46 Å²	46	40.8 Å²	40.8	22%	0.215	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	2.4	-179.7	-61.3	174.4	-179.7	0	0	112.7	D495 K499	D495-E497 VanDerWaalsContact OD1-C 3.29Å; D495-E497 WeakPolarHBondContact OD1-CA 3.23Å; D495-E497 WeakPolarHBondContact OD1-CB 3.24Å; D495-E497 PolarHBondContact OD1-N 2.83Å; E497-K499 HydrophobicContact CB-CD 4.24Å; E497-K499 HydrophobicContact CB-CG 4.07Å; E497-K499 PolarHBondContact O-N 2.8Å; E497-K499 VanDerWaalsContact OE2-CD 3.25Å; E497-K499 WeakPolarHBondContact OE2-CD 3.3Å; E497-K499 WeakPolarHBondContact OE2-CE 3.3Å; E497-K499 IonicContact OE2-NZ 3.16Å; E497-K499 PolarHBondContact OE2-NZ 3.09Å
498	R	87.2	Confident	91.8	Very high	93 Å²	93	45.3 Å²	45.3	35%	0.351	20%	0.204	S	C	.	.	S	Bend	trans	58.5	24.9	-177.2	-55.8	173.7	-175.6	-110.7	1	113.5	D459 H493 D495 V496 L522 S524	D459-R498 IonicContact OD1-CZ 3.46Å; D459-R498 IonicContact OD1-NH2 2.78Å; D459-R498 PolarHBondContact OD1-NH2 3.31Å; D459-R498 IonicContact OD2-NH2 3.98Å; D459-R498 PolarHBondContact OD2-NH2 3.08Å; H493-R498 VanDerWaalsContact CD2-CA 3.44Å; H493-R498 WeakPolarHBondContact CD2-CA 3.3Å; D495-R498 PolarHBondContact OD1-N 3.48Å; V496-R498 PolarHBondContact O-N 2.86Å; R498-L522 HydrophobicContact CG-CD2 3.54Å; R498-S524 PolarHBondContact NH1-OG 2.69Å; R498-S524 PolarHBondContact NH2-OG 2.51Å
499	K	85.3	Confident	91.6	Very high	156 Å²	156	52.1 Å²	52.1	68%	0.678	24%	0.241	S	C	*	.			trans	-76.6	-31.1	-179.3	-73.1	179	176.8	164.7	0	112.8	D495 E497	D495-K499 PolarHBondContact OD1-N 2.02Å; D495-K499 PolarHBondContact OD2-N 2.95Å; E497-K499 HydrophobicContact CB-CD 4.24Å; E497-K499 HydrophobicContact CB-CG 4.07Å; E497-K499 PolarHBondContact O-N 2.8Å; E497-K499 VanDerWaalsContact OE2-CD 3.25Å; E497-K499 WeakPolarHBondContact OE2-CD 3.3Å; E497-K499 WeakPolarHBondContact OE2-CE 3.3Å; E497-K499 IonicContact OE2-NZ 3.16Å; E497-K499 PolarHBondContact OE2-NZ 3.09Å
500	K	89.8	Confident	91.5	Very high	117 Å²	117	54.1 Å²	54.1	51%	0.509	26%	0.257	S	S	.	.	S	Bend	trans	-125	85.1	-175.6	-172	171.7	171.8	-176	0	110.6	H493 S494 D495 I502	H493-K500 WeakPolarHBondContact CA-O 3.18Å; S494-K500 PolarHBondContact N-O 2.81Å; S494-K500 VanDerWaalsContact OG-CD 3.29Å; S494-K500 WeakPolarHBondContact OG-CD 3.1Å; S494-K500 WeakPolarHBondContact OG-CG 3.5Å; S494-K500 PolarHBondContact OG-O 2.9Å; D495-K500 WeakPolarHBondContact OD2-CA 3.12Å; D495-K500 VanDerWaalsContact OD2-CB 3.28Å; D495-K500 WeakPolarHBondContact OD2-CB 3.42Å; D495-K500 PolarHBondContact OD2-N 3.02Å; K500-I502 HydrophobicContact CG-CG2 4.46Å; K500-I502 PolarHBondContact O-N 3.24Å
501	E	94.1	Very high	91.4	Very high	81 Å²	81	55.5 Å²	55.5	38%	0.379	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	126	168.1	-165.7	-179.1	101.2	0	0	109.2	H493 R504	H493-E501 VanDerWaalsContact CD2-CA 3.46Å; H493-E501 WeakPolarHBondContact CD2-CA 3.11Å; H493-E501 PolarHBondContact CD2-N 3.44Å; H493-E501 IonicContact NE2-OE2 3.51Å; E501-R504 WeakPolarHBondContact OE1-CB 3.13Å; E501-R504 IonicContact OE1-CZ 2.75Å; E501-R504 IonicContact OE1-NE 3.69Å; E501-R504 PolarHBondContact OE1-NE 3.41Å; E501-R504 IonicContact OE1-NH2 2.91Å; E501-R504 IonicContact OE2-CZ 3.11Å; E501-R504 IonicContact OE2-NE 2.59Å; E501-R504 PolarHBondContact OE2-NE 3.05Å; E501-R504 IonicContact OE2-NH2 2.76Å; E501-R504 PolarHBondContact OE2-NH2 3.47Å
502	I	94.9	Very high	91.3	Very high	51 Å²	51	61.1 Å²	61.1	26%	0.262	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-19.3	177.8	60.5	171.9	0	0	0	112.6	V492 K500 V514	V492-I502 HydrophobicContact CB-CD1 4.44Å; V492-I502 HydrophobicContact CB-CG1 3.92Å; V492-I502 HydrophobicContact CG1-CD1 3.75Å; V492-I502 HydrophobicContact CG1-CG1 3.75Å; V492-I502 VanDerWaalsContact O-CG1 3.25Å; V492-I502 WeakPolarHBondContact O-CG1 3.05Å; V492-I502 PolarHBondContact O-N 3.06Å; K500-I502 HydrophobicContact CG-CG2 4.46Å; K500-I502 PolarHBondContact O-N 3.24Å; I502-V514 HydrophobicContact CD1-CG1 3.7Å; I502-V514 HydrophobicContact CG1-CG1 3.99Å
503	A	94.5	Very high	91.2	Very high	16 Å²	16	64.2 Å²	64.2	13%	0.132	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	146.7	171.7	0	0	0	0	0	111.2	T491 V492 L505 V514	T491-A503 CarbonylContact C-O 3.38Å; T491-A503 WeakPolarHBondContact CA-O 3.38Å; V492-A503 HydrophobicContact CB-CB 4.12Å; V492-A503 HydrophobicContact CG2-CB 4.14Å; V492-A503 PolarHBondContact N-O 3.21Å; V492-A503 PolarHBondContact O-N 3.23Å; A503-L505 HydrophobicContact CB-CD1 4.4Å; A503-L505 HydrophobicContact CB-CD2 4.35Å; A503-L505 HydrophobicContact CB-CG 4.23Å; A503-V514 HydrophobicContact CB-CG1 4.03Å; A503-V514 HydrophobicContact CB-CG2 3.88Å
504	R	95.5	Very high	91.3	Very high	100 Å²	100	64.5 Å²	64.5	38%	0.377	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	126.2	164.6	-179.7	176.6	-62.2	-156.5	-6.7	107.9	C485 V490 T491 E501	C485-R504 HydrophobicContact CB-CG 4.02Å; V490-R504 CarbonylContact O-C 3.57Å; V490-R504 WeakPolarHBondContact O-CA 2.96Å; T491-R504 HydrophobicContact CG2-CB 4.12Å; T491-R504 HydrophobicContact CG2-CG 3.94Å; E501-R504 WeakPolarHBondContact OE1-CB 3.13Å; E501-R504 IonicContact OE1-CZ 2.75Å; E501-R504 IonicContact OE1-NE 3.69Å; E501-R504 PolarHBondContact OE1-NE 3.41Å; E501-R504 IonicContact OE1-NH2 2.91Å; E501-R504 IonicContact OE2-CZ 3.11Å; E501-R504 IonicContact OE2-NE 2.59Å; E501-R504 PolarHBondContact OE2-NE 3.05Å; E501-R504 IonicContact OE2-NH2 2.76Å; E501-R504 PolarHBondContact OE2-NH2 3.47Å
505	L	95	Very high	91.5	Very high	25 Å²	25	66.7 Å²	66.7	13%	0.131	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	129.3	-163.9	-55	169.8	0	0	0	109.7	F474 L477 Y489 V490 A503 P511 V514	F474-L505 HydrophobicContact CD2-CD1 4.31Å; F474-L505 HydrophobicContact CE2-CD1 3.42Å; F474-L505 VanDerWaalsContact CE2-CD1 3.42Å; F474-L505 HydrophobicContact CZ-CD1 3.73Å; L477-L505 HydrophobicContact CD2-CB 4.32Å; Y489-L505 CarbonylContact C-O 3.52Å; Y489-L505 WeakPolarHBondContact CA-O 3.43Å; V490-L505 HydrophobicContact CB-CB 4.46Å; V490-L505 PolarHBondContact N-O 2.97Å; V490-L505 PolarHBondContact O-N 2.63Å; A503-L505 HydrophobicContact CB-CD1 4.4Å; A503-L505 HydrophobicContact CB-CD2 4.35Å; A503-L505 HydrophobicContact CB-CG 4.23Å; L505-P511 HydrophobicContact CD1-CG 3.95Å; L505-P511 HydrophobicContact CD2-CB 3.89Å; L505-P511 HydrophobicContact CD2-CG 4.09Å; L505-V514 HydrophobicContact CD1-CG2 4.37Å
506	C	94.6	Very high	91.8	Very high	21 Å²	21	65.1 Å²	65.1	14%	0.142	33%	0.325	C	S	.	.			trans	-148.3	176	169.5	73.4	0	0	0	0	109.4	I479 C485 D488	I479-C506 HydrophobicContact CG2-CB 4.23Å; C485-C506 WeakPolarHBondContact CA-SG 3.29Å; C485-C506 HydrophobicContact CB-CB 3.62Å; C485-C506 WeakPolarHBondContact CB-SG 3.27Å; C485-C506 WeakPolarHBondContact SG-CB 3.37Å; C485-C506 PolarHBondContact SG-N 2.92Å; C485-C506 VanDerWaalsContact SG-N 3.42Å; C485-C506 CovalentContact SG-SG 2.03Å; C485-C506 PolarHBondContact SG-SG 2.85Å; D488-C506 VanDerWaalsContact O-CB 3.25Å; D488-C506 WeakPolarHBondContact O-CB 3.34Å
507	G	93.8	Very high	92.1	Very high	2 Å²	2	65.5 Å²	65.5	2%	0.021	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	89.4	-160.2	-178.7	0	0	0	0	0	114	E478 I479	E478-G507 WeakPolarHBondContact CA-O 3.32Å; I479-G507 PolarHBondContact N-O 2.95Å; I479-G507 CarbonylContact O-C 3.52Å; I479-G507 WeakPolarHBondContact O-CA 2.82Å; I479-G507 PolarHBondContact O-N 3.32Å
508	Y	93.7	Very high	92.3	Very high	125 Å²	125	64.9 Å²	64.9	49%	0.49	33%	0.329	S	S	.	.	S	Bend	trans	-113.8	-7.7	-167.4	-55.8	-84.4	0	0	0	114.1	L477 E478 E481 C533	L477-Y508 CarbonylContact O-C 3.58Å; L477-Y508 WeakPolarHBondContact O-CA 3.41Å; E478-Y508 HydrophobicContact CB-CD1 4.07Å; E478-Y508 HydrophobicContact CB-CE1 4.41Å; E478-Y508 HydrophobicContact CG-CD1 4.03Å; E481-Y508 HydrophobicContact CB-CE2 4.37Å; Y508-C533 PolarHBondContact OH-SG 2.78Å; Y508-C533 VanDerWaalsContact OH-SG 3.35Å
509	D	90.9	Very high	92.3	Very high	144 Å²	144	61.5 Å²	61.5	77%	0.77	32%	0.319	S	S	*	.	S	Bend	trans	-87.7	127.6	-179.3	-74.7	-36.9	0	0	0	110.7	P511	D509-P511 VanDerWaalsContact O-CD 3.25Å; D509-P511 WeakPolarHBondContact O-CD 3.15Å
510	V	93.7	Very high	92.6	Very high	80 Å²	80	54.7 Å²	54.7	49%	0.485	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-67.3	116.6	175.9	178.3	0	0	0	0	109.3	F474	F474-V510 HydrophobicContact CB-CG1 3.99Å; F474-V510 VanDerWaalsContact O-CG1 3.31Å; F474-V510 WeakPolarHBondContact O-CG1 3.46Å
511	P	93.9	Very high	92.7	Very high	29 Å²	29	49.1 Å²	49.1	19%	0.188	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-76.3	162.7	-174.5	30.6	-35.1	0	0	0	111.7	F474 L477 L505 D509	F474-P511 HydrophobicContact CB-CG 4.39Å; F474-P511 HydrophobicContact CD2-CG 3.64Å; F474-P511 HydrophobicContact CE2-CG 4.17Å; F474-P511 HydrophobicContact CG-CG 4.12Å; L477-P511 HydrophobicContact CD2-CG 4.26Å; L505-P511 HydrophobicContact CD1-CG 3.95Å; L505-P511 HydrophobicContact CD2-CB 3.89Å; L505-P511 HydrophobicContact CD2-CG 4.09Å; D509-P511 VanDerWaalsContact O-CD 3.25Å; D509-P511 WeakPolarHBondContact O-CD 3.15Å
512	T	93.9	Very high	92.7	Very high	120 Å²	120	45.4 Å²	45.4	74%	0.736	25%	0.249	S	C	*	.	P	Polyproline II helix	trans	-60.6	145.5	169.5	53.3	0	0	0	0	110.7	V514	T512-V514 PolarHBondContact O-N 3.1Å
513	P	95.5	Very high	92.7	Very high	66 Å²	66	43 Å²	43	43%	0.429	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-54.6	133.2	-179.8	-27.4	34.9	0	0	0	113.2	K471 L472	K471-P513 HydrophobicContact CD-CB 4.36Å; K471-P513 HydrophobicContact CG-CB 4.16Å; L472-P513 CarbonylContact O-C 3.53Å; L472-P513 VanDerWaalsContact O-CA 3.23Å; L472-P513 WeakPolarHBondContact O-CA 3.3Å
514	V	95.8	Very high	92.6	Very high	16 Å²	16	42.2 Å²	42.2	10%	0.097	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	124.8	-179.6	-176.9	0	0	0	0	108.6	K471 L472 V492 I502 A503 L505 T512	K471-V514 CarbonylContact C-O 3.51Å; K471-V514 WeakPolarHBondContact CA-O 3.05Å; L472-V514 HydrophobicContact CB-CB 4.34Å; L472-V514 PolarHBondContact N-O 3.23Å; L472-V514 PolarHBondContact O-N 3.42Å; V492-V514 HydrophobicContact CB-CG1 4.25Å; V492-V514 HydrophobicContact CG1-CG1 4.05Å; V492-V514 HydrophobicContact CG2-CG1 4.42Å; I502-V514 HydrophobicContact CD1-CG1 3.7Å; I502-V514 HydrophobicContact CG1-CG1 3.99Å; A503-V514 HydrophobicContact CB-CG1 4.03Å; A503-V514 HydrophobicContact CB-CG2 3.88Å; L505-V514 HydrophobicContact CD1-CG2 4.37Å; T512-V514 PolarHBondContact O-N 3.1Å
515	L	93.7	Very high	92.6	Very high	57 Å²	57	37.5 Å²	37.5	30%	0.298	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	121.5	178.7	-172.8	70.9	0	0	0	109.5	L469 K471 Y548	L469-L515 HydrophobicContact CB-CD1 4.14Å; L469-L515 HydrophobicContact CD1-CD2 4.32Å; K471-L515 HydrophobicContact CB-CD1 3.99Å; L515-Y548 HydrophobicContact CD2-CE2 4.48Å
516	S	92.1	Very high	92.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.219	C	C	.	.			trans	-75.1	133.8	171.3	-177.5	0	0	0	0	110	I470 S518 I520	I470-S516 PolarHBondContact O-N 2.86Å; S516-S518 PolarHBondContact O-N 3Å; S516-S518 PolarHBondContact OG-N 3.48Å; S516-S518 PolarHBondContact OG-O 2.66Å; S516-S518 PolarHBondContact OG-OG 3.42Å; S516-I520 WeakPolarHBondContact CB-O 3.12Å; S516-I520 PolarHBondContact OG-O 3.19Å
517	P	86.3	Confident	92.5	Very high	30 Å²	30	38.8 Å²	38.8	20%	0.195	22%	0.217	C	C	.	.	S	Bend	trans	-72.7	-8.6	172.2	31.7	-36.1	0	0	0	112.9	I553	P517-I553 HydrophobicContact CB-CD1 4.06Å; P517-I553 HydrophobicContact CB-CG1 4.39Å; P517-I553 WeakPolarHBondContact O-CD1 3.38Å
518	S	84.8	Confident	92.3	Very high	34 Å²	34	41.3 Å²	41.3	24%	0.238	23%	0.23	C	C	.	.	S	Bend	trans	-113.1	174.1	179.1	78.3	0	0	0	0	111	S494 S516 I520	S494-S518 PolarHBondContact O-OG 2.97Å; S516-S518 PolarHBondContact O-N 3Å; S516-S518 PolarHBondContact OG-N 3.48Å; S516-S518 PolarHBondContact OG-O 2.66Å; S516-S518 PolarHBondContact OG-OG 3.42Å; S518-I520 PolarHBondContact O-N 3.28Å; S518-I520 PolarHBondContact OG-N 3.38Å; S518-I520 VanDerWaalsContact OG-N 3.14Å; S518-I520 PolarHBondContact OG-O 3.03Å
519	S	87.9	Confident	92.1	Very high	21 Å²	21	42.1 Å²	42.1	15%	0.147	24%	0.238	C	C	.	.	S	Bend	trans	-84.1	17.9	170.9	57	0	0	0	0	112.4	A464 H468 I470	A464-S519 PolarHBondContact N-O 3.25Å; H468-S519 WeakPolarHBondContact O-CB 3.09Å; I470-S519 WeakPolarHBondContact CD1-O 3.47Å
520	I	89.8	Confident	91.7	Very high	14 Å²	14	40.8 Å²	40.8	7%	0.072	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	143.8	179.6	-65.5	173.2	0	0	0	108.5	F462 Q463 V496 S516 S518 M561	F462-I520 WeakPolarHBondContact O-CA 3.21Å; Q463-I520 HydrophobicContact CG-CG1 4.19Å; V496-I520 HydrophobicContact CG2-CG2 3.64Å; S516-I520 WeakPolarHBondContact CB-O 3.12Å; S516-I520 PolarHBondContact OG-O 3.19Å; S518-I520 PolarHBondContact O-N 3.28Å; S518-I520 PolarHBondContact OG-N 3.38Å; S518-I520 VanDerWaalsContact OG-N 3.14Å; S518-I520 PolarHBondContact OG-O 3.03Å; I520-M561 HydrophobicContact CD1-CG 3.8Å; I520-M561 HydrophobicContact CD1-SD 4.17Å
521	M	93.6	Very high	91.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	120.5	173.4	-175.9	-178.7	-79.3	0	0	108.9	I461 F462 I470 L472 V492 I523	I461-M521 WeakPolarHBondContact CA-O 3.02Å; F462-M521 PolarHBondContact N-O 2.87Å; F462-M521 PolarHBondContact O-N 3.19Å; I470-M521 HydrophobicContact CB-CB 4.03Å; I470-M521 HydrophobicContact CB-CE 4.04Å; I470-M521 HydrophobicContact CB-SD 4.49Å; I470-M521 HydrophobicContact CD1-CB 3.95Å; I470-M521 HydrophobicContact CG2-CB 3.83Å; I470-M521 HydrophobicContact CG2-CE 3.84Å; I470-M521 HydrophobicContact CG2-CG 4.43Å; I470-M521 HydrophobicContact CG2-SD 3.76Å; I470-M521 WeakPolarHBondContact O-CE 3.19Å; L472-M521 HydrophobicContact CB-CE 4.22Å; L472-M521 HydrophobicContact CB-SD 3.77Å; V492-M521 HydrophobicContact CG1-CE 4.24Å; V492-M521 HydrophobicContact CG1-CG 3.59Å; V492-M521 HydrophobicContact CG1-SD 3.87Å; M521-I523 HydrophobicContact CG-CD1 4.39Å; M521-I523 HydrophobicContact CG-CG1 3.92Å; M521-I523 HydrophobicContact SD-CD1 3.95Å; M521-I523 HydrophobicContact SD-CG1 4Å
522	L	92.8	Very high	90.8	Very high	3 Å²	3	39 Å²	39	2%	0.016	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120	170.3	168.1	63.8	0	0	0	108.4	D459 W460 I461 V492 H493 R498	D459-L522 HydrophobicContact CB-CD1 4.32Å; W460-L522 WeakPolarHBondContact O-CA 3.41Å; I461-L522 HydrophobicContact CG1-CD1 3.75Å; V492-L522 CarbonylContact C-O 3.53Å; V492-L522 WeakPolarHBondContact CA-O 3.47Å; H493-L522 HydrophobicContact CB-CB 4.27Å; H493-L522 PolarHBondContact N-O 3.44Å; H493-L522 PolarHBondContact O-N 2.93Å; R498-L522 HydrophobicContact CG-CD2 3.54Å
523	I	94.5	Very high	90.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.4	176.3	-53.7	167.4	0	0	0	106.6	I443 W460 F462 L472 V490 T491 V492 M521 V540	I443-I523 HydrophobicContact CD1-CB 4.43Å; I443-I523 HydrophobicContact CD1-CD1 3.63Å; I443-I523 HydrophobicContact CD1-CG2 3.96Å; W460-I523 HydrophobicContact CE3-CB 4.36Å; W460-I523 HydrophobicContact CE3-CG2 4.21Å; W460-I523 PolarHBondContact N-O 2.85Å; W460-I523 PolarHBondContact O-N 2.84Å; F462-I523 HydrophobicContact CD2-CD1 4.14Å; F462-I523 HydrophobicContact CE2-CD1 4.21Å; L472-I523 HydrophobicContact CD1-CD1 3.81Å; L472-I523 HydrophobicContact CD2-CD1 3.89Å; L472-I523 HydrophobicContact CD2-CG1 4.16Å; L472-I523 HydrophobicContact CD2-CG2 4.4Å; L472-I523 HydrophobicContact CG-CD1 4.32Å; V490-I523 HydrophobicContact CG1-CG2 3.83Å; T491-I523 WeakPolarHBondContact O-CA 3.41Å; V492-I523 HydrophobicContact CG1-CG1 4.44Å; M521-I523 HydrophobicContact CG-CD1 4.39Å; M521-I523 HydrophobicContact CG-CG1 3.92Å; M521-I523 HydrophobicContact SD-CD1 3.95Å; M521-I523 HydrophobicContact SD-CG1 4Å; I523-V540 HydrophobicContact CD1-CG2 3.98Å
524	S	93.9	Very high	90.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.2	179.9	-59.7	0	0	0	0	110.5	C458 D459 V490 T491 R498	C458-S524 CarbonylContact O-C 3.56Å; C458-S524 VanDerWaalsContact O-CA 3.23Å; C458-S524 WeakPolarHBondContact O-CA 3.33Å; D459-S524 WeakPolarHBondContact OD1-CB 3.48Å; D459-S524 PolarHBondContact OD1-OG 2.88Å; V490-S524 CarbonylContact C-O 3.6Å; V490-S524 VanDerWaalsContact CA-O 3.28Å; V490-S524 WeakPolarHBondContact CA-O 3.45Å; T491-S524 PolarHBondContact N-O 2.78Å; T491-S524 PolarHBondContact O-N 2.9Å; R498-S524 PolarHBondContact NH1-OG 2.69Å; R498-S524 PolarHBondContact NH2-OG 2.51Å
525	F	94.6	Very high	90.5	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	126.9	170.5	175.6	-125.5	0	0	0	110	Y452 A456 N457 C458 W460 I479 Y489 V490 F536	Y452-F525 HydrophobicContact CD1-CE1 4.38Å; Y452-F525 AromaticContact CD1-CZ 3.79Å; Y452-F525 HydrophobicContact CD1-CZ 3.79Å; Y452-F525 HydrophobicContact CD2-CE1 4.15Å; Y452-F525 AromaticContact CD2-CZ 3.73Å; Y452-F525 HydrophobicContact CD2-CZ 3.73Å; Y452-F525 HydrophobicContact CE1-CZ 4.02Å; Y452-F525 AromaticContact CE2-CZ 3.98Å; Y452-F525 HydrophobicContact CE2-CZ 3.98Å; Y452-F525 AromaticContact CG-CE1 3.93Å; Y452-F525 HydrophobicContact CG-CE1 3.93Å; Y452-F525 AromaticContact CG-CZ 3.64Å; Y452-F525 HydrophobicContact CG-CZ 3.64Å; A456-F525 HydrophobicContact CB-CD1 4.19Å; A456-F525 HydrophobicContact CB-CE1 3.91Å; N457-F525 WeakPolarHBondContact CA-O 3.31Å; C458-F525 HydrophobicContact CB-CB 4.23Å; C458-F525 PolarHBondContact N-O 2.7Å; C458-F525 PolarHBondContact O-N 2.92Å; W460-F525 HydrophobicContact CH2-CB 4.4Å; W460-F525 HydrophobicContact CZ3-CB 4.03Å; I479-F525 HydrophobicContact CD1-CD2 4.06Å; I479-F525 HydrophobicContact CD1-CE2 3.79Å; I479-F525 HydrophobicContact CG1-CE2 4.19Å; I479-F525 HydrophobicContact CG2-CE2 4.27Å; Y489-F525 WeakPolarHBondContact O-CA 3.28Å; Y489-F525 WeakPolarHBondContact O-CD2 3.06Å; V490-F525 HydrophobicContact CG2-CB 4.14Å; V490-F525 HydrophobicContact CG2-CD2 3.73Å; V490-F525 HydrophobicContact CG2-CG 4.31Å; F525-F536 HydrophobicContact CB-CE1 3.78Å; F525-F536 HydrophobicContact CB-CZ 4.11Å; F525-F536 AromaticContact CD1-CE1 3.99Å; F525-F536 HydrophobicContact CD1-CE1 3.99Å; F525-F536 HydrophobicContact CD2-CD1 4.44Å; F525-F536 AromaticContact CD2-CE1 3.89Å; F525-F536 HydrophobicContact CD2-CE1 3.89Å; F525-F536 AromaticContact CG-CE1 3.61Å; F525-F536 HydrophobicContact CG-CE1 3.61Å; F525-F536 HydrophobicContact CG-CZ 4.41Å
526	Q	93.6	Very high	90.5	Very high	58 Å²	58	33.6 Å²	33.6	27%	0.271	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.7	176.5	-73.2	178	77.4	0	0	110.1	A456 D488 Y489	A456-Q526 VanDerWaalsContact O-CA 3.29Å; A456-Q526 WeakPolarHBondContact O-CA 3.39Å; D488-Q526 WeakPolarHBondContact CA-O 3.48Å; Y489-Q526 HydrophobicContact CE1-CB 4.42Å; Y489-Q526 HydrophobicContact CE2-CB 3.98Å; Y489-Q526 HydrophobicContact CE2-CG 4.39Å; Y489-Q526 PolarHBondContact N-O 2.91Å; Y489-Q526 PolarHBondContact O-N 2.78Å; Y489-Q526 PolarHBondContact OH-NE2 2.03Å; Y489-Q526 PolarHBondContact OH-OE1 2.9Å
527	S	93.6	Very high	90.6	Very high	14 Å²	14	35.6 Å²	35.6	10%	0.098	19%	0.19	C	C	.	.			trans	-128.7	155.4	169.4	64.1	0	0	0	0	112.8	S453 K455 A456 D488	S453-S527 PolarHBondContact O-OG 3.44Å; K455-S527 VanDerWaalsContact CA-O 3.29Å; K455-S527 WeakPolarHBondContact CA-O 3.39Å; K455-S527 PolarHBondContact N-OG 3.01Å; A456-S527 VanDerWaalsContact CB-OG 3.31Å; A456-S527 WeakPolarHBondContact CB-OG 3.36Å; A456-S527 PolarHBondContact N-OG 2.85Å; A456-S527 PolarHBondContact O-N 3.36Å; D488-S527 WeakPolarHBondContact OD1-CA 3.41Å; D488-S527 VanDerWaalsContact OD1-CB 3.27Å; D488-S527 WeakPolarHBondContact OD1-CB 3.26Å
528	D	90.8	Very high	91	Very high	56 Å²	56	34.2 Å²	34.2	30%	0.299	18%	0.181	S	C	.	.			trans	-91.5	-159	179.8	79.4	10.5	0	0	0	112.6	D454 K455 D488 N530	D454-D528 CarbonylContact C-O 3.59Å; K455-D528 PolarHBondContact N-O 3Å; D488-D528 PolarHBondContact OD1-N 3.22Å; D528-N530 PolarHBondContact OD1-N 2.87Å
529	E	88.5	Confident	91.4	Very high	141 Å²	141	34.8 Å²	34.8	66%	0.659	18%	0.183	S	C	*	.	S	Bend	trans	-89.3	-1.7	-178.3	-39.9	-158	148.3	0	0	114.5	K455	K455-E529 WeakPolarHBondContact CE-OE1 3.44Å; K455-E529 HydrophobicContact CG-CG 4.43Å; K455-E529 VanDerWaalsContact NZ-CD 3.31Å; K455-E529 IonicContact NZ-OE1 2.75Å; K455-E529 PolarHBondContact NZ-OE1 2.96Å; K455-E529 IonicContact NZ-OE2 3.35Å
530	N	82.4	Confident	91.8	Very high	117 Å²	117	33.9 Å²	33.9	63%	0.626	18%	0.177	S	C	*	.	S	Bend	trans	-151.6	116.9	-167.5	177.8	71.7	0	0	0	113.6	D528	D528-N530 PolarHBondContact OD1-N 2.87Å
531	G	80.3	Confident	92	Very high	30 Å²	30	34.6 Å²	34.6	31%	0.309	18%	0.183	S	C	.	.			trans	101.7	82.2	165.9	0	0	0	0	0	111.9	Y452	Y452-G531 PolarHBondContact OH-O 3.06Å
532	T	89.3	Confident	92	Very high	42 Å²	42	36 Å²	36	26%	0.258	19%	0.189	S	C	.	.			trans	-92.8	143.5	179	62.5	0	0	0	0	112	N451 Y452 D454	N451-T532 PolarHBondContact ND2-O 2.78Å; N451-T532 VanDerWaalsContact ND2-O 3.07Å; N451-T532 PolarHBondContact ND2-OG1 3.29Å; Y452-T532 HydrophobicContact CD2-CG2 3.98Å; Y452-T532 HydrophobicContact CE2-CG2 3.92Å; Y452-T532 WeakPolarHBondContact O-CB 3.48Å; Y452-T532 WeakPolarHBondContact O-CG2 3.39Å; D454-T532 WeakPolarHBondContact OD1-CG2 3.46Å
533	C	92.1	Very high	92	Very high	17 Å²	17	37.7 Å²	37.7	12%	0.115	20%	0.198	C	C	.	.			trans	-115.9	-179	172.1	-68.2	0	0	0	0	110.4	N451 Y452 E478 Y508 G535	N451-C533 CarbonylContact C-O 3.53Å; N451-C533 WeakPolarHBondContact CA-O 3.32Å; N451-C533 WeakPolarHBondContact CB-O 3.15Å; Y452-C533 WeakPolarHBondContact CD1-O 3.09Å; Y452-C533 HydrophobicContact CE1-CB 3.82Å; Y452-C533 VanDerWaalsContact CE1-N 3.28Å; Y452-C533 VanDerWaalsContact CE1-O 3.23Å; Y452-C533 WeakPolarHBondContact CE1-O 3.29Å; Y452-C533 VanDerWaalsContact CZ-N 3.32Å; Y452-C533 PolarHBondContact N-O 2.79Å; Y452-C533 PolarHBondContact OH-N 2.92Å; E478-C533 HydrophobicContact CB-CB 4.39Å; E478-C533 WeakPolarHBondContact O-CB 3.41Å; Y508-C533 PolarHBondContact OH-SG 2.78Å; Y508-C533 VanDerWaalsContact OH-SG 3.35Å; C533-G535 PolarHBondContact O-N 3.37Å; C533-G535 VanDerWaalsContact O-N 3.16Å
534	R	93.1	Very high	91.7	Very high	127 Å²	127	40.6 Å²	40.6	48%	0.479	22%	0.216	S	C	.	.			trans	-63.2	-18.7	180	-72.8	-170.4	-73.5	168.5	-3.8	113.9	Y448 E478	Y448-R534 WeakPolarHBondContact CD2-O 3.31Å; E478-R534 HydrophobicContact CB-CB 4.29Å; E478-R534 VanDerWaalsContact CD-CZ 3.41Å; E478-R534 VanDerWaalsContact CD-NE 3.29Å; E478-R534 IonicContact OE1-CZ 3.2Å; E478-R534 IonicContact OE1-NE 3.25Å; E478-R534 PolarHBondContact OE1-NE 3.23Å; E478-R534 VanDerWaalsContact OE1-NE 3.16Å; E478-R534 IonicContact OE1-NH1 2.71Å; E478-R534 IonicContact OE1-NH2 3.49Å; E478-R534 PolarHBondContact OE1-NH2 2.84Å; E478-R534 IonicContact OE2-CZ 3.38Å; E478-R534 IonicContact OE2-NE 3.49Å; E478-R534 PolarHBondContact OE2-NE 2.77Å; E478-R534 IonicContact OE2-NH2 3.71Å; E478-R534 PolarHBondContact OE2-NH2 3.29Å
535	G	93.3	Very high	91.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.6	-140	178.7	0	0	0	0	0	112.2	S445 Y452 E478 C533	S445-G535 WeakPolarHBondContact OG-CA 3.41Å; Y452-G535 VanDerWaalsContact CD1-CA 3.48Å; E478-G535 WeakPolarHBondContact CA-O 3.45Å; E478-G535 PolarHBondContact N-O 3.05Å; E478-G535 WeakPolarHBondContact O-CA 3.21Å; E478-G535 PolarHBondContact O-N 3.05Å; C533-G535 PolarHBondContact O-N 3.37Å; C533-G535 VanDerWaalsContact O-N 3.16Å
536	F	93.8	Very high	90.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	158.1	-169.3	69.4	-89.3	0	0	0	113.2	I443 Q444 S445 W460 F474 S476 L477 I479 V490 F525 A538	I443-F536 HydrophobicContact CD1-CE2 4.16Å; I443-F536 HydrophobicContact CG1-CE2 4.2Å; Q444-F536 CarbonylContact C-O 3.47Å; Q444-F536 WeakPolarHBondContact CA-O 3.31Å; Q444-F536 VanDerWaalsContact CB-O 3.25Å; Q444-F536 WeakPolarHBondContact CB-O 3.31Å; S445-F536 PolarHBondContact N-O 2.81Å; S445-F536 PolarHBondContact OG-N 2.96Å; W460-F536 HydrophobicContact CH2-CE2 4.44Å; W460-F536 AromaticContact CH2-CZ 3.68Å; W460-F536 HydrophobicContact CH2-CZ 3.68Å; W460-F536 AromaticContact CZ3-CZ 3.85Å; W460-F536 HydrophobicContact CZ3-CZ 3.85Å; F474-F536 HydrophobicContact CD1-CB 4.2Å; F474-F536 HydrophobicContact CD1-CD2 4.33Å; F474-F536 HydrophobicContact CE1-CB 4.19Å; F474-F536 AromaticContact CE1-CD2 3.85Å; F474-F536 HydrophobicContact CE1-CD2 3.85Å; F474-F536 HydrophobicContact CE1-CG 4.13Å; S476-F536 WeakPolarHBondContact O-CA 3.15Å; S476-F536 VanDerWaalsContact O-CB 3.32Å; S476-F536 WeakPolarHBondContact O-CB 3.17Å; L477-F536 HydrophobicContact CD1-CB 3.95Å; I479-F536 HydrophobicContact CD1-CD1 4.12Å; V490-F536 HydrophobicContact CG2-CD1 3.86Å; V490-F536 HydrophobicContact CG2-CE1 3.64Å; V490-F536 HydrophobicContact CG2-CZ 4.1Å; F525-F536 HydrophobicContact CB-CE1 3.78Å; F525-F536 HydrophobicContact CB-CZ 4.11Å; F525-F536 AromaticContact CD1-CE1 3.99Å; F525-F536 HydrophobicContact CD1-CE1 3.99Å; F525-F536 HydrophobicContact CD2-CD1 4.44Å; F525-F536 AromaticContact CD2-CE1 3.89Å; F525-F536 HydrophobicContact CD2-CE1 3.89Å; F525-F536 AromaticContact CG-CE1 3.61Å; F525-F536 HydrophobicContact CG-CE1 3.61Å; F525-F536 HydrophobicContact CG-CZ 4.41Å; F536-A538 HydrophobicContact CD2-CB 4.45Å
537	Q	93.4	Very high	88.9	Confident	43 Å²	43	50.3 Å²	50.3	20%	0.201	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129.3	166.7	-175.6	172.3	73.6	0	0	108.6	L442 I443 Q444 Y448 Q475 S476	L442-Q537 HydrophobicContact CD1-CG 3.46Å; L442-Q537 VanDerWaalsContact CD1-CG 3.46Å; L442-Q537 HydrophobicContact CD2-CG 4.24Å; L442-Q537 HydrophobicContact CG-CG 4.09Å; I443-Q537 WeakPolarHBondContact O-CA 3.37Å; Q444-Q537 HydrophobicContact CB-CB 4.34Å; Q444-Q537 HydrophobicContact CB-CG 4.39Å; Y448-Q537 HydrophobicContact CD1-CB 4.28Å; Y448-Q537 HydrophobicContact CE1-CB 3.82Å; Y448-Q537 HydrophobicContact CE1-CG 4.38Å; Y448-Q537 HydrophobicContact CE2-CB 4.3Å; Q475-Q537 PolarHBondContact N-O 2.93Å; S476-Q537 PolarHBondContact N-O 3.1Å; S476-Q537 PolarHBondContact O-N 3.35Å; S476-Q537 VanDerWaalsContact O-N 3.13Å; S476-Q537 PolarHBondContact OG-N 2.78Å
538	A	94.2	Very high	87.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	149	-175.7	0	0	0	0	0	111.9	L442 I443 L472 S473 F474 F536	L442-A538 CarbonylContact C-O 3.6Å; L442-A538 WeakPolarHBondContact CA-O 3.33Å; L442-A538 VanDerWaalsContact CD1-O 3.31Å; L442-A538 WeakPolarHBondContact CD1-O 3.39Å; I443-A538 HydrophobicContact CG1-CB 4.07Å; I443-A538 PolarHBondContact N-O 2.9Å; I443-A538 PolarHBondContact O-N 2.62Å; L472-A538 HydrophobicContact CD1-CB 3.61Å; S473-A538 CarbonylContact O-C 3.58Å; S473-A538 VanDerWaalsContact O-CA 3.28Å; S473-A538 WeakPolarHBondContact O-CA 3.46Å; S473-A538 WeakPolarHBondContact O-CB 3.49Å; F474-A538 HydrophobicContact CD1-CB 3.75Å; F474-A538 HydrophobicContact CE1-CB 4.02Å; F474-A538 HydrophobicContact CG-CB 4.05Å; F536-A538 HydrophobicContact CD2-CB 4.45Å
539	T	94.3	Very high	85.8	Confident	46 Å²	46	57 Å²	57	28%	0.282	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	140.2	174.2	53.6	0	0	0	0	110.7	G441 L442 S473	G441-T539 WeakPolarHBondContact O-CA 3.37Å; L442-T539 HydrophobicContact CD1-CG2 3.84Å; S473-T539 PolarHBondContact N-O 3.16Å; S473-T539 PolarHBondContact O-N 2.99Å; S473-T539 PolarHBondContact O-OG1 3.24Å
540	V	95.1	Very high	84	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.018	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.8	175.2	-174.6	0	0	0	0	108.7	E440 G441 I443 F462 I470 K471 L472 I523 F542	E440-V540 WeakPolarHBondContact CA-O 3.45Å; E440-V540 WeakPolarHBondContact CB-O 3.49Å; G441-V540 PolarHBondContact N-O 3.38Å; G441-V540 VanDerWaalsContact N-O 3.09Å; G441-V540 PolarHBondContact O-N 3.25Å; I443-V540 HydrophobicContact CD1-CG2 4.45Å; F462-V540 HydrophobicContact CB-CG1 4.18Å; F462-V540 HydrophobicContact CD1-CB 4.03Å; F462-V540 HydrophobicContact CD1-CG1 3.61Å; F462-V540 HydrophobicContact CD2-CB 4.36Å; F462-V540 HydrophobicContact CD2-CG1 4Å; F462-V540 HydrophobicContact CD2-CG2 4.04Å; F462-V540 HydrophobicContact CE1-CB 3.75Å; F462-V540 HydrophobicContact CE1-CG1 3.89Å; F462-V540 HydrophobicContact CE1-CG2 4.15Å; F462-V540 HydrophobicContact CE2-CB 4.11Å; F462-V540 HydrophobicContact CE2-CG1 4.25Å; F462-V540 HydrophobicContact CE2-CG2 3.59Å; F462-V540 HydrophobicContact CG-CB 4.32Å; F462-V540 HydrophobicContact CG-CG1 3.66Å; F462-V540 HydrophobicContact CG-CG2 4.49Å; F462-V540 HydrophobicContact CZ-CB 3.77Å; F462-V540 HydrophobicContact CZ-CG1 4.19Å; F462-V540 HydrophobicContact CZ-CG2 3.64Å; I470-V540 HydrophobicContact CG2-CG1 3.44Å; I470-V540 VanDerWaalsContact CG2-CG1 3.44Å; K471-V540 WeakPolarHBondContact O-CA 3.43Å; L472-V540 HydrophobicContact CD1-CG2 3.76Å; I523-V540 HydrophobicContact CD1-CG2 3.98Å; V540-F542 HydrophobicContact CG1-CE1 4.46Å
541	S	94.6	Very high	82.7	Confident	29 Å²	29	55.9 Å²	55.9	20%	0.203	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	155	179.3	57.8	0	0	0	0	112.6	E440 K471	E440-S541 WeakPolarHBondContact OE1-CA 3.29Å; K471-S541 PolarHBondContact N-O 2.78Å; K471-S541 PolarHBondContact O-N 3.38Å
542	F	94.1	Very high	80.9	Confident	30 Å²	30	62.5 Å²	62.5	13%	0.132	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	115.7	-177.6	-63.8	-11.8	0	0	0	109.9	F438 E440 F462 A464 H468 L469 I470 V540	F438-F542 WeakPolarHBondContact O-CE2 3.39Å; E440-F542 HydrophobicContact CG-CB 4.29Å; E440-F542 HydrophobicContact CG-CD1 4.42Å; E440-F542 HydrophobicContact CG-CD2 4.13Å; E440-F542 HydrophobicContact CG-CG 4.04Å; E440-F542 PolarHBondContact OE1-N 2.99Å; F462-F542 HydrophobicContact CB-CE1 4.36Å; F462-F542 HydrophobicContact CD1-CE1 4.32Å; F462-F542 HydrophobicContact CD1-CZ 4.43Å; A464-F542 HydrophobicContact CB-CB 4.37Å; A464-F542 HydrophobicContact CB-CD1 3.73Å; A464-F542 HydrophobicContact CB-CD2 3.79Å; A464-F542 HydrophobicContact CB-CE1 3.91Å; A464-F542 HydrophobicContact CB-CE2 3.95Å; A464-F542 HydrophobicContact CB-CG 3.69Å; A464-F542 HydrophobicContact CB-CZ 4.01Å; H468-F542 HydrophobicContact CB-CB 4.09Å; L469-F542 CarbonylContact O-C 3.46Å; L469-F542 WeakPolarHBondContact O-CA 3.34Å; I470-F542 HydrophobicContact CD1-CE1 4.14Å; I470-F542 HydrophobicContact CG1-CD1 3.96Å; I470-F542 HydrophobicContact CG1-CE1 3.97Å; I470-F542 HydrophobicContact CG2-CD1 4.36Å; I470-F542 HydrophobicContact CG2-CE1 4.27Å; V540-F542 HydrophobicContact CG1-CE1 4.46Å
543	I	92.2	Very high	79	Confident	38 Å²	38	64 Å²	64	20%	0.195	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.6	-175.1	-50.2	-60.6	0	0	0	109.8	H468 L469 K471 K545 Y548	H468-I543 CarbonylContact C-O 3.6Å; H468-I543 VanDerWaalsContact CA-O 3.24Å; H468-I543 WeakPolarHBondContact CA-O 3.31Å; L469-I543 PolarHBondContact N-O 3.36Å; L469-I543 PolarHBondContact O-N 3.03Å; K471-I543 HydrophobicContact CB-CG1 3.99Å; K471-I543 HydrophobicContact CD-CG1 4.42Å; I543-K545 PolarHBondContact O-N 2.99Å; I543-Y548 HydrophobicContact CG2-CE2 3.91Å
544	P	89.4	Confident	76.4	Confident	60 Å²	60	68.4 Å²	68.4	39%	0.39	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	131.3	177.7	-22.6	32	0	0	0	112.2	A546 V547	P544-A546 PolarHBondContact O-N 3.5Å; P544-A546 VanDerWaalsContact O-N 3.16Å; P544-V547 HydrophobicContact CB-CG2 4.27Å; P544-V547 WeakPolarHBondContact O-CB 3.3Å; P544-V547 WeakPolarHBondContact O-CG2 3.37Å; P544-V547 PolarHBondContact O-N 2.94Å; P544-V547 VanDerWaalsContact O-N 3.11Å
545	K	81.1	Confident	73.9	Confident	82 Å²	82	69.3 Å²	69.3	36%	0.357	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-57.1	-31.5	179.7	-79.9	178.7	179.6	177	0	113.3	K466 H467 H468 L469 I543 V547 Y548	K466-K545 WeakPolarHBondContact O-CE 3.43Å; K466-K545 PolarHBondContact O-NZ 3.14Å; H467-K545 WeakPolarHBondContact O-CB 3.28Å; H467-K545 PolarHBondContact O-N 3.26Å; H468-K545 WeakPolarHBondContact O-CE 3.19Å; L469-K545 HydrophobicContact CD1-CG 4.46Å; L469-K545 HydrophobicContact CD2-CD 4.3Å; L469-K545 HydrophobicContact CD2-CG 3.84Å; L469-K545 HydrophobicContact CG-CG 3.73Å; I543-K545 PolarHBondContact O-N 2.99Å; K545-V547 PolarHBondContact O-N 3.49Å; K545-V547 VanDerWaalsContact O-N 3.07Å; K545-Y548 PolarHBondContact O-N 2.94Å
546	A	72.3	Confident	71	Confident	91 Å²	91	73.7 Å²	73.7	75%	0.752	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-60.6	-17.7	179.4	0	0	0	0	0	114	P544 Y548	P544-A546 PolarHBondContact O-N 3.5Å; P544-A546 VanDerWaalsContact O-N 3.16Å; A546-Y548 VanDerWaalsContact C-N 3.29Å
547	V	69.5	Low	68.3	Low	90 Å²	90	82.5 Å²	82.5	55%	0.545	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-76.4	-17.5	177.7	-176.9	0	0	0	0	112	P544 K545 P549	P544-V547 HydrophobicContact CB-CG2 4.27Å; P544-V547 WeakPolarHBondContact O-CB 3.3Å; P544-V547 WeakPolarHBondContact O-CG2 3.37Å; P544-V547 PolarHBondContact O-N 2.94Å; P544-V547 VanDerWaalsContact O-N 3.11Å; K545-V547 PolarHBondContact O-N 3.49Å; K545-V547 VanDerWaalsContact O-N 3.07Å; V547-P549 VanDerWaalsContact C-CD 3.5Å; V547-P549 WeakPolarHBondContact O-CD 3.34Å
548	Y	65.8	Low	65.6	Low	107 Å²	107	86.5 Å²	86.5	42%	0.42	49%	0.486	S	S	.	.			trans	-127.5	68.4	-179.5	-63.6	-80.7	0	0	0	112.3	L469 L515 I543 K545 A546 D550 L551	L469-Y548 HydrophobicContact CD1-CD2 4.42Å; L515-Y548 HydrophobicContact CD2-CE2 4.48Å; I543-Y548 HydrophobicContact CG2-CE2 3.91Å; K545-Y548 PolarHBondContact O-N 2.94Å; A546-Y548 VanDerWaalsContact C-N 3.29Å; Y548-D550 PolarHBondContact O-N 3.24Å; Y548-L551 HydrophobicContact CD1-CD1 4.33Å; Y548-L551 HydrophobicContact CG-CD1 4.25Å
549	P	52.9	Low	63.1	Low	104 Å²	104	94.5 Å²	94.5	68%	0.675	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.9	-176.7	26.1	-33.4	0	0	0	114.5	V547	V547-P549 VanDerWaalsContact C-CD 3.5Å; V547-P549 WeakPolarHBondContact O-CD 3.34Å
550	D	50.3	Low	60.6	Low	151 Å²	151	95 Å²	95	81%	0.807	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	2.1	-172.2	-61.7	-40.4	0	0	0	114.9	Y548 N552	Y548-D550 PolarHBondContact O-N 3.24Å; D550-N552 PolarHBondContact O-N 3.3Å
551	L	54.8	Low	58.4	Low	83 Å²	83	98.7 Å²	98.7	44%	0.435	55%	0.546	S	S	.	.			trans	-74.4	93.1	171.3	-101.4	123.3	0	0	0	108.9	Y548 I553	Y548-L551 HydrophobicContact CD1-CD1 4.33Å; Y548-L551 HydrophobicContact CG-CD1 4.25Å; L551-I553 HydrophobicContact CB-CD1 4.1Å; L551-I553 HydrophobicContact CB-CG1 4.19Å; L551-I553 HydrophobicContact CD2-CD1 4.11Å; L551-I553 HydrophobicContact CD2-CG1 4.13Å; L551-I553 PolarHBondContact O-N 3.47Å
552	N	43.4	Very low	56	Low	169 Å²	169	98.8 Å²	98.8	90%	0.904	54%	0.543	S	S	*	.			trans	-62.6	72.3	169.3	-102.6	-7.6	0	0	0	110.4	D550 S554	D550-N552 PolarHBondContact O-N 3.3Å; N552-S554 PolarHBondContact O-N 3.12Å
553	I	50.5	Low	53.8	Low	74 Å²	74	98.4 Å²	98.4	38%	0.379	54%	0.542	S	S	.	.			trans	-83.9	106.6	172.6	-62.4	160.9	0	0	0	105.9	P517 L551 I555	P517-I553 HydrophobicContact CB-CD1 4.06Å; P517-I553 HydrophobicContact CB-CG1 4.39Å; P517-I553 WeakPolarHBondContact O-CD1 3.38Å; L551-I553 HydrophobicContact CB-CD1 4.1Å; L551-I553 HydrophobicContact CB-CG1 4.19Å; L551-I553 HydrophobicContact CD2-CD1 4.11Å; L551-I553 HydrophobicContact CD2-CG1 4.13Å; L551-I553 PolarHBondContact O-N 3.47Å; I553-I555 PolarHBondContact O-N 3.27Å
554	S	37.2	Very low	51.2	Low	110 Å²	110	101.2 Å²	101.2	77%	0.769	56%	0.555	S	S	*	*			trans	-57	105.6	166.3	54	0	0	0	0	108.1	N552 S556	N552-S554 PolarHBondContact O-N 3.12Å; S554-S556 VanDerWaalsContact C-N 3.33Å; S554-S556 PolarHBondContact O-N 3.43Å
555	I	39.2	Very low	49.2	Very low	145 Å²	145	102.7 Å²	102.7	74%	0.744	56%	0.563	S	S	*	*			trans	-71.2	95.2	172	-58	169.4	0	0	0	105.7	I553 E557	I553-I555 PolarHBondContact O-N 3.27Å; I555-E557 HydrophobicContact CG2-CG 4.31Å; I555-E557 PolarHBondContact O-N 3.4Å
556	S	33.8	Very low	47.6	Very low	93 Å²	93	103.8 Å²	103.8	65%	0.65	57%	0.573	S	S	*	*			trans	-71.3	115.5	152.6	55.5	0	0	0	0	105.7	S554 D558	S554-S556 VanDerWaalsContact C-N 3.33Å; S554-S556 PolarHBondContact O-N 3.43Å; S556-D558 PolarHBondContact O-N 2.99Å
557	E	36.8	Very low	46.3	Very low	184 Å²	184	104.4 Å²	104.4	86%	0.86	56%	0.564	S	S	*	*			trans	-66.8	43.5	165	-64.6	-179.6	145	0	0	110.8	I555 E559	I555-E557 HydrophobicContact CG2-CG 4.31Å; I555-E557 PolarHBondContact O-N 3.4Å; E557-E559 PolarHBondContact O-N 2.91Å
558	D	35.5	Very low	45	Very low	127 Å²	127	105.2 Å²	105.2	68%	0.679	57%	0.565	S	S	*	*			trans	-94.9	96.4	175.3	-136.6	-1.8	0	0	0	107	S556 S560	S556-D558 PolarHBondContact O-N 2.99Å; D558-S560 PolarHBondContact O-N 3.42Å
559	E	41.9	Very low	43.8	Very low	168 Å²	168	105.1 Å²	105.1	79%	0.785	57%	0.573	S	S	*	*			trans	-67.9	40.1	176.7	-65.9	-172.8	134.5	0	0	112.8	E557 M561	E557-E559 PolarHBondContact O-N 2.91Å; E559-M561 PolarHBondContact O-N 3.08Å
560	S	41.6	Very low	43.2	Very low	58 Å²	58	105.2 Å²	105.2	41%	0.406	57%	0.567	S	S	.	*			trans	-83.7	69.5	169.3	74.2	0	0	0	0	109.3	D558	D558-S560 PolarHBondContact O-N 3.42Å
561	M	50.4	Low	42.7	Very low	79 Å²	79	102.1 Å²	102.1	39%	0.389	55%	0.551	S	S	.	*			trans	-117.7	46.2	-168.7	-165.4	178.7	39.3	0	0	111.1	P379 I520 E559	P379-M561 HydrophobicContact CG-CE 3.28Å; P379-M561 HydrophobicContact CG-CG 4.16Å; P379-M561 HydrophobicContact CG-SD 3.93Å; I520-M561 HydrophobicContact CD1-CG 3.8Å; I520-M561 HydrophobicContact CD1-SD 4.17Å; E559-M561 PolarHBondContact O-N 3.08Å
562	F	44.2	Very low	41.9	Very low	32 Å²	32	103.5 Å²	103.5	14%	0.14	56%	0.559	C	S	.	*	S	Bend	trans	-137.7	145	-179.1	-60.9	-77.3	0	0	0	110.5	P379 K382 E564	P379-F562 HydrophobicContact CB-CD1 4.25Å; P379-F562 HydrophobicContact CB-CE1 3.92Å; K382-F562 HydrophobicContact CB-CB 3.32Å; K382-F562 HydrophobicContact CB-CD1 3.48Å; K382-F562 VanDerWaalsContact CB-CD1 3.48Å; K382-F562 HydrophobicContact CB-CD2 4.07Å; K382-F562 HydrophobicContact CB-CE1 4.23Å; K382-F562 HydrophobicContact CB-CG 3.36Å; K382-F562 HydrophobicContact CD-CB 4.32Å; K382-F562 HydrophobicContact CD-CD1 4.41Å; K382-F562 HydrophobicContact CD-CD2 3.74Å; K382-F562 HydrophobicContact CD-CE2 4.09Å; K382-F562 HydrophobicContact CD-CG 3.92Å; K382-F562 HydrophobicContact CG-CD1 4.46Å; K382-F562 HydrophobicContact CG-CG 4.29Å; F562-E564 HydrophobicContact CB-CG 4.46Å; F562-E564 PolarHBondContact O-N 3.42Å
563	L	47.8	Very low	41.7	Very low	21 Å²	21	98.5 Å²	98.5	11%	0.11	53%	0.533	C	S	.	.			trans	-58	102.7	153.4	-75.9	154.7	0	0	0	107.3	I380 K382 L434 I461 V496	I380-L563 WeakPolarHBondContact O-CD1 3.48Å; K382-L563 CarbonylContact C-O 3.59Å; K382-L563 PolarHBondContact N-O 3.19Å; L434-L563 HydrophobicContact CD2-CD1 3.7Å; L434-L563 HydrophobicContact CD2-CD2 3.92Å; L434-L563 HydrophobicContact CD2-CG 4.5Å; I461-L563 HydrophobicContact CD1-CD1 4.12Å; I461-L563 HydrophobicContact CD1-CD2 4.37Å; V496-L563 HydrophobicContact CB-CD2 4.49Å; V496-L563 HydrophobicContact CB-CG 4.5Å; V496-L563 HydrophobicContact CG1-CD1 4.38Å; V496-L563 HydrophobicContact CG1-CD2 3.34Å; V496-L563 HydrophobicContact CG1-CG 3.57Å
564	E	37.3	Very low	41	Very low	98 Å²	98	100.5 Å²	100.5	46%	0.458	55%	0.546	S	S	.	.	B	Isolated β-bridge	trans	-94.4	122.3	166.7	-65.9	-166.8	156.8	0	0	108.1	F562	F562-E564 HydrophobicContact CB-CG 4.46Å; F562-E564 PolarHBondContact O-N 3.42Å
565	T	46.4	Very low	41.4	Very low	91 Å²	91	99.6 Å²	99.6	56%	0.558	53%	0.525	S	S	*	.			trans	-137.9	0	178.3	52.7	0	0	0	0	110.5	S387	S387-T565 VanDerWaalsContact OG-C 3.28Å; S387-T565 PolarHBondContact OG-O 3.29Å; S387-T565 PolarHBondContact OG-OXT 3.41Å

Retrieved 565 of 565 residues in 370.9 ms (Link to these results)

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