F7FMS7_MACMU Loading...

Cadherin 18

Cadherins are calcium-dependent cell adhesion proteins.

AlphaFold DB , UniProt , Accession F7FMS7, Species MACMU (Macaca mulatta, Rhesus macaque), Gene CDH18, Length 790 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	30.7	Very low	252 Å²	252	141.9 Å²	141.9	100%	1.241	82%	0.817	S	S	*	*				0	171.4	0	-148.2	153	172.9	0	0	108.3
2	K	27.9	Very low	30.8	Very low	190 Å²	190	139.3 Å²	139.3	83%	0.826	81%	0.805	S	S	*	*			trans	-68.5	160	-176.3	-66.2	178.9	179	-179.7	0	112.5
3	I	28.8	Very low	30.7	Very low	151 Å²	151	141.5 Å²	141.5	77%	0.774	81%	0.81	S	S	*	*			cis	-158.9	166.3	-16.1	-108.2	167.4	0	0	0	108.2
4	T	30.7	Very low	30.6	Very low	128 Å²	128	139 Å²	139	79%	0.785	80%	0.799	S	S	*	*			trans	-84.2	159.6	-178.8	48.5	0	0	0	0	116
5	S	31.4	Very low	30.5	Very low	107 Å²	107	137.1 Å²	137.1	75%	0.748	80%	0.796	S	S	*	*			trans	-167	121.4	134.1	48.2	0	0	0	0	114.4
6	T	29.8	Very low	30.5	Very low	129 Å²	129	139.4 Å²	139.4	79%	0.791	80%	0.803	S	S	*	*			trans	28.8	124.7	137.9	55.1	0	0	0	0	119.8
7	S	28.3	Very low	30.8	Very low	112 Å²	112	138.1 Å²	138.1	78%	0.783	80%	0.802	S	S	*	*			cis	62.5	138.3	37.6	-130.1	0	0	0	0	113.5
8	C	28.5	Very low	30.7	Very low	107 Å²	107	141.5 Å²	141.5	72%	0.723	81%	0.806	S	S	*	*			cis	-165.3	-163.9	8.7	-155.8	0	0	0	0	111.3
9	I	29	Very low	30.6	Very low	157 Å²	157	139.5 Å²	139.5	81%	0.805	80%	0.797	S	S	*	*			trans	90.1	96.1	155	-64.1	148.3	0	0	0	118.8
10	C	27.3	Very low	30.3	Very low	113 Å²	113	140.1 Å²	140.1	76%	0.764	79%	0.792	S	S	*	*			trans	-73.4	166.3	141.3	-118.9	0	0	0	0	109.6
11	P	41.8	Very low	30.2	Very low	115 Å²	115	143.6 Å²	143.6	75%	0.747	79%	0.793	S	S	*	*				-155.6	166.8	55.7	41.8	-20.2	0	0	0	120.5
12	V	32.1	Very low	29.8	Very low	111 Å²	111	137.8 Å²	137.8	67%	0.673	78%	0.775	S	S	*	*			trans	-6	138.4	144.9	-175.7	0	0	0	0	120	V14	V12-V14 HydrophobicContact CG1-CG2 4.28Å
13	L	29.2	Very low	30	Very low	167 Å²	167	139.9 Å²	139.9	87%	0.874	78%	0.78	S	S	*	*			trans	-173.4	164.5	136.6	-117	107.4	0	0	0	109
14	V	29.6	Very low	30	Very low	107 Å²	107	136.4 Å²	136.4	65%	0.648	78%	0.782	S	S	*	*			cis	-177.2	158.3	-49.9	135.7	0	0	0	0	109.1	V12	V12-V14 HydrophobicContact CG1-CG2 4.28Å
15	C	29.5	Very low	30	Very low	111 Å²	111	136.5 Å²	136.5	75%	0.75	78%	0.782	S	S	*	*			trans	67.1	107.2	165.6	-80.4	0	0	0	0	122.1
16	L	30.3	Very low	30	Very low	174 Å²	174	136.2 Å²	136.2	91%	0.911	79%	0.786	S	S	*	*				29.4	145.3	113.4	-77.3	164.1	0	0	0	122.5
17	C	35.5	Very low	30	Very low	117 Å²	117	138.6 Å²	138.6	79%	0.791	79%	0.788	S	S	*	*			trans	-92.6	154.9	-178.5	-52.7	0	0	0	0	113.8
18	F	28.3	Very low	30.1	Very low	199 Å²	199	142 Å²	142	87%	0.873	79%	0.791	S	S	*	*			trans	-148.7	108.4	151.9	-117.2	-93.3	0	0	0	113.4
19	V	28.9	Very low	30.1	Very low	104 Å²	104	142.4 Å²	142.4	63%	0.63	80%	0.795	S	S	*	*				70.5	124.5	128.5	173.2	0	0	0	0	123.3
20	Q	25.8	Very low	30	Very low	151 Å²	151	139.8 Å²	139.8	71%	0.706	79%	0.791	S	S	*	*			trans	88.4	125.9	145.6	-88.3	172.8	6.3	0	0	125.2
21	R	26.9	Very low	30.2	Very low	214 Å²	214	142.4 Å²	142.4	81%	0.808	80%	0.795	S	S	*	*			trans	52	122.2	135.4	-73.6	171.3	172.8	175.8	-3.3	120.1
22	C	26.8	Very low	29.7	Very low	129 Å²	129	145.7 Å²	145.7	87%	0.872	80%	0.798	S	S	*	*				-165.1	168.5	89.9	-114.6	0	0	0	0	113.7
23	Y	31.6	Very low	29.6	Very low	234 Å²	234	147.1 Å²	147.1	92%	0.918	81%	0.807	S	S	*	*			trans	-77.7	154.3	173.7	-80.4	-107	0	0	0	111.7
24	G	29.1	Very low	29.6	Very low	79 Å²	79	145.5 Å²	145.5	81%	0.814	80%	0.804	S	S	*	*			trans	-147.7	117	169	0	0	0	0	0	111.6
25	T	31.7	Very low	29.6	Very low	129 Å²	129	149.8 Å²	149.8	79%	0.791	81%	0.808	S	S	*	*			trans	-89.8	143.2	-176.6	47.5	0	0	0	0	112.7
26	A	30.3	Very low	29.6	Very low	101 Å²	101	152.4 Å²	152.4	84%	0.835	82%	0.815	S	S	*	*			trans	-78	140	170.6	0	0	0	0	0	111.7
27	H	30.6	Very low	29.8	Very low	180 Å²	180	151.4 Å²	151.4	83%	0.833	81%	0.805	S	S	*	*			trans	-145.8	155.7	172.5	-119.1	-90.3	0	0	0	111.8
28	H	30.2	Very low	29.5	Very low	184 Å²	184	152.3 Å²	152.3	85%	0.852	81%	0.808	S	S	*	*			trans	-55.5	147	-176.8	-84.2	-85.1	0	0	0	115.5
29	S	27.3	Very low	29.7	Very low	115 Å²	115	152.7 Å²	152.7	80%	0.804	81%	0.809	S	S	*	*			trans	-142.3	130.5	141.2	65.3	0	0	0	0	110.9
30	S	27.2	Very low	29.9	Very low	102 Å²	102	156 Å²	156	71%	0.713	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-98.5	132.8	177	61.3	0	0	0	0	111.4
31	I	31.6	Very low	30.2	Very low	167 Å²	167	157 Å²	157	86%	0.856	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-96.2	128.3	170	-62	179.1	0	0	0	109.1
32	K	31.1	Very low	30.4	Very low	184 Å²	184	155.2 Å²	155.2	80%	0.8	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-84.5	145	-176.6	-73.3	178.6	176.1	175	0	111.8
33	V	29.6	Very low	30.8	Very low	142 Å²	142	152.6 Å²	152.6	86%	0.861	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-75.2	128.4	168.9	176.3	0	0	0	0	109.9
34	T	30.1	Very low	30.9	Very low	132 Å²	132	150.7 Å²	150.7	81%	0.81	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-95	127.4	171	-44	0	0	0	0	109.8
35	R	30.1	Very low	31.4	Very low	198 Å²	198	153.5 Å²	153.5	75%	0.747	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-94.9	126.2	-176	179.5	-176.9	-179.7	174	0.7	110.7
36	N	29.1	Very low	31.6	Very low	165 Å²	165	155.4 Å²	155.4	88%	0.882	82%	0.822	S	S	*	*			trans	-138.3	139.8	163.9	-105.6	-18.9	0	0	0	109.8
37	Q	33	Very low	32.1	Very low	154 Å²	154	156.2 Å²	156.2	72%	0.72	82%	0.816	S	S	*	*			trans	-121.8	129.2	179.3	-67.1	176.8	-88.6	0	0	109.9
38	T	30.9	Very low	32.3	Very low	136 Å²	136	155.8 Å²	155.8	83%	0.834	81%	0.814	S	S	*	*			trans	-149	114.3	161.8	36	0	0	0	0	112.5
39	K	31.8	Very low	33	Very low	206 Å²	206	155.2 Å²	155.2	90%	0.896	81%	0.811	S	S	*	*			trans	58.3	134.2	150.7	-69.4	-174.5	170.6	-176.6	0	121.7
40	H	32.8	Very low	33.5	Very low	173 Å²	173	159.3 Å²	159.3	80%	0.801	81%	0.809	S	S	*	*			trans	-56.6	145.2	154.2	-83.2	-120.9	0	0	0	112.4
41	I	33.3	Very low	34.2	Very low	172 Å²	172	159.7 Å²	159.7	88%	0.882	81%	0.809	S	S	*	*				-131.7	157	125.6	-63.6	-172.1	0	0	0	106.5
42	E	30.7	Very low	35	Very low	178 Å²	178	158.2 Å²	158.2	83%	0.832	80%	0.797	S	S	*	*			trans	-90.1	151.1	-171.9	-62	168.2	118.9	0	0	113.6
43	G	34.4	Very low	35.7	Very low	73 Å²	73	159.1 Å²	159.1	75%	0.753	80%	0.795	S	S	*	*			trans	73.2	95.5	139.7	0	0	0	0	0	120
44	E	33.3	Very low	36.7	Very low	194 Å²	194	155.1 Å²	155.1	91%	0.907	78%	0.783	S	S	*	*				-160.2	147.2	125.4	-114.6	169.4	-161.3	0	0	110.6	E46	E44-E46 PolarHBondContact O-N 3.25Å
45	T	40.7	Very low	37.5	Very low	138 Å²	138	156.1 Å²	156.1	85%	0.847	77%	0.772	S	S	*	*			trans	-97.4	79.6	-175.5	51.7	0	0	0	0	111.7	V47	T45-V47 PolarHBondContact O-N 2.76Å
46	E	35.2	Very low	38.4	Very low	169 Å²	169	151.9 Å²	151.9	79%	0.79	77%	0.768	S	S	*	*			trans	-68	113.7	170.6	-72.2	-159.3	124.1	0	0	111.2	E44 H48	E44-E46 PolarHBondContact O-N 3.25Å; E46-H48 VanDerWaalsContact C-N 3.35Å; E46-H48 PolarHBondContact O-N 3.47Å
47	V	41.6	Very low	39.6	Very low	118 Å²	118	155 Å²	155	72%	0.715	77%	0.767	S	S	*	*			trans	-75.9	88	173	-178.4	0	0	0	0	108.8	T45 H49	T45-V47 PolarHBondContact O-N 2.76Å; V47-H49 PolarHBondContact O-N 2.98Å; V47-H49 PolarHBondContact O-ND1 2.91Å
48	H	34.9	Very low	41.3	Very low	172 Å²	172	151 Å²	151	80%	0.796	75%	0.751	S	S	*	*			trans	-50.5	97	175.5	-94.3	-60.5	0	0	0	111.8	E46 R50	E46-H48 VanDerWaalsContact C-N 3.35Å; E46-H48 PolarHBondContact O-N 3.47Å; H48-R50 PolarHBondContact O-N 2.76Å
49	H	43.9	Very low	43.8	Very low	171 Å²	171	148.7 Å²	148.7	79%	0.792	73%	0.731	S	S	*	*			trans	-70.8	83	164.5	-86.6	52.8	0	0	0	108.5	V47 P51	V47-H49 PolarHBondContact O-N 2.98Å; V47-H49 PolarHBondContact O-ND1 2.91Å; H49-P51 WeakPolarHBondContact O-CD 3.21Å
50	R	38.1	Very low	46.5	Very low	201 Å²	201	141 Å²	141	76%	0.758	70%	0.697	S	S	*	*			trans	-58.5	118.9	167.2	-169.9	-174.6	-161.4	-171.6	7.7	107	H48 K52	H48-R50 PolarHBondContact O-N 2.76Å; R50-K52 PolarHBondContact O-N 2.81Å
51	P	42.3	Very low	49.1	Very low	111 Å²	111	137.7 Å²	137.7	72%	0.721	68%	0.681	S	S	*	*			trans	-58	132.2	174.9	24	-32.8	0	0	0	108.4	H49 R53	H49-P51 WeakPolarHBondContact O-CD 3.21Å; P51-R53 PolarHBondContact O-N 3.19Å
52	K	47.1	Very low	51.8	Low	135 Å²	135	129.6 Å²	129.6	59%	0.587	64%	0.64	S	S	*	*			trans	-55.5	115.8	176.1	-77.2	-179.2	169.4	179.4	0	107.5	R50 G54 E140	R50-K52 PolarHBondContact O-N 2.81Å; K52-G54 PolarHBondContact O-N 3.16Å; K52-E140 IonicContact NZ-OE1 3.81Å; K52-E140 PolarHBondContact NZ-OE1 3.24Å; K52-E140 IonicContact NZ-OE2 3.68Å; K52-E140 PolarHBondContact NZ-OE2 2.79Å
53	R	47.6	Very low	54.4	Low	203 Å²	203	124.8 Å²	124.8	77%	0.766	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-62.9	131.4	163.1	-76.5	-173.8	172.5	-172.4	-3.9	106.1	P51	P51-R53 PolarHBondContact O-N 3.19Å
54	G	49.3	Very low	57	Low	59 Å²	59	121.6 Å²	121.6	61%	0.608	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-55.6	156	165	0	0	0	0	0	110.1	K52 V56	K52-G54 PolarHBondContact O-N 3.16Å; G54-V56 PolarHBondContact O-N 3.44Å
55	W	48.4	Very low	59.2	Low	153 Å²	153	117 Å²	117	58%	0.58	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-53.6	139.6	177.7	-60.6	95.9	0	0	0	110.6	N58 S143	W55-N58 VanDerWaalsContact CB-OD1 3.26Å; W55-N58 WeakPolarHBondContact CB-OD1 3.49Å; W55-N58 PolarHBondContact O-OD1 3.4Å; W55-S143 PolarHBondContact NE1-OG 2.81Å
56	V	47	Very low	61	Low	109 Å²	109	114.3 Å²	114.3	66%	0.661	54%	0.541	S	S	*	.	S	Bend	trans	-106.5	-9	-175.8	-179.4	0	0	0	0	111.3	G54	G54-V56 PolarHBondContact O-N 3.44Å
57	W	55.1	Low	62.1	Low	230 Å²	230	115.1 Å²	115.1	87%	0.871	55%	0.547	S	S	*	.			trans	-135	85.3	-178.2	-65.2	94.9	0	0	0	108.1	Q59	W57-Q59 VanDerWaalsContact C-N 3.32Å
58	N	69	Low	63.4	Low	71 Å²	71	111 Å²	111	38%	0.38	53%	0.529	S	S	.	.			trans	-100.4	26.9	-170.7	-51.7	7	0	0	0	111	W55 F145 I146	W55-N58 VanDerWaalsContact CB-OD1 3.26Å; W55-N58 WeakPolarHBondContact CB-OD1 3.49Å; W55-N58 PolarHBondContact O-OD1 3.4Å; N58-F145 WeakPolarHBondContact O-CA 3.44Å; N58-I146 PolarHBondContact O-N 3.12Å
59	Q	83.3	Confident	65	Low	87 Å²	87	109 Å²	109	41%	0.407	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	122.1	-171.9	-64	-177.9	20.7	0	0	110.1	W57 I146 K148	W57-Q59 VanDerWaalsContact C-N 3.32Å; Q59-I146 CarbonylContact C-O 3.49Å; Q59-I146 VanDerWaalsContact CA-O 3.27Å; Q59-I146 WeakPolarHBondContact CA-O 3.47Å; Q59-I146 HydrophobicContact CG-CB 4.41Å; Q59-K148 VanDerWaalsContact OE1-CE 3.27Å
60	F	88	Confident	66.7	Low	44 Å²	44	106.7 Å²	106.7	19%	0.193	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	164.2	162.1	-62.4	-79.2	0	0	0	109.6	V74 L77 F145 I146 I147 K148	F60-V74 HydrophobicContact CB-CG1 3.73Å; F60-V74 HydrophobicContact CG-CG1 4.2Å; F60-L77 HydrophobicContact CE2-CD2 4.11Å; F60-L77 HydrophobicContact CZ-CD2 4.08Å; F60-F145 AromaticContact CD2-CD2 3.47Å; F60-F145 HydrophobicContact CD2-CD2 3.47Å; F60-F145 VanDerWaalsContact CD2-CD2 3.47Å; F60-F145 AromaticContact CD2-CE2 3.57Å; F60-F145 HydrophobicContact CD2-CE2 3.57Å; F60-F145 HydrophobicContact CD2-CG 4.43Å; F60-F145 AromaticContact CE2-CD2 3.69Å; F60-F145 HydrophobicContact CE2-CD2 3.69Å; F60-F145 AromaticContact CE2-CE2 3.78Å; F60-F145 HydrophobicContact CE2-CE2 3.78Å; F60-F145 HydrophobicContact CE2-CG 4.3Å; F60-F145 HydrophobicContact CE2-CZ 4.47Å; F60-I146 PolarHBondContact N-O 3.15Å; F60-I147 HydrophobicContact CB-CG1 4.4Å; F60-K148 PolarHBondContact O-N 3.37Å
61	F	87.6	Confident	68.8	Low	103 Å²	103	100.3 Å²	100.3	45%	0.452	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137.6	-178.3	-67	-84.1	0	0	0	110.1	K148 Q150	F61-K148 WeakPolarHBondContact CA-O 3.25Å; F61-K148 HydrophobicContact CD1-CB 3.85Å; F61-K148 HydrophobicContact CD1-CD 4.47Å; F61-K148 HydrophobicContact CE1-CB 3.97Å; F61-K148 HydrophobicContact CE1-CD 3.74Å; F61-K148 HydrophobicContact CE1-CG 4.48Å; F61-K148 HydrophobicContact CZ-CD 4.32Å; F61-Q150 HydrophobicContact CB-CG 3.97Å; F61-Q150 HydrophobicContact CD1-CG 3.83Å; F61-Q150 HydrophobicContact CG-CG 4.31Å
62	V	89.3	Confident	70.8	Confident	3 Å²	3	96 Å²	96	2%	0.018	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	121.6	179.2	179.1	0	0	0	0	108	V74 L116 I147 K148 V149 Q150	V62-V74 HydrophobicContact CG2-CB 4.04Å; V62-V74 HydrophobicContact CG2-CG1 3.62Å; V62-V74 HydrophobicContact CG2-CG2 3.62Å; V62-L116 HydrophobicContact CB-CD1 4.12Å; V62-L116 HydrophobicContact CG1-CD1 3.67Å; V62-I147 HydrophobicContact CB-CG2 4.19Å; V62-I147 HydrophobicContact CG2-CG2 3.54Å; V62-K148 PolarHBondContact N-O 3.34Å; V62-V149 CarbonylContact O-C 3.47Å; V62-V149 WeakPolarHBondContact O-CA 3.33Å; V62-Q150 PolarHBondContact O-N 2.79Å
63	L	86.2	Confident	72.8	Confident	77 Å²	77	95.5 Å²	95.5	40%	0.403	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	136.7	171.2	-73.5	163.9	0	0	0	109.7	Q72 Q150 I152	L63-Q72 PolarHBondContact O-NE2 2.86Å; L63-Q72 PolarHBondContact O-OE1 3.19Å; L63-Q150 HydrophobicContact CD2-CB 3.82Å; L63-Q150 HydrophobicContact CG-CB 4.38Å; L63-I152 HydrophobicContact CB-CD1 4.47Å; L63-I152 HydrophobicContact CD2-CD1 4.45Å; L63-I152 HydrophobicContact CD2-CG1 4.29Å
64	E	88.9	Confident	74.7	Confident	5 Å²	5	86.4 Å²	86.4	2%	0.023	44%	0.441	C	S	.	.	S	Bend	trans	-71.7	177.4	173.1	73.8	-164.7	127	0	0	113.6	H66 L116 R118 V149 Q150 D151 I152	E64-H66 PolarHBondContact O-N 2.97Å; E64-L116 WeakPolarHBondContact CB-O 3.3Å; E64-R118 WeakPolarHBondContact OE2-CB 3.27Å; E64-R118 PolarHBondContact OE2-N 2.03Å; E64-V149 HydrophobicContact CB-CG1 3.66Å; E64-Q150 PolarHBondContact N-O 3.32Å; E64-D151 WeakPolarHBondContact OE1-CA 3.29Å; E64-I152 HydrophobicContact CG-CB 3.98Å; E64-I152 HydrophobicContact CG-CD1 4.03Å; E64-I152 HydrophobicContact CG-CG1 3.97Å; E64-I152 VanDerWaalsContact O-CD1 3.25Å; E64-I152 WeakPolarHBondContact O-CD1 3.44Å; E64-I152 PolarHBondContact OE1-N 3.12Å
65	E	80.1	Confident	76.6	Confident	97 Å²	97	84 Å²	84	45%	0.453	42%	0.416	S	S	.	.	S	Bend	trans	34.3	46.8	-178	-73	-62.8	177.1	0	0	116.3	M67 S115 L116	E65-M67 WeakPolarHBondContact O-CG 3.48Å; E65-M67 PolarHBondContact O-N 3.15Å; E65-S115 WeakPolarHBondContact CA-OG 3.44Å; E65-S115 WeakPolarHBondContact OE2-CB 3.3Å; E65-S115 PolarHBondContact OE2-OG 2.94Å; E65-L116 PolarHBondContact N-O 3.08Å; E65-L116 VanDerWaalsContact N-O 3.08Å
66	H	77.6	Confident	78.4	Confident	82 Å²	82	81 Å²	81	38%	0.38	41%	0.407	S	S	.	.			trans	-73.3	94.4	-178.5	-173.1	70.5	0	0	0	111.7	E64 G68 Q72	E64-H66 PolarHBondContact O-N 2.97Å; H66-G68 PolarHBondContact O-N 2.82Å; H66-Q72 VanDerWaalsContact CB-CD 3.48Å; H66-Q72 HydrophobicContact CB-CG 4.26Å
67	M	59.1	Low	80.3	Confident	186 Å²	186	77 Å²	77	92%	0.916	38%	0.382	S	S	*	.			trans	-71.1	32.6	-178.3	-47.2	-165.8	89.1	0	0	115.3	E65	E65-M67 WeakPolarHBondContact O-CG 3.48Å; E65-M67 PolarHBondContact O-N 3.15Å
68	G	68.3	Low	81.8	Confident	33 Å²	33	70.9 Å²	70.9	34%	0.34	36%	0.363	S	S	.	.			trans	-87.5	146.6	178.6	0	0	0	0	0	113.3	H66 D70	H66-G68 PolarHBondContact O-N 2.82Å; G68-D70 VanDerWaalsContact C-N 3.35Å
69	P	69.5	Low	82.5	Confident	129 Å²	129	67.7 Å²	67.7	84%	0.838	35%	0.346	S	S	*	.	S	Bend	trans	-78.7	-21.2	169.8	33.5	-35.1	0	0	0	112.8
70	D	78.3	Confident	82.4	Confident	123 Å²	123	69.4 Å²	69.4	66%	0.658	36%	0.358	S	S	*	.	S	Bend	trans	-94.7	145.6	179.1	-64	-58.3	0	0	0	110.6	G68 Q72	G68-D70 VanDerWaalsContact C-N 3.35Å; D70-Q72 PolarHBondContact O-N 2.89Å
71	P	81.8	Confident	82.1	Confident	66 Å²	66	69.6 Å²	69.6	43%	0.429	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-56.8	129.6	176.2	-26.8	36.3	0	0	0	112.9	Y73 H111 S112	P71-Y73 PolarHBondContact O-N 3.15Å; P71-H111 HydrophobicContact CB-CB 3.69Å; P71-S112 CarbonylContact C-O 3.58Å; P71-S112 VanDerWaalsContact CA-O 3.26Å; P71-S112 WeakPolarHBondContact CA-O 3.34Å; P71-S112 WeakPolarHBondContact CB-O 3.38Å
72	Q	85.5	Confident	81.8	Confident	22 Å²	22	65.9 Å²	65.9	10%	0.103	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	121	-175.3	-170.2	-174	12.8	0	0	110.7	L63 H66 D70 V74 H111 S112	L63-Q72 PolarHBondContact O-NE2 2.86Å; L63-Q72 PolarHBondContact O-OE1 3.19Å; H66-Q72 VanDerWaalsContact CB-CD 3.48Å; H66-Q72 HydrophobicContact CB-CG 4.26Å; D70-Q72 PolarHBondContact O-N 2.89Å; Q72-V74 PolarHBondContact O-N 2.61Å; Q72-H111 CarbonylContact O-C 3.6Å; Q72-H111 VanDerWaalsContact O-CA 3.24Å; Q72-H111 WeakPolarHBondContact O-CA 3.36Å; Q72-S112 PolarHBondContact N-O 3.23Å; Q72-S112 PolarHBondContact O-N 3.23Å
73	Y	88.4	Confident	81.4	Confident	124 Å²	124	74 Å²	74	49%	0.486	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	126.5	179.4	-174.5	-105.3	0	0	0	112.1	P71 K76 D109 H111	P71-Y73 PolarHBondContact O-N 3.15Å; Y73-K76 WeakPolarHBondContact OH-CB 3.38Å; Y73-D109 HydrophobicContact CE2-CB 3.84Å; Y73-D109 WeakPolarHBondContact CE2-OD1 3.33Å; Y73-D109 PolarHBondContact OH-OD1 2.93Å; Y73-H111 AromaticContact CD2-NE2 3.66Å
74	V	88.6	Confident	80.9	Confident	11 Å²	11	73.7 Å²	73.7	7%	0.067	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-36.6	-178.4	-179	0	0	0	0	111.9	F60 V62 Q72 F101 I110 I147	F60-V74 HydrophobicContact CB-CG1 3.73Å; F60-V74 HydrophobicContact CG-CG1 4.2Å; V62-V74 HydrophobicContact CG2-CB 4.04Å; V62-V74 HydrophobicContact CG2-CG1 3.62Å; V62-V74 HydrophobicContact CG2-CG2 3.62Å; Q72-V74 PolarHBondContact O-N 2.61Å; V74-F101 HydrophobicContact CG2-CD1 4.21Å; V74-F101 HydrophobicContact CG2-CE1 4.43Å; V74-I110 HydrophobicContact CB-CB 4.16Å; V74-I110 HydrophobicContact CB-CG2 3.88Å; V74-I110 WeakPolarHBondContact CB-O 3.47Å; V74-I110 HydrophobicContact CG1-CG2 4.28Å; V74-I110 HydrophobicContact CG2-CG2 4.05Å; V74-I110 PolarHBondContact N-O 3Å; V74-I147 HydrophobicContact CG1-CD1 3.91Å; V74-I147 HydrophobicContact CG1-CG1 4.17Å; V74-I147 HydrophobicContact CG1-CG2 4.41Å
75	G	87.7	Confident	80.5	Confident	8 Å²	8	78.2 Å²	78.2	8%	0.082	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.6	-172.4	-174.1	0	0	0	0	0	112.6	I110	G75-I110 PolarHBondContact O-N 2.91Å
76	K	87.9	Confident	80.4	Confident	91 Å²	91	75 Å²	75	40%	0.396	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.2	-176.5	-165.1	173.6	-161.8	65.8	0	111.7	Y73 T107 D109	Y73-K76 WeakPolarHBondContact OH-CB 3.38Å; K76-T107 WeakPolarHBondContact CE-O 3.47Å; K76-T107 PolarHBondContact NZ-O 3.11Å; K76-D109 WeakPolarHBondContact CB-OD1 3.32Å; K76-D109 WeakPolarHBondContact CD-OD1 3.09Å; K76-D109 VanDerWaalsContact CG-OD1 3.26Å; K76-D109 WeakPolarHBondContact CG-OD1 3.42Å; K76-D109 IonicContact NZ-OD1 2.73Å; K76-D109 PolarHBondContact NZ-OD1 3.31Å; K76-D109 IonicContact NZ-OD2 2.91Å; K76-D109 PolarHBondContact NZ-OD2 2.91Å
77	L	86.4	Confident	80.7	Confident	26 Å²	26	73.3 Å²	73.3	14%	0.136	42%	0.415	C	S	.	.			trans	-96.6	137.6	161.7	-63.6	176.4	0	0	0	109.2	F60 Y90 I103 G108 I110 A128 F145	F60-L77 HydrophobicContact CE2-CD2 4.11Å; F60-L77 HydrophobicContact CZ-CD2 4.08Å; L77-Y90 HydrophobicContact CB-CD1 4.36Å; L77-I103 HydrophobicContact CB-CD1 4.46Å; L77-I103 HydrophobicContact CD1-CD1 3.81Å; L77-I103 HydrophobicContact CG-CD1 4.48Å; L77-G108 PolarHBondContact N-O 3.12Å; L77-I110 HydrophobicContact CD1-CD1 3.84Å; L77-I110 HydrophobicContact CG-CD1 3.89Å; L77-A128 HydrophobicContact CD1-CB 3.48Å; L77-A128 VanDerWaalsContact CD1-CB 3.48Å; L77-A128 HydrophobicContact CD2-CB 4.46Å; L77-F145 HydrophobicContact CD1-CE1 4.3Å
78	H	85.5	Confident	82.1	Confident	101 Å²	101	64.5 Å²	64.5	47%	0.468	37%	0.372	S	S	.	.			trans	-144.9	125.4	179.7	176.1	56.8	0	0	0	110.3	D82 Y90	H78-D82 IonicContact ND1-OD2 2.71Å; H78-Y90 WeakPolarHBondContact CA-OH 3.22Å
79	S	83.8	Confident	83.1	Confident	3 Å²	3	66 Å²	66	2%	0.021	37%	0.369	C	S	.	.			trans	-86.1	138.5	172.1	176.8	0	0	0	0	109.8	S81 D82 Y90 E140	S79-S81 PolarHBondContact O-N 3.31Å; S79-S81 VanDerWaalsContact O-N 3.09Å; S79-S81 WeakPolarHBondContact OG-CB 3.48Å; S79-S81 PolarHBondContact OG-N 2.84Å; S79-S81 VanDerWaalsContact OG-N 3.1Å; S79-D82 VanDerWaalsContact O-CB 3.25Å; S79-D82 WeakPolarHBondContact O-CB 3.27Å; S79-D82 PolarHBondContact O-N 2.88Å; S79-Y90 PolarHBondContact N-OH 3.06Å; S79-E140 WeakPolarHBondContact OG-CG 3.15Å
80	N	81.8	Confident	84.1	Confident	124 Å²	124	60.1 Å²	60.1	66%	0.663	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-5.7	170.7	74	-27.1	0	0	0	113.8	E140	N80-E140 PolarHBondContact OD1-OE1 2.88Å
81	S	81.3	Confident	84.6	Confident	48 Å²	48	57 Å²	57	34%	0.336	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-13.7	171.4	-58.8	0	0	0	0	112.7	S79	S79-S81 PolarHBondContact O-N 3.31Å; S79-S81 VanDerWaalsContact O-N 3.09Å; S79-S81 WeakPolarHBondContact OG-CB 3.48Å; S79-S81 PolarHBondContact OG-N 2.84Å; S79-S81 VanDerWaalsContact OG-N 3.1Å
82	D	82.6	Confident	85	Confident	25 Å²	25	54.8 Å²	54.8	13%	0.134	30%	0.298	C	S	.	.			trans	-78.6	130.1	176.3	-176.7	5.2	0	0	0	110.8	H78 S79 G84 V88 Y90	H78-D82 IonicContact ND1-OD2 2.71Å; S79-D82 VanDerWaalsContact O-CB 3.25Å; S79-D82 WeakPolarHBondContact O-CB 3.27Å; S79-D82 PolarHBondContact O-N 2.88Å; D82-G84 PolarHBondContact OD1-N 2.82Å; D82-V88 HydrophobicContact CB-CB 4.06Å; D82-V88 HydrophobicContact CB-CG2 3.69Å; D82-Y90 VanDerWaalsContact CB-OH 3.28Å; D82-Y90 WeakPolarHBondContact CB-OH 3.37Å; D82-Y90 PolarHBondContact OD2-OH 2.58Å
83	K	80.3	Confident	85.2	Confident	172 Å²	172	56.3 Å²	56.3	75%	0.748	31%	0.308	S	S	*	.			trans	-109.7	5.3	-177.5	-63.1	174.2	-173.5	168.2	0	112.7	D85	K83-D85 PolarHBondContact O-N 2.87Å
84	G	74.9	Confident	85.3	Confident	72 Å²	72	52.5 Å²	52.5	74%	0.742	31%	0.307	S	S	*	.	S	Bend	trans	71.9	15.9	-170.9	0	0	0	0	0	113.5	D82	D82-G84 PolarHBondContact OD1-N 2.82Å
85	D	80.4	Confident	85.2	Confident	99 Å²	99	56 Å²	56	53%	0.529	32%	0.322	S	S	.	.	S	Bend	trans	-96	3.4	178.7	64.3	-1.3	0	0	0	113.2	K83 S87	K83-D85 PolarHBondContact O-N 2.87Å; D85-S87 PolarHBondContact O-N 3.1Å; D85-S87 WeakPolarHBondContact OD1-CB 3.49Å; D85-S87 PolarHBondContact OD1-N 3.42Å; D85-S87 VanDerWaalsContact OD1-N 3.09Å; D85-S87 PolarHBondContact OD1-OG 2.97Å
86	G	79.1	Confident	85	Confident	29 Å²	29	56.4 Å²	56.4	30%	0.299	33%	0.326	S	S	.	.	S	Bend	trans	70.5	14.3	-178.6	0	0	0	0	0	114.5	R133	G86-R133 WeakPolarHBondContact O-CD 3.4Å
87	S	84.6	Confident	85	Confident	47 Å²	47	53.2 Å²	53.2	33%	0.329	32%	0.317	S	S	.	.			trans	-75.9	-22.8	177.3	64.3	0	0	0	0	113.7	D85 R133	D85-S87 PolarHBondContact O-N 3.1Å; D85-S87 WeakPolarHBondContact OD1-CB 3.49Å; D85-S87 PolarHBondContact OD1-N 3.42Å; D85-S87 VanDerWaalsContact OD1-N 3.09Å; D85-S87 PolarHBondContact OD1-OG 2.97Å; S87-R133 VanDerWaalsContact O-CB 3.25Å; S87-R133 WeakPolarHBondContact O-CB 3.26Å; S87-R133 PolarHBondContact O-N 3.05Å
88	V	87.7	Confident	84.9	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	143.2	173.5	-179.4	0	0	0	0	109.6	D82 Y90 A130 L139	D82-V88 HydrophobicContact CB-CB 4.06Å; D82-V88 HydrophobicContact CB-CG2 3.69Å; V88-Y90 HydrophobicContact CG1-CE1 4.2Å; V88-Y90 HydrophobicContact CG1-CE2 4.07Å; V88-A130 HydrophobicContact CG1-CB 4Å; V88-L139 HydrophobicContact CG1-CD1 4.4Å; V88-L139 HydrophobicContact CG2-CD1 3.7Å
89	K	88.9	Confident	84.9	Confident	63 Å²	63	54 Å²	54	27%	0.274	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.1	166.3	173.8	173.6	176.5	123.9	0	110	I91 D105 I131 R133	K89-I91 HydrophobicContact CG-CG1 4.38Å; K89-D105 VanDerWaalsContact CA-O 3.29Å; K89-D105 WeakPolarHBondContact CA-O 3.34Å; K89-D105 HydrophobicContact CD-CB 4.44Å; K89-D105 VanDerWaalsContact CD-OD2 3.3Å; K89-D105 WeakPolarHBondContact CD-OD2 3.48Å; K89-D105 VanDerWaalsContact CE-OD2 3.29Å; K89-D105 WeakPolarHBondContact CE-OD2 3.35Å; K89-D105 HydrophobicContact CG-CB 4.02Å; K89-D105 IonicContact NZ-OD2 2.73Å; K89-D105 PolarHBondContact NZ-OD2 3.37Å; K89-I131 HydrophobicContact CB-CG1 3.91Å; K89-I131 HydrophobicContact CD-CD1 4.42Å; K89-I131 HydrophobicContact CG-CG1 4.35Å; K89-I131 PolarHBondContact N-O 2.89Å; K89-I131 PolarHBondContact O-N 3.16Å; K89-R133 HydrophobicContact CB-CB 4.11Å; K89-R133 HydrophobicContact CB-CG 4.01Å
90	Y	89.8	Confident	85.2	Confident	7 Å²	7	55.3 Å²	55.3	3%	0.027	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	139.8	173.3	-61	-82.4	0	0	0	110.9	L77 H78 S79 D82 V88 D105 A130	L77-Y90 HydrophobicContact CB-CD1 4.36Å; H78-Y90 WeakPolarHBondContact CA-OH 3.22Å; S79-Y90 PolarHBondContact N-OH 3.06Å; D82-Y90 VanDerWaalsContact CB-OH 3.28Å; D82-Y90 WeakPolarHBondContact CB-OH 3.37Å; D82-Y90 PolarHBondContact OD2-OH 2.58Å; V88-Y90 HydrophobicContact CG1-CE1 4.2Å; V88-Y90 HydrophobicContact CG1-CE2 4.07Å; Y90-D105 PolarHBondContact N-O 3.08Å; Y90-A130 HydrophobicContact CD1-CB 4.2Å; Y90-A130 HydrophobicContact CE1-CB 4.18Å
91	I	89.2	Confident	85.6	Confident	56 Å²	56	49.4 Å²	49.4	29%	0.287	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	137.3	177.5	-63.3	-178.7	0	0	0	108.7	K89 T93 Q129 I131	K89-I91 HydrophobicContact CG-CG1 4.38Å; I91-T93 HydrophobicContact CG2-CG2 4.44Å; I91-Q129 PolarHBondContact N-O 2.96Å; I91-Q129 PolarHBondContact O-N 2.89Å; I91-I131 HydrophobicContact CD1-CD1 3.68Å; I91-I131 HydrophobicContact CD1-CG1 4.26Å; I91-I131 HydrophobicContact CD1-CG2 4.46Å
92	L	91.3	Very high	86.1	Confident	21 Å²	21	50.3 Å²	50.3	11%	0.11	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.1	176.1	-176.3	65.8	0	0	0	109.3	A97 F101 I103 L126 F145	L92-A97 HydrophobicContact CD2-CB 4.46Å; L92-A97 HydrophobicContact CG-CB 4.06Å; L92-F101 HydrophobicContact CD2-CB 3.98Å; L92-I103 HydrophobicContact CB-CB 4.17Å; L92-I103 HydrophobicContact CB-CG2 3.64Å; L92-I103 HydrophobicContact CD2-CB 4.44Å; L92-L126 HydrophobicContact CD1-CB 4.04Å; L92-L126 HydrophobicContact CD1-CD1 4.24Å; L92-L126 HydrophobicContact CD1-CD2 4.05Å; L92-L126 HydrophobicContact CD1-CG 4.35Å; L92-L126 HydrophobicContact CD2-CD2 4.47Å; L92-L126 HydrophobicContact CG-CD2 4.15Å; L92-F145 HydrophobicContact CD1-CE1 3.71Å; L92-F145 HydrophobicContact CD1-CZ 3.56Å
93	T	89.8	Confident	86.5	Confident	53 Å²	53	50.7 Å²	50.7	33%	0.325	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	167.5	179.7	31.9	0	0	0	0	109.6	I91 L126 H127 E142	I91-T93 HydrophobicContact CG2-CG2 4.44Å; T93-L126 WeakPolarHBondContact O-CD2 3.32Å; T93-H127 PolarHBondContact N-O 2.89Å; T93-H127 PolarHBondContact O-N 2.98Å; T93-H127 WeakPolarHBondContact OG1-CB 3.25Å; T93-H127 PolarHBondContact OG1-O 3.46Å; T93-H127 VanDerWaalsContact OG1-O 3.12Å; T93-E142 PolarHBondContact OG1-OE1 2.92Å
94	G	88.9	Confident	87	Confident	44 Å²	44	45.4 Å²	45.4	45%	0.454	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	99.2	-157.2	-178.8	0	0	0	0	0	114.5	G96 A97	G94-G96 PolarHBondContact O-N 3.37Å; G94-A97 PolarHBondContact O-N 3.15Å
95	E	87.2	Confident	87.7	Confident	85 Å²	85	44 Å²	44	40%	0.397	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	119	-167.8	-61.3	-167	115.2	0	0	113.7	A97 K121 Y124 V125 L126	E95-A97 PolarHBondContact O-N 2.99Å; E95-K121 IonicContact OE1-NZ 3.59Å; E95-K121 PolarHBondContact OE1-NZ 2.66Å; E95-K121 IonicContact OE2-NZ 2.66Å; E95-K121 PolarHBondContact OE2-NZ 2.84Å; E95-Y124 HydrophobicContact CB-CD1 4.31Å; E95-V125 WeakPolarHBondContact CB-O 3.3Å; E95-V125 PolarHBondContact N-O 2.62Å; E95-V125 PolarHBondContact OE2-N 2.91Å; E95-L126 VanDerWaalsContact O-CD2 3.29Å; E95-L126 WeakPolarHBondContact O-CD2 3.49Å
96	G	84.4	Confident	88	Confident	16 Å²	16	41.8 Å²	41.8	17%	0.165	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	2.5	179.6	0	0	0	0	0	114.5	G94 G98 T99 I100 F101	G94-G96 PolarHBondContact O-N 3.37Å; G96-G98 PolarHBondContact O-N 3.42Å; G96-T99 PolarHBondContact O-N 3.24Å; G96-T99 PolarHBondContact O-OG1 2.98Å; G96-I100 PolarHBondContact O-N 3.19Å; G96-F101 PolarHBondContact O-N 3.15Å
97	A	87.9	Confident	88.3	Confident	24 Å²	24	42.8 Å²	42.8	20%	0.198	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-55.7	134.4	172.4	0	0	0	0	0	111.1	L92 G94 E95 T99 L126	L92-A97 HydrophobicContact CD2-CB 4.46Å; L92-A97 HydrophobicContact CG-CB 4.06Å; G94-A97 PolarHBondContact O-N 3.15Å; E95-A97 PolarHBondContact O-N 2.99Å; A97-T99 PolarHBondContact O-N 3.03Å; A97-T99 VanDerWaalsContact O-N 3.11Å; A97-T99 PolarHBondContact O-OG1 3.17Å; A97-L126 HydrophobicContact CB-CD2 3.91Å
98	G	83.4	Confident	88.4	Confident	61 Å²	61	40.5 Å²	40.5	63%	0.629	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.3	2	-179.8	0	0	0	0	0	116	G96 F101	G96-G98 PolarHBondContact O-N 3.42Å; G98-F101 PolarHBondContact N-O 2.81Å
99	T	86.5	Confident	88.5	Confident	84 Å²	84	41.9 Å²	41.9	52%	0.515	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	-23.3	-173.7	52.4	0	0	0	0	114.8	G96 A97 K114	G96-T99 PolarHBondContact O-N 3.24Å; G96-T99 PolarHBondContact O-OG1 2.98Å; A97-T99 PolarHBondContact O-N 3.03Å; A97-T99 VanDerWaalsContact O-N 3.11Å; A97-T99 PolarHBondContact O-OG1 3.17Å; T99-K114 WeakPolarHBondContact O-CE 3.47Å; T99-K114 PolarHBondContact O-NZ 3.13Å
100	I	88.6	Confident	88.6	Confident	30 Å²	30	38.9 Å²	38.9	15%	0.154	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-53	170.5	-57.9	177.5	0	0	0	107.2	G96 S112 T113 K114 L116 Y124	G96-I100 PolarHBondContact O-N 3.19Å; I100-S112 CarbonylContact O-C 3.55Å; I100-S112 WeakPolarHBondContact O-CA 3.3Å; I100-T113 PolarHBondContact O-N 3.1Å; I100-T113 PolarHBondContact O-OG1 3.26Å; I100-K114 HydrophobicContact CG1-CD 4.35Å; I100-L116 HydrophobicContact CG2-CD2 3.56Å; I100-Y124 HydrophobicContact CD1-CE1 3.8Å
101	F	91.4	Very high	88.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.9	177.7	-55.2	-69.4	0	0	0	110.7	V74 L92 G96 G98 I110 H111 L116 Y124 L126 I147	V74-F101 HydrophobicContact CG2-CD1 4.21Å; V74-F101 HydrophobicContact CG2-CE1 4.43Å; L92-F101 HydrophobicContact CD2-CB 3.98Å; G96-F101 PolarHBondContact O-N 3.15Å; G98-F101 PolarHBondContact N-O 2.81Å; F101-I110 HydrophobicContact CB-CG2 4.38Å; F101-H111 WeakPolarHBondContact CA-O 3.26Å; F101-L116 HydrophobicContact CE1-CD1 4.08Å; F101-L116 HydrophobicContact CZ-CD1 3.86Å; F101-L116 HydrophobicContact CZ-CD2 4.34Å; F101-Y124 AromaticContact CE2-CD1 3.98Å; F101-Y124 HydrophobicContact CE2-CD1 3.98Å; F101-Y124 AromaticContact CE2-CD2 3.8Å; F101-Y124 HydrophobicContact CE2-CD2 3.8Å; F101-Y124 HydrophobicContact CE2-CE1 4.44Å; F101-Y124 HydrophobicContact CE2-CE2 4.3Å; F101-Y124 AromaticContact CE2-CG 3.64Å; F101-Y124 HydrophobicContact CE2-CG 3.64Å; F101-Y124 AromaticContact CZ-CD2 3.89Å; F101-Y124 HydrophobicContact CZ-CD2 3.89Å; F101-Y124 HydrophobicContact CZ-CE2 4.23Å; F101-Y124 HydrophobicContact CZ-CG 4.21Å; F101-L126 HydrophobicContact CB-CD1 4.39Å; F101-L126 HydrophobicContact CD2-CD1 3.84Å; F101-L126 HydrophobicContact CE2-CD1 4.46Å; F101-L126 HydrophobicContact CG-CD1 4.21Å; F101-I147 HydrophobicContact CB-CD1 4.45Å; F101-I147 HydrophobicContact CD1-CD1 3.48Å; F101-I147 VanDerWaalsContact CD1-CD1 3.48Å; F101-I147 HydrophobicContact CD2-CD1 3.87Å; F101-I147 HydrophobicContact CE1-CD1 3.54Å; F101-I147 HydrophobicContact CE1-CG2 4.08Å; F101-I147 HydrophobicContact CE2-CD1 3.93Å; F101-I147 HydrophobicContact CG-CD1 3.64Å; F101-I147 HydrophobicContact CZ-CB 4.31Å; F101-I147 HydrophobicContact CZ-CD1 3.77Å; F101-I147 HydrophobicContact CZ-CG2 3.97Å
102	I	91.1	Very high	88.7	Confident	67 Å²	67	38.6 Å²	38.6	34%	0.344	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	150.3	171.5	64.9	172.4	0	0	0	109.8	I110 H111 T113	I102-I110 VanDerWaalsContact O-CA 3.31Å; I102-I110 WeakPolarHBondContact O-CA 3.28Å; I102-H111 HydrophobicContact CG1-CB 4.09Å; I102-H111 PolarHBondContact N-O 2.88Å; I102-H111 PolarHBondContact O-N 2.91Å; I102-T113 HydrophobicContact CB-CG2 4.34Å; I102-T113 HydrophobicContact CD1-CG2 3.59Å; I102-T113 HydrophobicContact CG1-CG2 3.72Å; I102-T113 HydrophobicContact CG2-CG2 3.75Å
103	I	91.5	Very high	88.5	Confident	33 Å²	33	40.6 Å²	40.6	17%	0.169	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136.9	170.7	-167.3	165.9	0	0	0	109.2	L77 L92 D105 D109 I110	L77-I103 HydrophobicContact CB-CD1 4.46Å; L77-I103 HydrophobicContact CD1-CD1 3.81Å; L77-I103 HydrophobicContact CG-CD1 4.48Å; L92-I103 HydrophobicContact CB-CB 4.17Å; L92-I103 HydrophobicContact CB-CG2 3.64Å; L92-I103 HydrophobicContact CD2-CB 4.44Å; I103-D105 PolarHBondContact O-N 3.23Å; I103-D109 WeakPolarHBondContact CA-O 3.17Å; I103-I110 HydrophobicContact CB-CG1 4.25Å; I103-I110 HydrophobicContact CD1-CD1 4.36Å; I103-I110 HydrophobicContact CD1-CG1 3.87Å; I103-I110 HydrophobicContact CG1-CG1 3.93Å
104	D	90.6	Very high	88.2	Confident	61 Å²	61	43.8 Å²	43.8	33%	0.326	26%	0.264	S	S	.	.			trans	-70.3	118.3	165.7	175.8	-22	0	0	0	108.8	T106 T107 G108 D109	D104-T106 PolarHBondContact O-N 2.86Å; D104-T106 VanDerWaalsContact O-N 3.13Å; D104-T106 WeakPolarHBondContact OD1-CA 3.45Å; D104-T106 WeakPolarHBondContact OD1-CB 3.33Å; D104-T106 PolarHBondContact OD1-N 3.27Å; D104-T106 PolarHBondContact OD1-OG1 2.59Å; D104-T107 WeakPolarHBondContact CB-OG1 3.4Å; D104-T107 PolarHBondContact OD1-N 3.07Å; D104-T107 WeakPolarHBondContact OD2-CB 3.21Å; D104-T107 WeakPolarHBondContact OD2-CG2 3.29Å; D104-T107 PolarHBondContact OD2-OG1 3.49Å; D104-G108 WeakPolarHBondContact O-CA 3.46Å; D104-G108 PolarHBondContact O-N 2.86Å; D104-D109 PolarHBondContact N-O 3.41Å
105	D	89.2	Confident	88.2	Confident	42 Å²	42	44.2 Å²	44.2	23%	0.225	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-11.5	-175	98.7	-48.4	0	0	0	113.5	K89 Y90 I103 R133	K89-D105 VanDerWaalsContact CA-O 3.29Å; K89-D105 WeakPolarHBondContact CA-O 3.34Å; K89-D105 HydrophobicContact CD-CB 4.44Å; K89-D105 VanDerWaalsContact CD-OD2 3.3Å; K89-D105 WeakPolarHBondContact CD-OD2 3.48Å; K89-D105 VanDerWaalsContact CE-OD2 3.29Å; K89-D105 WeakPolarHBondContact CE-OD2 3.35Å; K89-D105 HydrophobicContact CG-CB 4.02Å; K89-D105 IonicContact NZ-OD2 2.73Å; K89-D105 PolarHBondContact NZ-OD2 3.37Å; Y90-D105 PolarHBondContact N-O 3.08Å; I103-D105 PolarHBondContact O-N 3.23Å; D105-R133 IonicContact OD1-CZ 2.6Å; D105-R133 IonicContact OD1-NH2 2.69Å; D105-R133 PolarHBondContact OD1-NH2 2.87Å; D105-R133 IonicContact OD2-CZ 3.51Å; D105-R133 IonicContact OD2-NE 3.66Å; D105-R133 IonicContact OD2-NH2 2.73Å; D105-R133 PolarHBondContact OD2-NH2 2.87Å
106	T	86.9	Confident	88.3	Confident	53 Å²	53	40.4 Å²	40.4	33%	0.325	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-41.3	178.1	65.9	0	0	0	0	114.2	D104 R133	D104-T106 PolarHBondContact O-N 2.86Å; D104-T106 VanDerWaalsContact O-N 3.13Å; D104-T106 WeakPolarHBondContact OD1-CA 3.45Å; D104-T106 WeakPolarHBondContact OD1-CB 3.33Å; D104-T106 PolarHBondContact OD1-N 3.27Å; D104-T106 PolarHBondContact OD1-OG1 2.59Å; T106-R133 VanDerWaalsContact CG2-NH1 3.32Å; T106-R133 VanDerWaalsContact CG2-NH2 3.33Å
107	T	86.6	Confident	88.6	Confident	49 Å²	49	42.2 Å²	42.2	30%	0.301	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-19.2	-176.6	66.7	0	0	0	0	113.1	K76 D104 D109	K76-T107 WeakPolarHBondContact CE-O 3.47Å; K76-T107 PolarHBondContact NZ-O 3.11Å; D104-T107 WeakPolarHBondContact CB-OG1 3.4Å; D104-T107 PolarHBondContact OD1-N 3.07Å; D104-T107 WeakPolarHBondContact OD2-CB 3.21Å; D104-T107 WeakPolarHBondContact OD2-CG2 3.29Å; D104-T107 PolarHBondContact OD2-OG1 3.49Å; T107-D109 PolarHBondContact O-N 2.85Å; T107-D109 PolarHBondContact OG1-N 2.82Å; T107-D109 PolarHBondContact OG1-OD2 2.96Å
108	G	86.4	Confident	88.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.243	C	C	.	.			trans	73.2	9.4	-175.4	0	0	0	0	0	114.6	L77 D104	L77-G108 PolarHBondContact N-O 3.12Å; D104-G108 WeakPolarHBondContact O-CA 3.46Å; D104-G108 PolarHBondContact O-N 2.86Å
109	D	89.9	Confident	89.1	Confident	31 Å²	31	42.6 Å²	42.6	17%	0.166	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	126.3	176.4	-74.3	-44.4	0	0	0	111.4	Y73 K76 I103 D104 T107	Y73-D109 HydrophobicContact CE2-CB 3.84Å; Y73-D109 WeakPolarHBondContact CE2-OD1 3.33Å; Y73-D109 PolarHBondContact OH-OD1 2.93Å; K76-D109 WeakPolarHBondContact CB-OD1 3.32Å; K76-D109 WeakPolarHBondContact CD-OD1 3.09Å; K76-D109 VanDerWaalsContact CG-OD1 3.26Å; K76-D109 WeakPolarHBondContact CG-OD1 3.42Å; K76-D109 IonicContact NZ-OD1 2.73Å; K76-D109 PolarHBondContact NZ-OD1 3.31Å; K76-D109 IonicContact NZ-OD2 2.91Å; K76-D109 PolarHBondContact NZ-OD2 2.91Å; I103-D109 WeakPolarHBondContact CA-O 3.17Å; D104-D109 PolarHBondContact N-O 3.41Å; T107-D109 PolarHBondContact O-N 2.85Å; T107-D109 PolarHBondContact OG1-N 2.82Å; T107-D109 PolarHBondContact OG1-OD2 2.96Å
110	I	90.9	Very high	89.3	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.1	-179.5	-58.5	176.5	0	0	0	109.8	V74 G75 L77 F101 I102 I103 F145	V74-I110 HydrophobicContact CB-CB 4.16Å; V74-I110 HydrophobicContact CB-CG2 3.88Å; V74-I110 WeakPolarHBondContact CB-O 3.47Å; V74-I110 HydrophobicContact CG1-CG2 4.28Å; V74-I110 HydrophobicContact CG2-CG2 4.05Å; V74-I110 PolarHBondContact N-O 3Å; G75-I110 PolarHBondContact O-N 2.91Å; L77-I110 HydrophobicContact CD1-CD1 3.84Å; L77-I110 HydrophobicContact CG-CD1 3.89Å; F101-I110 HydrophobicContact CB-CG2 4.38Å; I102-I110 VanDerWaalsContact O-CA 3.31Å; I102-I110 WeakPolarHBondContact O-CA 3.28Å; I103-I110 HydrophobicContact CB-CG1 4.25Å; I103-I110 HydrophobicContact CD1-CD1 4.36Å; I103-I110 HydrophobicContact CD1-CG1 3.87Å; I103-I110 HydrophobicContact CG1-CG1 3.93Å; I110-F145 HydrophobicContact CD1-CE2 4.28Å; I110-F145 HydrophobicContact CD1-CZ 3.81Å
111	H	89.9	Confident	89.3	Confident	54 Å²	54	47.3 Å²	47.3	25%	0.25	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143.5	176.4	-57.1	76	0	0	0	111.3	P71 Q72 Y73 F101 I102	P71-H111 HydrophobicContact CB-CB 3.69Å; Q72-H111 CarbonylContact O-C 3.6Å; Q72-H111 VanDerWaalsContact O-CA 3.24Å; Q72-H111 WeakPolarHBondContact O-CA 3.36Å; Y73-H111 AromaticContact CD2-NE2 3.66Å; F101-H111 WeakPolarHBondContact CA-O 3.26Å; I102-H111 HydrophobicContact CG1-CB 4.09Å; I102-H111 PolarHBondContact N-O 2.88Å; I102-H111 PolarHBondContact O-N 2.91Å
112	S	90.4	Very high	89.2	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.014	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	132.4	163.8	-169.2	0	0	0	0	109.7	P71 Q72 I100 K114	P71-S112 CarbonylContact C-O 3.58Å; P71-S112 VanDerWaalsContact CA-O 3.26Å; P71-S112 WeakPolarHBondContact CA-O 3.34Å; P71-S112 WeakPolarHBondContact CB-O 3.38Å; Q72-S112 PolarHBondContact N-O 3.23Å; Q72-S112 PolarHBondContact O-N 3.23Å; I100-S112 CarbonylContact O-C 3.55Å; I100-S112 WeakPolarHBondContact O-CA 3.3Å; S112-K114 PolarHBondContact OG-O 3Å
113	T	86.3	Confident	89.3	Confident	63 Å²	63	51.1 Å²	51.1	39%	0.387	26%	0.264	S	S	.	.			trans	-101.2	5.2	177.9	59.2	0	0	0	0	113.5	I100 I102	I100-T113 PolarHBondContact O-N 3.1Å; I100-T113 PolarHBondContact O-OG1 3.26Å; I102-T113 HydrophobicContact CB-CG2 4.34Å; I102-T113 HydrophobicContact CD1-CG2 3.59Å; I102-T113 HydrophobicContact CG1-CG2 3.72Å; I102-T113 HydrophobicContact CG2-CG2 3.75Å
114	K	85.3	Confident	89.3	Confident	120 Å²	120	50.4 Å²	50.4	52%	0.522	26%	0.259	S	S	.	.	S	Bend	trans	-141.3	156	-178.9	-67.1	177.9	178.4	161.9	0	110.3	T99 I100 S112	T99-K114 WeakPolarHBondContact O-CE 3.47Å; T99-K114 PolarHBondContact O-NZ 3.13Å; I100-K114 HydrophobicContact CG1-CD 4.35Å; S112-K114 PolarHBondContact OG-O 3Å
115	S	86.9	Confident	89.3	Confident	53 Å²	53	49.3 Å²	49.3	37%	0.371	26%	0.255	S	S	.	.			trans	-55.6	147.4	158.1	-115.7	0	0	0	0	110	E65	E65-S115 WeakPolarHBondContact CA-OG 3.44Å; E65-S115 WeakPolarHBondContact OE2-CB 3.3Å; E65-S115 PolarHBondContact OE2-OG 2.94Å
116	L	90	Very high	89.4	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.026	24%	0.244	C	C	.	.			trans	-115.7	160.3	169.6	-56.7	-178	0	0	0	108.2	V62 E64 E65 I100 F101 Y124 V149	V62-L116 HydrophobicContact CB-CD1 4.12Å; V62-L116 HydrophobicContact CG1-CD1 3.67Å; E64-L116 WeakPolarHBondContact CB-O 3.3Å; E65-L116 PolarHBondContact N-O 3.08Å; E65-L116 VanDerWaalsContact N-O 3.08Å; I100-L116 HydrophobicContact CG2-CD2 3.56Å; F101-L116 HydrophobicContact CE1-CD1 4.08Å; F101-L116 HydrophobicContact CZ-CD1 3.86Å; F101-L116 HydrophobicContact CZ-CD2 4.34Å; L116-Y124 HydrophobicContact CD1-CE2 4.44Å; L116-Y124 HydrophobicContact CD2-CE2 4.24Å; L116-V149 HydrophobicContact CB-CG1 4.35Å; L116-V149 HydrophobicContact CB-CG2 4.35Å; L116-V149 HydrophobicContact CD1-CG2 4.05Å
117	D	90.4	Very high	89.5	Confident	54 Å²	54	47.3 Å²	47.3	29%	0.289	24%	0.24	S	C	.	.			trans	-142	115.9	-174.8	157	-6.3	0	0	0	105.1	E119 Q120 K121	D117-E119 PolarHBondContact OD1-N 3.44Å; D117-Q120 HydrophobicContact CB-CB 4.13Å; D117-Q120 VanDerWaalsContact OD1-CB 3.25Å; D117-Q120 WeakPolarHBondContact OD1-CB 3.43Å; D117-Q120 PolarHBondContact OD1-N 3.24Å; D117-Q120 VanDerWaalsContact OD2-CB 3.24Å; D117-Q120 WeakPolarHBondContact OD2-CB 3.47Å; D117-K121 PolarHBondContact O-N 2.8Å
118	R	91.4	Very high	89.6	Confident	26 Å²	26	45.5 Å²	45.5	10%	0.098	23%	0.23	C	C	.	.	H	α-helix	trans	-75.9	-35.6	-172	-171.4	-149.8	71	110.5	5.9	111.2	E64 Q120 K121 T122 V149 D151 A186 D187 D188	E64-R118 WeakPolarHBondContact OE2-CB 3.27Å; E64-R118 PolarHBondContact OE2-N 2.03Å; R118-Q120 VanDerWaalsContact C-N 3.28Å; R118-Q120 PolarHBondContact O-N 2.83Å; R118-K121 CarbonylContact O-C 3.51Å; R118-K121 VanDerWaalsContact O-C 3.3Å; R118-K121 PolarHBondContact O-N 2.7Å; R118-T122 HydrophobicContact CG-CG2 4.25Å; R118-T122 WeakPolarHBondContact O-CG2 3.35Å; R118-T122 PolarHBondContact O-N 2.79Å; R118-V149 HydrophobicContact CB-CB 4.23Å; R118-V149 HydrophobicContact CB-CG1 3.78Å; R118-V149 HydrophobicContact CG-CB 4.2Å; R118-V149 HydrophobicContact CG-CG1 4.22Å; R118-D151 IonicContact CZ-OD1 2.65Å; R118-D151 IonicContact NE-OD1 3.71Å; R118-D151 PolarHBondContact NE-OD1 3Å; R118-A186 PolarHBondContact NH2-O 3.49Å; R118-D187 VanDerWaalsContact NH2-C 3.26Å; R118-D188 VanDerWaalsContact NH1-CB 3.26Å; R118-D188 IonicContact NH1-OD2 2.67Å; R118-D188 PolarHBondContact NH1-OD2 3.18Å; R118-D188 VanDerWaalsContact NH1-OD2 3.1Å
119	E	90.8	Very high	89.7	Confident	67 Å²	67	48 Å²	48	31%	0.313	24%	0.242	S	C	.	.	H	α-helix	trans	-62.9	-37.4	176.8	-71.5	53.8	-114.1	0	0	110.4	D117 A186	D117-E119 PolarHBondContact OD1-N 3.44Å; E119-A186 HydrophobicContact CG-CB 3.83Å
120	Q	90.3	Very high	89.7	Confident	155 Å²	155	46.8 Å²	46.8	72%	0.724	24%	0.236	S	C	*	.	H	α-helix	trans	-74.3	-46.5	170.2	-177.6	175.2	121.1	0	0	112.1	D117 R118	D117-Q120 HydrophobicContact CB-CB 4.13Å; D117-Q120 VanDerWaalsContact OD1-CB 3.25Å; D117-Q120 WeakPolarHBondContact OD1-CB 3.43Å; D117-Q120 PolarHBondContact OD1-N 3.24Å; D117-Q120 VanDerWaalsContact OD2-CB 3.24Å; D117-Q120 WeakPolarHBondContact OD2-CB 3.47Å; R118-Q120 VanDerWaalsContact C-N 3.28Å; R118-Q120 PolarHBondContact O-N 2.83Å
121	K	89.9	Confident	89.6	Confident	59 Å²	59	47.2 Å²	47.2	26%	0.257	24%	0.239	S	C	.	.	H	α-helix	trans	-155.3	98	178.3	-172.8	153.7	176	166.8	0	115.2	E95 D117 R118 H123 Y124 V149	E95-K121 IonicContact OE1-NZ 3.59Å; E95-K121 PolarHBondContact OE1-NZ 2.66Å; E95-K121 IonicContact OE2-NZ 2.66Å; E95-K121 PolarHBondContact OE2-NZ 2.84Å; D117-K121 PolarHBondContact O-N 2.8Å; R118-K121 CarbonylContact O-C 3.51Å; R118-K121 VanDerWaalsContact O-C 3.3Å; R118-K121 PolarHBondContact O-N 2.7Å; K121-H123 VanDerWaalsContact C-N 3.28Å; K121-H123 WeakPolarHBondContact CE-O 3.14Å; K121-H123 WeakPolarHBondContact CG-O 3.23Å; K121-H123 PolarHBondContact O-N 2.94Å; K121-H123 VanDerWaalsContact O-N 3.1Å; K121-Y124 HydrophobicContact CB-CE2 4.47Å; K121-Y124 HydrophobicContact CD-CD1 4.11Å; K121-Y124 HydrophobicContact CD-CE1 3.76Å; K121-Y124 HydrophobicContact CG-CE1 4.27Å; K121-Y124 HydrophobicContact CG-CE2 4.16Å; K121-V149 VanDerWaalsContact O-CG2 3.3Å; K121-V149 WeakPolarHBondContact O-CG2 3.28Å
122	T	89.5	Confident	89.5	Confident	68 Å²	68	46.3 Å²	46.3	42%	0.417	24%	0.236	S	C	.	.	S	Bend	trans	-52.2	-30.4	177.4	60.4	0	0	0	0	116.9	R118 V149	R118-T122 HydrophobicContact CG-CG2 4.25Å; R118-T122 WeakPolarHBondContact O-CG2 3.35Å; R118-T122 PolarHBondContact O-N 2.79Å; T122-V149 PolarHBondContact O-N 2.91Å
123	H	91.6	Very high	89.2	Confident	79 Å²	79	51.1 Å²	51.1	37%	0.366	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	157.5	-178.4	67.6	-71.5	0	0	0	113.5	K121 I146 I147 K148	K121-H123 VanDerWaalsContact C-N 3.28Å; K121-H123 WeakPolarHBondContact CE-O 3.14Å; K121-H123 WeakPolarHBondContact CG-O 3.23Å; K121-H123 PolarHBondContact O-N 2.94Å; K121-H123 VanDerWaalsContact O-N 3.1Å; H123-I146 HydrophobicContact CB-CG2 3.8Å; H123-I147 CarbonylContact C-O 3.56Å; H123-I147 VanDerWaalsContact CA-O 3.23Å; H123-I147 WeakPolarHBondContact CA-O 3.2Å; H123-I147 WeakPolarHBondContact CB-O 3.09Å; H123-K148 HydrophobicContact CB-CG 4.25Å
124	Y	91.7	Very high	89.1	Confident	18 Å²	18	58.6 Å²	58.6	7%	0.071	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.6	177.6	-62.6	-99.9	0	0	0	110.4	E95 I100 F101 L116 K121 I146 I147 V149	E95-Y124 HydrophobicContact CB-CD1 4.31Å; I100-Y124 HydrophobicContact CD1-CE1 3.8Å; F101-Y124 AromaticContact CE2-CD1 3.98Å; F101-Y124 HydrophobicContact CE2-CD1 3.98Å; F101-Y124 AromaticContact CE2-CD2 3.8Å; F101-Y124 HydrophobicContact CE2-CD2 3.8Å; F101-Y124 HydrophobicContact CE2-CE1 4.44Å; F101-Y124 HydrophobicContact CE2-CE2 4.3Å; F101-Y124 AromaticContact CE2-CG 3.64Å; F101-Y124 HydrophobicContact CE2-CG 3.64Å; F101-Y124 AromaticContact CZ-CD2 3.89Å; F101-Y124 HydrophobicContact CZ-CD2 3.89Å; F101-Y124 HydrophobicContact CZ-CE2 4.23Å; F101-Y124 HydrophobicContact CZ-CG 4.21Å; L116-Y124 HydrophobicContact CD1-CE2 4.44Å; L116-Y124 HydrophobicContact CD2-CE2 4.24Å; K121-Y124 HydrophobicContact CB-CE2 4.47Å; K121-Y124 HydrophobicContact CD-CD1 4.11Å; K121-Y124 HydrophobicContact CD-CE1 3.76Å; K121-Y124 HydrophobicContact CG-CE1 4.27Å; K121-Y124 HydrophobicContact CG-CE2 4.16Å; Y124-I146 WeakPolarHBondContact O-CA 3.2Å; Y124-I147 PolarHBondContact N-O 2.73Å; Y124-I147 PolarHBondContact O-N 2.8Å; Y124-V149 HydrophobicContact CD2-CG2 4.47Å; Y124-V149 HydrophobicContact CE2-CG2 4.07Å
125	V	91.1	Very high	89.1	Confident	38 Å²	38	55.9 Å²	55.9	23%	0.23	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125.8	175.1	-173.6	0	0	0	0	110	E95 E144	E95-V125 WeakPolarHBondContact CB-O 3.3Å; E95-V125 PolarHBondContact N-O 2.62Å; E95-V125 PolarHBondContact OE2-N 2.91Å; V125-E144 HydrophobicContact CG1-CG 3.77Å
126	L	90.6	Very high	88.8	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	153.4	-174.5	-75.8	165.9	0	0	0	111.5	L92 T93 E95 A97 F101 E144 F145 I147	L92-L126 HydrophobicContact CD1-CB 4.04Å; L92-L126 HydrophobicContact CD1-CD1 4.24Å; L92-L126 HydrophobicContact CD1-CD2 4.05Å; L92-L126 HydrophobicContact CD1-CG 4.35Å; L92-L126 HydrophobicContact CD2-CD2 4.47Å; L92-L126 HydrophobicContact CG-CD2 4.15Å; T93-L126 WeakPolarHBondContact O-CD2 3.32Å; E95-L126 VanDerWaalsContact O-CD2 3.29Å; E95-L126 WeakPolarHBondContact O-CD2 3.49Å; A97-L126 HydrophobicContact CB-CD2 3.91Å; F101-L126 HydrophobicContact CB-CD1 4.39Å; F101-L126 HydrophobicContact CD2-CD1 3.84Å; F101-L126 HydrophobicContact CE2-CD1 4.46Å; F101-L126 HydrophobicContact CG-CD1 4.21Å; L126-E144 WeakPolarHBondContact O-CA 3.37Å; L126-F145 HydrophobicContact CB-CD1 4.25Å; L126-F145 HydrophobicContact CB-CD2 4.45Å; L126-F145 HydrophobicContact CB-CE1 3.7Å; L126-F145 HydrophobicContact CB-CE2 3.97Å; L126-F145 HydrophobicContact CB-CZ 3.58Å; L126-F145 HydrophobicContact CD1-CE2 4.01Å; L126-F145 HydrophobicContact CD1-CZ 3.93Å; L126-F145 HydrophobicContact CG-CZ 4.41Å; L126-F145 PolarHBondContact N-O 3.09Å; L126-F145 PolarHBondContact O-N 3.07Å; L126-F145 VanDerWaalsContact O-O 3.04Å; L126-I147 HydrophobicContact CD1-CD1 3.33Å; L126-I147 HydrophobicContact CD1-CG1 3.89Å
127	H	90.2	Very high	88.6	Confident	52 Å²	52	65.3 Å²	65.3	24%	0.241	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	134.2	-178.5	-59.7	100.3	0	0	0	109.5	T93 E142 E144	T93-H127 PolarHBondContact N-O 2.89Å; T93-H127 PolarHBondContact O-N 2.98Å; T93-H127 WeakPolarHBondContact OG1-CB 3.25Å; T93-H127 PolarHBondContact OG1-O 3.46Å; T93-H127 VanDerWaalsContact OG1-O 3.12Å; H127-E142 HydrophobicContact CB-CG 3.92Å; H127-E142 WeakPolarHBondContact CB-OE1 3.32Å; H127-E144 IonicContact CD2-OE2 2.88Å; H127-E144 IonicContact CE1-OE2 3.67Å; H127-E144 IonicContact NE2-OE2 2.65Å; H127-E144 PolarHBondContact NE2-OE2 2.8Å
128	A	88.8	Confident	88.3	Confident	11 Å²	11	66.5 Å²	66.5	9%	0.091	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	134.3	-176.4	0	0	0	0	0	111.1	L77 E142 S143 F145	L77-A128 HydrophobicContact CD1-CB 3.48Å; L77-A128 VanDerWaalsContact CD1-CB 3.48Å; L77-A128 HydrophobicContact CD2-CB 4.46Å; A128-E142 CarbonylContact O-C 3.47Å; A128-E142 VanDerWaalsContact O-CA 3.31Å; A128-E142 WeakPolarHBondContact O-CA 3.36Å; A128-S143 PolarHBondContact N-O 3.07Å; A128-S143 PolarHBondContact O-N 2.92Å; A128-F145 HydrophobicContact CB-CD1 4.12Å; A128-F145 HydrophobicContact CB-CE1 3.9Å
129	Q	88.7	Confident	88	Confident	52 Å²	52	68.3 Å²	68.3	24%	0.243	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	135.7	171.4	-165.7	175.5	100.8	0	0	111.4	I91 I131 P138	I91-Q129 PolarHBondContact N-O 2.96Å; I91-Q129 PolarHBondContact O-N 2.89Å; Q129-I131 HydrophobicContact CG-CG2 4.04Å; Q129-P138 HydrophobicContact CG-CB 4.47Å
130	A	89	Confident	87.6	Confident	7 Å²	7	66.4 Å²	66.4	6%	0.058	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125.2	171.8	0	0	0	0	0	109.5	V88 Y90 L139 E140	V88-A130 HydrophobicContact CG1-CB 4Å; Y90-A130 HydrophobicContact CD1-CB 4.2Å; Y90-A130 HydrophobicContact CE1-CB 4.18Å; A130-L139 PolarHBondContact O-N 2.83Å; A130-E140 HydrophobicContact CB-CB 4.29Å; A130-E140 HydrophobicContact CB-CG 4.34Å; A130-E140 PolarHBondContact O-N 3.16Å
131	I	89.5	Confident	87.2	Confident	9 Å²	9	63.2 Å²	63.2	5%	0.046	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	154	-177.7	73.3	172.1	0	0	0	111.7	K89 I91 Q129 R133 N136 K137	K89-I131 HydrophobicContact CB-CG1 3.91Å; K89-I131 HydrophobicContact CD-CD1 4.42Å; K89-I131 HydrophobicContact CG-CG1 4.35Å; K89-I131 PolarHBondContact N-O 2.89Å; K89-I131 PolarHBondContact O-N 3.16Å; I91-I131 HydrophobicContact CD1-CD1 3.68Å; I91-I131 HydrophobicContact CD1-CG1 4.26Å; I91-I131 HydrophobicContact CD1-CG2 4.46Å; Q129-I131 HydrophobicContact CG-CG2 4.04Å; I131-R133 PolarHBondContact O-N 2.99Å; I131-N136 HydrophobicContact CD1-CB 4.43Å; I131-K137 CarbonylContact C-O 3.51Å; I131-K137 VanDerWaalsContact CA-O 3.28Å; I131-K137 WeakPolarHBondContact CA-O 3.26Å; I131-K137 WeakPolarHBondContact CB-O 3.41Å
132	D	87.8	Confident	87	Confident	35 Å²	35	65.4 Å²	65.4	19%	0.187	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	117.6	168.3	168.6	-10.2	0	0	0	109	R134 T135 N136 K137 L139	D132-R134 PolarHBondContact O-N 2.78Å; D132-R134 VanDerWaalsContact O-N 3.16Å; D132-R134 WeakPolarHBondContact OD1-CA 3.17Å; D132-R134 WeakPolarHBondContact OD1-CB 3.35Å; D132-R134 PolarHBondContact OD1-N 2.97Å; D132-T135 WeakPolarHBondContact CB-OG1 3.46Å; D132-T135 PolarHBondContact O-N 2.88Å; D132-T135 PolarHBondContact OD1-N 2.84Å; D132-T135 WeakPolarHBondContact OD2-CB 2.99Å; D132-T135 WeakPolarHBondContact OD2-CG2 3.31Å; D132-T135 PolarHBondContact OD2-OG1 3.44Å; D132-N136 VanDerWaalsContact O-CA 3.27Å; D132-N136 WeakPolarHBondContact O-CA 2.98Å; D132-N136 PolarHBondContact O-N 3.43Å; D132-K137 PolarHBondContact N-O 3.33Å; D132-L139 HydrophobicContact CB-CD1 4.18Å; D132-L139 HydrophobicContact CB-CD2 4.18Å; D132-L139 HydrophobicContact CB-CG 4.14Å
133	R	84.3	Confident	86.8	Confident	103 Å²	103	63.4 Å²	63.4	39%	0.389	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-17.2	-175.3	-159.6	171.7	-155.6	-165.6	8.6	113.8	G86 S87 K89 D105 T106 I131	G86-R133 WeakPolarHBondContact O-CD 3.4Å; S87-R133 VanDerWaalsContact O-CB 3.25Å; S87-R133 WeakPolarHBondContact O-CB 3.26Å; S87-R133 PolarHBondContact O-N 3.05Å; K89-R133 HydrophobicContact CB-CB 4.11Å; K89-R133 HydrophobicContact CB-CG 4.01Å; D105-R133 IonicContact OD1-CZ 2.6Å; D105-R133 IonicContact OD1-NH2 2.69Å; D105-R133 PolarHBondContact OD1-NH2 2.87Å; D105-R133 IonicContact OD2-CZ 3.51Å; D105-R133 IonicContact OD2-NE 3.66Å; D105-R133 IonicContact OD2-NH2 2.73Å; D105-R133 PolarHBondContact OD2-NH2 2.87Å; T106-R133 VanDerWaalsContact CG2-NH1 3.32Å; T106-R133 VanDerWaalsContact CG2-NH2 3.33Å; I131-R133 PolarHBondContact O-N 2.99Å
134	R	83.4	Confident	86.6	Confident	220 Å²	220	65 Å²	65	83%	0.83	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-29.7	178.1	-166.9	-173.1	66.3	148.3	2.1	112.9	D132	D132-R134 PolarHBondContact O-N 2.78Å; D132-R134 VanDerWaalsContact O-N 3.16Å; D132-R134 WeakPolarHBondContact OD1-CA 3.17Å; D132-R134 WeakPolarHBondContact OD1-CB 3.35Å; D132-R134 PolarHBondContact OD1-N 2.97Å
135	T	84.6	Confident	86.4	Confident	62 Å²	62	64.7 Å²	64.7	38%	0.38	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-8	-179.1	71.3	0	0	0	0	115.1	D132 K137	D132-T135 WeakPolarHBondContact CB-OG1 3.46Å; D132-T135 PolarHBondContact O-N 2.88Å; D132-T135 PolarHBondContact OD1-N 2.84Å; D132-T135 WeakPolarHBondContact OD2-CB 2.99Å; D132-T135 WeakPolarHBondContact OD2-CG2 3.31Å; D132-T135 PolarHBondContact OD2-OG1 3.44Å; T135-K137 PolarHBondContact O-N 2.03Å
136	N	82.1	Confident	86.3	Confident	114 Å²	114	64.8 Å²	64.8	61%	0.61	32%	0.319	S	S	*	.			trans	50.9	30.7	-173.7	-66.3	-58	0	0	0	114.1	I131 D132	I131-N136 HydrophobicContact CD1-CB 4.43Å; D132-N136 VanDerWaalsContact O-CA 3.27Å; D132-N136 WeakPolarHBondContact O-CA 2.98Å; D132-N136 PolarHBondContact O-N 3.43Å
137	K	85.6	Confident	86.3	Confident	143 Å²	143	64.8 Å²	64.8	62%	0.622	32%	0.319	S	S	*	.			trans	-97.1	139.6	174.6	-67.9	-173	175.9	-173.5	0	110.6	I131 D132 T135 L139	I131-K137 CarbonylContact C-O 3.51Å; I131-K137 VanDerWaalsContact CA-O 3.28Å; I131-K137 WeakPolarHBondContact CA-O 3.26Å; I131-K137 WeakPolarHBondContact CB-O 3.41Å; D132-K137 PolarHBondContact N-O 3.33Å; T135-K137 PolarHBondContact O-N 2.03Å; K137-L139 PolarHBondContact O-N 2.74Å
138	P	83.9	Confident	86.3	Confident	78 Å²	78	66 Å²	66	51%	0.506	32%	0.323	S	S	.	.	B	Isolated β-bridge	trans	-56.4	126.3	169.8	-23.9	34	0	0	0	111.5	Q129	Q129-P138 HydrophobicContact CG-CB 4.47Å
139	L	84.6	Confident	86.4	Confident	65 Å²	65	66.1 Å²	66.1	34%	0.34	32%	0.323	S	S	.	.	S	Bend	trans	-89.3	-33.8	169	-67.1	169.8	0	0	0	110.4	V88 A130 D132 K137	V88-L139 HydrophobicContact CG1-CD1 4.4Å; V88-L139 HydrophobicContact CG2-CD1 3.7Å; A130-L139 PolarHBondContact O-N 2.83Å; D132-L139 HydrophobicContact CB-CD1 4.18Å; D132-L139 HydrophobicContact CB-CD2 4.18Å; D132-L139 HydrophobicContact CB-CG 4.14Å; K137-L139 PolarHBondContact O-N 2.74Å
140	E	82.1	Confident	86.3	Confident	26 Å²	26	65.8 Å²	65.8	12%	0.121	32%	0.321	C	S	.	.	S	Bend	trans	-120.7	149.8	174.1	-65.7	-56.5	144.2	0	0	110.7	K52 S79 N80 A130	K52-E140 IonicContact NZ-OE1 3.81Å; K52-E140 PolarHBondContact NZ-OE1 3.24Å; K52-E140 IonicContact NZ-OE2 3.68Å; K52-E140 PolarHBondContact NZ-OE2 2.79Å; S79-E140 WeakPolarHBondContact OG-CG 3.15Å; N80-E140 PolarHBondContact OD1-OE1 2.88Å; A130-E140 HydrophobicContact CB-CB 4.29Å; A130-E140 HydrophobicContact CB-CG 4.34Å; A130-E140 PolarHBondContact O-N 3.16Å
141	P	83.2	Confident	86.3	Confident	88 Å²	88	65.9 Å²	65.9	57%	0.571	32%	0.321	S	S	*	.			trans	-65.3	152.7	170.4	30.6	-35.1	0	0	0	110.6	S143	P141-S143 PolarHBondContact O-N 2.71Å; P141-S143 PolarHBondContact O-OG 3.12Å
142	E	85	Confident	86.2	Confident	106 Å²	106	68.5 Å²	68.5	50%	0.495	33%	0.334	S	S	.	.			trans	-58.5	129.1	172.7	-169.1	162.8	-148	0	0	110.1	T93 H127 A128	T93-E142 PolarHBondContact OG1-OE1 2.92Å; H127-E142 HydrophobicContact CB-CG 3.92Å; H127-E142 WeakPolarHBondContact CB-OE1 3.32Å; A128-E142 CarbonylContact O-C 3.47Å; A128-E142 VanDerWaalsContact O-CA 3.31Å; A128-E142 WeakPolarHBondContact O-CA 3.36Å
143	S	84.6	Confident	86.2	Confident	25 Å²	25	68.3 Å²	68.3	18%	0.175	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120.1	-171.6	-62.7	0	0	0	0	109.9	W55 A128 P141	W55-S143 PolarHBondContact NE1-OG 2.81Å; A128-S143 PolarHBondContact N-O 3.07Å; A128-S143 PolarHBondContact O-N 2.92Å; P141-S143 PolarHBondContact O-N 2.71Å; P141-S143 PolarHBondContact O-OG 3.12Å
144	E	87.6	Confident	86.3	Confident	113 Å²	113	67.5 Å²	67.5	53%	0.528	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	137	175.4	-173.4	171.7	96.9	0	0	111.4	V125 L126 H127	V125-E144 HydrophobicContact CG1-CG 3.77Å; L126-E144 WeakPolarHBondContact O-CA 3.37Å; H127-E144 IonicContact CD2-OE2 2.88Å; H127-E144 IonicContact CE1-OE2 3.67Å; H127-E144 IonicContact NE2-OE2 2.65Å; H127-E144 PolarHBondContact NE2-OE2 2.8Å
145	F	87.5	Confident	86.6	Confident	11 Å²	11	58.4 Å²	58.4	5%	0.048	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	161.3	171.6	72.5	-84.8	0	0	0	110.6	N58 F60 L77 L92 I110 L126 A128 I147	N58-F145 WeakPolarHBondContact O-CA 3.44Å; F60-F145 AromaticContact CD2-CD2 3.47Å; F60-F145 HydrophobicContact CD2-CD2 3.47Å; F60-F145 VanDerWaalsContact CD2-CD2 3.47Å; F60-F145 AromaticContact CD2-CE2 3.57Å; F60-F145 HydrophobicContact CD2-CE2 3.57Å; F60-F145 HydrophobicContact CD2-CG 4.43Å; F60-F145 AromaticContact CE2-CD2 3.69Å; F60-F145 HydrophobicContact CE2-CD2 3.69Å; F60-F145 AromaticContact CE2-CE2 3.78Å; F60-F145 HydrophobicContact CE2-CE2 3.78Å; F60-F145 HydrophobicContact CE2-CG 4.3Å; F60-F145 HydrophobicContact CE2-CZ 4.47Å; L77-F145 HydrophobicContact CD1-CE1 4.3Å; L92-F145 HydrophobicContact CD1-CE1 3.71Å; L92-F145 HydrophobicContact CD1-CZ 3.56Å; I110-F145 HydrophobicContact CD1-CE2 4.28Å; I110-F145 HydrophobicContact CD1-CZ 3.81Å; L126-F145 HydrophobicContact CB-CD1 4.25Å; L126-F145 HydrophobicContact CB-CD2 4.45Å; L126-F145 HydrophobicContact CB-CE1 3.7Å; L126-F145 HydrophobicContact CB-CE2 3.97Å; L126-F145 HydrophobicContact CB-CZ 3.58Å; L126-F145 HydrophobicContact CD1-CE2 4.01Å; L126-F145 HydrophobicContact CD1-CZ 3.93Å; L126-F145 HydrophobicContact CG-CZ 4.41Å; L126-F145 PolarHBondContact N-O 3.09Å; L126-F145 PolarHBondContact O-N 3.07Å; L126-F145 VanDerWaalsContact O-O 3.04Å; A128-F145 HydrophobicContact CB-CD1 4.12Å; A128-F145 HydrophobicContact CB-CE1 3.9Å; F145-I147 HydrophobicContact CD2-CG1 4.38Å; F145-I147 HydrophobicContact CE2-CD1 4.24Å; F145-I147 HydrophobicContact CE2-CG1 3.84Å
146	I	90.1	Very high	87	Confident	41 Å²	41	56.9 Å²	56.9	21%	0.21	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.1	-178.6	-57.1	176.6	0	0	0	108.7	N58 Q59 F60 H123 Y124 K148	N58-I146 PolarHBondContact O-N 3.12Å; Q59-I146 CarbonylContact C-O 3.49Å; Q59-I146 VanDerWaalsContact CA-O 3.27Å; Q59-I146 WeakPolarHBondContact CA-O 3.47Å; Q59-I146 HydrophobicContact CG-CB 4.41Å; F60-I146 PolarHBondContact N-O 3.15Å; H123-I146 HydrophobicContact CB-CG2 3.8Å; Y124-I146 WeakPolarHBondContact O-CA 3.2Å; I146-K148 HydrophobicContact CG2-CG 4.13Å
147	I	90.3	Very high	87.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	117.4	160.3	-61.7	175.6	0	0	0	106.8	F60 V62 V74 F101 H123 Y124 L126 F145	F60-I147 HydrophobicContact CB-CG1 4.4Å; V62-I147 HydrophobicContact CB-CG2 4.19Å; V62-I147 HydrophobicContact CG2-CG2 3.54Å; V74-I147 HydrophobicContact CG1-CD1 3.91Å; V74-I147 HydrophobicContact CG1-CG1 4.17Å; V74-I147 HydrophobicContact CG1-CG2 4.41Å; F101-I147 HydrophobicContact CB-CD1 4.45Å; F101-I147 HydrophobicContact CD1-CD1 3.48Å; F101-I147 VanDerWaalsContact CD1-CD1 3.48Å; F101-I147 HydrophobicContact CD2-CD1 3.87Å; F101-I147 HydrophobicContact CE1-CD1 3.54Å; F101-I147 HydrophobicContact CE1-CG2 4.08Å; F101-I147 HydrophobicContact CE2-CD1 3.93Å; F101-I147 HydrophobicContact CG-CD1 3.64Å; F101-I147 HydrophobicContact CZ-CB 4.31Å; F101-I147 HydrophobicContact CZ-CD1 3.77Å; F101-I147 HydrophobicContact CZ-CG2 3.97Å; H123-I147 CarbonylContact C-O 3.56Å; H123-I147 VanDerWaalsContact CA-O 3.23Å; H123-I147 WeakPolarHBondContact CA-O 3.2Å; H123-I147 WeakPolarHBondContact CB-O 3.09Å; Y124-I147 PolarHBondContact N-O 2.73Å; Y124-I147 PolarHBondContact O-N 2.8Å; L126-I147 HydrophobicContact CD1-CD1 3.33Å; L126-I147 HydrophobicContact CD1-CG1 3.89Å; F145-I147 HydrophobicContact CD2-CG1 4.38Å; F145-I147 HydrophobicContact CE2-CD1 4.24Å; F145-I147 HydrophobicContact CE2-CG1 3.84Å
148	K	89.7	Confident	87.9	Confident	77 Å²	77	49.7 Å²	49.7	34%	0.335	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	134.6	170.3	-77.1	179.4	168.4	174.1	0	109.8	Q59 F60 F61 V62 H123 I146	Q59-K148 VanDerWaalsContact OE1-CE 3.27Å; F60-K148 PolarHBondContact O-N 3.37Å; F61-K148 WeakPolarHBondContact CA-O 3.25Å; F61-K148 HydrophobicContact CD1-CB 3.85Å; F61-K148 HydrophobicContact CD1-CD 4.47Å; F61-K148 HydrophobicContact CE1-CB 3.97Å; F61-K148 HydrophobicContact CE1-CD 3.74Å; F61-K148 HydrophobicContact CE1-CG 4.48Å; F61-K148 HydrophobicContact CZ-CD 4.32Å; V62-K148 PolarHBondContact N-O 3.34Å; H123-K148 HydrophobicContact CB-CG 4.25Å; I146-K148 HydrophobicContact CG2-CG 4.13Å
149	V	90.4	Very high	88.4	Confident	13 Å²	13	47.4 Å²	47.4	8%	0.079	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	135.9	166.8	-171.8	0	0	0	0	107.8	V62 E64 L116 R118 K121 T122 Y124	V62-V149 CarbonylContact O-C 3.47Å; V62-V149 WeakPolarHBondContact O-CA 3.33Å; E64-V149 HydrophobicContact CB-CG1 3.66Å; L116-V149 HydrophobicContact CB-CG1 4.35Å; L116-V149 HydrophobicContact CB-CG2 4.35Å; L116-V149 HydrophobicContact CD1-CG2 4.05Å; R118-V149 HydrophobicContact CB-CB 4.23Å; R118-V149 HydrophobicContact CB-CG1 3.78Å; R118-V149 HydrophobicContact CG-CB 4.2Å; R118-V149 HydrophobicContact CG-CG1 4.22Å; K121-V149 VanDerWaalsContact O-CG2 3.3Å; K121-V149 WeakPolarHBondContact O-CG2 3.28Å; T122-V149 PolarHBondContact O-N 2.91Å; Y124-V149 HydrophobicContact CD2-CG2 4.47Å; Y124-V149 HydrophobicContact CE2-CG2 4.07Å
150	Q	87.8	Confident	88.4	Confident	46 Å²	46	48.8 Å²	48.8	22%	0.215	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	126.8	174.3	-80.6	-172.6	-18.7	0	0	109.8	F61 V62 L63 E64 Y191	F61-Q150 HydrophobicContact CB-CG 3.97Å; F61-Q150 HydrophobicContact CD1-CG 3.83Å; F61-Q150 HydrophobicContact CG-CG 4.31Å; V62-Q150 PolarHBondContact O-N 2.79Å; L63-Q150 HydrophobicContact CD2-CB 3.82Å; L63-Q150 HydrophobicContact CG-CB 4.38Å; E64-Q150 PolarHBondContact N-O 3.32Å; Q150-Y191 VanDerWaalsContact CD-OH 3.26Å; Q150-Y191 PolarHBondContact NE2-OH 2.9Å; Q150-Y191 PolarHBondContact OE1-OH 3.19Å
151	D	88.1	Confident	88.7	Confident	8 Å²	8	52.4 Å²	52.4	4%	0.043	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-58.5	134.4	-178.5	-179.5	88.6	0	0	0	114	E64 R118 D188 Y191 S194	E64-D151 WeakPolarHBondContact OE1-CA 3.29Å; R118-D151 IonicContact CZ-OD1 2.65Å; R118-D151 IonicContact NE-OD1 3.71Å; R118-D151 PolarHBondContact NE-OD1 3Å; D151-D188 HydrophobicContact CB-CB 3.86Å; D151-D188 VanDerWaalsContact OD1-CB 3.31Å; D151-D188 WeakPolarHBondContact OD1-CB 3.28Å; D151-D188 PolarHBondContact OD1-N 2.85Å; D151-Y191 HydrophobicContact CB-CD1 3.65Å; D151-Y191 HydrophobicContact CB-CE1 4.44Å; D151-Y191 HydrophobicContact CB-CG 4.02Å; D151-Y191 WeakPolarHBondContact O-CD1 3.3Å; D151-Y191 VanDerWaalsContact O-CE1 3.3Å; D151-Y191 WeakPolarHBondContact O-CE1 3.39Å; D151-S194 WeakPolarHBondContact OD2-CB 3.42Å; D151-S194 PolarHBondContact OD2-OG 3.47Å
152	I	87.4	Confident	88.7	Confident	65 Å²	65	49.8 Å²	49.8	33%	0.333	26%	0.264	S	S	.	.			trans	-124	138.6	168.1	-64.7	179.2	0	0	0	107.9	L63 E64 D154	L63-I152 HydrophobicContact CB-CD1 4.47Å; L63-I152 HydrophobicContact CD2-CD1 4.45Å; L63-I152 HydrophobicContact CD2-CG1 4.29Å; E64-I152 HydrophobicContact CG-CB 3.98Å; E64-I152 HydrophobicContact CG-CD1 4.03Å; E64-I152 HydrophobicContact CG-CG1 3.97Å; E64-I152 VanDerWaalsContact O-CD1 3.25Å; E64-I152 WeakPolarHBondContact O-CD1 3.44Å; E64-I152 PolarHBondContact OE1-N 3.12Å; I152-D154 VanDerWaalsContact C-N 3.28Å; I152-D154 PolarHBondContact O-N 2.81Å
153	N	87.4	Confident	88.9	Confident	31 Å²	31	49.5 Å²	49.5	17%	0.166	27%	0.272	C	S	.	.			trans	-73.8	76.4	-179.3	-167	122.8	0	0	0	111.6	D187 S194 D240 M241	N153-D187 VanDerWaalsContact CA-OD2 3.24Å; N153-D187 WeakPolarHBondContact CA-OD2 3.3Å; N153-S194 VanDerWaalsContact OD1-CA 3.26Å; N153-S194 WeakPolarHBondContact OD1-CA 3.14Å; N153-S194 PolarHBondContact OD1-O 2.98Å; N153-D240 PolarHBondContact ND2-OD2 3.2Å; N153-M241 WeakPolarHBondContact OD1-CG 3.45Å
154	D	87.6	Confident	89.4	Confident	86 Å²	86	49.4 Å²	49.4	46%	0.46	27%	0.268	S	S	.	.			trans	-105.2	-22.1	-176.5	108.6	-47.1	0	0	0	113.4	I152 D187 L248	I152-D154 VanDerWaalsContact C-N 3.28Å; I152-D154 PolarHBondContact O-N 2.81Å; D154-D187 PolarHBondContact N-OD2 2.8Å; D154-L248 WeakPolarHBondContact O-CD1 3.05Å
155	N	89.9	Confident	89.7	Confident	29 Å²	29	50.9 Å²	50.9	16%	0.155	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-87.6	140.7	172.6	-68.2	-87.4	0	0	0	111.8	K158 A186 D187	N155-K158 PolarHBondContact OD1-NZ 3.4Å; N155-A186 HydrophobicContact CB-CB 3.98Å; N155-D187 WeakPolarHBondContact CB-OD1 3.45Å; N155-D187 PolarHBondContact N-OD1 2.89Å; N155-D187 PolarHBondContact N-OD2 2.88Å; N155-D187 PolarHBondContact ND2-OD1 2.83Å
156	A	91.6	Very high	90.1	Very high	30 Å²	30	51.5 Å²	51.5	25%	0.248	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-90.4	146.4	166.4	0	0	0	0	0	110.7	K158 L248	A156-K158 WeakPolarHBondContact O-CD 3.47Å; A156-K158 VanDerWaalsContact O-CE 3.25Å; A156-K158 WeakPolarHBondContact O-CE 3.39Å; A156-K158 WeakPolarHBondContact O-CG 3.28Å; A156-K158 PolarHBondContact O-N 3.5Å; A156-L248 HydrophobicContact CB-CB 3.85Å; A156-L248 HydrophobicContact CB-CD1 4.41Å
157	P	94.1	Very high	90.4	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.013	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-54.7	132.5	173.6	-23	27.4	0	0	0	112.1	A183 D185 V197 A238 D240 G250	P157-A183 HydrophobicContact CB-CB 4.17Å; P157-D185 VanDerWaalsContact CD-OD2 3.22Å; P157-D185 WeakPolarHBondContact CD-OD2 3.29Å; P157-D185 WeakPolarHBondContact CG-OD2 3.18Å; P157-V197 HydrophobicContact CB-CG2 4.04Å; P157-V197 HydrophobicContact CG-CG2 4.09Å; P157-A238 HydrophobicContact CB-CB 3.82Å; P157-D240 HydrophobicContact CG-CB 3.91Å; P157-G250 VanDerWaalsContact O-CA 3.24Å; P157-G250 WeakPolarHBondContact O-CA 3.41Å; P157-G250 PolarHBondContact O-N 2.92Å
158	K	93.3	Very high	90.6	Very high	104 Å²	104	54 Å²	54	45%	0.452	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.1	-178.6	-68	137.6	-168.8	163.2	0	110.5	N155 A156 A183 T184	N155-K158 PolarHBondContact OD1-NZ 3.4Å; A156-K158 WeakPolarHBondContact O-CD 3.47Å; A156-K158 VanDerWaalsContact O-CE 3.25Å; A156-K158 WeakPolarHBondContact O-CE 3.39Å; A156-K158 WeakPolarHBondContact O-CG 3.28Å; A156-K158 PolarHBondContact O-N 3.5Å; K158-A183 CarbonylContact O-C 3.57Å; K158-A183 WeakPolarHBondContact O-CA 3.38Å; K158-T184 PolarHBondContact N-O 2.63Å; K158-T184 PolarHBondContact O-N 2.72Å; K158-T184 PolarHBondContact O-OG1 3.38Å
159	F	94.3	Very high	90.8	Very high	30 Å²	30	53.2 Å²	53.2	13%	0.132	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.6	169.1	-66.7	-89.4	0	0	0	108.9	Y164 V181 T182 A183 Y199 I236 A238 T252	F159-Y164 HydrophobicContact CD1-CE2 4.36Å; F159-V181 HydrophobicContact CD1-CB 4.39Å; F159-V181 HydrophobicContact CE1-CB 4.05Å; F159-V181 HydrophobicContact CE1-CG2 3.91Å; F159-T182 WeakPolarHBondContact CD1-O 3.03Å; F159-A183 HydrophobicContact CD1-CB 3.9Å; F159-A183 HydrophobicContact CD2-CB 4.24Å; F159-A183 HydrophobicContact CE1-CB 3.87Å; F159-A183 HydrophobicContact CE2-CB 4.22Å; F159-A183 HydrophobicContact CG-CB 4.09Å; F159-A183 HydrophobicContact CZ-CB 4.04Å; F159-Y199 HydrophobicContact CE1-CD1 4.34Å; F159-Y199 AromaticContact CE1-CE1 3.93Å; F159-Y199 HydrophobicContact CE1-CE1 3.93Å; F159-Y199 HydrophobicContact CZ-CD1 4.27Å; F159-Y199 HydrophobicContact CZ-CE1 4.17Å; F159-I236 HydrophobicContact CZ-CB 4.46Å; F159-I236 HydrophobicContact CZ-CG2 4.04Å; F159-A238 HydrophobicContact CE1-CB 4.33Å; F159-A238 HydrophobicContact CE2-CB 3.55Å; F159-A238 HydrophobicContact CZ-CB 3.44Å; F159-A238 VanDerWaalsContact CZ-CB 3.44Å; F159-T252 HydrophobicContact CB-CG2 4.36Å; F159-T252 HydrophobicContact CD1-CG2 3.58Å; F159-T252 HydrophobicContact CD2-CG2 3.72Å; F159-T252 HydrophobicContact CE1-CG2 3.62Å; F159-T252 HydrophobicContact CE2-CG2 3.76Å; F159-T252 HydrophobicContact CG-CG2 3.63Å; F159-T252 HydrophobicContact CZ-CG2 3.7Å
160	T	85.7	Confident	90.9	Very high	94 Å²	94	52.7 Å²	52.7	58%	0.577	30%	0.299	S	S	*	.	S	Bend	trans	-80.2	-31.5	-176.3	47.4	0	0	0	0	113.6
161	D	87.4	Confident	90.9	Very high	101 Å²	101	53.5 Å²	53.5	54%	0.54	30%	0.303	S	S	.	.	S	Bend	trans	-111.7	14.5	-167.2	-16.8	-59.9	0	0	0	112.9	Y164	D161-Y164 HydrophobicContact CB-CE1 3.82Å; D161-Y164 WeakPolarHBondContact O-CE1 3.39Å; D161-Y164 PolarHBondContact OD2-OH 2.99Å
162	G	83.2	Confident	91.1	Very high	34 Å²	34	54 Å²	54	35%	0.351	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-87.5	157.3	177.3	0	0	0	0	0	113.6
163	P	89.3	Confident	91.3	Very high	99 Å²	99	56.6 Å²	56.6	64%	0.643	32%	0.322	S	S	*	.	S	Bend	cis	-76.4	145.6	-0.4	32.2	-35.6	0	0	0	112.4	T253	P163-T253 WeakPolarHBondContact CA-O 3.36Å
164	Y	94.3	Very high	91.5	Very high	24 Å²	24	60 Å²	60	9%	0.094	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	145.9	-176.1	-61.2	-89.4	0	0	0	111.4	F159 D161 L179 V181 T252 T253 V254 N255	F159-Y164 HydrophobicContact CD1-CE2 4.36Å; D161-Y164 HydrophobicContact CB-CE1 3.82Å; D161-Y164 WeakPolarHBondContact O-CE1 3.39Å; D161-Y164 PolarHBondContact OD2-OH 2.99Å; Y164-L179 HydrophobicContact CD1-CD2 3.89Å; Y164-L179 HydrophobicContact CG-CD2 3.84Å; Y164-V181 HydrophobicContact CD1-CG1 4.48Å; Y164-V181 HydrophobicContact CD2-CG1 3.72Å; Y164-V181 HydrophobicContact CE1-CG1 4.42Å; Y164-V181 HydrophobicContact CE2-CB 4.06Å; Y164-V181 HydrophobicContact CE2-CG1 3.65Å; Y164-V181 HydrophobicContact CG-CG1 4.16Å; Y164-T252 HydrophobicContact CD2-CG2 4.15Å; Y164-T252 HydrophobicContact CE2-CG2 3.98Å; Y164-T253 PolarHBondContact N-O 2.91Å; Y164-V254 HydrophobicContact CD2-CG2 4.08Å; Y164-V254 HydrophobicContact CG-CG2 4.45Å; Y164-V254 WeakPolarHBondContact O-CA 2.96Å; Y164-N255 PolarHBondContact O-N 3.09Å
165	I	95.3	Very high	91.8	Very high	143 Å²	143	57.2 Å²	57.2	73%	0.733	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.7	130.3	170.5	-56.5	176.4	0	0	0	107.5	N255	I165-N255 WeakPolarHBondContact CA-O 3.34Å
166	V	95.6	Very high	92	Very high	25 Å²	25	58 Å²	58	15%	0.152	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	150.7	-177.8	63.1	0	0	0	0	110.9	V178 L179 V254 N255 I256 T257	V166-V178 HydrophobicContact CG1-CG1 3.74Å; V166-V178 HydrophobicContact CG2-CG1 4Å; V166-L179 HydrophobicContact CB-CD2 4.5Å; V166-L179 HydrophobicContact CG1-CB 4.32Å; V166-L179 HydrophobicContact CG1-CD2 4.31Å; V166-L179 HydrophobicContact CG2-CB 4.4Å; V166-V254 HydrophobicContact CG1-CG1 3.92Å; V166-N255 PolarHBondContact N-O 3.37Å; V166-I256 HydrophobicContact CG1-CB 4.41Å; V166-I256 HydrophobicContact CG1-CG1 3.82Å; V166-I256 HydrophobicContact CG1-CG2 4.41Å; V166-I256 WeakPolarHBondContact O-CA 3.07Å; V166-T257 PolarHBondContact O-N 3.35Å; V166-T257 VanDerWaalsContact O-N 3.07Å
167	T	96.1	Very high	92.1	Very high	88 Å²	88	60 Å²	60	54%	0.54	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	150.4	173.9	43.3	0	0	0	0	111.4	T257 T259	T167-T257 VanDerWaalsContact CA-O 3.3Å; T167-T257 WeakPolarHBondContact CA-O 3.27Å; T167-T259 HydrophobicContact CG2-CG2 3.62Å
168	V	94.8	Very high	92.1	Very high	5 Å²	5	60.8 Å²	60.8	3%	0.03	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	137.5	170.9	63.4	0	0	0	0	109.2	T176 V178 I256 T257 L258 T259	V168-T176 HydrophobicContact CG2-CG2 4.47Å; V168-V178 HydrophobicContact CB-CG1 4.29Å; V168-V178 HydrophobicContact CB-CG2 4.38Å; V168-V178 HydrophobicContact CG2-CG2 4.17Å; V168-I256 HydrophobicContact CG1-CG2 3.74Å; V168-T257 PolarHBondContact N-O 2.93Å; V168-T257 VanDerWaalsContact N-O 3.14Å; V168-L258 HydrophobicContact CG1-CD2 3.63Å; V168-L258 CarbonylContact O-C 3.57Å; V168-L258 VanDerWaalsContact O-CA 3.31Å; V168-L258 WeakPolarHBondContact O-CA 3.37Å; V168-T259 PolarHBondContact O-N 2.98Å; V168-T259 PolarHBondContact O-OG1 3.28Å
169	P	92.8	Very high	92.2	Very high	61 Å²	61	57.8 Å²	57.8	40%	0.396	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	141.1	174.4	-24.5	35	0	0	0	111.7	S172 T259	P169-S172 VanDerWaalsContact O-CB 3.3Å; P169-S172 WeakPolarHBondContact O-CB 3.48Å; P169-S172 PolarHBondContact O-OG 2.95Å; P169-T259 WeakPolarHBondContact CA-OG1 3.39Å
170	E	93.4	Very high	92.3	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.005	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	165.6	165.9	77.6	-165.6	109.8	0	0	111.8	S172 M224 R226 L258 T259 D260 V261 R357	E170-S172 PolarHBondContact O-N 3.38Å; E170-M224 WeakPolarHBondContact CB-O 3.44Å; E170-R226 VanDerWaalsContact CD-CB 3.47Å; E170-R226 WeakPolarHBondContact OE1-CB 3.4Å; E170-R226 WeakPolarHBondContact OE2-CB 3.42Å; E170-R226 PolarHBondContact OE2-N 3.02Å; E170-L258 HydrophobicContact CB-CB 4.4Å; E170-L258 HydrophobicContact CB-CD1 4.17Å; E170-T259 PolarHBondContact N-O 3.15Å; E170-D260 VanDerWaalsContact OE1-CA 3.23Å; E170-D260 WeakPolarHBondContact OE1-CA 3.4Å; E170-V261 HydrophobicContact CG-CB 3.7Å; E170-V261 HydrophobicContact CG-CG2 3.66Å; E170-V261 PolarHBondContact OE1-N 3.17Å; E170-R357 PolarHBondContact O-NH1 3.01Å
171	M	88.3	Confident	92.7	Very high	63 Å²	63	57.2 Å²	57.2	31%	0.31	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	19.6	-164.7	-55.7	-164.4	-179	0	0	114.7	D173 M224 D263 F358	M171-D173 PolarHBondContact O-N 2.85Å; M171-M224 PolarHBondContact N-O 3.38Å; M171-D263 HydrophobicContact CE-CB 3.69Å; M171-D263 WeakPolarHBondContact CE-OD2 3.12Å; M171-D263 HydrophobicContact SD-CB 4.38Å; M171-F358 HydrophobicContact SD-CZ 4.15Å
172	S	91.3	Very high	93	Very high	18 Å²	18	55.6 Å²	55.6	13%	0.126	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-60.2	134.6	171.4	-76.4	0	0	0	0	111.1	P169 E170	P169-S172 VanDerWaalsContact O-CB 3.3Å; P169-S172 WeakPolarHBondContact O-CB 3.48Å; P169-S172 PolarHBondContact O-OG 2.95Å; E170-S172 PolarHBondContact O-N 3.38Å
173	D	91.4	Very high	93.4	Very high	121 Å²	121	54.3 Å²	54.3	65%	0.647	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-55.2	150	176.9	-79	-55.4	0	0	0	112.4	M171 G175 T176 T219	M171-D173 PolarHBondContact O-N 2.85Å; D173-G175 PolarHBondContact O-N 2.87Å; D173-T176 VanDerWaalsContact O-CB 3.28Å; D173-T176 WeakPolarHBondContact O-CB 3.37Å; D173-T176 PolarHBondContact O-N 2.93Å; D173-T176 VanDerWaalsContact O-N 3.15Å; D173-T176 PolarHBondContact O-OG1 3Å; D173-T219 PolarHBondContact O-OG1 2.79Å
174	M	92.8	Very high	93.5	Very high	101 Å²	101	53 Å²	53	50%	0.498	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	131.9	172.7	-177.2	-173.4	-69.7	0	0	110.2	A220	M174-A220 WeakPolarHBondContact CE-O 3Å
175	G	92.6	Very high	93.4	Very high	29 Å²	29	53.4 Å²	53.4	30%	0.299	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	-1.7	-177.6	0	0	0	0	0	114.5	D173 S177 R218 T219	D173-G175 PolarHBondContact O-N 2.87Å; G175-S177 PolarHBondContact O-N 2.84Å; G175-R218 WeakPolarHBondContact O-CD 3.24Å; G175-R218 PolarHBondContact O-NH1 2.91Å; G175-T219 PolarHBondContact N-O 3.12Å; G175-T219 PolarHBondContact N-OG1 3.4Å; G175-T219 VanDerWaalsContact N-OG1 3.13Å
176	T	93.8	Very high	93.2	Very high	45 Å²	45	48.6 Å²	48.6	28%	0.276	29%	0.289	S	S	.	.			trans	-54.3	130	171.5	-64.5	0	0	0	0	110.2	V168 D173 R218 T219	V168-T176 HydrophobicContact CG2-CG2 4.47Å; D173-T176 VanDerWaalsContact O-CB 3.28Å; D173-T176 WeakPolarHBondContact O-CB 3.37Å; D173-T176 PolarHBondContact O-N 2.93Å; D173-T176 VanDerWaalsContact O-N 3.15Å; D173-T176 PolarHBondContact O-OG1 3Å; T176-R218 WeakPolarHBondContact O-CA 3.08Å; T176-R218 WeakPolarHBondContact O-CB 3.38Å; T176-T219 WeakPolarHBondContact CB-OG1 3.33Å; T176-T219 PolarHBondContact N-OG1 3.37Å; T176-T219 PolarHBondContact O-N 2.96Å; T176-T219 VanDerWaalsContact O-N 3.08Å
177	S	94.8	Very high	93	Very high	71 Å²	71	47.7 Å²	47.7	50%	0.497	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	120.1	-177.2	-171.2	0	0	0	0	110.4	G175 V216	G175-S177 PolarHBondContact O-N 2.84Å; S177-V216 WeakPolarHBondContact OG-CG1 3.32Å
178	V	94.5	Very high	92.4	Very high	20 Å²	20	45.4 Å²	45.4	12%	0.121	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-55.6	-175.8	-176.4	0	0	0	0	111.2	V166 V168 F208 I217 T219 I256	V166-V178 HydrophobicContact CG1-CG1 3.74Å; V166-V178 HydrophobicContact CG2-CG1 4Å; V168-V178 HydrophobicContact CB-CG1 4.29Å; V168-V178 HydrophobicContact CB-CG2 4.38Å; V168-V178 HydrophobicContact CG2-CG2 4.17Å; V178-F208 HydrophobicContact CG2-CD1 4.48Å; V178-F208 HydrophobicContact CG2-CE1 4.2Å; V178-I217 PolarHBondContact N-O 3.34Å; V178-T219 HydrophobicContact CG2-CG2 4.2Å; V178-I256 HydrophobicContact CG1-CD1 4.3Å; V178-I256 HydrophobicContact CG1-CG2 4.25Å
179	L	95	Very high	91.6	Very high	41 Å²	41	49.3 Å²	49.3	22%	0.215	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	148.1	-175.8	-179.6	63.5	0	0	0	109.7	Y164 V166 V181 I217 V254	Y164-L179 HydrophobicContact CD1-CD2 3.89Å; Y164-L179 HydrophobicContact CG-CD2 3.84Å; V166-L179 HydrophobicContact CB-CD2 4.5Å; V166-L179 HydrophobicContact CG1-CB 4.32Å; V166-L179 HydrophobicContact CG1-CD2 4.31Å; V166-L179 HydrophobicContact CG2-CB 4.4Å; L179-V181 HydrophobicContact CD2-CG1 3.86Å; L179-V181 HydrophobicContact CG-CG1 4.21Å; L179-I217 PolarHBondContact O-N 3.13Å; L179-V254 HydrophobicContact CD2-CG1 3.8Å
180	Q	94.9	Very high	90.8	Very high	112 Å²	112	52.5 Å²	52.5	52%	0.523	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.3	164.3	-171.2	175	-0.7	0	0	109	T214 V216	Q180-T214 WeakPolarHBondContact CG-O 3.25Å; Q180-T214 PolarHBondContact NE2-O 3.34Å; Q180-V216 HydrophobicContact CB-CG2 4Å; Q180-V216 HydrophobicContact CG-CG2 3.73Å
181	V	94.6	Very high	89.8	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	33%	0.33	C	S	.	.			trans	-97.3	143.9	172.5	-62.7	0	0	0	0	110.2	F159 Y164 L179 Y199 G215 I217 I236 V254	F159-V181 HydrophobicContact CD1-CB 4.39Å; F159-V181 HydrophobicContact CE1-CB 4.05Å; F159-V181 HydrophobicContact CE1-CG2 3.91Å; Y164-V181 HydrophobicContact CD1-CG1 4.48Å; Y164-V181 HydrophobicContact CD2-CG1 3.72Å; Y164-V181 HydrophobicContact CE1-CG1 4.42Å; Y164-V181 HydrophobicContact CE2-CB 4.06Å; Y164-V181 HydrophobicContact CE2-CG1 3.65Å; Y164-V181 HydrophobicContact CG-CG1 4.16Å; L179-V181 HydrophobicContact CD2-CG1 3.86Å; L179-V181 HydrophobicContact CG-CG1 4.21Å; V181-Y199 HydrophobicContact CG2-CD1 4.5Å; V181-G215 PolarHBondContact N-O 3.14Å; V181-I217 HydrophobicContact CG1-CD1 4.05Å; V181-I217 HydrophobicContact CG2-CD1 4.45Å; V181-I236 HydrophobicContact CG2-CB 4.46Å; V181-I236 HydrophobicContact CG2-CG1 4.29Å; V181-I236 HydrophobicContact CG2-CG2 4Å; V181-V254 HydrophobicContact CG1-CG2 3.92Å
182	T	93.8	Very high	88.8	Confident	66 Å²	66	56.7 Å²	56.7	41%	0.405	34%	0.342	S	S	.	.			trans	-125.2	128.8	179.1	-55	0	0	0	0	109.6	F159	F159-T182 WeakPolarHBondContact CD1-O 3.03Å
183	A	92.9	Very high	87.9	Confident	8 Å²	8	58.8 Å²	58.8	7%	0.066	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	138.1	164.2	0	0	0	0	0	109.2	P157 K158 F159 V197 Y199 A238	P157-A183 HydrophobicContact CB-CB 4.17Å; K158-A183 CarbonylContact O-C 3.57Å; K158-A183 WeakPolarHBondContact O-CA 3.38Å; F159-A183 HydrophobicContact CD1-CB 3.9Å; F159-A183 HydrophobicContact CD2-CB 4.24Å; F159-A183 HydrophobicContact CE1-CB 3.87Å; F159-A183 HydrophobicContact CE2-CB 4.22Å; F159-A183 HydrophobicContact CG-CB 4.09Å; F159-A183 HydrophobicContact CZ-CB 4.04Å; A183-V197 HydrophobicContact CB-CG1 4.48Å; A183-Y199 HydrophobicContact CB-CE1 4.09Å; A183-Y199 PolarHBondContact N-OH 3.36Å; A183-A238 HydrophobicContact CB-CB 3.37Å
184	T	91.4	Very high	87.2	Confident	72 Å²	72	53.2 Å²	53.2	44%	0.442	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.8	171.6	53.4	0	0	0	0	109.3	K158	K158-T184 PolarHBondContact N-O 2.63Å; K158-T184 PolarHBondContact O-N 2.72Å; K158-T184 PolarHBondContact O-OG1 3.38Å
185	D	91.9	Very high	86.6	Confident	31 Å²	31	49.3 Å²	49.3	17%	0.166	31%	0.305	C	S	.	.			trans	-99.7	160.8	164.1	-139.5	-47.7	0	0	0	110.5	P157 A195 V197	P157-D185 VanDerWaalsContact CD-OD2 3.22Å; P157-D185 WeakPolarHBondContact CD-OD2 3.29Å; P157-D185 WeakPolarHBondContact CG-OD2 3.18Å; D185-A195 HydrophobicContact CB-CB 3.68Å; D185-V197 HydrophobicContact CB-CG2 4.4Å
186	A	90.9	Very high	86.3	Confident	43 Å²	43	54.3 Å²	54.3	36%	0.355	32%	0.315	S	S	.	.			trans	-94.5	-33.7	179.1	0	0	0	0	0	112.3	R118 E119 N155	R118-A186 PolarHBondContact NH2-O 3.49Å; E119-A186 HydrophobicContact CG-CB 3.83Å; N155-A186 HydrophobicContact CB-CB 3.98Å
187	D	90.3	Very high	86.2	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.027	31%	0.31	C	S	.	.	S	Bend	trans	-62.8	178.4	-172.6	-56.7	-5.7	0	0	0	113.3	R118 N153 D154 N155 P189 A195	R118-D187 VanDerWaalsContact NH2-C 3.26Å; N153-D187 VanDerWaalsContact CA-OD2 3.24Å; N153-D187 WeakPolarHBondContact CA-OD2 3.3Å; D154-D187 PolarHBondContact N-OD2 2.8Å; N155-D187 WeakPolarHBondContact CB-OD1 3.45Å; N155-D187 PolarHBondContact N-OD1 2.89Å; N155-D187 PolarHBondContact N-OD2 2.88Å; N155-D187 PolarHBondContact ND2-OD1 2.83Å; D187-P189 WeakPolarHBondContact O-CD 3.43Å; D187-A195 HydrophobicContact CB-CB 4.09Å; D187-A195 WeakPolarHBondContact O-CB 3.47Å
188	D	84.9	Confident	86.1	Confident	40 Å²	40	52 Å²	52	21%	0.214	30%	0.298	C	S	.	.			trans	-80.6	119	-178.6	-153.9	-61	0	0	0	112.1	R118 D151 T190 Y191	R118-D188 VanDerWaalsContact NH1-CB 3.26Å; R118-D188 IonicContact NH1-OD2 2.67Å; R118-D188 PolarHBondContact NH1-OD2 3.18Å; R118-D188 VanDerWaalsContact NH1-OD2 3.1Å; D151-D188 HydrophobicContact CB-CB 3.86Å; D151-D188 VanDerWaalsContact OD1-CB 3.31Å; D151-D188 WeakPolarHBondContact OD1-CB 3.28Å; D151-D188 PolarHBondContact OD1-N 2.85Å; D188-T190 PolarHBondContact O-N 3.21Å; D188-T190 WeakPolarHBondContact OD1-CA 3.38Å; D188-T190 VanDerWaalsContact OD1-CB 3.27Å; D188-T190 WeakPolarHBondContact OD1-CB 3.29Å; D188-T190 PolarHBondContact OD1-N 3.32Å; D188-T190 PolarHBondContact OD1-OG1 3.05Å; D188-Y191 VanDerWaalsContact O-O 3.09Å; D188-Y191 PolarHBondContact OD1-N 3.48Å
189	P	77.1	Confident	86.1	Confident	88 Å²	88	52 Å²	52	57%	0.571	30%	0.296	S	S	*	.	S	Bend	trans	-73.9	-9.1	176.6	30.6	-35.7	0	0	0	113.1	D187 A195	D187-P189 WeakPolarHBondContact O-CD 3.43Å; P189-A195 HydrophobicContact CB-CB 4.21Å
190	T	76.9	Confident	86.1	Confident	128 Å²	128	52 Å²	52	79%	0.785	30%	0.299	S	S	*	.	S	Bend	trans	-99.5	-19.8	-179.9	76.9	0	0	0	0	113.5	D188	D188-T190 PolarHBondContact O-N 3.21Å; D188-T190 WeakPolarHBondContact OD1-CA 3.38Å; D188-T190 VanDerWaalsContact OD1-CB 3.27Å; D188-T190 WeakPolarHBondContact OD1-CB 3.29Å; D188-T190 PolarHBondContact OD1-N 3.32Å; D188-T190 PolarHBondContact OD1-OG1 3.05Å
191	Y	71.4	Confident	86.2	Confident	98 Å²	98	48.2 Å²	48.2	38%	0.384	28%	0.282	S	S	.	.	S	Bend	trans	-98.7	144.5	173.4	-153.9	-109.1	0	0	0	110	Q150 D151 D188 N193 S194	Q150-Y191 VanDerWaalsContact CD-OH 3.26Å; Q150-Y191 PolarHBondContact NE2-OH 2.9Å; Q150-Y191 PolarHBondContact OE1-OH 3.19Å; D151-Y191 HydrophobicContact CB-CD1 3.65Å; D151-Y191 HydrophobicContact CB-CE1 4.44Å; D151-Y191 HydrophobicContact CB-CG 4.02Å; D151-Y191 WeakPolarHBondContact O-CD1 3.3Å; D151-Y191 VanDerWaalsContact O-CE1 3.3Å; D151-Y191 WeakPolarHBondContact O-CE1 3.39Å; D188-Y191 VanDerWaalsContact O-O 3.09Å; D188-Y191 PolarHBondContact OD1-N 3.48Å; Y191-N193 PolarHBondContact O-N 3.1Å; Y191-S194 PolarHBondContact O-N 2.75Å; Y191-S194 PolarHBondContact O-OG 3.4Å
192	G	66.6	Low	86.2	Confident	54 Å²	54	53.1 Å²	53.1	56%	0.557	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	-26.2	174.7	0	0	0	0	0	118.6	S194	G192-S194 VanDerWaalsContact C-N 3.34Å
193	N	73.6	Confident	86.2	Confident	61 Å²	61	55.8 Å²	55.8	33%	0.326	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	23.9	-140.8	-53	-104.7	0	0	0	113.6	Y191 R196 M241	Y191-N193 PolarHBondContact O-N 3.1Å; N193-R196 HydrophobicContact CB-CB 3.95Å; N193-R196 WeakPolarHBondContact O-CB 3.33Å; N193-R196 PolarHBondContact O-N 3.14Å; N193-R196 VanDerWaalsContact OD1-CD 3.32Å; N193-R196 WeakPolarHBondContact OD1-CD 3.13Å; N193-R196 PolarHBondContact OD1-NH1 3.36Å; N193-M241 VanDerWaalsContact O-CA 3.27Å; N193-M241 WeakPolarHBondContact O-CA 3.24Å; N193-M241 PolarHBondContact O-N 3.15Å
194	S	75.8	Confident	86.1	Confident	5 Å²	5	56 Å²	56	4%	0.035	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-73.7	-173.8	-46.9	0	0	0	0	111.4	D151 N153 Y191 G192 R196 D240 M241	D151-S194 WeakPolarHBondContact OD2-CB 3.42Å; D151-S194 PolarHBondContact OD2-OG 3.47Å; N153-S194 VanDerWaalsContact OD1-CA 3.26Å; N153-S194 WeakPolarHBondContact OD1-CA 3.14Å; N153-S194 PolarHBondContact OD1-O 2.98Å; Y191-S194 PolarHBondContact O-N 2.75Å; Y191-S194 PolarHBondContact O-OG 3.4Å; G192-S194 VanDerWaalsContact C-N 3.34Å; S194-R196 PolarHBondContact O-N 3.39Å; S194-D240 WeakPolarHBondContact O-CB 3.24Å; S194-M241 PolarHBondContact O-N 3.04Å
195	A	80.2	Confident	86.1	Confident	18 Å²	18	58.7 Å²	58.7	15%	0.149	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	16	176.6	0	0	0	0	0	115.8	D185 D187 P189 V197	D185-A195 HydrophobicContact CB-CB 3.68Å; D187-A195 HydrophobicContact CB-CB 4.09Å; D187-A195 WeakPolarHBondContact O-CB 3.47Å; P189-A195 HydrophobicContact CB-CB 4.21Å; A195-V197 PolarHBondContact O-N 3.18Å; A195-V197 VanDerWaalsContact O-N 3.13Å
196	R	87.4	Confident	86.1	Confident	135 Å²	135	60.9 Å²	60.9	51%	0.509	34%	0.343	S	S	.	.			trans	-87.4	83.2	-179	-169.3	175.3	166.8	-168.2	-2.8	111.4	N193 S194 A242	N193-R196 HydrophobicContact CB-CB 3.95Å; N193-R196 WeakPolarHBondContact O-CB 3.33Å; N193-R196 PolarHBondContact O-N 3.14Å; N193-R196 VanDerWaalsContact OD1-CD 3.32Å; N193-R196 WeakPolarHBondContact OD1-CD 3.13Å; N193-R196 PolarHBondContact OD1-NH1 3.36Å; S194-R196 PolarHBondContact O-N 3.39Å; R196-A242 HydrophobicContact CG-CB 4.33Å; R196-A242 VanDerWaalsContact O-CA 3.29Å; R196-A242 WeakPolarHBondContact O-CA 3.44Å; R196-A242 PolarHBondContact O-N 3.48Å
197	V	91.1	Very high	86.3	Confident	26 Å²	26	62.3 Å²	62.3	16%	0.158	34%	0.339	C	S	.	.			trans	-58.8	138.7	176.6	-177	0	0	0	0	112.8	P157 A183 D185 A195 Y199 A238 K239	P157-V197 HydrophobicContact CB-CG2 4.04Å; P157-V197 HydrophobicContact CG-CG2 4.09Å; A183-V197 HydrophobicContact CB-CG1 4.48Å; D185-V197 HydrophobicContact CB-CG2 4.4Å; A195-V197 PolarHBondContact O-N 3.18Å; A195-V197 VanDerWaalsContact O-N 3.13Å; V197-Y199 HydrophobicContact CG1-CD1 4.39Å; V197-Y199 HydrophobicContact CG1-CD2 4.47Å; V197-Y199 HydrophobicContact CG1-CE1 3.98Å; V197-Y199 HydrophobicContact CG1-CE2 4.07Å; V197-A238 HydrophobicContact CG1-CB 3.65Å; V197-K239 CarbonylContact C-O 3.53Å; V197-K239 WeakPolarHBondContact CA-O 3.26Å
198	V	93.3	Very high	86.6	Confident	42 Å²	42	62 Å²	62	26%	0.255	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	134.9	163.9	165.9	0	0	0	0	109	P212 K239	V198-P212 WeakPolarHBondContact CA-O 3.48Å; V198-P212 HydrophobicContact CG1-CB 4Å; V198-K239 PolarHBondContact N-O 2.95Å; V198-K239 PolarHBondContact O-N 3.36Å
199	Y	95.1	Very high	87.1	Confident	19 Å²	19	62 Å²	62	8%	0.075	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	144.1	-179.6	-59.3	-83.4	0	0	0	112.4	F159 V181 A183 V197 P212 I236 Q237 A238	F159-Y199 HydrophobicContact CE1-CD1 4.34Å; F159-Y199 AromaticContact CE1-CE1 3.93Å; F159-Y199 HydrophobicContact CE1-CE1 3.93Å; F159-Y199 HydrophobicContact CZ-CD1 4.27Å; F159-Y199 HydrophobicContact CZ-CE1 4.17Å; V181-Y199 HydrophobicContact CG2-CD1 4.5Å; A183-Y199 HydrophobicContact CB-CE1 4.09Å; A183-Y199 PolarHBondContact N-OH 3.36Å; V197-Y199 HydrophobicContact CG1-CD1 4.39Å; V197-Y199 HydrophobicContact CG1-CD2 4.47Å; V197-Y199 HydrophobicContact CG1-CE1 3.98Å; V197-Y199 HydrophobicContact CG1-CE2 4.07Å; Y199-P212 PolarHBondContact N-O 3.04Å; Y199-P212 WeakPolarHBondContact O-CA 3.02Å; Y199-P212 WeakPolarHBondContact O-CB 3.37Å; Y199-I236 HydrophobicContact CD1-CG2 4.22Å; Y199-Q237 WeakPolarHBondContact CA-O 3.4Å; Y199-A238 HydrophobicContact CD1-CB 4.15Å; Y199-A238 HydrophobicContact CE1-CB 4.03Å
200	S	95.1	Very high	88	Confident	40 Å²	40	59 Å²	59	28%	0.28	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	161.3	174.2	68.8	0	0	0	0	111.7	I236 Q237	S200-I236 WeakPolarHBondContact O-CA 2.97Å; S200-Q237 PolarHBondContact N-O 3.11Å; S200-Q237 PolarHBondContact O-N 2.66Å; S200-Q237 PolarHBondContact OG-OE1 2.88Å
201	I	95.9	Very high	88.9	Confident	33 Å²	33	55.4 Å²	55.4	17%	0.169	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.7	172.7	-73.9	165.9	0	0	0	108.9	Q203 Q205 F208 S209 V210 V234 I236	I201-Q203 WeakPolarHBondContact CG2-O 3.32Å; I201-Q205 HydrophobicContact CB-CG 4.36Å; I201-Q205 HydrophobicContact CG2-CG 3.81Å; I201-F208 HydrophobicContact CD1-CB 4.34Å; I201-F208 WeakPolarHBondContact CD1-O 3.49Å; I201-S209 VanDerWaalsContact CD1-C 3.48Å; I201-V210 HydrophobicContact CD1-CB 4.15Å; I201-V210 HydrophobicContact CD1-CG1 4.21Å; I201-V210 HydrophobicContact CG1-CB 4.16Å; I201-V210 HydrophobicContact CG1-CG1 3.86Å; I201-V234 HydrophobicContact CD1-CG1 4.48Å; I201-V234 HydrophobicContact CG1-CG1 4.25Å; I201-V234 HydrophobicContact CG2-CG1 4.49Å; I201-I236 HydrophobicContact CD1-CD1 4.49Å; I201-I236 HydrophobicContact CG1-CD1 3.63Å
202	L	94.4	Very high	90	Very high	104 Å²	104	53.9 Å²	53.9	55%	0.545	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-33.2	169.4	-63.2	-179.4	0	0	0	111.9	V235 Q237	L202-V235 HydrophobicContact CB-CB 4.32Å; L202-V235 HydrophobicContact CB-CG1 4.19Å; L202-V235 HydrophobicContact CD1-CG1 4.2Å; L202-V235 PolarHBondContact N-O 3.07Å; L202-Q237 HydrophobicContact CD1-CB 3.9Å; L202-Q237 HydrophobicContact CD2-CB 4.31Å; L202-Q237 HydrophobicContact CG-CB 3.86Å
203	Q	94.9	Very high	91.2	Very high	121 Å²	121	59.8 Å²	59.8	57%	0.565	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.7	137	179.7	179.3	176.5	-9.2	0	0	109.2	I201 V234 V235	I201-Q203 WeakPolarHBondContact CG2-O 3.32Å; Q203-V234 CarbonylContact O-C 3.52Å; Q203-V234 VanDerWaalsContact O-CA 3.24Å; Q203-V234 WeakPolarHBondContact O-CA 3.45Å; Q203-V234 WeakPolarHBondContact O-CG1 3.19Å; Q203-V235 HydrophobicContact CB-CB 4.07Å; Q203-V235 HydrophobicContact CB-CG2 4.08Å; Q203-V235 PolarHBondContact O-N 2.86Å
204	G	89.5	Confident	92.1	Very high	14 Å²	14	59.4 Å²	59.4	14%	0.144	31%	0.309	C	S	.	.			trans	130.9	-13.5	-179.2	0	0	0	0	0	114.8	Y207 F208	G204-Y207 PolarHBondContact O-N 3.03Å; G204-F208 PolarHBondContact O-N 3.47Å; G204-F208 VanDerWaalsContact O-N 3.16Å
205	Q	91.6	Very high	92.9	Very high	128 Å²	128	59.2 Å²	59.2	60%	0.598	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	150.5	168.3	-62.1	-116.8	-70	0	0	110.6	I201 F208	I201-Q205 HydrophobicContact CB-CG 4.36Å; I201-Q205 HydrophobicContact CG2-CG 3.81Å; Q205-F208 PolarHBondContact NE2-O 3.47Å
206	P	92.8	Very high	93.7	Very high	77 Å²	77	59 Å²	59	50%	0.5	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	cis	-81.7	-5.4	-0.1	34.7	-37.3	0	0	0	114.5	F208 A220	P206-F208 VanDerWaalsContact C-N 3.34Å; P206-F208 PolarHBondContact O-N 3.12Å; P206-A220 WeakPolarHBondContact O-CB 3.37Å
207	Y	94.1	Very high	94.1	Very high	72 Å²	72	52.6 Å²	52.6	28%	0.282	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-34.7	-171.1	-52.4	-83.3	0	0	0	114.1	G204 A220 L221 M224 Y232	G204-Y207 PolarHBondContact O-N 3.03Å; Y207-A220 PolarHBondContact O-N 3.07Å; Y207-L221 HydrophobicContact CD1-CD2 3.58Å; Y207-L221 HydrophobicContact CE1-CD2 3.69Å; Y207-M224 HydrophobicContact CD1-CE 4.05Å; Y207-M224 HydrophobicContact CG-CE 4.34Å; Y207-Y232 HydrophobicContact CD1-CD1 4.34Å; Y207-Y232 AromaticContact CD1-CE1 3.49Å; Y207-Y232 HydrophobicContact CD1-CE1 3.49Å; Y207-Y232 VanDerWaalsContact CD1-CE1 3.49Å; Y207-Y232 HydrophobicContact CD2-CD1 4.12Å; Y207-Y232 AromaticContact CD2-CE1 3.94Å; Y207-Y232 HydrophobicContact CD2-CE1 3.94Å; Y207-Y232 AromaticContact CE1-CE1 3.79Å; Y207-Y232 HydrophobicContact CE1-CE1 3.79Å; Y207-Y232 HydrophobicContact CE2-CE1 4.22Å; Y207-Y232 AromaticContact CG-CD1 3.96Å; Y207-Y232 HydrophobicContact CG-CD1 3.96Å; Y207-Y232 AromaticContact CG-CE1 3.57Å; Y207-Y232 HydrophobicContact CG-CE1 3.57Å
208	F	96.1	Very high	94.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	153.6	-177.6	-60	-80.8	0	0	0	113.5	V178 I201 G204 Q205 P206 I217 R218 T219 M224 Y232 V234 I256	V178-F208 HydrophobicContact CG2-CD1 4.48Å; V178-F208 HydrophobicContact CG2-CE1 4.2Å; I201-F208 HydrophobicContact CD1-CB 4.34Å; I201-F208 WeakPolarHBondContact CD1-O 3.49Å; G204-F208 PolarHBondContact O-N 3.47Å; G204-F208 VanDerWaalsContact O-N 3.16Å; Q205-F208 PolarHBondContact NE2-O 3.47Å; P206-F208 VanDerWaalsContact C-N 3.34Å; P206-F208 PolarHBondContact O-N 3.12Å; F208-I217 HydrophobicContact CB-CG2 4.26Å; F208-I217 HydrophobicContact CD1-CG2 4.23Å; F208-R218 WeakPolarHBondContact CA-O 3.31Å; F208-T219 HydrophobicContact CE1-CG2 4.42Å; F208-M224 HydrophobicContact CE1-CE 4.48Å; F208-M224 HydrophobicContact CE1-SD 4.42Å; F208-M224 HydrophobicContact CE2-CE 3.91Å; F208-M224 HydrophobicContact CZ-CE 3.67Å; F208-M224 HydrophobicContact CZ-SD 4.16Å; F208-Y232 HydrophobicContact CE2-CD1 4.04Å; F208-Y232 HydrophobicContact CE2-CD2 4.45Å; F208-Y232 AromaticContact CE2-CG 3.83Å; F208-Y232 HydrophobicContact CE2-CG 3.83Å; F208-Y232 HydrophobicContact CZ-CG 4.41Å; F208-V234 HydrophobicContact CB-CG2 4.34Å; F208-V234 HydrophobicContact CD2-CG2 3.48Å; F208-V234 VanDerWaalsContact CD2-CG2 3.48Å; F208-V234 HydrophobicContact CE2-CG2 4.03Å; F208-V234 HydrophobicContact CG-CG2 4.03Å; F208-I256 HydrophobicContact CD1-CD1 3.87Å; F208-I256 HydrophobicContact CD2-CD1 4.11Å; F208-I256 HydrophobicContact CE1-CD1 3.6Å; F208-I256 HydrophobicContact CE1-CG2 4.24Å; F208-I256 HydrophobicContact CE2-CD1 3.87Å; F208-I256 HydrophobicContact CG-CD1 4.12Å; F208-I256 HydrophobicContact CZ-CB 4.18Å; F208-I256 HydrophobicContact CZ-CD1 3.6Å; F208-I256 HydrophobicContact CZ-CG1 4.48Å; F208-I256 HydrophobicContact CZ-CG2 3.85Å
209	S	95.6	Very high	94.4	Very high	40 Å²	40	54.2 Å²	54.2	28%	0.28	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	159.3	171.1	61.6	0	0	0	0	109.7	I201 I217 R218	I201-S209 VanDerWaalsContact CD1-C 3.48Å; S209-I217 CarbonylContact O-C 3.3Å; S209-I217 WeakPolarHBondContact O-CA 3.46Å; S209-R218 PolarHBondContact N-O 2.85Å; S209-R218 PolarHBondContact O-N 3.29Å; S209-R218 PolarHBondContact OG-O 2.9Å
210	V	96.7	Very high	94.4	Very high	23 Å²	23	54.7 Å²	54.7	14%	0.139	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	138.6	172.5	70.2	0	0	0	0	109.1	I201 P212 V216 I217 I236	I201-V210 HydrophobicContact CD1-CB 4.15Å; I201-V210 HydrophobicContact CD1-CG1 4.21Å; I201-V210 HydrophobicContact CG1-CB 4.16Å; I201-V210 HydrophobicContact CG1-CG1 3.86Å; V210-P212 WeakPolarHBondContact O-CD 3.5Å; V210-V216 WeakPolarHBondContact CA-O 3.35Å; V210-I217 HydrophobicContact CG2-CG1 4.07Å; V210-I236 HydrophobicContact CB-CD1 4.41Å; V210-I236 HydrophobicContact CG2-CD1 4.5Å
211	D	95.9	Very high	94.2	Very high	54 Å²	54	56 Å²	56	29%	0.289	29%	0.291	S	S	.	.			trans	-70.7	117.4	168.5	175.4	-14.3	0	0	0	109.1	K213 T214 G215 V216	D211-K213 PolarHBondContact O-N 3.24Å; D211-K213 PolarHBondContact OD1-N 2.9Å; D211-T214 VanDerWaalsContact CB-OG1 3.23Å; D211-T214 WeakPolarHBondContact CB-OG1 3.36Å; D211-T214 PolarHBondContact O-N 2.82Å; D211-T214 PolarHBondContact OD1-N 2.84Å; D211-T214 VanDerWaalsContact OD2-CG2 3.3Å; D211-T214 WeakPolarHBondContact OD2-CG2 3.23Å; D211-T214 PolarHBondContact OD2-OG1 3.24Å; D211-G215 PolarHBondContact O-N 3.29Å; D211-V216 HydrophobicContact CB-CB 4.47Å; D211-V216 PolarHBondContact N-O 2.98Å
212	P	94.4	Very high	93.7	Very high	65 Å²	65	59.5 Å²	59.5	42%	0.422	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.5	-175	27	-35.6	0	0	0	114.3	V198 Y199 V210	V198-P212 WeakPolarHBondContact CA-O 3.48Å; V198-P212 HydrophobicContact CG1-CB 4Å; Y199-P212 PolarHBondContact N-O 3.04Å; Y199-P212 WeakPolarHBondContact O-CA 3.02Å; Y199-P212 WeakPolarHBondContact O-CB 3.37Å; V210-P212 WeakPolarHBondContact O-CD 3.5Å
213	K	91	Very high	93.2	Very high	178 Å²	178	60.3 Å²	60.3	77%	0.774	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-35.1	179	-62.3	176.9	-174.9	171	0	113.5	D211	D211-K213 PolarHBondContact O-N 3.24Å; D211-K213 PolarHBondContact OD1-N 2.9Å
214	T	93.2	Very high	93.1	Very high	54 Å²	54	55 Å²	55	33%	0.331	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-16	-172.1	64.6	0	0	0	0	113.8	Q180 D211 V216	Q180-T214 WeakPolarHBondContact CG-O 3.25Å; Q180-T214 PolarHBondContact NE2-O 3.34Å; D211-T214 VanDerWaalsContact CB-OG1 3.23Å; D211-T214 WeakPolarHBondContact CB-OG1 3.36Å; D211-T214 PolarHBondContact O-N 2.82Å; D211-T214 PolarHBondContact OD1-N 2.84Å; D211-T214 VanDerWaalsContact OD2-CG2 3.3Å; D211-T214 WeakPolarHBondContact OD2-CG2 3.23Å; D211-T214 PolarHBondContact OD2-OG1 3.24Å; T214-V216 PolarHBondContact O-N 3.15Å; T214-V216 WeakPolarHBondContact OG1-CG2 3.24Å; T214-V216 PolarHBondContact OG1-N 3.41Å
215	G	92.8	Very high	93.3	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.296	C	S	.	.			trans	73.7	9.3	-175.5	0	0	0	0	0	113.8	V181 D211 I217	V181-G215 PolarHBondContact N-O 3.14Å; D211-G215 PolarHBondContact O-N 3.29Å; G215-I217 PolarHBondContact O-N 3.07Å
216	V	96.3	Very high	93.5	Very high	15 Å²	15	52.6 Å²	52.6	9%	0.091	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	115.8	176.6	178.2	0	0	0	0	110.1	S177 Q180 V210 D211 T214 R218	S177-V216 WeakPolarHBondContact OG-CG1 3.32Å; Q180-V216 HydrophobicContact CB-CG2 4Å; Q180-V216 HydrophobicContact CG-CG2 3.73Å; V210-V216 WeakPolarHBondContact CA-O 3.35Å; D211-V216 HydrophobicContact CB-CB 4.47Å; D211-V216 PolarHBondContact N-O 2.98Å; T214-V216 PolarHBondContact O-N 3.15Å; T214-V216 WeakPolarHBondContact OG1-CG2 3.24Å; T214-V216 PolarHBondContact OG1-N 3.41Å; V216-R218 HydrophobicContact CG1-CG 4.14Å
217	I	96.1	Very high	93.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	133.7	174.5	-55.9	172.1	0	0	0	109.1	V178 L179 V181 F208 S209 V210 G215 I236 V254	V178-I217 PolarHBondContact N-O 3.34Å; L179-I217 PolarHBondContact O-N 3.13Å; V181-I217 HydrophobicContact CG1-CD1 4.05Å; V181-I217 HydrophobicContact CG2-CD1 4.45Å; F208-I217 HydrophobicContact CB-CG2 4.26Å; F208-I217 HydrophobicContact CD1-CG2 4.23Å; S209-I217 CarbonylContact O-C 3.3Å; S209-I217 WeakPolarHBondContact O-CA 3.46Å; V210-I217 HydrophobicContact CG2-CG1 4.07Å; G215-I217 PolarHBondContact O-N 3.07Å; I217-I236 HydrophobicContact CD1-CD1 3.85Å; I217-I236 HydrophobicContact CD1-CG1 3.87Å; I217-I236 HydrophobicContact CG1-CD1 4.09Å; I217-V254 HydrophobicContact CD1-CB 4.33Å; I217-V254 HydrophobicContact CD1-CG1 4.23Å; I217-V254 HydrophobicContact CD1-CG2 3.8Å
218	R	95.9	Very high	93.6	Very high	99 Å²	99	52.1 Å²	52.1	37%	0.374	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	150.1	-179.9	-62.5	178.1	-179.7	-86	-5.1	112.2	G175 T176 F208 S209 V216	G175-R218 WeakPolarHBondContact O-CD 3.24Å; G175-R218 PolarHBondContact O-NH1 2.91Å; T176-R218 WeakPolarHBondContact O-CA 3.08Å; T176-R218 WeakPolarHBondContact O-CB 3.38Å; F208-R218 WeakPolarHBondContact CA-O 3.31Å; S209-R218 PolarHBondContact N-O 2.85Å; S209-R218 PolarHBondContact O-N 3.29Å; S209-R218 PolarHBondContact OG-O 2.9Å; V216-R218 HydrophobicContact CG1-CG 4.14Å
219	T	96	Very high	93.5	Very high	3 Å²	3	57.7 Å²	57.7	2%	0.018	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	137.4	166.1	53.7	0	0	0	0	110.2	D173 G175 T176 V178 F208 M224	D173-T219 PolarHBondContact O-OG1 2.79Å; G175-T219 PolarHBondContact N-O 3.12Å; G175-T219 PolarHBondContact N-OG1 3.4Å; G175-T219 VanDerWaalsContact N-OG1 3.13Å; T176-T219 WeakPolarHBondContact CB-OG1 3.33Å; T176-T219 PolarHBondContact N-OG1 3.37Å; T176-T219 PolarHBondContact O-N 2.96Å; T176-T219 VanDerWaalsContact O-N 3.08Å; V178-T219 HydrophobicContact CG2-CG2 4.2Å; F208-T219 HydrophobicContact CE1-CG2 4.42Å; T219-M224 HydrophobicContact CG2-SD 4.49Å
220	A	93.5	Very high	93.4	Very high	28 Å²	28	59.1 Å²	59.1	23%	0.231	30%	0.303	C	S	.	.			trans	-130.1	0.5	-177.5	0	0	0	0	0	113.5	M174 P206 Y207	M174-A220 WeakPolarHBondContact CE-O 3Å; P206-A220 WeakPolarHBondContact O-CB 3.37Å; Y207-A220 PolarHBondContact O-N 3.07Å
221	L	92.1	Very high	93.4	Very high	67 Å²	67	63.5 Å²	63.5	35%	0.351	32%	0.321	S	S	.	.	S	Bend	trans	-121.5	140.1	171.2	-168.5	68.6	0	0	0	108.8	Y207 M224	Y207-L221 HydrophobicContact CD1-CD2 3.58Å; Y207-L221 HydrophobicContact CE1-CD2 3.69Å; L221-M224 HydrophobicContact CB-CG 4.34Å
222	H	85.7	Confident	93.4	Very high	107 Å²	107	61.8 Å²	61.8	50%	0.495	31%	0.311	S	S	.	.	S	Bend	trans	-73.5	155.5	169	-75.2	-76.6	0	0	0	110.7	M224	H222-M224 VanDerWaalsContact C-N 3.3Å; H222-M224 PolarHBondContact O-N 3.13Å
223	N	83.9	Confident	93.4	Very high	122 Å²	122	60.8 Å²	60.8	65%	0.652	31%	0.305	S	S	*	.	S	Bend	trans	50.9	49.6	170.4	-55.3	17	0	0	0	112
224	M	92.4	Very high	93.7	Very high	8 Å²	8	52.3 Å²	52.3	4%	0.039	27%	0.269	C	S	.	.			trans	-63.4	136.7	161.6	-64.4	-170.6	64.7	0	0	108.2	E170 M171 Y207 F208 T219 L221 H222 Y232 L258	E170-M224 WeakPolarHBondContact CB-O 3.44Å; M171-M224 PolarHBondContact N-O 3.38Å; Y207-M224 HydrophobicContact CD1-CE 4.05Å; Y207-M224 HydrophobicContact CG-CE 4.34Å; F208-M224 HydrophobicContact CE1-CE 4.48Å; F208-M224 HydrophobicContact CE1-SD 4.42Å; F208-M224 HydrophobicContact CE2-CE 3.91Å; F208-M224 HydrophobicContact CZ-CE 3.67Å; F208-M224 HydrophobicContact CZ-SD 4.16Å; T219-M224 HydrophobicContact CG2-SD 4.49Å; L221-M224 HydrophobicContact CB-CG 4.34Å; H222-M224 VanDerWaalsContact C-N 3.3Å; H222-M224 PolarHBondContact O-N 3.13Å; M224-Y232 HydrophobicContact CE-CD1 4.17Å; M224-Y232 HydrophobicContact CE-CD2 3.95Å; M224-Y232 HydrophobicContact CE-CE1 3.72Å; M224-Y232 HydrophobicContact CE-CE2 3.49Å; M224-Y232 VanDerWaalsContact CE-CE2 3.49Å; M224-Y232 HydrophobicContact CE-CG 4.29Å; M224-L258 HydrophobicContact CB-CD1 4.13Å; M224-L258 HydrophobicContact CB-CD2 4.48Å; M224-L258 HydrophobicContact CE-CD2 4.3Å
225	D	93.6	Very high	93.8	Very high	65 Å²	65	50.9 Å²	50.9	35%	0.348	26%	0.26	S	S	.	.			trans	-140.6	127.1	-158.1	156.6	-16	0	0	0	107	E227 A228 R229	D225-E227 PolarHBondContact OD1-N 2.79Å; D225-A228 HydrophobicContact CB-CB 4.32Å; D225-A228 VanDerWaalsContact CG-CB 3.48Å; D225-A228 WeakPolarHBondContact OD1-CB 3.43Å; D225-A228 PolarHBondContact OD1-N 2.9Å; D225-R229 CarbonylContact O-C 3.6Å; D225-R229 PolarHBondContact O-N 2.96Å
226	R	95.5	Very high	94	Very high	28 Å²	28	50.9 Å²	50.9	11%	0.106	26%	0.26	C	S	.	.	H	α-helix	trans	-86	-37.2	-169.3	-173.2	-144.3	67.5	87.2	-1.2	111.5	E170 A228 R229 E230 L258 D260 A295	E170-R226 VanDerWaalsContact CD-CB 3.47Å; E170-R226 WeakPolarHBondContact OE1-CB 3.4Å; E170-R226 WeakPolarHBondContact OE2-CB 3.42Å; E170-R226 PolarHBondContact OE2-N 3.02Å; R226-A228 VanDerWaalsContact C-N 3.28Å; R226-A228 PolarHBondContact O-N 3.43Å; R226-R229 CarbonylContact O-C 3.54Å; R226-R229 VanDerWaalsContact O-C 3.25Å; R226-R229 PolarHBondContact O-N 2.78Å; R226-R229 VanDerWaalsContact O-N 3.15Å; R226-E230 HydrophobicContact CG-CB 3.79Å; R226-E230 HydrophobicContact CG-CG 3.72Å; R226-E230 IonicContact NH1-OE2 3.76Å; R226-E230 PolarHBondContact NH1-OE2 3Å; R226-E230 PolarHBondContact O-N 2.88Å; R226-L258 HydrophobicContact CB-CB 4.01Å; R226-L258 HydrophobicContact CB-CD1 4.33Å; R226-L258 HydrophobicContact CG-CB 4.03Å; R226-D260 IonicContact CZ-OD1 2.78Å; R226-D260 IonicContact NE-OD1 3.75Å; R226-D260 PolarHBondContact NE-OD1 3.38Å; R226-D260 IonicContact NH2-OD1 2.79Å; R226-A295 PolarHBondContact NH2-O 2.64Å
227	E	94.8	Very high	93.9	Very high	62 Å²	62	52.1 Å²	52.1	29%	0.29	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-39	175.1	-70.3	58.1	-126.4	0	0	110.6	D225 A295	D225-E227 PolarHBondContact OD1-N 2.79Å; E227-A295 HydrophobicContact CG-CB 3.86Å
228	A	93.6	Very high	93.9	Very high	77 Å²	77	52.1 Å²	52.1	64%	0.636	27%	0.265	S	S	*	.	H	α-helix	trans	-75.3	-43.4	170.3	0	0	0	0	0	112	D225 R226	D225-A228 HydrophobicContact CB-CB 4.32Å; D225-A228 VanDerWaalsContact CG-CB 3.48Å; D225-A228 WeakPolarHBondContact OD1-CB 3.43Å; D225-A228 PolarHBondContact OD1-N 2.9Å; R226-A228 VanDerWaalsContact C-N 3.28Å; R226-A228 PolarHBondContact O-N 3.43Å
229	R	93.9	Very high	93.8	Very high	117 Å²	117	49.4 Å²	49.4	44%	0.442	26%	0.255	S	S	.	.	H	α-helix	trans	-162.6	101.6	177.1	-174.3	178.1	173	159.9	7	114.9	D225 R226 H231 Y232	D225-R229 CarbonylContact O-C 3.6Å; D225-R229 PolarHBondContact O-N 2.96Å; R226-R229 CarbonylContact O-C 3.54Å; R226-R229 VanDerWaalsContact O-C 3.25Å; R226-R229 PolarHBondContact O-N 2.78Å; R226-R229 VanDerWaalsContact O-N 3.15Å; R229-H231 PolarHBondContact NE-O 2.85Å; R229-H231 PolarHBondContact NH2-O 3.31Å; R229-H231 VanDerWaalsContact NH2-O 3.15Å; R229-Y232 HydrophobicContact CG-CE1 4.29Å; R229-Y232 HydrophobicContact CG-CE2 4.13Å; R229-Y232 WeakPolarHBondContact O-CE2 3.47Å; R229-Y232 PolarHBondContact O-OH 3.31Å
230	E	94.8	Very high	93.6	Very high	70 Å²	70	49.3 Å²	49.3	33%	0.327	26%	0.255	S	S	.	.			trans	-66.5	-40.1	174.8	-170.6	176.3	135	0	0	115.3	R226 T257 L258	R226-E230 HydrophobicContact CG-CB 3.79Å; R226-E230 HydrophobicContact CG-CG 3.72Å; R226-E230 IonicContact NH1-OE2 3.76Å; R226-E230 PolarHBondContact NH1-OE2 3Å; R226-E230 PolarHBondContact O-N 2.88Å; E230-T257 HydrophobicContact CG-CG2 4.03Å; E230-L258 PolarHBondContact O-N 2.92Å
231	H	96	Very high	93.2	Very high	114 Å²	114	50.5 Å²	50.5	53%	0.528	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.3	-167.6	-62.6	-26.2	0	0	0	114.9	R229 T257	R229-H231 PolarHBondContact NE-O 2.85Å; R229-H231 PolarHBondContact NH2-O 3.31Å; R229-H231 VanDerWaalsContact NH2-O 3.15Å; H231-T257 PolarHBondContact ND1-OG1 2.81Å
232	Y	95.3	Very high	92.9	Very high	19 Å²	19	48.7 Å²	48.7	8%	0.075	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	145.1	173.7	-60.9	-95.7	0	0	0	110.6	Y207 F208 M224 R229 I256 L258	Y207-Y232 HydrophobicContact CD1-CD1 4.34Å; Y207-Y232 AromaticContact CD1-CE1 3.49Å; Y207-Y232 HydrophobicContact CD1-CE1 3.49Å; Y207-Y232 VanDerWaalsContact CD1-CE1 3.49Å; Y207-Y232 HydrophobicContact CD2-CD1 4.12Å; Y207-Y232 AromaticContact CD2-CE1 3.94Å; Y207-Y232 HydrophobicContact CD2-CE1 3.94Å; Y207-Y232 AromaticContact CE1-CE1 3.79Å; Y207-Y232 HydrophobicContact CE1-CE1 3.79Å; Y207-Y232 HydrophobicContact CE2-CE1 4.22Å; Y207-Y232 AromaticContact CG-CD1 3.96Å; Y207-Y232 HydrophobicContact CG-CD1 3.96Å; Y207-Y232 AromaticContact CG-CE1 3.57Å; Y207-Y232 HydrophobicContact CG-CE1 3.57Å; F208-Y232 HydrophobicContact CE2-CD1 4.04Å; F208-Y232 HydrophobicContact CE2-CD2 4.45Å; F208-Y232 AromaticContact CE2-CG 3.83Å; F208-Y232 HydrophobicContact CE2-CG 3.83Å; F208-Y232 HydrophobicContact CZ-CG 4.41Å; M224-Y232 HydrophobicContact CE-CD1 4.17Å; M224-Y232 HydrophobicContact CE-CD2 3.95Å; M224-Y232 HydrophobicContact CE-CE1 3.72Å; M224-Y232 HydrophobicContact CE-CE2 3.49Å; M224-Y232 VanDerWaalsContact CE-CE2 3.49Å; M224-Y232 HydrophobicContact CE-CG 4.29Å; R229-Y232 HydrophobicContact CG-CE1 4.29Å; R229-Y232 HydrophobicContact CG-CE2 4.13Å; R229-Y232 WeakPolarHBondContact O-CE2 3.47Å; R229-Y232 PolarHBondContact O-OH 3.31Å; Y232-I256 PolarHBondContact N-O 2.91Å; Y232-I256 PolarHBondContact O-N 3.49Å; Y232-L258 HydrophobicContact CD2-CG 4.35Å; Y232-L258 HydrophobicContact CE2-CD1 3.83Å; Y232-L258 HydrophobicContact CE2-CD2 4.4Å; Y232-L258 HydrophobicContact CE2-CG 3.88Å
233	S	95.4	Very high	92.7	Very high	44 Å²	44	45 Å²	45	31%	0.308	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	120.4	172.7	-164.7	0	0	0	0	107.9	T253 N255	S233-T253 WeakPolarHBondContact OG-CG2 3.31Å; S233-N255 WeakPolarHBondContact CB-OD1 3.5Å; S233-N255 PolarHBondContact OG-OD1 3.01Å
234	V	95.9	Very high	92.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	123.1	-173.9	-178.3	0	0	0	0	108.3	I201 Q203 F208 I236 V254 I256	I201-V234 HydrophobicContact CD1-CG1 4.48Å; I201-V234 HydrophobicContact CG1-CG1 4.25Å; I201-V234 HydrophobicContact CG2-CG1 4.49Å; Q203-V234 CarbonylContact O-C 3.52Å; Q203-V234 VanDerWaalsContact O-CA 3.24Å; Q203-V234 WeakPolarHBondContact O-CA 3.45Å; Q203-V234 WeakPolarHBondContact O-CG1 3.19Å; F208-V234 HydrophobicContact CB-CG2 4.34Å; F208-V234 HydrophobicContact CD2-CG2 3.48Å; F208-V234 VanDerWaalsContact CD2-CG2 3.48Å; F208-V234 HydrophobicContact CE2-CG2 4.03Å; F208-V234 HydrophobicContact CG-CG2 4.03Å; V234-I236 HydrophobicContact CG1-CD1 3.69Å; V234-I236 HydrophobicContact CG1-CG1 4.41Å; V234-V254 HydrophobicContact CB-CB 4.42Å; V234-V254 PolarHBondContact N-O 2.89Å; V234-V254 PolarHBondContact O-N 3.12Å; V234-I256 HydrophobicContact CB-CD1 4.47Å; V234-I256 HydrophobicContact CG2-CD1 3.7Å; V234-I256 HydrophobicContact CG2-CG1 4.42Å
235	V	96.5	Very high	92	Very high	24 Å²	24	51.8 Å²	51.8	15%	0.145	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.4	176.3	-178.6	0	0	0	0	108.3	L202 Q203 T252	L202-V235 HydrophobicContact CB-CB 4.32Å; L202-V235 HydrophobicContact CB-CG1 4.19Å; L202-V235 HydrophobicContact CD1-CG1 4.2Å; L202-V235 PolarHBondContact N-O 3.07Å; Q203-V235 HydrophobicContact CB-CB 4.07Å; Q203-V235 HydrophobicContact CB-CG2 4.08Å; Q203-V235 PolarHBondContact O-N 2.86Å; V235-T252 WeakPolarHBondContact CA-O 3.45Å
236	I	96.2	Very high	91.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	134.2	174.5	-51.9	-61	0	0	0	108.6	F159 V181 Y199 S200 I201 V210 I217 V234 S251 T252 V254	F159-I236 HydrophobicContact CZ-CB 4.46Å; F159-I236 HydrophobicContact CZ-CG2 4.04Å; V181-I236 HydrophobicContact CG2-CB 4.46Å; V181-I236 HydrophobicContact CG2-CG1 4.29Å; V181-I236 HydrophobicContact CG2-CG2 4Å; Y199-I236 HydrophobicContact CD1-CG2 4.22Å; S200-I236 WeakPolarHBondContact O-CA 2.97Å; I201-I236 HydrophobicContact CD1-CD1 4.49Å; I201-I236 HydrophobicContact CG1-CD1 3.63Å; V210-I236 HydrophobicContact CB-CD1 4.41Å; V210-I236 HydrophobicContact CG2-CD1 4.5Å; I217-I236 HydrophobicContact CD1-CD1 3.85Å; I217-I236 HydrophobicContact CD1-CG1 3.87Å; I217-I236 HydrophobicContact CG1-CD1 4.09Å; V234-I236 HydrophobicContact CG1-CD1 3.69Å; V234-I236 HydrophobicContact CG1-CG1 4.41Å; I236-S251 CarbonylContact O-C 3.54Å; I236-S251 WeakPolarHBondContact O-CA 3.29Å; I236-S251 WeakPolarHBondContact O-CB 3.42Å; I236-T252 HydrophobicContact CB-CG2 4.16Å; I236-T252 PolarHBondContact N-O 3.38Å; I236-T252 PolarHBondContact O-N 3.11Å; I236-V254 HydrophobicContact CG1-CG2 4.04Å
237	Q	95.5	Very high	90.7	Very high	41 Å²	41	51.1 Å²	51.1	19%	0.192	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	136	166.6	-180	179.9	52.2	0	0	109.2	Y199 S200 L202 S249 G250	Y199-Q237 WeakPolarHBondContact CA-O 3.4Å; S200-Q237 PolarHBondContact N-O 3.11Å; S200-Q237 PolarHBondContact O-N 2.66Å; S200-Q237 PolarHBondContact OG-OE1 2.88Å; L202-Q237 HydrophobicContact CD1-CB 3.9Å; L202-Q237 HydrophobicContact CD2-CB 4.31Å; L202-Q237 HydrophobicContact CG-CB 3.86Å; Q237-S249 VanDerWaalsContact NE2-CB 3.32Å; Q237-S249 PolarHBondContact NE2-OG 3.1Å; Q237-G250 WeakPolarHBondContact CA-O 3.4Å
238	A	95.4	Very high	90.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.5	163	0	0	0	0	0	107.2	P157 F159 A183 V197 Y199 S249 G250	P157-A238 HydrophobicContact CB-CB 3.82Å; F159-A238 HydrophobicContact CE1-CB 4.33Å; F159-A238 HydrophobicContact CE2-CB 3.55Å; F159-A238 HydrophobicContact CZ-CB 3.44Å; F159-A238 VanDerWaalsContact CZ-CB 3.44Å; A183-A238 HydrophobicContact CB-CB 3.37Å; V197-A238 HydrophobicContact CG1-CB 3.65Å; Y199-A238 HydrophobicContact CD1-CB 4.15Å; Y199-A238 HydrophobicContact CE1-CB 4.03Å; A238-S249 CarbonylContact O-C 3.6Å; A238-S249 WeakPolarHBondContact O-CA 3.44Å; A238-S249 WeakPolarHBondContact O-CB 3.25Å; A238-G250 PolarHBondContact N-O 3.08Å; A238-G250 PolarHBondContact O-N 3.07Å; A238-G250 VanDerWaalsContact O-O 3.12Å
239	K	93.4	Very high	90.5	Very high	42 Å²	42	50.3 Å²	50.3	18%	0.183	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.4	-178.3	-170.7	-179.6	173.8	-164.8	0	110.6	V197 V198 G243 Q244 G247 L248	V197-K239 CarbonylContact C-O 3.53Å; V197-K239 WeakPolarHBondContact CA-O 3.26Å; V198-K239 PolarHBondContact N-O 2.95Å; V198-K239 PolarHBondContact O-N 3.36Å; K239-G243 PolarHBondContact NZ-O 3.5Å; K239-Q244 VanDerWaalsContact CE-O 3.24Å; K239-Q244 WeakPolarHBondContact CE-O 3.5Å; K239-Q244 PolarHBondContact NZ-O 3.05Å; K239-G247 VanDerWaalsContact CE-O 3.26Å; K239-G247 WeakPolarHBondContact CE-O 3.48Å; K239-L248 WeakPolarHBondContact CA-O 3.29Å; K239-L248 VanDerWaalsContact CG-O 3.27Å; K239-L248 WeakPolarHBondContact CG-O 3.48Å
240	D	91.2	Very high	90.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	-71.7	-166.6	180	65.3	22.3	0	0	0	112.5	N153 P157 S194 A242 G243 G247 L248	N153-D240 PolarHBondContact ND2-OD2 3.2Å; P157-D240 HydrophobicContact CG-CB 3.91Å; S194-D240 WeakPolarHBondContact O-CB 3.24Å; D240-A242 PolarHBondContact O-N 3.29Å; D240-G243 WeakPolarHBondContact O-CA 3.48Å; D240-G243 PolarHBondContact O-N 3.01Å; D240-G247 WeakPolarHBondContact OD1-CA 3.36Å; D240-L248 VanDerWaalsContact CG-O 3.25Å; D240-L248 PolarHBondContact N-O 2.8Å; D240-L248 VanDerWaalsContact N-O 3.16Å; D240-L248 PolarHBondContact OD1-N 3.18Å; D240-L248 VanDerWaalsContact OD2-CA 3.26Å; D240-L248 WeakPolarHBondContact OD2-CA 3.3Å; D240-L248 WeakPolarHBondContact OD2-CB 3.21Å; D240-L248 PolarHBondContact OD2-N 3.28Å
241	M	86.7	Confident	90.5	Very high	54 Å²	54	46 Å²	46	27%	0.266	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	51.6	30	175.7	-61.8	-160.8	83.4	0	0	114.4	N153 N193 S194 G243 Q244	N153-M241 WeakPolarHBondContact OD1-CG 3.45Å; N193-M241 VanDerWaalsContact O-CA 3.27Å; N193-M241 WeakPolarHBondContact O-CA 3.24Å; N193-M241 PolarHBondContact O-N 3.15Å; S194-M241 PolarHBondContact O-N 3.04Å; M241-G243 PolarHBondContact O-N 3.12Å; M241-Q244 HydrophobicContact CB-CB 4.42Å; M241-Q244 WeakPolarHBondContact O-CB 3.23Å; M241-Q244 VanDerWaalsContact O-CG 3.25Å; M241-Q244 WeakPolarHBondContact O-CG 3.42Å; M241-Q244 PolarHBondContact O-N 3.44Å; M241-Q244 VanDerWaalsContact O-N 3.17Å
242	A	84.6	Confident	90.5	Very high	29 Å²	29	41 Å²	41	24%	0.24	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	52.6	31.7	-169.4	0	0	0	0	0	114.5	R196 D240	R196-A242 HydrophobicContact CG-CB 4.33Å; R196-A242 VanDerWaalsContact O-CA 3.29Å; R196-A242 WeakPolarHBondContact O-CA 3.44Å; R196-A242 PolarHBondContact O-N 3.48Å; D240-A242 PolarHBondContact O-N 3.29Å
243	G	81.9	Confident	90.5	Very high	29 Å²	29	42.4 Å²	42.4	30%	0.299	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	83.5	1.4	-179.2	0	0	0	0	0	115.8	K239 D240 M241	K239-G243 PolarHBondContact NZ-O 3.5Å; D240-G243 WeakPolarHBondContact O-CA 3.48Å; D240-G243 PolarHBondContact O-N 3.01Å; M241-G243 PolarHBondContact O-N 3.12Å
244	Q	84.4	Confident	90.6	Very high	119 Å²	119	40.3 Å²	40.3	56%	0.556	26%	0.259	S	S	*	.			trans	-67.6	162.4	-170	-68.3	-177.6	37.8	0	0	114.7	K239 M241 G246 G247	K239-Q244 VanDerWaalsContact CE-O 3.24Å; K239-Q244 WeakPolarHBondContact CE-O 3.5Å; K239-Q244 PolarHBondContact NZ-O 3.05Å; M241-Q244 HydrophobicContact CB-CB 4.42Å; M241-Q244 WeakPolarHBondContact O-CB 3.23Å; M241-Q244 VanDerWaalsContact O-CG 3.25Å; M241-Q244 WeakPolarHBondContact O-CG 3.42Å; M241-Q244 PolarHBondContact O-N 3.44Å; M241-Q244 VanDerWaalsContact O-N 3.17Å; Q244-G246 PolarHBondContact O-N 3.24Å; Q244-G247 PolarHBondContact O-N 3.34Å
245	V	76.8	Confident	90.6	Very high	154 Å²	154	43.4 Å²	43.4	93%	0.933	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	120.3	177.5	-177.4	0	0	0	0	109.3
246	G	76.4	Confident	90.6	Very high	64 Å²	64	42.2 Å²	42.2	66%	0.66	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	123.3	-33.2	-171.6	0	0	0	0	0	112.3	Q244	Q244-G246 PolarHBondContact O-N 3.24Å
247	G	85.8	Confident	90.6	Very high	15 Å²	15	44.1 Å²	44.1	16%	0.155	28%	0.28	C	S	.	.			trans	-67.9	145.3	-177.4	0	0	0	0	0	116	K239 D240 Q244	K239-G247 VanDerWaalsContact CE-O 3.26Å; K239-G247 WeakPolarHBondContact CE-O 3.48Å; D240-G247 WeakPolarHBondContact OD1-CA 3.36Å; Q244-G247 PolarHBondContact O-N 3.34Å
248	L	90.9	Very high	90.6	Very high	69 Å²	69	42.3 Å²	42.3	36%	0.361	27%	0.271	S	S	.	.			trans	-80.4	166.9	176.5	-44.5	174.1	0	0	0	110.9	D154 A156 K239 D240	D154-L248 WeakPolarHBondContact O-CD1 3.05Å; A156-L248 HydrophobicContact CB-CB 3.85Å; A156-L248 HydrophobicContact CB-CD1 4.41Å; K239-L248 WeakPolarHBondContact CA-O 3.29Å; K239-L248 VanDerWaalsContact CG-O 3.27Å; K239-L248 WeakPolarHBondContact CG-O 3.48Å; D240-L248 VanDerWaalsContact CG-O 3.25Å; D240-L248 PolarHBondContact N-O 2.8Å; D240-L248 VanDerWaalsContact N-O 3.16Å; D240-L248 PolarHBondContact OD1-N 3.18Å; D240-L248 VanDerWaalsContact OD2-CA 3.26Å; D240-L248 WeakPolarHBondContact OD2-CA 3.3Å; D240-L248 WeakPolarHBondContact OD2-CB 3.21Å; D240-L248 PolarHBondContact OD2-N 3.28Å
249	S	93.5	Very high	90.6	Very high	53 Å²	53	44.8 Å²	44.8	37%	0.371	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	137.4	-178.1	71.6	0	0	0	0	114	Q237 A238	Q237-S249 VanDerWaalsContact NE2-CB 3.32Å; Q237-S249 PolarHBondContact NE2-OG 3.1Å; A238-S249 CarbonylContact O-C 3.6Å; A238-S249 WeakPolarHBondContact O-CA 3.44Å; A238-S249 WeakPolarHBondContact O-CB 3.25Å
250	G	93.6	Very high	90.6	Very high	15 Å²	15	44.4 Å²	44.4	16%	0.155	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	162.6	160.1	0	0	0	0	0	111.9	P157 Q237 A238	P157-G250 VanDerWaalsContact O-CA 3.24Å; P157-G250 WeakPolarHBondContact O-CA 3.41Å; P157-G250 PolarHBondContact O-N 2.92Å; Q237-G250 WeakPolarHBondContact CA-O 3.4Å; A238-G250 PolarHBondContact N-O 3.08Å; A238-G250 PolarHBondContact O-N 3.07Å; A238-G250 VanDerWaalsContact O-O 3.12Å
251	S	95	Very high	90.6	Very high	80 Å²	80	44.6 Å²	44.6	56%	0.559	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.6	149.7	173.4	58.7	0	0	0	0	111.5	I236	I236-S251 CarbonylContact O-C 3.54Å; I236-S251 WeakPolarHBondContact O-CA 3.29Å; I236-S251 WeakPolarHBondContact O-CB 3.42Å
252	T	95.5	Very high	90.8	Very high	10 Å²	10	42.2 Å²	42.2	6%	0.061	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	154.7	175.6	-170.4	0	0	0	0	110.6	F159 Y164 V235 I236	F159-T252 HydrophobicContact CB-CG2 4.36Å; F159-T252 HydrophobicContact CD1-CG2 3.58Å; F159-T252 HydrophobicContact CD2-CG2 3.72Å; F159-T252 HydrophobicContact CE1-CG2 3.62Å; F159-T252 HydrophobicContact CE2-CG2 3.76Å; F159-T252 HydrophobicContact CG-CG2 3.63Å; F159-T252 HydrophobicContact CZ-CG2 3.7Å; Y164-T252 HydrophobicContact CD2-CG2 4.15Å; Y164-T252 HydrophobicContact CE2-CG2 3.98Å; V235-T252 WeakPolarHBondContact CA-O 3.45Å; I236-T252 HydrophobicContact CB-CG2 4.16Å; I236-T252 PolarHBondContact N-O 3.38Å; I236-T252 PolarHBondContact O-N 3.11Å
253	T	96.1	Very high	91	Very high	49 Å²	49	42.5 Å²	42.5	30%	0.301	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132	175.1	-55.9	0	0	0	0	109.7	P163 Y164 S233	P163-T253 WeakPolarHBondContact CA-O 3.36Å; Y164-T253 PolarHBondContact N-O 2.91Å; S233-T253 WeakPolarHBondContact OG-CG2 3.31Å
254	V	96.5	Very high	91.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	112.1	171.8	-173.7	0	0	0	0	107.4	Y164 V166 L179 V181 I217 V234 I236 I256	Y164-V254 HydrophobicContact CD2-CG2 4.08Å; Y164-V254 HydrophobicContact CG-CG2 4.45Å; Y164-V254 WeakPolarHBondContact O-CA 2.96Å; V166-V254 HydrophobicContact CG1-CG1 3.92Å; L179-V254 HydrophobicContact CD2-CG1 3.8Å; V181-V254 HydrophobicContact CG1-CG2 3.92Å; I217-V254 HydrophobicContact CD1-CB 4.33Å; I217-V254 HydrophobicContact CD1-CG1 4.23Å; I217-V254 HydrophobicContact CD1-CG2 3.8Å; V234-V254 HydrophobicContact CB-CB 4.42Å; V234-V254 PolarHBondContact N-O 2.89Å; V234-V254 PolarHBondContact O-N 3.12Å; I236-V254 HydrophobicContact CG1-CG2 4.04Å; V254-I256 HydrophobicContact CG1-CD1 4.29Å; V254-I256 HydrophobicContact CG1-CG1 3.86Å
255	N	96.9	Very high	91.6	Very high	64 Å²	64	39.1 Å²	39.1	34%	0.342	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	120.8	173.2	-67.5	-30.3	0	0	0	108.6	Y164 I165 V166 S233	Y164-N255 PolarHBondContact O-N 3.09Å; I165-N255 WeakPolarHBondContact CA-O 3.34Å; V166-N255 PolarHBondContact N-O 3.37Å; S233-N255 WeakPolarHBondContact CB-OD1 3.5Å; S233-N255 PolarHBondContact OG-OD1 3.01Å
256	I	96.4	Very high	92.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.9	-176	-51.3	177.3	0	0	0	107.9	V166 V168 V178 F208 Y232 V234 V254	V166-I256 HydrophobicContact CG1-CB 4.41Å; V166-I256 HydrophobicContact CG1-CG1 3.82Å; V166-I256 HydrophobicContact CG1-CG2 4.41Å; V166-I256 WeakPolarHBondContact O-CA 3.07Å; V168-I256 HydrophobicContact CG1-CG2 3.74Å; V178-I256 HydrophobicContact CG1-CD1 4.3Å; V178-I256 HydrophobicContact CG1-CG2 4.25Å; F208-I256 HydrophobicContact CD1-CD1 3.87Å; F208-I256 HydrophobicContact CD2-CD1 4.11Å; F208-I256 HydrophobicContact CE1-CD1 3.6Å; F208-I256 HydrophobicContact CE1-CG2 4.24Å; F208-I256 HydrophobicContact CE2-CD1 3.87Å; F208-I256 HydrophobicContact CG-CD1 4.12Å; F208-I256 HydrophobicContact CZ-CB 4.18Å; F208-I256 HydrophobicContact CZ-CD1 3.6Å; F208-I256 HydrophobicContact CZ-CG1 4.48Å; F208-I256 HydrophobicContact CZ-CG2 3.85Å; Y232-I256 PolarHBondContact N-O 2.91Å; Y232-I256 PolarHBondContact O-N 3.49Å; V234-I256 HydrophobicContact CB-CD1 4.47Å; V234-I256 HydrophobicContact CG2-CD1 3.7Å; V234-I256 HydrophobicContact CG2-CG1 4.42Å; V254-I256 HydrophobicContact CG1-CD1 4.29Å; V254-I256 HydrophobicContact CG1-CG1 3.86Å
257	T	96.6	Very high	93.2	Very high	39 Å²	39	35.1 Å²	35.1	24%	0.239	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.3	175.1	-68.8	0	0	0	0	109.1	V166 T167 V168 E230 H231	V166-T257 PolarHBondContact O-N 3.35Å; V166-T257 VanDerWaalsContact O-N 3.07Å; T167-T257 VanDerWaalsContact CA-O 3.3Å; T167-T257 WeakPolarHBondContact CA-O 3.27Å; V168-T257 PolarHBondContact N-O 2.93Å; V168-T257 VanDerWaalsContact N-O 3.14Å; E230-T257 HydrophobicContact CG-CG2 4.03Å; H231-T257 PolarHBondContact ND1-OG1 2.81Å
258	L	95.9	Very high	93.7	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.016	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	131.4	170	-64.2	-172.6	0	0	0	109.6	V168 E170 M224 R226 E230 Y232	V168-L258 HydrophobicContact CG1-CD2 3.63Å; V168-L258 CarbonylContact O-C 3.57Å; V168-L258 VanDerWaalsContact O-CA 3.31Å; V168-L258 WeakPolarHBondContact O-CA 3.37Å; E170-L258 HydrophobicContact CB-CB 4.4Å; E170-L258 HydrophobicContact CB-CD1 4.17Å; M224-L258 HydrophobicContact CB-CD1 4.13Å; M224-L258 HydrophobicContact CB-CD2 4.48Å; M224-L258 HydrophobicContact CE-CD2 4.3Å; R226-L258 HydrophobicContact CB-CB 4.01Å; R226-L258 HydrophobicContact CB-CD1 4.33Å; R226-L258 HydrophobicContact CG-CB 4.03Å; E230-L258 PolarHBondContact O-N 2.92Å; Y232-L258 HydrophobicContact CD2-CG 4.35Å; Y232-L258 HydrophobicContact CE2-CD1 3.83Å; Y232-L258 HydrophobicContact CE2-CD2 4.4Å; Y232-L258 HydrophobicContact CE2-CG 3.88Å
259	T	94.4	Very high	93.9	Very high	53 Å²	53	35.7 Å²	35.7	33%	0.325	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	129.7	170.7	48.5	0	0	0	0	110.7	T167 V168 P169 E170	T167-T259 HydrophobicContact CG2-CG2 3.62Å; V168-T259 PolarHBondContact O-N 2.98Å; V168-T259 PolarHBondContact O-OG1 3.28Å; P169-T259 WeakPolarHBondContact CA-OG1 3.39Å; E170-T259 PolarHBondContact N-O 3.15Å
260	D	93.3	Very high	94	Very high	33 Å²	33	38.3 Å²	38.3	18%	0.176	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-47.8	137.4	-177.5	-157	99.4	0	0	0	114.9	E170 R226 T297 N300	E170-D260 VanDerWaalsContact OE1-CA 3.23Å; E170-D260 WeakPolarHBondContact OE1-CA 3.4Å; R226-D260 IonicContact CZ-OD1 2.78Å; R226-D260 IonicContact NE-OD1 3.75Å; R226-D260 PolarHBondContact NE-OD1 3.38Å; R226-D260 IonicContact NH2-OD1 2.79Å; D260-T297 VanDerWaalsContact CG-N 3.27Å; D260-T297 WeakPolarHBondContact OD1-CA 3.49Å; D260-T297 VanDerWaalsContact OD1-CB 3.28Å; D260-T297 WeakPolarHBondContact OD1-CB 3.44Å; D260-T297 PolarHBondContact OD1-N 3.34Å; D260-T297 PolarHBondContact OD1-OG1 3.2Å; D260-T297 PolarHBondContact OD2-N 2.95Å; D260-T297 VanDerWaalsContact OD2-N 3.1Å; D260-N300 PolarHBondContact O-ND2 2.71Å; D260-N300 WeakPolarHBondContact OD2-CB 3.18Å; D260-N300 PolarHBondContact OD2-ND2 3.07Å
261	V	90.8	Very high	94	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.024	24%	0.24	C	C	.	.			trans	-129.1	141.3	178.1	168.9	0	0	0	0	108.9	E170 D263 F358	E170-V261 HydrophobicContact CG-CB 3.7Å; E170-V261 HydrophobicContact CG-CG2 3.66Å; E170-V261 PolarHBondContact OE1-N 3.17Å; V261-D263 VanDerWaalsContact C-N 3.3Å; V261-D263 PolarHBondContact O-N 2.6Å; V261-F358 HydrophobicContact CG1-CE2 4.18Å
262	N	90.7	Very high	94	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	24%	0.24	C	C	.	.	S	Bend	trans	-74.8	84.3	174.7	-170.3	-28.2	0	0	0	110.4	D296 N300 H353 D355 F358 F364	N262-D296 VanDerWaalsContact CA-OD2 3.27Å; N262-D296 WeakPolarHBondContact CA-OD2 3.42Å; N262-N300 HydrophobicContact CB-CB 3.79Å; N262-N300 PolarHBondContact N-ND2 3.09Å; N262-N300 PolarHBondContact ND2-O 3.1Å; N262-H353 PolarHBondContact ND2-O 2.93Å; N262-H353 VanDerWaalsContact ND2-O 3.09Å; N262-D355 HydrophobicContact CB-CB 4.38Å; N262-F358 WeakPolarHBondContact O-CD2 3.43Å; N262-F358 WeakPolarHBondContact O-CE2 3.5Å; N262-F364 VanDerWaalsContact OD1-CD2 3.29Å; N262-F364 WeakPolarHBondContact OD1-CD2 3.47Å
263	D	88.8	Confident	94	Very high	36 Å²	36	49.1 Å²	49.1	19%	0.193	25%	0.245	C	C	.	.			trans	-114.2	-23.1	173.5	93.9	-71.7	0	0	0	113.4	M171 V261 P265 F358 F364	M171-D263 HydrophobicContact CE-CB 3.69Å; M171-D263 WeakPolarHBondContact CE-OD2 3.12Å; M171-D263 HydrophobicContact SD-CB 4.38Å; V261-D263 VanDerWaalsContact C-N 3.3Å; V261-D263 PolarHBondContact O-N 2.6Å; D263-P265 WeakPolarHBondContact O-CD 3.44Å; D263-F358 HydrophobicContact CB-CE2 3.71Å; D263-F358 HydrophobicContact CB-CZ 3.86Å; D263-F364 WeakPolarHBondContact O-CE2 3.4Å
264	N	89	Confident	94	Very high	46 Å²	46	53.1 Å²	53.1	25%	0.246	26%	0.26	C	S	.	.	S	Bend	trans	-91.2	118.9	179.8	-63	-86.4	0	0	0	112.2	A295 D296	N264-A295 HydrophobicContact CB-CB 3.91Å; N264-D296 WeakPolarHBondContact CB-OD1 3.36Å; N264-D296 PolarHBondContact N-OD1 3.42Å; N264-D296 PolarHBondContact ND2-OD1 3.18Å
265	P	89.8	Confident	94	Very high	31 Å²	31	55 Å²	55	20%	0.201	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-71.9	141.1	173.1	28.2	-34.6	0	0	0	111.3	D263 R267 F364	D263-P265 WeakPolarHBondContact O-CD 3.44Å; P265-R267 WeakPolarHBondContact O-CG 3.5Å; P265-R267 PolarHBondContact O-N 3.12Å; P265-F364 HydrophobicContact CB-CB 3.79Å; P265-F364 HydrophobicContact CB-CD1 4.35Å; P265-F364 HydrophobicContact CB-CG 4.01Å
266	P	93.8	Very high	94	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-60.2	136.9	174.5	25.7	-36.1	0	0	0	109.5	A292 N293 D294 M303 N351 D366	P266-A292 HydrophobicContact CB-CB 4.04Å; P266-N293 CarbonylContact C-O 3.51Å; P266-N293 WeakPolarHBondContact CA-O 3.48Å; P266-D294 HydrophobicContact CB-CB 4.29Å; P266-M303 HydrophobicContact CB-CE 3.91Å; P266-M303 HydrophobicContact CB-SD 4.22Å; P266-N351 WeakPolarHBondContact CD-OD1 3.44Å; P266-D366 WeakPolarHBondContact O-CB 3.19Å
267	R	94.6	Very high	94	Very high	134 Å²	134	59 Å²	59	51%	0.506	28%	0.282	S	S	.	.	B	Isolated β-bridge	trans	-123.2	128.4	-178.1	-64.2	-54.6	-177.3	-173.2	-5.2	111.6	P265 P269 A292 N293 D366	P265-R267 WeakPolarHBondContact O-CG 3.5Å; P265-R267 PolarHBondContact O-N 3.12Å; R267-P269 VanDerWaalsContact O-CD 3.3Å; R267-P269 WeakPolarHBondContact O-CD 3.23Å; R267-A292 CarbonylContact O-C 3.56Å; R267-A292 WeakPolarHBondContact O-CA 3.21Å; R267-N293 PolarHBondContact N-O 2.73Å; R267-N293 PolarHBondContact O-N 2.69Å; R267-D366 WeakPolarHBondContact CA-OD2 3.46Å; R267-D366 IonicContact NH1-OD1 3.73Å
268	F	96.3	Very high	94	Very high	15 Å²	15	59.4 Å²	59.4	7%	0.066	29%	0.285	C	S	.	.			trans	-73.4	123.9	167.6	-72.9	-75.8	0	0	0	110.2	Q270 Y273 I290 A292 Y305 I347 D366 T368	F268-Q270 PolarHBondContact O-N 2.83Å; F268-Y273 HydrophobicContact CB-CE2 4.21Å; F268-Y273 HydrophobicContact CD1-CE2 4.09Å; F268-Y273 HydrophobicContact CG-CE2 4.49Å; F268-I290 HydrophobicContact CD1-CD1 4.36Å; F268-I290 HydrophobicContact CD1-CG1 4.22Å; F268-I290 HydrophobicContact CE1-CD1 4.02Å; F268-I290 HydrophobicContact CE1-CG1 3.93Å; F268-I290 HydrophobicContact CE1-CG2 4.49Å; F268-A292 HydrophobicContact CD1-CB 3.92Å; F268-A292 HydrophobicContact CD2-CB 4.32Å; F268-A292 HydrophobicContact CE1-CB 3.91Å; F268-A292 HydrophobicContact CE2-CB 4.31Å; F268-A292 HydrophobicContact CG-CB 4.14Å; F268-A292 HydrophobicContact CZ-CB 4.12Å; F268-Y305 HydrophobicContact CE1-CD1 4.25Å; F268-Y305 AromaticContact CE1-CE1 3.81Å; F268-Y305 HydrophobicContact CE1-CE1 3.81Å; F268-Y305 AromaticContact CZ-CD1 3.96Å; F268-Y305 HydrophobicContact CZ-CD1 3.96Å; F268-Y305 AromaticContact CZ-CE1 3.84Å; F268-Y305 HydrophobicContact CZ-CE1 3.84Å; F268-I347 HydrophobicContact CZ-CG2 4.21Å; F268-D366 HydrophobicContact CD2-CB 4.24Å; F268-D366 WeakPolarHBondContact CE2-O 3.26Å; F268-D366 PolarHBondContact N-OD2 2.92Å; F268-T368 HydrophobicContact CB-CG2 4.13Å; F268-T368 HydrophobicContact CD1-CG2 3.52Å; F268-T368 HydrophobicContact CD2-CG2 3.63Å; F268-T368 HydrophobicContact CE1-CG2 3.71Å; F268-T368 HydrophobicContact CE2-CG2 3.8Å; F268-T368 HydrophobicContact CG-CG2 3.47Å; F268-T368 VanDerWaalsContact CG-CG2 3.47Å; F268-T368 HydrophobicContact CZ-CG2 3.84Å
269	P	95.2	Very high	94	Very high	81 Å²	81	59.7 Å²	59.7	53%	0.526	29%	0.286	S	S	.	.	S	Bend	trans	-56.5	-18.8	175.3	-29.6	36.2	0	0	0	115.2	R267 Y273 K291	R267-P269 VanDerWaalsContact O-CD 3.3Å; R267-P269 WeakPolarHBondContact O-CD 3.23Å; P269-Y273 WeakPolarHBondContact CD-OH 3.39Å; P269-K291 WeakPolarHBondContact CD-O 3.12Å
270	Q	94.4	Very high	94	Very high	107 Å²	107	61 Å²	61	50%	0.5	30%	0.298	S	S	.	.			trans	-135.1	140.9	176.7	-59.2	178.7	-27.7	0	0	110.8	F268 H272 Y273 T368	F268-Q270 PolarHBondContact O-N 2.83Å; Q270-H272 VanDerWaalsContact C-N 3.3Å; Q270-Y273 HydrophobicContact CB-CD2 4.31Å; Q270-Y273 HydrophobicContact CB-CE1 4.18Å; Q270-Y273 HydrophobicContact CB-CE2 3.85Å; Q270-Y273 HydrophobicContact CG-CE1 4.41Å; Q270-Y273 PolarHBondContact N-OH 2.92Å; Q270-Y273 WeakPolarHBondContact O-CE2 3.07Å; Q270-T368 PolarHBondContact O-OG1 3.41Å
271	K	93.2	Very high	94.2	Very high	170 Å²	170	60.3 Å²	60.3	74%	0.739	30%	0.297	S	S	*	.	S	Bend	trans	-78.2	-15.6	172.9	-64.8	-170	175.8	-171.4	0	113.8	T368 M369	K271-T368 PolarHBondContact O-OG1 2.87Å; K271-M369 PolarHBondContact O-N 2.93Å
272	H	95.5	Very high	94.4	Very high	119 Å²	119	67.7 Å²	67.7	55%	0.551	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139	116.4	-179.7	-55	-69.2	0	0	0	108.8	Q270 M369	Q270-H272 VanDerWaalsContact C-N 3.3Å; H272-M369 CarbonylContact C-O 3.48Å; H272-M369 VanDerWaalsContact CA-O 3.29Å; H272-M369 WeakPolarHBondContact CA-O 3.43Å; H272-M369 PolarHBondContact ND1-SD 2.95Å
273	Y	95.8	Very high	94.7	Very high	44 Å²	44	71.5 Å²	71.5	17%	0.173	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	151.4	169.7	-72.7	-90.6	0	0	0	110.1	F268 P269 Q270 I290 T368 M369 K371	F268-Y273 HydrophobicContact CB-CE2 4.21Å; F268-Y273 HydrophobicContact CD1-CE2 4.09Å; F268-Y273 HydrophobicContact CG-CE2 4.49Å; P269-Y273 WeakPolarHBondContact CD-OH 3.39Å; Q270-Y273 HydrophobicContact CB-CD2 4.31Å; Q270-Y273 HydrophobicContact CB-CE1 4.18Å; Q270-Y273 HydrophobicContact CB-CE2 3.85Å; Q270-Y273 HydrophobicContact CG-CE1 4.41Å; Q270-Y273 PolarHBondContact N-OH 2.92Å; Q270-Y273 WeakPolarHBondContact O-CE2 3.07Å; Y273-I290 HydrophobicContact CD1-CG1 4.36Å; Y273-I290 HydrophobicContact CD2-CD1 3.61Å; Y273-I290 HydrophobicContact CD2-CG1 4Å; Y273-I290 HydrophobicContact CE1-CG1 4.39Å; Y273-I290 HydrophobicContact CE2-CD1 3.99Å; Y273-I290 HydrophobicContact CE2-CG1 4.01Å; Y273-I290 HydrophobicContact CG-CD1 3.98Å; Y273-I290 HydrophobicContact CG-CG1 4.17Å; Y273-T368 HydrophobicContact CD2-CG2 3.83Å; Y273-T368 WeakPolarHBondContact CD2-OG1 3.38Å; Y273-T368 HydrophobicContact CE2-CG2 3.9Å; Y273-M369 PolarHBondContact N-O 2.97Å; Y273-K371 PolarHBondContact O-N 2.63Å
274	Q	96.5	Very high	94.9	Very high	132 Å²	132	72.5 Å²	72.5	62%	0.617	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	126.5	171	-166.3	174.5	-89.7	0	0	110.2	K371 I373	Q274-K371 VanDerWaalsContact CA-O 3.29Å; Q274-K371 WeakPolarHBondContact CA-O 3.29Å; Q274-I373 VanDerWaalsContact CD-CD1 3.45Å; Q274-I373 HydrophobicContact CG-CD1 4.06Å; Q274-I373 HydrophobicContact CG-CG1 4.24Å
275	L	96.3	Very high	95.2	Very high	39 Å²	39	72.2 Å²	72.2	20%	0.204	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	157.5	170.1	-69.4	176.4	0	0	0	110.2	V287 L329 L370 K371 I373	L275-V287 HydrophobicContact CB-CG1 4.41Å; L275-V287 HydrophobicContact CD1-CG1 4.25Å; L275-L329 HydrophobicContact CD1-CD2 4.48Å; L275-L370 HydrophobicContact CB-CD1 4.31Å; L275-L370 HydrophobicContact CD1-CD1 3.9Å; L275-L370 HydrophobicContact CD1-CD2 4.19Å; L275-L370 HydrophobicContact CG-CD1 3.83Å; L275-K371 PolarHBondContact N-O 2.9Å; L275-I373 PolarHBondContact O-N 3.35Å
276	Y	96.7	Very high	95.5	Very high	144 Å²	144	74 Å²	74	57%	0.565	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	139.1	175.7	176.9	-92.2	0	0	0	109.1	I373 G375	Y276-I373 WeakPolarHBondContact CA-O 3.19Å; Y276-I373 HydrophobicContact CD2-CG2 4.23Å; Y276-G375 WeakPolarHBondContact OH-CA 3.22Å
277	V	97.3	Very high	95.6	Very high	4 Å²	4	74.8 Å²	74.8	2%	0.024	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	124.4	176.3	57.1	0	0	0	0	109.3	A281 V287 L335 I372 I373 V374 G375	V277-A281 HydrophobicContact CG2-CB 3.54Å; V277-V287 HydrophobicContact CB-CG1 4.09Å; V277-V287 HydrophobicContact CG1-CG1 4.4Å; V277-V287 HydrophobicContact CG2-CG2 4.17Å; V277-L335 HydrophobicContact CB-CD1 4.3Å; V277-L335 HydrophobicContact CG1-CD1 3.57Å; V277-L335 HydrophobicContact CG2-CD1 3.76Å; V277-I372 HydrophobicContact CG1-CG2 3.54Å; V277-I373 PolarHBondContact N-O 2.92Å; V277-V374 CarbonylContact O-C 3.5Å; V277-V374 VanDerWaalsContact O-CA 3.32Å; V277-V374 WeakPolarHBondContact O-CA 3.19Å; V277-G375 PolarHBondContact O-N 2.71Å
278	P	96.6	Very high	95.6	Very high	48 Å²	48	69.3 Å²	69.3	31%	0.312	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	146.2	170.4	29	-33.5	0	0	0	109.4	S280 A281 V377	P278-S280 VanDerWaalsContact C-N 3.25Å; P278-S280 PolarHBondContact O-N 2.63Å; P278-A281 HydrophobicContact CG-CB 4.39Å; P278-A281 WeakPolarHBondContact O-CB 3.32Å; P278-A281 PolarHBondContact O-N 3.3Å; P278-V377 HydrophobicContact CB-CG2 3.59Å
279	E	95.8	Very high	95.5	Very high	10 Å²	10	73.3 Å²	73.3	5%	0.047	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-29	-178.2	67.5	-159.2	106.3	0	0	114.4	A281 L335 N336 Y337 V374 G375 D376 V377	E279-A281 PolarHBondContact O-N 3.33Å; E279-L335 HydrophobicContact CB-CB 3.89Å; E279-N336 VanDerWaalsContact OE2-CA 3.27Å; E279-N336 WeakPolarHBondContact OE2-CA 3.37Å; E279-Y337 VanDerWaalsContact CD-CB 3.48Å; E279-Y337 WeakPolarHBondContact OE1-CB 3.16Å; E279-Y337 VanDerWaalsContact OE2-CB 3.24Å; E279-Y337 WeakPolarHBondContact OE2-CB 3.36Å; E279-Y337 PolarHBondContact OE2-N 3.06Å; E279-V374 HydrophobicContact CB-CG1 3.8Å; E279-G375 PolarHBondContact N-O 3.05Å; E279-G375 VanDerWaalsContact N-O 3.17Å; E279-D376 WeakPolarHBondContact OE1-CA 3.02Å; E279-V377 HydrophobicContact CG-CB 4.42Å; E279-V377 PolarHBondContact OE1-N 3.46Å
280	S	94.9	Very high	95.5	Very high	81 Å²	81	69.7 Å²	69.7	57%	0.566	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	1.4	170.9	58.6	0	0	0	0	114.6	P278 Q282	P278-S280 VanDerWaalsContact C-N 3.25Å; P278-S280 PolarHBondContact O-N 2.63Å; S280-Q282 PolarHBondContact O-N 2.83Å
281	A	96.4	Very high	95.6	Very high	18 Å²	18	68 Å²	68	15%	0.149	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-60.5	125.4	172.3	0	0	0	0	0	111.8	V277 P278 E279 L331	V277-A281 HydrophobicContact CG2-CB 3.54Å; P278-A281 HydrophobicContact CG-CB 4.39Å; P278-A281 WeakPolarHBondContact O-CB 3.32Å; P278-A281 PolarHBondContact O-N 3.3Å; E279-A281 PolarHBondContact O-N 3.33Å; A281-L331 HydrophobicContact CB-CD2 4.22Å; A281-L331 WeakPolarHBondContact O-CD2 3.25Å
282	Q	95.9	Very high	95.7	Very high	159 Å²	159	59.9 Å²	59.9	74%	0.743	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-68.6	146	-177.5	-64.9	-177.4	-4.5	0	0	112.4	S280 G284 S285	S280-Q282 PolarHBondContact O-N 2.83Å; Q282-G284 PolarHBondContact O-N 3.27Å; Q282-S285 WeakPolarHBondContact O-CB 3.48Å; Q282-S285 PolarHBondContact O-N 2.77Å; Q282-S285 PolarHBondContact O-OG 3.31Å
283	V	96	Very high	95.6	Very high	84 Å²	84	58.6 Å²	58.6	51%	0.509	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	133.8	172.1	178.9	0	0	0	0	110
284	G	93.9	Very high	95.5	Very high	56 Å²	56	57.8 Å²	57.8	58%	0.577	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.6	-19.1	-172.1	0	0	0	0	0	114.2	Q282 L331	Q282-G284 PolarHBondContact O-N 3.27Å; G284-L331 WeakPolarHBondContact CA-O 3.32Å; G284-L331 PolarHBondContact N-O 2.88Å
285	S	94.7	Very high	95.3	Very high	41 Å²	41	53.9 Å²	53.9	29%	0.287	32%	0.317	S	S	.	.			trans	-63.9	149.5	177.8	67	0	0	0	0	112.5	Q282 S330 L331	Q282-S285 WeakPolarHBondContact O-CB 3.48Å; Q282-S285 PolarHBondContact O-N 2.77Å; Q282-S285 PolarHBondContact O-OG 3.31Å; S285-S330 CarbonylContact O-C 3.54Å; S285-S330 WeakPolarHBondContact O-CA 3.31Å; S285-S330 WeakPolarHBondContact O-CB 3.37Å; S285-L331 PolarHBondContact O-N 2.79Å
286	A	95.7	Very high	95.2	Very high	69 Å²	69	52.3 Å²	52.3	57%	0.57	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	120.8	174.1	0	0	0	0	0	110.2	I328 L329	A286-I328 HydrophobicContact CB-CG2 4.01Å; A286-L329 CarbonylContact C-O 3.56Å; A286-L329 WeakPolarHBondContact CA-O 3.49Å
287	V	95.8	Very high	94.9	Very high	16 Å²	16	48.4 Å²	48.4	10%	0.097	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-29.3	176.7	172.5	0	0	0	0	111.2	L275 V277 F316 L329 L331 I372	L275-V287 HydrophobicContact CB-CG1 4.41Å; L275-V287 HydrophobicContact CD1-CG1 4.25Å; V277-V287 HydrophobicContact CB-CG1 4.09Å; V277-V287 HydrophobicContact CG1-CG1 4.4Å; V277-V287 HydrophobicContact CG2-CG2 4.17Å; V287-F316 HydrophobicContact CG2-CD1 4.06Å; V287-F316 HydrophobicContact CG2-CE1 3.99Å; V287-L329 HydrophobicContact CB-CD2 4.09Å; V287-L329 HydrophobicContact CB-CG 4.44Å; V287-L329 HydrophobicContact CG1-CD2 3.95Å; V287-L329 PolarHBondContact N-O 2.91Å; V287-L331 HydrophobicContact CG2-CB 4.2Å; V287-I372 HydrophobicContact CG1-CG2 4.32Å
288	G	94.8	Very high	94.6	Very high	19 Å²	19	51 Å²	51	20%	0.196	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.7	-174.2	176.5	0	0	0	0	0	111.8	L329	G288-L329 PolarHBondContact N-O 2.95Å; G288-L329 PolarHBondContact O-N 2.76Å
289	K	95.2	Very high	94.2	Very high	98 Å²	98	51.9 Å²	51.9	43%	0.426	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	148.7	177.6	-61.6	-161.4	174.9	-168.3	0	110.8	D321 E326 G327 I328	K289-D321 IonicContact NZ-OD2 2.76Å; K289-E326 HydrophobicContact CD-CB 4.05Å; K289-E326 HydrophobicContact CD-CG 4.44Å; K289-E326 WeakPolarHBondContact CD-OE2 3.46Å; K289-E326 WeakPolarHBondContact CE-OE2 3.27Å; K289-E326 IonicContact NZ-OE2 3.1Å; K289-E326 PolarHBondContact NZ-OE2 2.84Å; K289-G327 CarbonylContact C-O 3.55Å; K289-G327 WeakPolarHBondContact CA-O 3.34Å; K289-I328 HydrophobicContact CD-CG1 4.32Å; K289-I328 HydrophobicContact CG-CG1 4.28Å
290	I	95.5	Very high	93.9	Very high	5 Å²	5	52 Å²	52	3%	0.026	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	146.9	171.4	-159	172.5	0	0	0	108.8	F268 Y273 Y305 I318 G327 I347 T368 L370	F268-I290 HydrophobicContact CD1-CD1 4.36Å; F268-I290 HydrophobicContact CD1-CG1 4.22Å; F268-I290 HydrophobicContact CE1-CD1 4.02Å; F268-I290 HydrophobicContact CE1-CG1 3.93Å; F268-I290 HydrophobicContact CE1-CG2 4.49Å; Y273-I290 HydrophobicContact CD1-CG1 4.36Å; Y273-I290 HydrophobicContact CD2-CD1 3.61Å; Y273-I290 HydrophobicContact CD2-CG1 4Å; Y273-I290 HydrophobicContact CE1-CG1 4.39Å; Y273-I290 HydrophobicContact CE2-CD1 3.99Å; Y273-I290 HydrophobicContact CE2-CG1 4.01Å; Y273-I290 HydrophobicContact CG-CD1 3.98Å; Y273-I290 HydrophobicContact CG-CG1 4.17Å; I290-Y305 HydrophobicContact CG2-CD1 4.34Å; I290-I318 HydrophobicContact CG2-CD1 3.9Å; I290-G327 PolarHBondContact N-O 2.72Å; I290-G327 PolarHBondContact O-N 3.48Å; I290-I347 HydrophobicContact CD1-CB 4.39Å; I290-I347 HydrophobicContact CD1-CG1 4.24Å; I290-I347 HydrophobicContact CG2-CG2 4.3Å; I290-T368 HydrophobicContact CD1-CG2 3.53Å; I290-L370 HydrophobicContact CD1-CD2 4.48Å
291	K	94.6	Very high	93.7	Very high	71 Å²	71	48.2 Å²	48.2	31%	0.309	31%	0.309	S	S	.	.			trans	-139.8	129.5	-179	-172.5	165.4	-172.5	155.5	0	111.4	P269 Y305 T324 E326	P269-K291 WeakPolarHBondContact CD-O 3.12Å; K291-Y305 WeakPolarHBondContact CA-OH 3.33Å; K291-T324 PolarHBondContact NZ-O 3.2Å; K291-E326 HydrophobicContact CB-CG 4.33Å; K291-E326 HydrophobicContact CD-CG 3.9Å; K291-E326 HydrophobicContact CG-CG 4.39Å
292	A	95.1	Very high	93.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	32%	0.319	C	S	.	.			trans	-91.2	144.2	158	0	0	0	0	0	108.7	P266 R267 F268 M303 Y305	P266-A292 HydrophobicContact CB-CB 4.04Å; R267-A292 CarbonylContact O-C 3.56Å; R267-A292 WeakPolarHBondContact O-CA 3.21Å; F268-A292 HydrophobicContact CD1-CB 3.92Å; F268-A292 HydrophobicContact CD2-CB 4.32Å; F268-A292 HydrophobicContact CE1-CB 3.91Å; F268-A292 HydrophobicContact CE2-CB 4.31Å; F268-A292 HydrophobicContact CG-CB 4.14Å; F268-A292 HydrophobicContact CZ-CB 4.12Å; A292-M303 HydrophobicContact CB-SD 3.93Å; A292-Y305 HydrophobicContact CB-CE1 4.26Å; A292-Y305 PolarHBondContact N-OH 3.34Å
293	N	94.2	Very high	93.2	Very high	92 Å²	92	43.3 Å²	43.3	49%	0.492	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-99.2	139.5	174.1	-69.2	-10.4	0	0	0	108.7	P266 R267	P266-N293 CarbonylContact C-O 3.51Å; P266-N293 WeakPolarHBondContact CA-O 3.48Å; R267-N293 PolarHBondContact N-O 2.73Å; R267-N293 PolarHBondContact O-N 2.69Å
294	D	93.5	Very high	93.1	Very high	28 Å²	28	42.7 Å²	42.7	15%	0.15	28%	0.282	C	S	.	.			trans	-131	145.9	179.7	-165.3	-42.3	0	0	0	107	P266 D296 A301 M303 N351	P266-D294 HydrophobicContact CB-CB 4.29Å; D294-D296 PolarHBondContact OD1-N 3.02Å; D294-A301 HydrophobicContact CB-CB 3.85Å; D294-M303 HydrophobicContact CB-CE 3.53Å; D294-N351 PolarHBondContact OD2-ND2 3.31Å
295	A	92.9	Very high	93.2	Very high	49 Å²	49	40.6 Å²	40.6	41%	0.405	26%	0.257	S	S	.	.			trans	-94.4	-24.8	-171.6	0	0	0	0	0	112.6	R226 E227 N264	R226-A295 PolarHBondContact NH2-O 2.64Å; E227-A295 HydrophobicContact CG-CB 3.86Å; N264-A295 HydrophobicContact CB-CB 3.91Å
296	D	93.5	Very high	93.3	Very high	6 Å²	6	41 Å²	41	3%	0.032	26%	0.26	C	S	.	.	S	Bend	trans	-68.7	177.3	-179.3	-52.3	-14.4	0	0	0	111.1	N262 N264 D294 N300 A301	N262-D296 VanDerWaalsContact CA-OD2 3.27Å; N262-D296 WeakPolarHBondContact CA-OD2 3.42Å; N264-D296 WeakPolarHBondContact CB-OD1 3.36Å; N264-D296 PolarHBondContact N-OD1 3.42Å; N264-D296 PolarHBondContact ND2-OD1 3.18Å; D294-D296 PolarHBondContact OD1-N 3.02Å; D296-N300 HydrophobicContact CB-CB 3.74Å; D296-A301 HydrophobicContact CB-CB 3.97Å; D296-A301 WeakPolarHBondContact O-CB 3.07Å
297	T	91.6	Very high	93.3	Very high	63 Å²	63	39.1 Å²	39.1	39%	0.387	24%	0.24	S	C	.	.			trans	-129.3	167.8	-178.3	69.8	0	0	0	0	113.7	D260 S299 N300	D260-T297 VanDerWaalsContact CG-N 3.27Å; D260-T297 WeakPolarHBondContact OD1-CA 3.49Å; D260-T297 VanDerWaalsContact OD1-CB 3.28Å; D260-T297 WeakPolarHBondContact OD1-CB 3.44Å; D260-T297 PolarHBondContact OD1-N 3.34Å; D260-T297 PolarHBondContact OD1-OG1 3.2Å; D260-T297 PolarHBondContact OD2-N 2.95Å; D260-T297 VanDerWaalsContact OD2-N 3.1Å; T297-S299 PolarHBondContact O-N 2.73Å; T297-N300 PolarHBondContact O-N 3.13Å
298	G	89.3	Confident	93.3	Very high	59 Å²	59	41.7 Å²	41.7	61%	0.608	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	-129.7	-175.6	0	0	0	0	0	112.3	N300	G298-N300 VanDerWaalsContact C-N 3.35Å; G298-N300 PolarHBondContact O-N 2.77Å
299	S	89.3	Confident	93.2	Very high	65 Å²	65	44.7 Å²	44.7	46%	0.455	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-10.9	-176.8	52.4	0	0	0	0	115.1	T297 H353	T297-S299 PolarHBondContact O-N 2.73Å; S299-H353 VanDerWaalsContact O-CB 3.26Å; S299-H353 WeakPolarHBondContact O-CB 3.3Å
300	N	89.6	Confident	93.1	Very high	14 Å²	14	41.5 Å²	41.5	8%	0.075	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-50	177.5	-69.1	-27	0	0	0	109.6	D260 N262 D296 T297 G298 D302 N351 H353	D260-N300 PolarHBondContact O-ND2 2.71Å; D260-N300 WeakPolarHBondContact OD2-CB 3.18Å; D260-N300 PolarHBondContact OD2-ND2 3.07Å; N262-N300 HydrophobicContact CB-CB 3.79Å; N262-N300 PolarHBondContact N-ND2 3.09Å; N262-N300 PolarHBondContact ND2-O 3.1Å; D296-N300 HydrophobicContact CB-CB 3.74Å; T297-N300 PolarHBondContact O-N 3.13Å; G298-N300 VanDerWaalsContact C-N 3.35Å; G298-N300 PolarHBondContact O-N 2.77Å; N300-D302 PolarHBondContact O-N 3.03Å; N300-D302 VanDerWaalsContact O-N 3.17Å; N300-N351 PolarHBondContact O-ND2 3.46Å; N300-H353 PolarHBondContact OD1-ND1 3.31Å
301	A	90.4	Very high	93	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	17.4	171.2	0	0	0	0	0	115	D294 D296 R325	D294-A301 HydrophobicContact CB-CB 3.85Å; D296-A301 HydrophobicContact CB-CB 3.97Å; D296-A301 WeakPolarHBondContact O-CB 3.07Å; A301-R325 VanDerWaalsContact O-CD 3.3Å; A301-R325 WeakPolarHBondContact O-CD 3.47Å; A301-R325 PolarHBondContact O-NH1 2.97Å
302	D	90.9	Very high	92.8	Very high	67 Å²	67	41.8 Å²	41.8	36%	0.358	26%	0.263	S	S	.	.			trans	-86.1	111.5	167.8	-93.5	-23.2	0	0	0	110	N300 T352	N300-D302 PolarHBondContact O-N 3.03Å; N300-D302 VanDerWaalsContact O-N 3.17Å; D302-T352 WeakPolarHBondContact O-CB 3.31Å; D302-T352 PolarHBondContact O-N 2.97Å; D302-T352 PolarHBondContact O-OG1 3.15Å
303	M	91.4	Very high	92.7	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.039	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	165.4	-173.7	68.1	-173.5	72.7	0	0	113	P266 A292 D294 Y305 T320 A350	P266-M303 HydrophobicContact CB-CE 3.91Å; P266-M303 HydrophobicContact CB-SD 4.22Å; A292-M303 HydrophobicContact CB-SD 3.93Å; D294-M303 HydrophobicContact CB-CE 3.53Å; M303-Y305 HydrophobicContact CG-CE2 4.08Å; M303-Y305 HydrophobicContact SD-CE1 4.3Å; M303-Y305 HydrophobicContact SD-CE2 4.16Å; M303-Y305 PolarHBondContact SD-OH 3.34Å; M303-T320 WeakPolarHBondContact O-CG2 3.29Å; M303-A350 CarbonylContact C-O 3.57Å; M303-A350 VanDerWaalsContact CA-O 3.24Å; M303-A350 WeakPolarHBondContact CA-O 3.39Å; M303-A350 WeakPolarHBondContact CB-O 2.98Å
304	T	94	Very high	92.6	Very high	70 Å²	70	43.8 Å²	43.8	43%	0.429	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	141.6	170.6	44.7	0	0	0	0	111.4	G349 A350 T352	T304-G349 WeakPolarHBondContact O-CA 3.48Å; T304-A350 PolarHBondContact N-O 2.77Å; T304-A350 PolarHBondContact O-N 2.88Å; T304-T352 HydrophobicContact CG2-CG2 3.57Å
305	Y	96	Very high	92.7	Very high	12 Å²	12	44 Å²	44	5%	0.047	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	139.6	177.6	-58.9	-89.2	0	0	0	111.4	F268 I290 K291 A292 M303 I318 T320 R325 G327 I347 E348	F268-Y305 HydrophobicContact CE1-CD1 4.25Å; F268-Y305 AromaticContact CE1-CE1 3.81Å; F268-Y305 HydrophobicContact CE1-CE1 3.81Å; F268-Y305 AromaticContact CZ-CD1 3.96Å; F268-Y305 HydrophobicContact CZ-CD1 3.96Å; F268-Y305 AromaticContact CZ-CE1 3.84Å; F268-Y305 HydrophobicContact CZ-CE1 3.84Å; I290-Y305 HydrophobicContact CG2-CD1 4.34Å; K291-Y305 WeakPolarHBondContact CA-OH 3.33Å; A292-Y305 HydrophobicContact CB-CE1 4.26Å; A292-Y305 PolarHBondContact N-OH 3.34Å; M303-Y305 HydrophobicContact CG-CE2 4.08Å; M303-Y305 HydrophobicContact SD-CE1 4.3Å; M303-Y305 HydrophobicContact SD-CE2 4.16Å; M303-Y305 PolarHBondContact SD-OH 3.34Å; Y305-I318 HydrophobicContact CG-CD1 4.46Å; Y305-T320 HydrophobicContact CD2-CG2 3.79Å; Y305-T320 HydrophobicContact CE2-CG2 4.06Å; Y305-T320 PolarHBondContact N-OG1 3.2Å; Y305-R325 WeakPolarHBondContact CE2-O 3.15Å; Y305-R325 PolarHBondContact OH-O 3.02Å; Y305-G327 VanDerWaalsContact CD2-CA 3.41Å; Y305-I347 HydrophobicContact CD1-CG2 4.26Å; Y305-E348 CarbonylContact C-O 3.42Å; Y305-E348 WeakPolarHBondContact CA-O 3.15Å
306	S	95.6	Very high	92.9	Very high	50 Å²	50	41.8 Å²	41.8	35%	0.35	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	155.9	174.8	72.8	0	0	0	0	111.9	I347 E348	S306-I347 WeakPolarHBondContact O-CA 3.39Å; S306-E348 PolarHBondContact N-O 2.94Å; S306-E348 PolarHBondContact O-N 3.41Å
307	I	96.8	Very high	93	Very high	30 Å²	30	43.8 Å²	43.8	15%	0.154	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	104.5	170.7	-53.5	168.4	0	0	0	106.9	M313 I318 L329 L345 I347	I307-M313 HydrophobicContact CG2-CG 3.77Å; I307-I318 HydrophobicContact CD1-CB 4.44Å; I307-I318 HydrophobicContact CD1-CG2 4.46Å; I307-I318 HydrophobicContact CG1-CB 4.17Å; I307-I318 HydrophobicContact CG1-CG2 3.83Å; I307-L329 HydrophobicContact CD1-CD1 4.28Å; I307-L345 HydrophobicContact CD1-CD1 4.09Å; I307-L345 HydrophobicContact CG1-CD1 4.45Å; I307-L345 HydrophobicContact CG2-CB 4.25Å; I307-L345 HydrophobicContact CG2-CD1 4.39Å; I307-L345 HydrophobicContact CG2-CD2 4.04Å; I307-L345 HydrophobicContact CG2-CG 4.46Å; I307-I347 HydrophobicContact CB-CD1 4.46Å; I307-I347 HydrophobicContact CG1-CD1 3.8Å
308	I	94.4	Very high	93.3	Very high	69 Å²	69	42.1 Å²	42.1	35%	0.354	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-39.4	-174.5	47	163.2	0	0	0	112.9	N346 E348 A367	I308-N346 HydrophobicContact CD1-CB 4.17Å; I308-N346 HydrophobicContact CG1-CB 4Å; I308-N346 WeakPolarHBondContact CG1-O 3.32Å; I308-N346 PolarHBondContact N-O 2.84Å; I308-N346 VanDerWaalsContact N-O 3.12Å; I308-E348 HydrophobicContact CB-CB 4.48Å; I308-E348 HydrophobicContact CD1-CB 4.22Å; I308-E348 HydrophobicContact CG1-CB 4.21Å; I308-E348 HydrophobicContact CG2-CB 3.49Å; I308-E348 VanDerWaalsContact CG2-CB 3.49Å; I308-E348 HydrophobicContact CG2-CG 4.3Å; I308-A367 HydrophobicContact CD1-CB 4.3Å
309	N	93.2	Very high	93.6	Very high	82 Å²	82	42.3 Å²	42.3	44%	0.439	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	168.6	170.3	61	36.6	0	0	0	110.3	N346	N309-N346 PolarHBondContact O-N 3.05Å; N309-N346 WeakPolarHBondContact OD1-CB 3.45Å; N309-N346 PolarHBondContact OD1-ND2 3.26Å
310	G	93.1	Very high	93.9	Very high	31 Å²	31	41.1 Å²	41.1	32%	0.32	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	149.6	164.8	178.3	0	0	0	0	0	112.9	G312 M313 T344	G310-G312 VanDerWaalsContact C-N 3.26Å; G310-G312 PolarHBondContact O-N 3.23Å; G310-M313 WeakPolarHBondContact O-CG 3.14Å; G310-T344 CarbonylContact C-O 3.53Å; G310-T344 WeakPolarHBondContact CA-O 3.34Å
311	D	93.8	Very high	94.1	Very high	82 Å²	82	42.3 Å²	42.3	44%	0.439	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	3.8	-176.5	71.6	-0.2	0	0	0	113.8	K340 Y343 T344	D311-K340 PolarHBondContact O-NZ 2.89Å; D311-K340 IonicContact OD1-NZ 3.07Å; D311-K340 WeakPolarHBondContact OD2-CE 3.46Å; D311-K340 IonicContact OD2-NZ 3.07Å; D311-K340 PolarHBondContact OD2-NZ 3.44Å; D311-Y343 VanDerWaalsContact OD1-CA 3.28Å; D311-Y343 WeakPolarHBondContact OD1-CA 3.22Å; D311-Y343 WeakPolarHBondContact OD1-CB 3.39Å; D311-T344 PolarHBondContact N-O 3.48Å; D311-T344 PolarHBondContact OD1-N 3.17Å
312	G	90.8	Very high	94	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	7.9	178.6	0	0	0	0	0	114.8	G310 G314 I315 F316	G310-G312 VanDerWaalsContact C-N 3.26Å; G310-G312 PolarHBondContact O-N 3.23Å; G312-G314 PolarHBondContact O-N 3.47Å; G312-I315 WeakPolarHBondContact O-CA 3.24Å; G312-I315 PolarHBondContact O-N 3.21Å; G312-F316 PolarHBondContact O-N 2.96Å
313	M	91.6	Very high	93.9	Very high	94 Å²	94	56.9 Å²	56.9	46%	0.463	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-25.9	-179.2	-66.2	176.6	84	0	0	114.2	I307 G310	I307-M313 HydrophobicContact CG2-CG 3.77Å; G310-M313 WeakPolarHBondContact O-CG 3.14Å
314	G	92.1	Very high	93.8	Very high	41 Å²	41	58.7 Å²	58.7	42%	0.423	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-3.3	175.8	0	0	0	0	0	115	G312 K333	G312-G314 PolarHBondContact O-N 3.47Å; G314-K333 WeakPolarHBondContact O-CD 3.43Å; G314-K333 VanDerWaalsContact O-CE 3.25Å; G314-K333 WeakPolarHBondContact O-CE 3.46Å
315	I	96	Very high	93.7	Very high	31 Å²	31	59.4 Å²	59.4	16%	0.159	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	-34.3	-172.5	-52	-56.8	0	0	0	111.6	G312 L331 K332 K333 L335 Y343	G312-I315 WeakPolarHBondContact O-CA 3.24Å; G312-I315 PolarHBondContact O-N 3.21Å; I315-L331 HydrophobicContact CG2-CD1 4.05Å; I315-K332 WeakPolarHBondContact O-CA 2.9Å; I315-K332 VanDerWaalsContact O-CB 3.31Å; I315-K332 WeakPolarHBondContact O-CB 3.29Å; I315-K332 PolarHBondContact O-N 2.96Å; I315-K333 HydrophobicContact CD1-CB 4.27Å; I315-K333 HydrophobicContact CD1-CD 4.11Å; I315-K333 PolarHBondContact O-N 2.85Å; I315-L335 HydrophobicContact CG2-CD2 3.69Å; I315-Y343 HydrophobicContact CB-CE1 4.43Å; I315-Y343 HydrophobicContact CG1-CE1 3.8Å
316	F	97.2	Very high	93.6	Very high	3 Å²	3	61.2 Å²	61.2	1%	0.013	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	161.1	179.2	-54.7	-82.8	0	0	0	111.7	V287 G312 L329 S330 L331 L335 Y343 L345 I372	V287-F316 HydrophobicContact CG2-CD1 4.06Å; V287-F316 HydrophobicContact CG2-CE1 3.99Å; G312-F316 PolarHBondContact O-N 2.96Å; F316-L329 HydrophobicContact CB-CD1 4.01Å; F316-L329 HydrophobicContact CB-CD2 4.49Å; F316-L329 HydrophobicContact CB-CG 4.34Å; F316-L329 HydrophobicContact CD1-CD2 4.16Å; F316-L329 HydrophobicContact CG-CD2 4.4Å; F316-S330 WeakPolarHBondContact CA-O 3.42Å; F316-L331 HydrophobicContact CD1-CD1 3.84Å; F316-L331 HydrophobicContact CE1-CD1 3.53Å; F316-L331 HydrophobicContact CZ-CD1 4.24Å; F316-L335 HydrophobicContact CE1-CD2 4.43Å; F316-L335 HydrophobicContact CZ-CD2 3.92Å; F316-Y343 HydrophobicContact CE2-CD1 4.16Å; F316-Y343 AromaticContact CE2-CD2 3.82Å; F316-Y343 HydrophobicContact CE2-CD2 3.82Å; F316-Y343 HydrophobicContact CE2-CE2 4.37Å; F316-Y343 AromaticContact CE2-CG 3.71Å; F316-Y343 HydrophobicContact CE2-CG 3.71Å; F316-Y343 HydrophobicContact CZ-CD2 4.08Å; F316-Y343 HydrophobicContact CZ-CG 4.41Å; F316-L345 HydrophobicContact CB-CD1 4.17Å; F316-L345 HydrophobicContact CD2-CD1 4.28Å; F316-L345 HydrophobicContact CG-CD1 4.44Å; F316-I372 HydrophobicContact CD1-CD1 4.05Å; F316-I372 HydrophobicContact CD2-CD1 3.7Å; F316-I372 HydrophobicContact CE1-CD1 3.94Å; F316-I372 HydrophobicContact CE1-CG2 4.24Å; F316-I372 HydrophobicContact CE2-CD1 3.6Å; F316-I372 HydrophobicContact CG-CD1 3.94Å; F316-I372 HydrophobicContact CZ-CB 4.44Å; F316-I372 HydrophobicContact CZ-CD1 3.72Å; F316-I372 HydrophobicContact CZ-CG2 3.9Å
317	S	96.5	Very high	93.6	Very high	48 Å²	48	58.8 Å²	58.8	34%	0.336	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	144.8	170.1	47.7	0	0	0	0	109.5	S330	S317-S330 PolarHBondContact N-O 2.93Å; S317-S330 PolarHBondContact O-N 3.38Å
318	I	97.2	Very high	93.6	Very high	29 Å²	29	59.2 Å²	59.2	15%	0.149	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	140	172.6	-160.6	162.1	0	0	0	109.8	I290 Y305 I307 I328 L329 I347	I290-I318 HydrophobicContact CG2-CD1 3.9Å; Y305-I318 HydrophobicContact CG-CD1 4.46Å; I307-I318 HydrophobicContact CD1-CB 4.44Å; I307-I318 HydrophobicContact CD1-CG2 4.46Å; I307-I318 HydrophobicContact CG1-CB 4.17Å; I307-I318 HydrophobicContact CG1-CG2 3.83Å; I318-I328 WeakPolarHBondContact CA-O 3.23Å; I318-L329 HydrophobicContact CB-CD1 4.2Å; I318-I347 HydrophobicContact CD1-CD1 4.18Å; I318-I347 HydrophobicContact CD1-CG2 3.71Å
319	S	95.6	Very high	93.8	Very high	62 Å²	62	56 Å²	56	43%	0.434	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	158.1	168.3	61.7	0	0	0	0	109.4	G327 I328	S319-G327 CarbonylContact O-C 3.59Å; S319-G327 WeakPolarHBondContact O-CA 3.24Å; S319-I328 PolarHBondContact N-O 2.57Å; S319-I328 PolarHBondContact O-N 3.08Å
320	T	95.7	Very high	93.9	Very high	41 Å²	41	53.2 Å²	53.2	25%	0.252	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	120.9	175.3	-52.2	0	0	0	0	109.5	M303 Y305	M303-T320 WeakPolarHBondContact O-CG2 3.29Å; Y305-T320 HydrophobicContact CD2-CG2 3.79Å; Y305-T320 HydrophobicContact CE2-CG2 4.06Å; Y305-T320 PolarHBondContact N-OG1 3.2Å
321	D	94	Very high	94.1	Very high	38 Å²	38	51.8 Å²	51.8	20%	0.203	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	119.6	168.8	176.8	-9.4	0	0	0	108.8	K289 E323 T324 R325 E326 I328	K289-D321 IonicContact NZ-OD2 2.76Å; D321-E323 PolarHBondContact OD1-N 2.96Å; D321-T324 WeakPolarHBondContact CB-OG1 3.29Å; D321-T324 PolarHBondContact OD1-N 3.22Å; D321-T324 VanDerWaalsContact OD2-CG2 3.32Å; D321-T324 WeakPolarHBondContact OD2-CG2 3.49Å; D321-T324 PolarHBondContact OD2-OG1 2.77Å; D321-R325 WeakPolarHBondContact O-CA 3.43Å; D321-R325 PolarHBondContact O-N 2.8Å; D321-E326 PolarHBondContact N-O 2.77Å; D321-E326 PolarHBondContact O-N 2.78Å; D321-I328 HydrophobicContact CB-CD1 3.92Å; D321-I328 HydrophobicContact CB-CG1 4.25Å
322	K	88.3	Confident	94.2	Very high	187 Å²	187	54 Å²	54	81%	0.813	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-25.3	-176.2	-68.5	-171.9	173.3	-167.9	0	113.6
323	E	88.1	Confident	94.5	Very high	186 Å²	186	59.2 Å²	59.2	87%	0.869	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-41.5	-177.6	-64.2	-176.4	-174.3	0	0	110.7	D321	D321-E323 PolarHBondContact OD1-N 2.96Å
324	T	90.6	Very high	94.7	Very high	47 Å²	47	59.5 Å²	59.5	29%	0.288	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-15.7	-179.6	64.8	0	0	0	0	113.9	K291 D321 E326	K291-T324 PolarHBondContact NZ-O 3.2Å; D321-T324 WeakPolarHBondContact CB-OG1 3.29Å; D321-T324 PolarHBondContact OD1-N 3.22Å; D321-T324 VanDerWaalsContact OD2-CG2 3.32Å; D321-T324 WeakPolarHBondContact OD2-CG2 3.49Å; D321-T324 PolarHBondContact OD2-OG1 2.77Å; T324-E326 WeakPolarHBondContact CB-OE2 3.13Å; T324-E326 PolarHBondContact O-N 2.92Å; T324-E326 WeakPolarHBondContact OG1-CB 3.45Å; T324-E326 WeakPolarHBondContact OG1-CG 3.28Å; T324-E326 PolarHBondContact OG1-N 3.04Å; T324-E326 PolarHBondContact OG1-OE2 2.86Å
325	R	91.3	Very high	94.8	Very high	85 Å²	85	58.4 Å²	58.4	32%	0.321	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	36.2	-169.1	-65.1	-178.4	-76.9	155.1	-5.5	112.9	A301 Y305 D321	A301-R325 VanDerWaalsContact O-CD 3.3Å; A301-R325 WeakPolarHBondContact O-CD 3.47Å; A301-R325 PolarHBondContact O-NH1 2.97Å; Y305-R325 WeakPolarHBondContact CE2-O 3.15Å; Y305-R325 PolarHBondContact OH-O 3.02Å; D321-R325 WeakPolarHBondContact O-CA 3.43Å; D321-R325 PolarHBondContact O-N 2.8Å
326	E	94.3	Very high	94.7	Very high	49 Å²	49	59.2 Å²	59.2	23%	0.229	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	140.8	179.7	-66.2	176	147.6	0	0	111.9	K289 K291 D321 T324 I328	K289-E326 HydrophobicContact CD-CB 4.05Å; K289-E326 HydrophobicContact CD-CG 4.44Å; K289-E326 WeakPolarHBondContact CD-OE2 3.46Å; K289-E326 WeakPolarHBondContact CE-OE2 3.27Å; K289-E326 IonicContact NZ-OE2 3.1Å; K289-E326 PolarHBondContact NZ-OE2 2.84Å; K291-E326 HydrophobicContact CB-CG 4.33Å; K291-E326 HydrophobicContact CD-CG 3.9Å; K291-E326 HydrophobicContact CG-CG 4.39Å; D321-E326 PolarHBondContact N-O 2.77Å; D321-E326 PolarHBondContact O-N 2.78Å; T324-E326 WeakPolarHBondContact CB-OE2 3.13Å; T324-E326 PolarHBondContact O-N 2.92Å; T324-E326 WeakPolarHBondContact OG1-CB 3.45Å; T324-E326 WeakPolarHBondContact OG1-CG 3.28Å; T324-E326 PolarHBondContact OG1-N 3.04Å; T324-E326 PolarHBondContact OG1-OE2 2.86Å; E326-I328 PolarHBondContact O-N 3.3Å
327	G	95.7	Very high	94.6	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	106.6	169.2	0	0	0	0	0	109.7	K289 I290 Y305 S319	K289-G327 CarbonylContact C-O 3.55Å; K289-G327 WeakPolarHBondContact CA-O 3.34Å; I290-G327 PolarHBondContact N-O 2.72Å; I290-G327 PolarHBondContact O-N 3.48Å; Y305-G327 VanDerWaalsContact CD2-CA 3.41Å; S319-G327 CarbonylContact O-C 3.59Å; S319-G327 WeakPolarHBondContact O-CA 3.24Å
328	I	96.8	Very high	94.3	Very high	38 Å²	38	61.4 Å²	61.4	20%	0.195	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.6	175.2	-57.8	-179.5	0	0	0	108	A286 K289 I318 S319 D321 E326	A286-I328 HydrophobicContact CB-CG2 4.01Å; K289-I328 HydrophobicContact CD-CG1 4.32Å; K289-I328 HydrophobicContact CG-CG1 4.28Å; I318-I328 WeakPolarHBondContact CA-O 3.23Å; S319-I328 PolarHBondContact N-O 2.57Å; S319-I328 PolarHBondContact O-N 3.08Å; D321-I328 HydrophobicContact CB-CD1 3.92Å; D321-I328 HydrophobicContact CB-CG1 4.25Å; E326-I328 PolarHBondContact O-N 3.3Å
329	L	97.2	Very high	94.1	Very high	2 Å²	2	68.8 Å²	68.8	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	125.1	171.9	-169.5	80.1	0	0	0	109.2	L275 A286 V287 G288 I307 F316 I318 L345 L370 I372	L275-L329 HydrophobicContact CD1-CD2 4.48Å; A286-L329 CarbonylContact C-O 3.56Å; A286-L329 WeakPolarHBondContact CA-O 3.49Å; V287-L329 HydrophobicContact CB-CD2 4.09Å; V287-L329 HydrophobicContact CB-CG 4.44Å; V287-L329 HydrophobicContact CG1-CD2 3.95Å; V287-L329 PolarHBondContact N-O 2.91Å; G288-L329 PolarHBondContact N-O 2.95Å; G288-L329 PolarHBondContact O-N 2.76Å; I307-L329 HydrophobicContact CD1-CD1 4.28Å; F316-L329 HydrophobicContact CB-CD1 4.01Å; F316-L329 HydrophobicContact CB-CD2 4.49Å; F316-L329 HydrophobicContact CB-CG 4.34Å; F316-L329 HydrophobicContact CD1-CD2 4.16Å; F316-L329 HydrophobicContact CG-CD2 4.4Å; I318-L329 HydrophobicContact CB-CD1 4.2Å; L329-L345 HydrophobicContact CD1-CD1 4.02Å; L329-L345 HydrophobicContact CD2-CD1 4.47Å; L329-L370 HydrophobicContact CD2-CD2 3.94Å; L329-I372 HydrophobicContact CD2-CD1 3.53Å; L329-I372 HydrophobicContact CD2-CG1 4.21Å
330	S	96.9	Very high	94.1	Very high	23 Å²	23	68.6 Å²	68.6	16%	0.161	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	153.5	177.7	-66.3	0	0	0	0	112.5	S285 F316 S317	S285-S330 CarbonylContact O-C 3.54Å; S285-S330 WeakPolarHBondContact O-CA 3.31Å; S285-S330 WeakPolarHBondContact O-CB 3.37Å; F316-S330 WeakPolarHBondContact CA-O 3.42Å; S317-S330 PolarHBondContact N-O 2.93Å; S317-S330 PolarHBondContact O-N 3.38Å
331	L	97.3	Very high	94	Very high	2 Å²	2	70.6 Å²	70.6	1%	0.01	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	133.9	179.5	-169.6	67.5	0	0	0	111.7	A281 G284 S285 V287 I315 F316 K333 L335	A281-L331 HydrophobicContact CB-CD2 4.22Å; A281-L331 WeakPolarHBondContact O-CD2 3.25Å; G284-L331 WeakPolarHBondContact CA-O 3.32Å; G284-L331 PolarHBondContact N-O 2.88Å; S285-L331 PolarHBondContact O-N 2.79Å; V287-L331 HydrophobicContact CG2-CB 4.2Å; I315-L331 HydrophobicContact CG2-CD1 4.05Å; F316-L331 HydrophobicContact CD1-CD1 3.84Å; F316-L331 HydrophobicContact CE1-CD1 3.53Å; F316-L331 HydrophobicContact CZ-CD1 4.24Å; L331-K333 VanDerWaalsContact CD1-O 3.22Å; L331-K333 WeakPolarHBondContact CD1-O 3.4Å; L331-K333 WeakPolarHBondContact CD2-O 3.37Å; L331-K333 WeakPolarHBondContact CG-O 3.47Å; L331-L335 HydrophobicContact CD1-CD1 4.17Å; L331-L335 HydrophobicContact CD1-CD2 3.81Å; L331-L335 HydrophobicContact CD1-CG 3.83Å; L331-L335 HydrophobicContact CD2-CD1 4.42Å; L331-L335 HydrophobicContact CD2-CG 4.2Å
332	K	96	Very high	94.2	Very high	127 Å²	127	70.9 Å²	70.9	55%	0.552	34%	0.337	S	S	*	.	S	Bend	trans	-111.9	-17.1	-177	-174.8	174	179.2	175.5	0	113.8	I315	I315-K332 WeakPolarHBondContact O-CA 2.9Å; I315-K332 VanDerWaalsContact O-CB 3.31Å; I315-K332 WeakPolarHBondContact O-CB 3.29Å; I315-K332 PolarHBondContact O-N 2.96Å
333	K	95.8	Very high	94.6	Very high	111 Å²	111	63 Å²	63	48%	0.483	30%	0.302	S	S	.	.	S	Bend	trans	-144.8	152.2	175.4	-67.1	-168.8	-174.7	176.2	0	109.5	G314 I315 L331	G314-K333 WeakPolarHBondContact O-CD 3.43Å; G314-K333 VanDerWaalsContact O-CE 3.25Å; G314-K333 WeakPolarHBondContact O-CE 3.46Å; I315-K333 HydrophobicContact CD1-CB 4.27Å; I315-K333 HydrophobicContact CD1-CD 4.11Å; I315-K333 PolarHBondContact O-N 2.85Å; L331-K333 VanDerWaalsContact CD1-O 3.22Å; L331-K333 WeakPolarHBondContact CD1-O 3.4Å; L331-K333 WeakPolarHBondContact CD2-O 3.37Å; L331-K333 WeakPolarHBondContact CG-O 3.47Å
334	P	95.8	Very high	95	Very high	99 Å²	99	56.6 Å²	56.6	64%	0.643	28%	0.276	S	S	*	.			trans	-57.3	149.8	174	26.8	-35.7	0	0	0	110.7
335	L	95.6	Very high	95.3	Very high	18 Å²	18	54.4 Å²	54.4	9%	0.094	26%	0.262	C	S	.	.			trans	-89	169	172.6	-62.1	172.9	0	0	0	109.6	V277 E279 I315 F316 L331 Y343 V374	V277-L335 HydrophobicContact CB-CD1 4.3Å; V277-L335 HydrophobicContact CG1-CD1 3.57Å; V277-L335 HydrophobicContact CG2-CD1 3.76Å; E279-L335 HydrophobicContact CB-CB 3.89Å; I315-L335 HydrophobicContact CG2-CD2 3.69Å; F316-L335 HydrophobicContact CE1-CD2 4.43Å; F316-L335 HydrophobicContact CZ-CD2 3.92Å; L331-L335 HydrophobicContact CD1-CD1 4.17Å; L331-L335 HydrophobicContact CD1-CD2 3.81Å; L331-L335 HydrophobicContact CD1-CG 3.83Å; L331-L335 HydrophobicContact CD2-CD1 4.42Å; L331-L335 HydrophobicContact CD2-CG 4.2Å; L335-Y343 HydrophobicContact CD2-CE2 3.99Å; L335-V374 HydrophobicContact CB-CG1 4.32Å; L335-V374 HydrophobicContact CD1-CG1 4.27Å; L335-V374 HydrophobicContact CD1-CG2 4.29Å; L335-V374 HydrophobicContact CD2-CG2 4.4Å
336	N	93.6	Very high	95.6	Very high	49 Å²	49	52.7 Å²	52.7	26%	0.262	26%	0.259	S	S	.	.			trans	-158.3	129.6	160.5	164.4	-103	0	0	0	106.7	E279 E338 K339 K340	E279-N336 VanDerWaalsContact OE2-CA 3.27Å; E279-N336 WeakPolarHBondContact OE2-CA 3.37Å; N336-E338 PolarHBondContact ND2-OE2 2.69Å; N336-K339 WeakPolarHBondContact OD1-CB 3.48Å; N336-K339 PolarHBondContact OD1-N 2.79Å; N336-K339 VanDerWaalsContact OD1-N 3.09Å; N336-K340 PolarHBondContact O-N 2.82Å
337	Y	94.4	Very high	95.7	Very high	36 Å²	36	50.3 Å²	50.3	14%	0.141	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-41.2	-166.4	169.8	-102	0	0	0	111.8	E279 K339 K340 K341 V374 D376 S412	E279-Y337 VanDerWaalsContact CD-CB 3.48Å; E279-Y337 WeakPolarHBondContact OE1-CB 3.16Å; E279-Y337 VanDerWaalsContact OE2-CB 3.24Å; E279-Y337 WeakPolarHBondContact OE2-CB 3.36Å; E279-Y337 PolarHBondContact OE2-N 3.06Å; Y337-K339 PolarHBondContact O-N 2.87Å; Y337-K340 CarbonylContact O-C 3.59Å; Y337-K340 VanDerWaalsContact O-C 3.24Å; Y337-K340 PolarHBondContact O-N 2.6Å; Y337-K341 HydrophobicContact CD1-CD 4.3Å; Y337-K341 HydrophobicContact CD1-CG 4.26Å; Y337-K341 HydrophobicContact CD2-CB 3.83Å; Y337-K341 HydrophobicContact CD2-CD 4.14Å; Y337-K341 HydrophobicContact CD2-CG 3.59Å; Y337-K341 HydrophobicContact CE1-CD 3.79Å; Y337-K341 HydrophobicContact CE1-CG 4.2Å; Y337-K341 HydrophobicContact CE2-CB 3.71Å; Y337-K341 HydrophobicContact CE2-CD 3.61Å; Y337-K341 HydrophobicContact CE2-CG 3.53Å; Y337-K341 HydrophobicContact CG-CD 4.46Å; Y337-K341 HydrophobicContact CG-CG 3.98Å; Y337-K341 VanDerWaalsContact CZ-CD 3.45Å; Y337-K341 VanDerWaalsContact CZ-CE 3.48Å; Y337-K341 VanDerWaalsContact CZ-NZ 3.26Å; Y337-K341 WeakPolarHBondContact O-CG 3.22Å; Y337-K341 PolarHBondContact O-N 3.23Å; Y337-K341 VanDerWaalsContact O-N 3.08Å; Y337-K341 PolarHBondContact OH-NZ 2.67Å; Y337-V374 HydrophobicContact CD2-CB 4.13Å; Y337-V374 HydrophobicContact CD2-CG1 4.17Å; Y337-V374 VanDerWaalsContact CD2-O 3.29Å; Y337-V374 WeakPolarHBondContact CD2-O 3.46Å; Y337-V374 VanDerWaalsContact CE2-O 3.31Å; Y337-V374 WeakPolarHBondContact CE2-O 3.4Å; Y337-D376 HydrophobicContact CD1-CB 4.29Å; Y337-D376 VanDerWaalsContact CD1-OD1 3.32Å; Y337-D376 WeakPolarHBondContact CD1-OD1 3.34Å; Y337-D376 HydrophobicContact CE1-CB 3.97Å; Y337-D376 WeakPolarHBondContact CE1-OD1 3.4Å; Y337-D376 WeakPolarHBondContact CE1-OD2 3.24Å; Y337-D376 VanDerWaalsContact CZ-CG 3.43Å; Y337-D376 PolarHBondContact OH-OD2 2.73Å; Y337-S412 WeakPolarHBondContact CE1-OG 3.18Å
338	E	91.3	Very high	95.7	Very high	61 Å²	61	52 Å²	52	29%	0.285	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-48.1	176.3	-72.4	47.9	-97.9	0	0	109.8	N336 P410 S412	N336-E338 PolarHBondContact ND2-OE2 2.69Å; E338-P410 WeakPolarHBondContact CG-O 3.32Å; E338-S412 PolarHBondContact OE1-OG 2.8Å
339	K	92.5	Very high	95.6	Very high	184 Å²	184	50.2 Å²	50.2	80%	0.8	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-37.6	179.2	-172.8	174.2	-171.2	168.6	0	112.5	N336 Y337	N336-K339 WeakPolarHBondContact OD1-CB 3.48Å; N336-K339 PolarHBondContact OD1-N 2.79Å; N336-K339 VanDerWaalsContact OD1-N 3.09Å; Y337-K339 PolarHBondContact O-N 2.87Å
340	K	94.4	Very high	95.4	Very high	57 Å²	57	50.8 Å²	50.8	25%	0.248	25%	0.252	C	S	.	.			trans	-161.1	94	-179.1	-169.1	154.2	174.8	179.3	0	115.7	D311 N336 Y337 S342 Y343 V374	D311-K340 PolarHBondContact O-NZ 2.89Å; D311-K340 IonicContact OD1-NZ 3.07Å; D311-K340 WeakPolarHBondContact OD2-CE 3.46Å; D311-K340 IonicContact OD2-NZ 3.07Å; D311-K340 PolarHBondContact OD2-NZ 3.44Å; N336-K340 PolarHBondContact O-N 2.82Å; Y337-K340 CarbonylContact O-C 3.59Å; Y337-K340 VanDerWaalsContact O-C 3.24Å; Y337-K340 PolarHBondContact O-N 2.6Å; K340-S342 VanDerWaalsContact C-N 3.3Å; K340-S342 WeakPolarHBondContact CE-O 3.38Å; K340-S342 WeakPolarHBondContact CG-O 3.43Å; K340-S342 PolarHBondContact O-N 3.04Å; K340-Y343 HydrophobicContact CB-CE2 4.27Å; K340-Y343 HydrophobicContact CD-CD1 3.96Å; K340-Y343 HydrophobicContact CD-CE1 3.48Å; K340-Y343 VanDerWaalsContact CD-CE1 3.48Å; K340-Y343 HydrophobicContact CD-CE2 4.21Å; K340-Y343 VanDerWaalsContact CE-CD1 3.42Å; K340-Y343 HydrophobicContact CG-CD2 4.38Å; K340-Y343 HydrophobicContact CG-CE1 4.12Å; K340-Y343 HydrophobicContact CG-CE2 3.91Å; K340-V374 WeakPolarHBondContact O-CG2 3.28Å
341	K	95.1	Very high	95.1	Very high	84 Å²	84	50 Å²	50	37%	0.365	25%	0.246	S	C	.	.	S	Bend	trans	-65.1	-15.8	178.9	-53.5	-165.9	169.3	-151.8	0	116.7	Y337 V374 S412	Y337-K341 HydrophobicContact CD1-CD 4.3Å; Y337-K341 HydrophobicContact CD1-CG 4.26Å; Y337-K341 HydrophobicContact CD2-CB 3.83Å; Y337-K341 HydrophobicContact CD2-CD 4.14Å; Y337-K341 HydrophobicContact CD2-CG 3.59Å; Y337-K341 HydrophobicContact CE1-CD 3.79Å; Y337-K341 HydrophobicContact CE1-CG 4.2Å; Y337-K341 HydrophobicContact CE2-CB 3.71Å; Y337-K341 HydrophobicContact CE2-CD 3.61Å; Y337-K341 HydrophobicContact CE2-CG 3.53Å; Y337-K341 HydrophobicContact CG-CD 4.46Å; Y337-K341 HydrophobicContact CG-CG 3.98Å; Y337-K341 VanDerWaalsContact CZ-CD 3.45Å; Y337-K341 VanDerWaalsContact CZ-CE 3.48Å; Y337-K341 VanDerWaalsContact CZ-NZ 3.26Å; Y337-K341 WeakPolarHBondContact O-CG 3.22Å; Y337-K341 PolarHBondContact O-N 3.23Å; Y337-K341 VanDerWaalsContact O-N 3.08Å; Y337-K341 PolarHBondContact OH-NZ 2.67Å; K341-V374 PolarHBondContact O-N 2.83Å; K341-S412 PolarHBondContact NZ-OG 3.16Å
342	S	96.8	Very high	94.4	Very high	44 Å²	44	53.8 Å²	53.8	31%	0.308	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	155	174	67.5	0	0	0	0	113.6	K340 I372	K340-S342 VanDerWaalsContact C-N 3.3Å; K340-S342 WeakPolarHBondContact CE-O 3.38Å; K340-S342 WeakPolarHBondContact CG-O 3.43Å; K340-S342 PolarHBondContact O-N 3.04Å; S342-I372 CarbonylContact C-O 3.57Å; S342-I372 WeakPolarHBondContact CA-O 3.17Å; S342-I372 VanDerWaalsContact CB-O 3.3Å; S342-I372 WeakPolarHBondContact CB-O 3.46Å
343	Y	97.1	Very high	93.8	Very high	22 Å²	22	51.8 Å²	51.8	9%	0.086	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	154.9	174.6	-64.8	-97.1	0	0	0	110.5	D311 I315 F316 L335 K340 K371 I372 V374	D311-Y343 VanDerWaalsContact OD1-CA 3.28Å; D311-Y343 WeakPolarHBondContact OD1-CA 3.22Å; D311-Y343 WeakPolarHBondContact OD1-CB 3.39Å; I315-Y343 HydrophobicContact CB-CE1 4.43Å; I315-Y343 HydrophobicContact CG1-CE1 3.8Å; F316-Y343 HydrophobicContact CE2-CD1 4.16Å; F316-Y343 AromaticContact CE2-CD2 3.82Å; F316-Y343 HydrophobicContact CE2-CD2 3.82Å; F316-Y343 HydrophobicContact CE2-CE2 4.37Å; F316-Y343 AromaticContact CE2-CG 3.71Å; F316-Y343 HydrophobicContact CE2-CG 3.71Å; F316-Y343 HydrophobicContact CZ-CD2 4.08Å; F316-Y343 HydrophobicContact CZ-CG 4.41Å; L335-Y343 HydrophobicContact CD2-CE2 3.99Å; K340-Y343 HydrophobicContact CB-CE2 4.27Å; K340-Y343 HydrophobicContact CD-CD1 3.96Å; K340-Y343 HydrophobicContact CD-CE1 3.48Å; K340-Y343 VanDerWaalsContact CD-CE1 3.48Å; K340-Y343 HydrophobicContact CD-CE2 4.21Å; K340-Y343 VanDerWaalsContact CE-CD1 3.42Å; K340-Y343 HydrophobicContact CG-CD2 4.38Å; K340-Y343 HydrophobicContact CG-CE1 4.12Å; K340-Y343 HydrophobicContact CG-CE2 3.91Å; Y343-K371 WeakPolarHBondContact O-CA 3.38Å; Y343-I372 PolarHBondContact N-O 2.88Å; Y343-I372 PolarHBondContact O-N 2.98Å; Y343-V374 HydrophobicContact CD2-CG2 4.03Å; Y343-V374 HydrophobicContact CE2-CG2 3.9Å
344	T	97.1	Very high	92.9	Very high	51 Å²	51	50.7 Å²	50.7	31%	0.313	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	121.1	173.7	-52	0	0	0	0	109.5	G310 D311 M369	G310-T344 CarbonylContact C-O 3.53Å; G310-T344 WeakPolarHBondContact CA-O 3.34Å; D311-T344 PolarHBondContact N-O 3.48Å; D311-T344 PolarHBondContact OD1-N 3.17Å; T344-M369 HydrophobicContact CG2-CG 3.58Å; T344-M369 HydrophobicContact CG2-SD 3.95Å
345	L	97	Very high	92.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	147.6	173.8	-55.5	-178.3	0	0	0	109	I307 F316 L329 I347 M369 L370 I372	I307-L345 HydrophobicContact CD1-CD1 4.09Å; I307-L345 HydrophobicContact CG1-CD1 4.45Å; I307-L345 HydrophobicContact CG2-CB 4.25Å; I307-L345 HydrophobicContact CG2-CD1 4.39Å; I307-L345 HydrophobicContact CG2-CD2 4.04Å; I307-L345 HydrophobicContact CG2-CG 4.46Å; F316-L345 HydrophobicContact CB-CD1 4.17Å; F316-L345 HydrophobicContact CD2-CD1 4.28Å; F316-L345 HydrophobicContact CG-CD1 4.44Å; L329-L345 HydrophobicContact CD1-CD1 4.02Å; L329-L345 HydrophobicContact CD2-CD1 4.47Å; L345-I347 HydrophobicContact CB-CD1 4.03Å; L345-I347 HydrophobicContact CD1-CD1 4.29Å; L345-M369 CarbonylContact O-C 3.53Å; L345-L370 PolarHBondContact N-O 2.88Å; L345-L370 PolarHBondContact O-N 2.72Å; L345-I372 HydrophobicContact CD1-CD1 3.79Å; L345-I372 HydrophobicContact CG-CD1 4.18Å
346	N	96.6	Very high	91.6	Very high	49 Å²	49	53.6 Å²	53.6	26%	0.262	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	125.2	157.8	-65.7	-45.1	0	0	0	108.3	I308 N309 T368 M369	I308-N346 HydrophobicContact CD1-CB 4.17Å; I308-N346 HydrophobicContact CG1-CB 4Å; I308-N346 WeakPolarHBondContact CG1-O 3.32Å; I308-N346 PolarHBondContact N-O 2.84Å; I308-N346 VanDerWaalsContact N-O 3.12Å; N309-N346 PolarHBondContact O-N 3.05Å; N309-N346 WeakPolarHBondContact OD1-CB 3.45Å; N309-N346 PolarHBondContact OD1-ND2 3.26Å; N346-T368 WeakPolarHBondContact CA-O 3.36Å; N346-M369 WeakPolarHBondContact OD1-CA 3.31Å
347	I	96.8	Very high	91	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	127.7	178.6	-51.8	-56.5	0	0	0	107.7	F268 I290 Y305 S306 I307 I318 L345 A367 T368 L370	F268-I347 HydrophobicContact CZ-CG2 4.21Å; I290-I347 HydrophobicContact CD1-CB 4.39Å; I290-I347 HydrophobicContact CD1-CG1 4.24Å; I290-I347 HydrophobicContact CG2-CG2 4.3Å; Y305-I347 HydrophobicContact CD1-CG2 4.26Å; S306-I347 WeakPolarHBondContact O-CA 3.39Å; I307-I347 HydrophobicContact CB-CD1 4.46Å; I307-I347 HydrophobicContact CG1-CD1 3.8Å; I318-I347 HydrophobicContact CD1-CD1 4.18Å; I318-I347 HydrophobicContact CD1-CG2 3.71Å; L345-I347 HydrophobicContact CB-CD1 4.03Å; L345-I347 HydrophobicContact CD1-CD1 4.29Å; I347-A367 VanDerWaalsContact O-CA 3.28Å; I347-A367 WeakPolarHBondContact O-CA 3.36Å; I347-T368 HydrophobicContact CB-CG2 4.35Å; I347-T368 PolarHBondContact N-O 2.89Å; I347-T368 PolarHBondContact O-N 2.82Å; I347-L370 HydrophobicContact CD1-CD2 4.38Å; I347-L370 HydrophobicContact CG1-CB 3.98Å; I347-L370 HydrophobicContact CG1-CD2 4.09Å
348	E	95.6	Very high	90.4	Very high	36 Å²	36	55.1 Å²	55.1	17%	0.168	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.6	170.1	-176.1	165.6	102.7	0	0	108.9	Y305 S306 I308 K365 D366	Y305-E348 CarbonylContact C-O 3.42Å; Y305-E348 WeakPolarHBondContact CA-O 3.15Å; S306-E348 PolarHBondContact N-O 2.94Å; S306-E348 PolarHBondContact O-N 3.41Å; I308-E348 HydrophobicContact CB-CB 4.48Å; I308-E348 HydrophobicContact CD1-CB 4.22Å; I308-E348 HydrophobicContact CG1-CB 4.21Å; I308-E348 HydrophobicContact CG2-CB 3.49Å; I308-E348 VanDerWaalsContact CG2-CB 3.49Å; I308-E348 HydrophobicContact CG2-CG 4.3Å; E348-K365 HydrophobicContact CG-CB 4.24Å; E348-K365 HydrophobicContact CG-CD 4.38Å; E348-K365 IonicContact OE1-NZ 3.79Å; E348-K365 PolarHBondContact OE1-NZ 3.18Å; E348-K365 IonicContact OE2-NZ 2.79Å; E348-K365 PolarHBondContact OE2-NZ 2.92Å; E348-D366 WeakPolarHBondContact CA-O 2.87Å
349	G	95.1	Very high	89.8	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127	168.1	0	0	0	0	0	108.6	T304 K365 D366	T304-G349 WeakPolarHBondContact O-CA 3.48Å; G349-K365 WeakPolarHBondContact O-CA 3.29Å; G349-K365 WeakPolarHBondContact O-CB 3.29Å; G349-D366 PolarHBondContact N-O 3.25Å; G349-D366 PolarHBondContact O-N 2.92Å
350	A	92.3	Very high	89.1	Confident	13 Å²	13	53.9 Å²	53.9	11%	0.107	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.2	-175.6	0	0	0	0	0	111.9	M303 T304 F364 K365	M303-A350 CarbonylContact C-O 3.57Å; M303-A350 VanDerWaalsContact CA-O 3.24Å; M303-A350 WeakPolarHBondContact CA-O 3.39Å; M303-A350 WeakPolarHBondContact CB-O 2.98Å; T304-A350 PolarHBondContact N-O 2.77Å; T304-A350 PolarHBondContact O-N 2.88Å; A350-F364 CarbonylContact C-O 3.56Å; A350-F364 VanDerWaalsContact CA-O 3.26Å; A350-F364 WeakPolarHBondContact CA-O 2.98Å; A350-K365 HydrophobicContact CB-CB 3.63Å
351	N	90.3	Very high	88.3	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.037	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	146.2	176	-54.2	78.3	0	0	0	111	P266 D294 N300 F364	P266-N351 WeakPolarHBondContact CD-OD1 3.44Å; D294-N351 PolarHBondContact OD2-ND2 3.31Å; N300-N351 PolarHBondContact O-ND2 3.46Å; N351-F364 PolarHBondContact N-O 3.48Å; N351-F364 VanDerWaalsContact OD1-CB 3.29Å; N351-F364 WeakPolarHBondContact OD1-CB 3.14Å; N351-F364 PolarHBondContact OD1-O 2.74Å
352	T	84.2	Confident	87.1	Confident	81 Å²	81	53.3 Å²	53.3	50%	0.497	28%	0.281	S	S	.	.	S	Bend	trans	-87.6	-26.1	174.9	60.3	0	0	0	0	112.5	D302 T304	D302-T352 WeakPolarHBondContact O-CB 3.31Å; D302-T352 PolarHBondContact O-N 2.97Å; D302-T352 PolarHBondContact O-OG1 3.15Å; T304-T352 HydrophobicContact CG2-CG2 3.57Å
353	H	82.8	Confident	86.2	Confident	86 Å²	86	54 Å²	54	40%	0.398	28%	0.284	S	S	.	.			trans	-95	151.6	176.2	-163.8	-122.4	0	0	0	111.4	N262 S299 N300	N262-H353 PolarHBondContact ND2-O 2.93Å; N262-H353 VanDerWaalsContact ND2-O 3.09Å; S299-H353 VanDerWaalsContact O-CB 3.26Å; S299-H353 WeakPolarHBondContact O-CB 3.3Å; N300-H353 PolarHBondContact OD1-ND1 3.31Å
354	L	77.6	Confident	85.7	Confident	87 Å²	87	54.8 Å²	54.8	46%	0.455	29%	0.288	S	S	.	.			trans	-134.9	110.6	-174.5	-102.2	157.7	0	0	0	108.7	P363	L354-P363 HydrophobicContact CD1-CB 4.34Å; L354-P363 HydrophobicContact CD2-CB 4.44Å; L354-P363 HydrophobicContact CG-CB 4.29Å
355	D	81.9	Confident	85.4	Confident	19 Å²	19	57.2 Å²	57.2	10%	0.102	29%	0.294	C	S	.	.			trans	-73.4	137.5	170.4	-168.2	-70.8	0	0	0	110.2	N262 R357 F358 S359	N262-D355 HydrophobicContact CB-CB 4.38Å; D355-R357 PolarHBondContact O-N 3.12Å; D355-R357 VanDerWaalsContact OD1-CB 3.22Å; D355-R357 WeakPolarHBondContact OD1-CB 3.29Å; D355-R357 WeakPolarHBondContact OD1-CG 3.48Å; D355-R357 IonicContact OD1-CZ 3.57Å; D355-R357 PolarHBondContact OD1-N 3.05Å; D355-R357 IonicContact OD1-NE 3.47Å; D355-R357 PolarHBondContact OD1-NE 2.86Å; D355-R357 IonicContact OD1-NH2 3.56Å; D355-R357 IonicContact OD2-CZ 3.8Å; D355-R357 IonicContact OD2-NE 3.91Å; D355-R357 PolarHBondContact OD2-NE 2.73Å; D355-R357 IonicContact OD2-NH2 3.78Å; D355-R357 PolarHBondContact OD2-NH2 3.03Å; D355-F358 HydrophobicContact CB-CD2 4.08Å; D355-F358 PolarHBondContact O-N 2.88Å; D355-F358 VanDerWaalsContact O-N 3.13Å; D355-S359 PolarHBondContact O-N 3.35Å; D355-S359 VanDerWaalsContact O-N 3.09Å
356	F	81.3	Confident	85.3	Confident	160 Å²	160	59.2 Å²	59.2	70%	0.702	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-29.1	-178.1	64.4	-85	0	0	0	112.8	F358 S359	F356-F358 VanDerWaalsContact C-N 3.33Å; F356-F358 PolarHBondContact O-N 2.92Å; F356-S359 WeakPolarHBondContact O-CB 3.13Å; F356-S359 PolarHBondContact O-N 2.77Å; F356-S359 PolarHBondContact O-OG 3.22Å
357	R	81.7	Confident	85.3	Confident	75 Å²	75	59.1 Å²	59.1	28%	0.283	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-41.5	175.2	-70.2	168.8	-84.6	-167.1	-8.1	111.7	E170 D355 H360	E170-R357 PolarHBondContact O-NH1 3.01Å; D355-R357 PolarHBondContact O-N 3.12Å; D355-R357 VanDerWaalsContact OD1-CB 3.22Å; D355-R357 WeakPolarHBondContact OD1-CB 3.29Å; D355-R357 WeakPolarHBondContact OD1-CG 3.48Å; D355-R357 IonicContact OD1-CZ 3.57Å; D355-R357 PolarHBondContact OD1-N 3.05Å; D355-R357 IonicContact OD1-NE 3.47Å; D355-R357 PolarHBondContact OD1-NE 2.86Å; D355-R357 IonicContact OD1-NH2 3.56Å; D355-R357 IonicContact OD2-CZ 3.8Å; D355-R357 IonicContact OD2-NE 3.91Å; D355-R357 PolarHBondContact OD2-NE 2.73Å; D355-R357 IonicContact OD2-NH2 3.78Å; D355-R357 PolarHBondContact OD2-NH2 3.03Å; R357-H360 PolarHBondContact O-CE1 2.82Å; R357-H360 PolarHBondContact O-ND1 3.43Å
358	F	81.1	Confident	85.3	Confident	41 Å²	41	59.2 Å²	59.2	18%	0.18	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	3	-176.6	-50.6	-61.1	0	0	0	113.8	M171 V261 N262 D263 D355 F356 H360 L361 F364	M171-F358 HydrophobicContact SD-CZ 4.15Å; V261-F358 HydrophobicContact CG1-CE2 4.18Å; N262-F358 WeakPolarHBondContact O-CD2 3.43Å; N262-F358 WeakPolarHBondContact O-CE2 3.5Å; D263-F358 HydrophobicContact CB-CE2 3.71Å; D263-F358 HydrophobicContact CB-CZ 3.86Å; D355-F358 HydrophobicContact CB-CD2 4.08Å; D355-F358 PolarHBondContact O-N 2.88Å; D355-F358 VanDerWaalsContact O-N 3.13Å; F356-F358 VanDerWaalsContact C-N 3.33Å; F356-F358 PolarHBondContact O-N 2.92Å; F358-H360 PolarHBondContact O-N 2.97Å; F358-L361 HydrophobicContact CB-CD1 4.41Å; F358-L361 HydrophobicContact CD1-CD1 4.33Å; F358-L361 WeakPolarHBondContact O-CB 3.41Å; F358-L361 PolarHBondContact O-N 2.96Å; F358-F364 HydrophobicContact CB-CE2 4.27Å; F358-F364 HydrophobicContact CB-CZ 3.86Å; F358-F364 HydrophobicContact CD1-CZ 4.17Å; F358-F364 HydrophobicContact CD2-CE2 4.04Å; F358-F364 HydrophobicContact CD2-CZ 4.14Å; F358-F364 HydrophobicContact CG-CE2 4.14Å; F358-F364 AromaticContact CG-CZ 3.79Å; F358-F364 HydrophobicContact CG-CZ 3.79Å
359	S	78	Confident	85.3	Confident	76 Å²	76	61 Å²	61	53%	0.531	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-48.9	-29.7	177.2	60.8	0	0	0	0	114.9	D355 F356 L361 G362	D355-S359 PolarHBondContact O-N 3.35Å; D355-S359 VanDerWaalsContact O-N 3.09Å; F356-S359 WeakPolarHBondContact O-CB 3.13Å; F356-S359 PolarHBondContact O-N 2.77Å; F356-S359 PolarHBondContact O-OG 3.22Å; S359-L361 VanDerWaalsContact C-N 3.29Å; S359-L361 PolarHBondContact O-N 3.32Å; S359-G362 PolarHBondContact O-N 2.8Å
360	H	78.6	Confident	85.4	Confident	143 Å²	143	61 Å²	61	66%	0.662	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-71.6	-16.4	176.5	69.1	-85.6	0	0	0	114.7	R357 F358	R357-H360 PolarHBondContact O-CE1 2.82Å; R357-H360 PolarHBondContact O-ND1 3.43Å; F358-H360 PolarHBondContact O-N 2.97Å
361	L	77.2	Confident	85.6	Confident	106 Å²	106	64.2 Å²	64.2	56%	0.555	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-93.5	-12.4	175.1	-55.7	177	0	0	0	112.4	F358 S359 F364	F358-L361 HydrophobicContact CB-CD1 4.41Å; F358-L361 HydrophobicContact CD1-CD1 4.33Å; F358-L361 WeakPolarHBondContact O-CB 3.41Å; F358-L361 PolarHBondContact O-N 2.96Å; S359-L361 VanDerWaalsContact C-N 3.29Å; S359-L361 PolarHBondContact O-N 3.32Å; L361-F364 HydrophobicContact CB-CE1 4.45Å; L361-F364 HydrophobicContact CD1-CE1 3.81Å; L361-F364 HydrophobicContact CD1-CZ 4.22Å
362	G	71.2	Confident	86	Confident	24 Å²	24	63.9 Å²	63.9	25%	0.247	33%	0.331	C	S	.	.			trans	77	-174.9	-167.7	0	0	0	0	0	112.5	S359 F364	S359-G362 PolarHBondContact O-N 2.8Å; G362-F364 PolarHBondContact O-N 2.7Å
363	P	76.4	Confident	86.6	Confident	59 Å²	59	62.3 Å²	62.3	38%	0.383	32%	0.319	S	S	.	.	S	Bend	trans	-66.4	132.6	176.6	27.9	-33.7	0	0	0	109.6	L354	L354-P363 HydrophobicContact CD1-CB 4.34Å; L354-P363 HydrophobicContact CD2-CB 4.44Å; L354-P363 HydrophobicContact CG-CB 4.29Å
364	F	87.8	Confident	87.3	Confident	38 Å²	38	58.3 Å²	58.3	17%	0.167	30%	0.3	C	S	.	.			trans	-61.5	142.7	174.6	-74	-37.2	0	0	0	111.3	N262 D263 P265 A350 N351 F358 L361 G362	N262-F364 VanDerWaalsContact OD1-CD2 3.29Å; N262-F364 WeakPolarHBondContact OD1-CD2 3.47Å; D263-F364 WeakPolarHBondContact O-CE2 3.4Å; P265-F364 HydrophobicContact CB-CB 3.79Å; P265-F364 HydrophobicContact CB-CD1 4.35Å; P265-F364 HydrophobicContact CB-CG 4.01Å; A350-F364 CarbonylContact C-O 3.56Å; A350-F364 VanDerWaalsContact CA-O 3.26Å; A350-F364 WeakPolarHBondContact CA-O 2.98Å; N351-F364 PolarHBondContact N-O 3.48Å; N351-F364 VanDerWaalsContact OD1-CB 3.29Å; N351-F364 WeakPolarHBondContact OD1-CB 3.14Å; N351-F364 PolarHBondContact OD1-O 2.74Å; F358-F364 HydrophobicContact CB-CE2 4.27Å; F358-F364 HydrophobicContact CB-CZ 3.86Å; F358-F364 HydrophobicContact CD1-CZ 4.17Å; F358-F364 HydrophobicContact CD2-CE2 4.04Å; F358-F364 HydrophobicContact CD2-CZ 4.14Å; F358-F364 HydrophobicContact CG-CE2 4.14Å; F358-F364 AromaticContact CG-CZ 3.79Å; F358-F364 HydrophobicContact CG-CZ 3.79Å; L361-F364 HydrophobicContact CB-CE1 4.45Å; L361-F364 HydrophobicContact CD1-CE1 3.81Å; L361-F364 HydrophobicContact CD1-CZ 4.22Å; G362-F364 PolarHBondContact O-N 2.7Å
365	K	91.1	Very high	88.1	Confident	102 Å²	102	54.3 Å²	54.3	44%	0.443	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	157.1	-172.2	65.5	-162.3	-161.6	129	0	113.2	E348 G349 A350	E348-K365 HydrophobicContact CG-CB 4.24Å; E348-K365 HydrophobicContact CG-CD 4.38Å; E348-K365 IonicContact OE1-NZ 3.79Å; E348-K365 PolarHBondContact OE1-NZ 3.18Å; E348-K365 IonicContact OE2-NZ 2.79Å; E348-K365 PolarHBondContact OE2-NZ 2.92Å; G349-K365 WeakPolarHBondContact O-CA 3.29Å; G349-K365 WeakPolarHBondContact O-CB 3.29Å; A350-K365 HydrophobicContact CB-CB 3.63Å
366	D	94.8	Very high	88.6	Confident	41 Å²	41	56.6 Å²	56.6	22%	0.219	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	160.8	172.2	-172.1	35.9	0	0	0	109.7	P266 R267 F268 E348 G349	P266-D366 WeakPolarHBondContact O-CB 3.19Å; R267-D366 WeakPolarHBondContact CA-OD2 3.46Å; R267-D366 IonicContact NH1-OD1 3.73Å; F268-D366 HydrophobicContact CD2-CB 4.24Å; F268-D366 WeakPolarHBondContact CE2-O 3.26Å; F268-D366 PolarHBondContact N-OD2 2.92Å; E348-D366 WeakPolarHBondContact CA-O 2.87Å; G349-D366 PolarHBondContact N-O 3.25Å; G349-D366 PolarHBondContact O-N 2.92Å
367	A	95.1	Very high	89.1	Confident	48 Å²	48	51.4 Å²	51.4	40%	0.397	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	137.2	-175.8	0	0	0	0	0	112.3	I308 I347	I308-A367 HydrophobicContact CD1-CB 4.3Å; I347-A367 VanDerWaalsContact O-CA 3.28Å; I347-A367 WeakPolarHBondContact O-CA 3.36Å
368	T	96.5	Very high	89.5	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	148.7	-177.9	-170.2	0	0	0	0	111.8	F268 Q270 K271 Y273 I290 N346 I347	F268-T368 HydrophobicContact CB-CG2 4.13Å; F268-T368 HydrophobicContact CD1-CG2 3.52Å; F268-T368 HydrophobicContact CD2-CG2 3.63Å; F268-T368 HydrophobicContact CE1-CG2 3.71Å; F268-T368 HydrophobicContact CE2-CG2 3.8Å; F268-T368 HydrophobicContact CG-CG2 3.47Å; F268-T368 VanDerWaalsContact CG-CG2 3.47Å; F268-T368 HydrophobicContact CZ-CG2 3.84Å; Q270-T368 PolarHBondContact O-OG1 3.41Å; K271-T368 PolarHBondContact O-OG1 2.87Å; Y273-T368 HydrophobicContact CD2-CG2 3.83Å; Y273-T368 WeakPolarHBondContact CD2-OG1 3.38Å; Y273-T368 HydrophobicContact CE2-CG2 3.9Å; I290-T368 HydrophobicContact CD1-CG2 3.53Å; N346-T368 WeakPolarHBondContact CA-O 3.36Å; I347-T368 HydrophobicContact CB-CG2 4.35Å; I347-T368 PolarHBondContact N-O 2.89Å; I347-T368 PolarHBondContact O-N 2.82Å
369	M	96.8	Very high	90	Very high	72 Å²	72	53.8 Å²	53.8	36%	0.355	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	122.8	176.2	-177.7	-161.7	-67.8	0	0	109.7	K271 H272 Y273 T344 L345 N346	K271-M369 PolarHBondContact O-N 2.93Å; H272-M369 CarbonylContact C-O 3.48Å; H272-M369 VanDerWaalsContact CA-O 3.29Å; H272-M369 WeakPolarHBondContact CA-O 3.43Å; H272-M369 PolarHBondContact ND1-SD 2.95Å; Y273-M369 PolarHBondContact N-O 2.97Å; T344-M369 HydrophobicContact CG2-CG 3.58Å; T344-M369 HydrophobicContact CG2-SD 3.95Å; L345-M369 CarbonylContact O-C 3.53Å; N346-M369 WeakPolarHBondContact OD1-CA 3.31Å
370	L	97.1	Very high	90.6	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	109.7	172.9	174.6	54.9	0	0	0	109.9	L275 I290 L329 L345 I347 I372	L275-L370 HydrophobicContact CB-CD1 4.31Å; L275-L370 HydrophobicContact CD1-CD1 3.9Å; L275-L370 HydrophobicContact CD1-CD2 4.19Å; L275-L370 HydrophobicContact CG-CD1 3.83Å; I290-L370 HydrophobicContact CD1-CD2 4.48Å; L329-L370 HydrophobicContact CD2-CD2 3.94Å; L345-L370 PolarHBondContact N-O 2.88Å; L345-L370 PolarHBondContact O-N 2.72Å; I347-L370 HydrophobicContact CD1-CD2 4.38Å; I347-L370 HydrophobicContact CG1-CB 3.98Å; I347-L370 HydrophobicContact CG1-CD2 4.09Å; L370-I372 HydrophobicContact CG-CG1 4.2Å
371	K	96.9	Very high	91.3	Very high	80 Å²	80	45.9 Å²	45.9	35%	0.348	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	126.5	170.3	-171.2	-176.1	178.3	-171.7	0	109.7	Y273 Q274 L275 Y343	Y273-K371 PolarHBondContact O-N 2.63Å; Q274-K371 VanDerWaalsContact CA-O 3.29Å; Q274-K371 WeakPolarHBondContact CA-O 3.29Å; L275-K371 PolarHBondContact N-O 2.9Å; Y343-K371 WeakPolarHBondContact O-CA 3.38Å
372	I	97.5	Very high	92.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	118.3	176.3	-55.2	163	0	0	0	106.9	V277 V287 F316 L329 S342 Y343 L345 L370	V277-I372 HydrophobicContact CG1-CG2 3.54Å; V287-I372 HydrophobicContact CG1-CG2 4.32Å; F316-I372 HydrophobicContact CD1-CD1 4.05Å; F316-I372 HydrophobicContact CD2-CD1 3.7Å; F316-I372 HydrophobicContact CE1-CD1 3.94Å; F316-I372 HydrophobicContact CE1-CG2 4.24Å; F316-I372 HydrophobicContact CE2-CD1 3.6Å; F316-I372 HydrophobicContact CG-CD1 3.94Å; F316-I372 HydrophobicContact CZ-CB 4.44Å; F316-I372 HydrophobicContact CZ-CD1 3.72Å; F316-I372 HydrophobicContact CZ-CG2 3.9Å; L329-I372 HydrophobicContact CD2-CD1 3.53Å; L329-I372 HydrophobicContact CD2-CG1 4.21Å; S342-I372 CarbonylContact C-O 3.57Å; S342-I372 WeakPolarHBondContact CA-O 3.17Å; S342-I372 VanDerWaalsContact CB-O 3.3Å; S342-I372 WeakPolarHBondContact CB-O 3.46Å; Y343-I372 PolarHBondContact N-O 2.88Å; Y343-I372 PolarHBondContact O-N 2.98Å; L345-I372 HydrophobicContact CD1-CD1 3.79Å; L345-I372 HydrophobicContact CG-CD1 4.18Å; L370-I372 HydrophobicContact CG-CG1 4.2Å
373	I	97.1	Very high	93.2	Very high	48 Å²	48	46.5 Å²	46.5	25%	0.246	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.3	171.9	-63.1	-176.1	0	0	0	107.7	Q274 L275 Y276 V277	Q274-I373 VanDerWaalsContact CD-CD1 3.45Å; Q274-I373 HydrophobicContact CG-CD1 4.06Å; Q274-I373 HydrophobicContact CG-CG1 4.24Å; L275-I373 PolarHBondContact O-N 3.35Å; Y276-I373 WeakPolarHBondContact CA-O 3.19Å; Y276-I373 HydrophobicContact CD2-CG2 4.23Å; V277-I373 PolarHBondContact N-O 2.92Å
374	V	96.9	Very high	94	Very high	1 Å²	1	47 Å²	47	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	136.6	168.9	-174.1	0	0	0	0	107.4	V277 E279 L335 Y337 K340 K341 Y343	V277-V374 CarbonylContact O-C 3.5Å; V277-V374 VanDerWaalsContact O-CA 3.32Å; V277-V374 WeakPolarHBondContact O-CA 3.19Å; E279-V374 HydrophobicContact CB-CG1 3.8Å; L335-V374 HydrophobicContact CB-CG1 4.32Å; L335-V374 HydrophobicContact CD1-CG1 4.27Å; L335-V374 HydrophobicContact CD1-CG2 4.29Å; L335-V374 HydrophobicContact CD2-CG2 4.4Å; Y337-V374 HydrophobicContact CD2-CB 4.13Å; Y337-V374 HydrophobicContact CD2-CG1 4.17Å; Y337-V374 VanDerWaalsContact CD2-O 3.29Å; Y337-V374 WeakPolarHBondContact CD2-O 3.46Å; Y337-V374 VanDerWaalsContact CE2-O 3.31Å; Y337-V374 WeakPolarHBondContact CE2-O 3.4Å; K340-V374 WeakPolarHBondContact O-CG2 3.28Å; K341-V374 PolarHBondContact O-N 2.83Å; Y343-V374 HydrophobicContact CD2-CG2 4.03Å; Y343-V374 HydrophobicContact CE2-CG2 3.9Å
375	G	94.8	Very high	94.3	Very high	4 Å²	4	50 Å²	50	4%	0.041	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.7	172.8	0	0	0	0	0	112.3	Y276 V277 E279 V377	Y276-G375 WeakPolarHBondContact OH-CA 3.22Å; V277-G375 PolarHBondContact O-N 2.71Å; E279-G375 PolarHBondContact N-O 3.05Å; E279-G375 VanDerWaalsContact N-O 3.17Å; G375-V377 PolarHBondContact O-N 3.02Å
376	D	93.3	Very high	94.4	Very high	66 Å²	66	50.9 Å²	50.9	35%	0.353	28%	0.284	S	S	.	.			trans	-37.5	128.1	158.1	-96.6	-59.5	0	0	0	109.7	E279 Y337	E279-D376 WeakPolarHBondContact OE1-CA 3.02Å; Y337-D376 HydrophobicContact CD1-CB 4.29Å; Y337-D376 VanDerWaalsContact CD1-OD1 3.32Å; Y337-D376 WeakPolarHBondContact CD1-OD1 3.34Å; Y337-D376 HydrophobicContact CE1-CB 3.97Å; Y337-D376 WeakPolarHBondContact CE1-OD1 3.4Å; Y337-D376 WeakPolarHBondContact CE1-OD2 3.24Å; Y337-D376 VanDerWaalsContact CZ-CG 3.43Å; Y337-D376 PolarHBondContact OH-OD2 2.73Å
377	V	92.3	Very high	94.5	Very high	51 Å²	51	51.7 Å²	51.7	31%	0.309	29%	0.294	S	S	.	.			trans	-143.2	97.8	163	-174.8	0	0	0	0	111.7	P278 E279 G375 E379	P278-V377 HydrophobicContact CB-CG2 3.59Å; E279-V377 HydrophobicContact CG-CB 4.42Å; E279-V377 PolarHBondContact OE1-N 3.46Å; G375-V377 PolarHBondContact O-N 3.02Å; V377-E379 PolarHBondContact O-N 3.34Å
378	D	90.1	Very high	94.5	Very high	84 Å²	84	50.9 Å²	50.9	45%	0.449	28%	0.28	S	S	.	.			trans	13	90.3	154.9	-112.6	64	0	0	0	114.8	D411 N465 L468	D378-D411 WeakPolarHBondContact CA-OD2 3.39Å; D378-N465 PolarHBondContact OD2-ND2 2.76Å; D378-L468 HydrophobicContact CB-CD1 3.92Å; D378-L468 WeakPolarHBondContact O-CD1 3.38Å
379	E	90.4	Very high	94.5	Very high	82 Å²	82	55.9 Å²	55.9	38%	0.383	31%	0.31	S	S	.	.			trans	-107.2	137.6	179	-71.7	-149.5	124.4	0	0	112.6	V377 P410 D411	V377-E379 PolarHBondContact O-N 3.34Å; E379-P410 HydrophobicContact CB-CG 3.69Å; E379-D411 PolarHBondContact N-OD2 3.48Å
380	P	91.6	Very high	94.4	Very high	54 Å²	54	53.2 Å²	53.2	35%	0.351	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-63.9	139.1	-175.7	25.9	-34.6	0	0	0	113	L382 L468	P380-L382 PolarHBondContact O-N 3.01Å; P380-L468 HydrophobicContact CB-CB 4.06Å
381	P	93.2	Very high	94.4	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-51.6	124.6	-172.4	-31.8	35.7	0	0	0	115.4	A407 Q408 V417 A460 E462 S470	P381-A407 HydrophobicContact CB-CB 4.29Å; P381-Q408 CarbonylContact C-O 3.5Å; P381-V417 HydrophobicContact CB-CG1 3.96Å; P381-V417 HydrophobicContact CB-CG2 3.85Å; P381-V417 HydrophobicContact CG-CG1 4.2Å; P381-V417 HydrophobicContact CG-CG2 3.92Å; P381-A460 HydrophobicContact CB-CB 4.42Å; P381-E462 HydrophobicContact CG-CG 3.65Å; P381-S470 WeakPolarHBondContact O-CB 3.27Å; P381-S470 PolarHBondContact O-OG 3.44Å
382	L	92.9	Very high	94.3	Very high	122 Å²	122	54.6 Å²	54.6	64%	0.639	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	122.8	-175.8	-174.4	62.3	0	0	0	111.9	P380 A407 Q408	P380-L382 PolarHBondContact O-N 3.01Å; L382-A407 CarbonylContact O-C 3.57Å; L382-A407 VanDerWaalsContact O-CA 3.25Å; L382-A407 WeakPolarHBondContact O-CA 3.37Å; L382-Q408 PolarHBondContact N-O 2.84Å; L382-Q408 PolarHBondContact O-N 3.03Å
383	F	94.9	Very high	94.1	Very high	20 Å²	20	60.8 Å²	60.8	9%	0.088	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	134.9	170.4	-76.6	-82.2	0	0	0	111.5	M385 Y388 V405 L406 A407 Y419 V458 A460 S470 V472	F383-M385 PolarHBondContact O-N 3Å; F383-M385 VanDerWaalsContact O-N 3.1Å; F383-Y388 HydrophobicContact CD1-CE2 4.24Å; F383-V405 HydrophobicContact CD1-CB 4.44Å; F383-V405 HydrophobicContact CE1-CB 4.22Å; F383-V405 HydrophobicContact CE1-CG2 3.99Å; F383-L406 WeakPolarHBondContact CA-O 3.32Å; F383-A407 HydrophobicContact CD1-CB 3.77Å; F383-A407 HydrophobicContact CD2-CB 4.4Å; F383-A407 HydrophobicContact CE1-CB 3.96Å; F383-A407 HydrophobicContact CG-CB 4.01Å; F383-A407 HydrophobicContact CZ-CB 4.38Å; F383-Y419 HydrophobicContact CE1-CD1 4.28Å; F383-Y419 HydrophobicContact CE1-CE1 4.1Å; F383-V458 HydrophobicContact CE1-CG1 4.44Å; F383-V458 HydrophobicContact CZ-CG1 4.21Å; F383-A460 HydrophobicContact CE1-CB 4.26Å; F383-A460 HydrophobicContact CE2-CB 3.77Å; F383-A460 HydrophobicContact CZ-CB 3.51Å; F383-S470 WeakPolarHBondContact CD2-OG 3.48Å; F383-S470 VanDerWaalsContact CE2-OG 3.27Å; F383-S470 WeakPolarHBondContact CE2-OG 3.49Å; F383-V472 HydrophobicContact CB-CB 4.26Å; F383-V472 HydrophobicContact CB-CG2 4.45Å; F383-V472 HydrophobicContact CD1-CB 4.06Å; F383-V472 HydrophobicContact CD1-CG1 3.54Å; F383-V472 HydrophobicContact CD2-CB 3.7Å; F383-V472 HydrophobicContact CD2-CG1 3.93Å; F383-V472 HydrophobicContact CE1-CB 4.32Å; F383-V472 HydrophobicContact CE1-CG1 3.46Å; F383-V472 VanDerWaalsContact CE1-CG1 3.46Å; F383-V472 HydrophobicContact CE2-CB 3.97Å; F383-V472 HydrophobicContact CE2-CG1 3.84Å; F383-V472 HydrophobicContact CG-CB 3.74Å; F383-V472 HydrophobicContact CG-CG1 3.77Å; F383-V472 HydrophobicContact CG-CG2 4.4Å; F383-V472 HydrophobicContact CZ-CB 4.26Å; F383-V472 HydrophobicContact CZ-CG1 3.61Å
384	S	93.8	Very high	93.9	Very high	70 Å²	70	59 Å²	59	49%	0.49	32%	0.32	S	S	.	.	S	Bend	trans	-68.3	-11.6	-176.4	64.1	0	0	0	0	114.6	Y388 L406	S384-Y388 PolarHBondContact OG-OH 2.83Å; S384-Y388 VanDerWaalsContact OG-OH 3.13Å; S384-L406 PolarHBondContact N-O 2.99Å; S384-L406 PolarHBondContact OG-O 3.01Å
385	M	94.3	Very high	93.7	Very high	102 Å²	102	64 Å²	64	50%	0.502	35%	0.347	S	S	.	.	S	Bend	trans	-138.8	142.8	175.4	-67.2	-68.4	-74.1	0	0	109.1	F383 S387 Y388	F383-M385 PolarHBondContact O-N 3Å; F383-M385 VanDerWaalsContact O-N 3.1Å; M385-S387 VanDerWaalsContact C-N 3.27Å; M385-S387 PolarHBondContact O-N 3.01Å; M385-Y388 HydrophobicContact CB-CD2 4.48Å; M385-Y388 HydrophobicContact CB-CE1 4.11Å; M385-Y388 HydrophobicContact CB-CE2 4.07Å; M385-Y388 HydrophobicContact CG-CE1 4.24Å
386	P	93.1	Very high	93.6	Very high	119 Å²	119	64.2 Å²	64.2	77%	0.773	35%	0.349	S	S	*	.	S	Bend	trans	-73.3	-18.1	-177.2	30.8	-36.7	0	0	0	113.7
387	S	95.5	Very high	93.6	Very high	59 Å²	59	69.3 Å²	69.3	41%	0.413	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	160.1	167.5	60.7	0	0	0	0	109	M385 T473	M385-S387 VanDerWaalsContact C-N 3.27Å; M385-S387 PolarHBondContact O-N 3.01Å; S387-T473 WeakPolarHBondContact CA-O 3.34Å
388	Y	95.8	Very high	93.7	Very high	31 Å²	31	72.3 Å²	72.3	12%	0.122	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.2	175.9	-65.1	-101.1	0	0	0	110	F383 S384 M385 M390 V405 L406 V472 T473 V474 G475	F383-Y388 HydrophobicContact CD1-CE2 4.24Å; S384-Y388 PolarHBondContact OG-OH 2.83Å; S384-Y388 VanDerWaalsContact OG-OH 3.13Å; M385-Y388 HydrophobicContact CB-CD2 4.48Å; M385-Y388 HydrophobicContact CB-CE1 4.11Å; M385-Y388 HydrophobicContact CB-CE2 4.07Å; M385-Y388 HydrophobicContact CG-CE1 4.24Å; Y388-M390 HydrophobicContact CD1-CE 4.16Å; Y388-M390 HydrophobicContact CG-CE 4.28Å; Y388-V405 HydrophobicContact CD1-CG1 4.16Å; Y388-V405 HydrophobicContact CD2-CB 4.4Å; Y388-V405 HydrophobicContact CD2-CG1 3.69Å; Y388-V405 HydrophobicContact CE1-CB 4.33Å; Y388-V405 HydrophobicContact CE1-CG1 4.21Å; Y388-V405 HydrophobicContact CE2-CB 3.95Å; Y388-V405 HydrophobicContact CE2-CG1 3.76Å; Y388-V405 HydrophobicContact CG-CG1 3.9Å; Y388-L406 PolarHBondContact OH-N 2.83Å; Y388-L406 VanDerWaalsContact OH-N 3.07Å; Y388-L406 PolarHBondContact OH-O 3.18Å; Y388-V472 HydrophobicContact CD2-CG1 4.17Å; Y388-V472 HydrophobicContact CD2-CG2 3.79Å; Y388-V472 HydrophobicContact CE2-CG1 4.11Å; Y388-V472 HydrophobicContact CE2-CG2 3.91Å; Y388-T473 PolarHBondContact N-O 2.93Å; Y388-V474 HydrophobicContact CD2-CG2 4.38Å; Y388-V474 WeakPolarHBondContact O-CA 3.47Å; Y388-G475 PolarHBondContact O-N 2.84Å
389	V	96.5	Very high	93.8	Very high	106 Å²	106	70.4 Å²	70.4	64%	0.642	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	130	165.7	-178.4	0	0	0	0	107.6	G475	V389-G475 VanDerWaalsContact CA-O 3.32Å; V389-G475 WeakPolarHBondContact CA-O 3.33Å
390	M	95.6	Very high	94	Very high	17 Å²	17	69 Å²	69	8%	0.084	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	153.1	-179.8	-53.5	-176.2	-179.5	0	0	109.3	Y388 V402 V405 I440 V474 G475 I476 R477	Y388-M390 HydrophobicContact CD1-CE 4.16Å; Y388-M390 HydrophobicContact CG-CE 4.28Å; M390-V402 HydrophobicContact CB-CG1 3.77Å; M390-V402 HydrophobicContact SD-CG1 4.26Å; M390-V405 HydrophobicContact CE-CG1 3.76Å; M390-I440 HydrophobicContact CE-CD1 4.02Å; M390-I440 HydrophobicContact SD-CD1 4.01Å; M390-V474 HydrophobicContact CE-CG1 3.96Å; M390-V474 HydrophobicContact CG-CG1 4.11Å; M390-V474 HydrophobicContact SD-CG1 3.92Å; M390-G475 PolarHBondContact N-O 2.93Å; M390-I476 WeakPolarHBondContact O-CA 3.16Å; M390-R477 PolarHBondContact O-N 3.04Å
391	E	95.5	Very high	94.2	Very high	102 Å²	102	70.4 Å²	70.4	48%	0.477	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139.2	-177.2	-53.9	-163.8	123.1	0	0	110.7	R477 L479	E391-R477 WeakPolarHBondContact CA-O 3.29Å; E391-R477 HydrophobicContact CG-CB 4.32Å; E391-R477 WeakPolarHBondContact OE1-CD 3.29Å; E391-R477 IonicContact OE1-CZ 3.74Å; E391-R477 IonicContact OE1-NE 2.87Å; E391-R477 IonicContact OE1-NH1 3.39Å; E391-R477 PolarHBondContact OE1-NH1 2.64Å; E391-L479 HydrophobicContact CB-CD1 3.82Å; E391-L479 HydrophobicContact CB-CD2 4.27Å; E391-L479 HydrophobicContact CB-CG 3.96Å
392	V	96.1	Very high	94.3	Very high	8 Å²	8	71.1 Å²	71.1	5%	0.048	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	132.9	-179.5	60	0	0	0	0	110.4	A396 V402 T442 L446 I476 R477 V478 L479	V392-A396 HydrophobicContact CG2-CB 3.58Å; V392-V402 HydrophobicContact CB-CG1 4.25Å; V392-V402 HydrophobicContact CB-CG2 4.3Å; V392-V402 HydrophobicContact CG1-CG1 4.32Å; V392-V402 HydrophobicContact CG1-CG2 4.42Å; V392-V402 HydrophobicContact CG2-CG2 4.28Å; V392-T442 HydrophobicContact CG2-CG2 4.27Å; V392-L446 HydrophobicContact CG1-CD1 3.59Å; V392-L446 HydrophobicContact CG2-CD1 4.32Å; V392-I476 HydrophobicContact CG1-CG2 3.61Å; V392-R477 PolarHBondContact N-O 3.29Å; V392-V478 CarbonylContact O-C 3.52Å; V392-V478 VanDerWaalsContact O-CA 3.31Å; V392-V478 WeakPolarHBondContact O-CA 3.29Å; V392-L479 PolarHBondContact O-N 2.79Å
393	Y	93.4	Very high	94.4	Very high	131 Å²	131	66.2 Å²	66.2	51%	0.514	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	144.6	174.1	-66.9	-80.1	0	0	0	111.3	N395 A396 L479 V481	Y393-N395 VanDerWaalsContact C-N 3.32Å; Y393-N395 PolarHBondContact O-N 3.42Å; Y393-A396 WeakPolarHBondContact O-CB 3.3Å; Y393-A396 PolarHBondContact O-N 3.09Å; Y393-L479 WeakPolarHBondContact CA-O 3.22Å; Y393-L479 HydrophobicContact CD1-CB 3.53Å; Y393-L479 HydrophobicContact CD1-CD1 4.36Å; Y393-L479 HydrophobicContact CD2-CD1 4.47Å; Y393-L479 HydrophobicContact CE1-CB 3.73Å; Y393-L479 HydrophobicContact CE1-CD1 4Å; Y393-L479 HydrophobicContact CE2-CD1 4.1Å; Y393-L479 HydrophobicContact CG-CB 4.08Å; Y393-V481 HydrophobicContact CD1-CG2 3.8Å; Y393-V481 HydrophobicContact CG-CG2 4.34Å
394	E	93.2	Very high	94.4	Very high	9 Å²	9	69.3 Å²	69.3	4%	0.042	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-35.7	-178.7	65.3	-146.8	116.3	0	0	114.1	A396 L446 R448 V478 L479 D480 V481	E394-A396 PolarHBondContact O-N 3.44Å; E394-L446 HydrophobicContact CB-CB 4.34Å; E394-R448 WeakPolarHBondContact OE2-CB 3.42Å; E394-R448 PolarHBondContact OE2-N 3.19Å; E394-V478 HydrophobicContact CB-CG1 3.64Å; E394-L479 PolarHBondContact N-O 3.34Å; E394-D480 VanDerWaalsContact OE1-CA 3.29Å; E394-D480 WeakPolarHBondContact OE1-CA 3.06Å; E394-V481 HydrophobicContact CG-CB 4.14Å; E394-V481 HydrophobicContact CG-CG2 4.12Å; E394-V481 PolarHBondContact OE1-N 2.84Å
395	N	91.1	Very high	94.6	Very high	107 Å²	107	66.2 Å²	66.2	57%	0.572	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	2.4	172.8	76.7	11.8	0	0	0	114.2	Y393 K397 V481	Y393-N395 VanDerWaalsContact C-N 3.32Å; Y393-N395 PolarHBondContact O-N 3.42Å; N395-K397 PolarHBondContact O-N 3.13Å; N395-K397 VanDerWaalsContact O-N 3.15Å; N395-V481 HydrophobicContact CB-CG1 4.4Å; N395-V481 HydrophobicContact CB-CG2 4.32Å; N395-V481 WeakPolarHBondContact ND2-CG1 3.49Å
396	A	93.4	Very high	94.6	Very high	9 Å²	9	65.2 Å²	65.2	7%	0.074	36%	0.363	C	S	.	.			trans	-59.2	115.4	174.6	0	0	0	0	0	111.1	V392 Y393 E394 T400	V392-A396 HydrophobicContact CG2-CB 3.58Å; Y393-A396 WeakPolarHBondContact O-CB 3.3Å; Y393-A396 PolarHBondContact O-N 3.09Å; E394-A396 PolarHBondContact O-N 3.44Å; A396-T400 HydrophobicContact CB-CG2 3.95Å
397	K	94	Very high	94.6	Very high	173 Å²	173	59.7 Å²	59.7	75%	0.752	33%	0.328	S	S	*	.			trans	-56.2	147.5	176	-64.1	175	-176.8	173.7	0	111	N395 G399 T400 T442	N395-K397 PolarHBondContact O-N 3.13Å; N395-K397 VanDerWaalsContact O-N 3.15Å; K397-G399 PolarHBondContact O-N 3.46Å; K397-T400 PolarHBondContact N-OG1 3.09Å; K397-T400 VanDerWaalsContact O-CB 3.26Å; K397-T400 WeakPolarHBondContact O-CB 3.37Å; K397-T400 PolarHBondContact O-N 3.23Å; K397-T400 PolarHBondContact O-OG1 2.82Å; K397-T442 PolarHBondContact O-OG1 2.83Å
398	I	93	Very high	94.3	Very high	114 Å²	114	62.9 Å²	62.9	59%	0.585	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	128.6	172.6	-63.8	169	0	0	0	109.4
399	G	92.3	Very high	94	Very high	44 Å²	44	62 Å²	62	45%	0.454	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	94	-0.9	-175.3	0	0	0	0	0	115.1	K397 V401 T442	K397-G399 PolarHBondContact O-N 3.46Å; G399-V401 PolarHBondContact O-N 2.79Å; G399-T442 WeakPolarHBondContact CA-O 3.48Å; G399-T442 PolarHBondContact N-O 2.88Å; G399-T442 PolarHBondContact N-OG1 2.87Å
400	T	95.1	Very high	93.6	Very high	51 Å²	51	58.8 Å²	58.8	31%	0.313	32%	0.315	S	S	.	.			trans	-61.1	133.2	172.7	-62.9	0	0	0	0	110.4	A396 K397 K441 T442	A396-T400 HydrophobicContact CB-CG2 3.95Å; K397-T400 PolarHBondContact N-OG1 3.09Å; K397-T400 VanDerWaalsContact O-CB 3.26Å; K397-T400 WeakPolarHBondContact O-CB 3.37Å; K397-T400 PolarHBondContact O-N 3.23Å; K397-T400 PolarHBondContact O-OG1 2.82Å; T400-K441 CarbonylContact O-C 3.51Å; T400-K441 WeakPolarHBondContact O-CA 3.35Å; T400-T442 PolarHBondContact N-OG1 3.27Å; T400-T442 PolarHBondContact O-N 3.3Å
401	V	96.2	Very high	93.3	Very high	84 Å²	84	58.6 Å²	58.6	51%	0.509	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	124.4	174.1	174.9	0	0	0	0	109.4	G399 T439 K441	G399-V401 PolarHBondContact O-N 2.79Å; V401-T439 HydrophobicContact CB-CG2 4.44Å; V401-T439 HydrophobicContact CG1-CG2 3.66Å; V401-T439 HydrophobicContact CG2-CG2 3.96Å; V401-K441 HydrophobicContact CG2-CD 4.48Å; V401-K441 HydrophobicContact CG2-CG 3.95Å
402	V	95.8	Very high	92.4	Very high	16 Å²	16	56.6 Å²	56.6	10%	0.097	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-38.1	176.1	-177.6	0	0	0	0	110.6	M390 V392 F431 I440 T442 I476	M390-V402 HydrophobicContact CB-CG1 3.77Å; M390-V402 HydrophobicContact SD-CG1 4.26Å; V392-V402 HydrophobicContact CB-CG1 4.25Å; V392-V402 HydrophobicContact CB-CG2 4.3Å; V392-V402 HydrophobicContact CG1-CG1 4.32Å; V392-V402 HydrophobicContact CG1-CG2 4.42Å; V392-V402 HydrophobicContact CG2-CG2 4.28Å; V402-F431 HydrophobicContact CG2-CD1 4.02Å; V402-F431 HydrophobicContact CG2-CE1 4.04Å; V402-I440 HydrophobicContact CB-CG2 4.22Å; V402-I440 HydrophobicContact CG2-CG2 4.42Å; V402-I440 PolarHBondContact N-O 3.32Å; V402-T442 HydrophobicContact CG2-CG2 3.96Å; V402-I476 HydrophobicContact CG1-CD1 4.22Å; V402-I476 HydrophobicContact CG1-CG1 4.23Å; V402-I476 HydrophobicContact CG1-CG2 3.82Å
403	G	94.3	Very high	91.5	Very high	18 Å²	18	60.1 Å²	60.1	19%	0.186	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.3	-168.6	178	0	0	0	0	0	112.3	T439 I440	G403-T439 WeakPolarHBondContact O-CA 3.33Å; G403-I440 PolarHBondContact O-N 3.45Å
404	T	95.8	Very high	90.3	Very high	86 Å²	86	60.4 Å²	60.4	53%	0.528	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.8	-178.5	53.6	0	0	0	0	109.9	G438 T439	T404-G438 WeakPolarHBondContact CA-O 3.22Å; T404-T439 HydrophobicContact CG2-CG2 4.13Å
405	V	95.9	Very high	89.6	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.024	36%	0.359	C	S	.	.			trans	-91.8	152.3	163.2	-61.3	0	0	0	0	110	F383 Y388 M390 Y419 I433 G438 I440 V458 V474	F383-V405 HydrophobicContact CD1-CB 4.44Å; F383-V405 HydrophobicContact CE1-CB 4.22Å; F383-V405 HydrophobicContact CE1-CG2 3.99Å; Y388-V405 HydrophobicContact CD1-CG1 4.16Å; Y388-V405 HydrophobicContact CD2-CB 4.4Å; Y388-V405 HydrophobicContact CD2-CG1 3.69Å; Y388-V405 HydrophobicContact CE1-CB 4.33Å; Y388-V405 HydrophobicContact CE1-CG1 4.21Å; Y388-V405 HydrophobicContact CE2-CB 3.95Å; Y388-V405 HydrophobicContact CE2-CG1 3.76Å; Y388-V405 HydrophobicContact CG-CG1 3.9Å; M390-V405 HydrophobicContact CE-CG1 3.76Å; V405-Y419 HydrophobicContact CG2-CD1 3.94Å; V405-Y419 HydrophobicContact CG2-CE1 4.09Å; V405-I433 HydrophobicContact CG2-CD1 3.94Å; V405-G438 PolarHBondContact N-O 3.37Å; V405-I440 HydrophobicContact CG1-CD1 4.19Å; V405-V458 HydrophobicContact CG2-CG1 4.02Å; V405-V474 HydrophobicContact CG1-CG2 3.8Å
406	L	94.3	Very high	89.5	Confident	81 Å²	81	62.6 Å²	62.6	42%	0.424	37%	0.365	S	S	.	.			trans	-127.2	130.3	173.2	-179.7	64.4	0	0	0	109.7	F383 S384 Y388 Q408	F383-L406 WeakPolarHBondContact CA-O 3.32Å; S384-L406 PolarHBondContact N-O 2.99Å; S384-L406 PolarHBondContact OG-O 3.01Å; Y388-L406 PolarHBondContact OH-N 2.83Å; Y388-L406 VanDerWaalsContact OH-N 3.07Å; Y388-L406 PolarHBondContact OH-O 3.18Å; L406-Q408 HydrophobicContact CD1-CG 4.46Å; L406-Q408 HydrophobicContact CG-CG 4.45Å
407	A	93.2	Very high	89.4	Confident	3 Å²	3	63.2 Å²	63.2	3%	0.025	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	150.7	162.4	0	0	0	0	0	109.3	P381 L382 F383 V417 Y419 A460	P381-A407 HydrophobicContact CB-CB 4.29Å; L382-A407 CarbonylContact O-C 3.57Å; L382-A407 VanDerWaalsContact O-CA 3.25Å; L382-A407 WeakPolarHBondContact O-CA 3.37Å; F383-A407 HydrophobicContact CD1-CB 3.77Å; F383-A407 HydrophobicContact CD2-CB 4.4Å; F383-A407 HydrophobicContact CE1-CB 3.96Å; F383-A407 HydrophobicContact CG-CB 4.01Å; F383-A407 HydrophobicContact CZ-CB 4.38Å; A407-V417 HydrophobicContact CB-CG1 4.2Å; A407-Y419 HydrophobicContact CB-CE1 3.97Å; A407-Y419 PolarHBondContact N-OH 2.81Å; A407-Y419 PolarHBondContact O-OH 2.77Å; A407-Y419 VanDerWaalsContact O-OH 3.08Å; A407-A460 HydrophobicContact CB-CB 3.88Å
408	Q	90.2	Very high	89.4	Confident	127 Å²	127	59.5 Å²	59.5	59%	0.593	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.6	130.7	174.6	-68.5	-177.3	-27.9	0	0	107.7	P381 L382 L406	P381-Q408 CarbonylContact C-O 3.5Å; L382-Q408 PolarHBondContact N-O 2.84Å; L382-Q408 PolarHBondContact O-N 3.03Å; L406-Q408 HydrophobicContact CD1-CG 4.46Å; L406-Q408 HydrophobicContact CG-CG 4.45Å
409	D	90.4	Very high	89.5	Confident	13 Å²	13	54.7 Å²	54.7	7%	0.07	32%	0.324	C	S	.	.			trans	-49.2	124.2	159.5	166.8	24.3	0	0	0	108.9	D411 N414 S415 V417	D409-D411 VanDerWaalsContact C-N 3.3Å; D409-D411 VanDerWaalsContact OD1-CB 3.24Å; D409-D411 WeakPolarHBondContact OD1-CB 3.01Å; D409-D411 PolarHBondContact OD1-N 3.41Å; D409-N414 WeakPolarHBondContact OD2-CA 3.46Å; D409-N414 PolarHBondContact OD2-N 2.72Å; D409-S415 PolarHBondContact OD2-N 3.24Å; D409-V417 HydrophobicContact CB-CG2 4.33Å
410	P	87.8	Confident	89.5	Confident	38 Å²	38	56.3 Å²	56.3	25%	0.247	32%	0.318	C	S	.	.			trans	-72.9	-25	175.5	32.5	-35.9	0	0	0	112.4	E338 E379	E338-P410 WeakPolarHBondContact CG-O 3.32Å; E379-P410 HydrophobicContact CB-CG 3.69Å
411	D	88.6	Confident	89.4	Confident	13 Å²	13	54.6 Å²	54.6	7%	0.07	31%	0.307	C	S	.	.	S	Bend	trans	-71.6	163.5	-163	-65.6	-27	0	0	0	112.7	D378 E379 D409 A413	D378-D411 WeakPolarHBondContact CA-OD2 3.39Å; E379-D411 PolarHBondContact N-OD2 3.48Å; D409-D411 VanDerWaalsContact C-N 3.3Å; D409-D411 VanDerWaalsContact OD1-CB 3.24Å; D409-D411 WeakPolarHBondContact OD1-CB 3.01Å; D409-D411 PolarHBondContact OD1-N 3.41Å; D411-A413 PolarHBondContact O-N 3.26Å
412	S	77.4	Confident	88.8	Confident	60 Å²	60	55.9 Å²	55.9	42%	0.42	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-2.2	-179.9	-65.4	0	0	0	0	114.2	Y337 E338 K341	Y337-S412 WeakPolarHBondContact CE1-OG 3.18Å; E338-S412 PolarHBondContact OE1-OG 2.8Å; K341-S412 PolarHBondContact NZ-OG 3.16Å
413	A	76.5	Confident	88	Confident	81 Å²	81	58.2 Å²	58.2	67%	0.669	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-13.3	-175.3	0	0	0	0	0	115.4	D411	D411-A413 PolarHBondContact O-N 3.26Å
414	N	68.9	Low	87	Confident	138 Å²	138	62.9 Å²	62.9	74%	0.738	34%	0.34	S	S	*	.			trans	54.2	54.8	169.2	-136.6	-38.7	0	0	0	114.2	D409	D409-N414 WeakPolarHBondContact OD2-CA 3.46Å; D409-N414 PolarHBondContact OD2-N 2.72Å
415	S	78.7	Confident	85.4	Confident	28 Å²	28	64.3 Å²	64.3	20%	0.196	36%	0.36	C	S	.	.			trans	-59.2	149.7	176.9	-85.8	0	0	0	0	113.5	D409 V417 E462	D409-S415 PolarHBondContact OD2-N 3.24Å; S415-V417 PolarHBondContact O-N 2.85Å; S415-V417 VanDerWaalsContact O-N 3.13Å; S415-E462 WeakPolarHBondContact CB-OE2 3.41Å; S415-E462 PolarHBondContact OG-OE2 3.13Å
416	L	87.2	Confident	83.9	Confident	134 Å²	134	73.2 Å²	73.2	70%	0.702	40%	0.401	S	S	*	.			trans	-77.5	99.7	174.8	-77.7	172.5	0	0	0	111.2	N463	L416-N463 HydrophobicContact CB-CB 4.25Å; L416-N463 VanDerWaalsContact O-CB 3.29Å; L416-N463 WeakPolarHBondContact O-CB 3.37Å; L416-N463 PolarHBondContact O-N 3.01Å
417	V	92.2	Very high	82.8	Confident	21 Å²	21	73.1 Å²	73.1	13%	0.127	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	136.4	177.1	-174.2	0	0	0	0	111.9	P381 A407 D409 S415 Y419 A460 S461	P381-V417 HydrophobicContact CB-CG1 3.96Å; P381-V417 HydrophobicContact CB-CG2 3.85Å; P381-V417 HydrophobicContact CG-CG1 4.2Å; P381-V417 HydrophobicContact CG-CG2 3.92Å; A407-V417 HydrophobicContact CB-CG1 4.2Å; D409-V417 HydrophobicContact CB-CG2 4.33Å; S415-V417 PolarHBondContact O-N 2.85Å; S415-V417 VanDerWaalsContact O-N 3.13Å; V417-Y419 HydrophobicContact CG1-CE1 4.39Å; V417-Y419 HydrophobicContact CG1-CE2 4.25Å; V417-A460 HydrophobicContact CG1-CB 3.85Å; V417-S461 CarbonylContact C-O 3.59Å; V417-S461 WeakPolarHBondContact CA-O 3.19Å
418	R	93.2	Very high	81.7	Confident	95 Å²	95	77.6 Å²	77.6	36%	0.358	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	148.4	173.1	-62.4	-61.5	-165.4	127.5	19.8	110.7	A435 N436 A460 S461 N463	R418-A435 WeakPolarHBondContact CA-O 3.3Å; R418-N436 PolarHBondContact NH1-OD1 2.89Å; R418-A460 VanDerWaalsContact O-CA 3.29Å; R418-A460 WeakPolarHBondContact O-CA 3.27Å; R418-S461 PolarHBondContact N-O 3.32Å; R418-S461 PolarHBondContact O-N 3.39Å; R418-N463 HydrophobicContact CG-CB 4.37Å; R418-N463 PolarHBondContact NE-OD1 2.89Å; R418-N463 PolarHBondContact NH2-OD1 2.71Å
419	Y	95.2	Very high	81.5	Confident	14 Å²	14	79.6 Å²	79.6	6%	0.055	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	140.8	-178.3	-57.1	-92.4	0	0	0	112.1	F383 V405 A407 V417 I433 A435 T459 A460	F383-Y419 HydrophobicContact CE1-CD1 4.28Å; F383-Y419 HydrophobicContact CE1-CE1 4.1Å; V405-Y419 HydrophobicContact CG2-CD1 3.94Å; V405-Y419 HydrophobicContact CG2-CE1 4.09Å; A407-Y419 HydrophobicContact CB-CE1 3.97Å; A407-Y419 PolarHBondContact N-OH 2.81Å; A407-Y419 PolarHBondContact O-OH 2.77Å; A407-Y419 VanDerWaalsContact O-OH 3.08Å; V417-Y419 HydrophobicContact CG1-CE1 4.39Å; V417-Y419 HydrophobicContact CG1-CE2 4.25Å; Y419-I433 HydrophobicContact CG-CD1 4.5Å; Y419-A435 PolarHBondContact N-O 3.25Å; Y419-A435 WeakPolarHBondContact O-CA 3.47Å; Y419-A435 WeakPolarHBondContact O-CB 3.31Å; Y419-T459 WeakPolarHBondContact CA-O 3.46Å; Y419-A460 HydrophobicContact CD1-CB 4.28Å; Y419-A460 HydrophobicContact CE1-CB 4.36Å
420	F	93.4	Very high	81.6	Confident	77 Å²	77	80.5 Å²	80.5	34%	0.338	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	152	170.9	57.3	-82.1	0	0	0	111.7	T459 L469	F420-T459 HydrophobicContact CD1-CG2 4.35Å; F420-T459 HydrophobicContact CD2-CG2 4.42Å; F420-T459 HydrophobicContact CE1-CG2 3.61Å; F420-T459 HydrophobicContact CE2-CG2 3.69Å; F420-T459 HydrophobicContact CZ-CG2 3.24Å; F420-T459 PolarHBondContact N-O 3.46Å; F420-T459 PolarHBondContact O-N 3.41Å; F420-L469 HydrophobicContact CE1-CD2 4.26Å; F420-L469 HydrophobicContact CZ-CD2 3.93Å
421	I	92.4	Very high	81.8	Confident	15 Å²	15	78.9 Å²	78.9	8%	0.077	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.9	168.2	-66	158	0	0	0	106.8	Y423 I433 I456 V458	I421-Y423 HydrophobicContact CB-CD2 4.49Å; I421-Y423 HydrophobicContact CB-CE1 4.31Å; I421-Y423 HydrophobicContact CB-CE2 3.75Å; I421-Y423 HydrophobicContact CG2-CD1 3.98Å; I421-Y423 HydrophobicContact CG2-CD2 4.14Å; I421-Y423 HydrophobicContact CG2-CE1 3.59Å; I421-Y423 HydrophobicContact CG2-CE2 3.74Å; I421-Y423 HydrophobicContact CG2-CG 4.25Å; I421-Y423 VanDerWaalsContact CG2-CZ 3.45Å; I421-Y423 WeakPolarHBondContact O-CD2 3.42Å; I421-Y423 VanDerWaalsContact O-CE2 3.31Å; I421-Y423 WeakPolarHBondContact O-CE2 3.36Å; I421-I433 HydrophobicContact CD1-CB 3.85Å; I421-I433 HydrophobicContact CD1-CG2 4.06Å; I421-I433 HydrophobicContact CG1-CB 4.11Å; I421-I433 HydrophobicContact CG1-CG2 3.88Å; I421-I456 HydrophobicContact CD1-CD1 3.84Å; I421-I456 HydrophobicContact CG1-CD1 4.27Å; I421-V458 HydrophobicContact CG1-CG2 4.07Å
422	N	82.8	Confident	82.1	Confident	112 Å²	112	82.3 Å²	82.3	60%	0.599	44%	0.438	S	S	*	.			trans	-92.2	119.5	172.6	-163.4	13.9	0	0	0	108.9
423	Y	80.4	Confident	83	Confident	65 Å²	65	80 Å²	80	26%	0.255	42%	0.421	S	S	.	.			trans	-108.3	137.5	179.2	-50.2	-96.2	0	0	0	108.7	I421 R429 F431	I421-Y423 HydrophobicContact CB-CD2 4.49Å; I421-Y423 HydrophobicContact CB-CE1 4.31Å; I421-Y423 HydrophobicContact CB-CE2 3.75Å; I421-Y423 HydrophobicContact CG2-CD1 3.98Å; I421-Y423 HydrophobicContact CG2-CD2 4.14Å; I421-Y423 HydrophobicContact CG2-CE1 3.59Å; I421-Y423 HydrophobicContact CG2-CE2 3.74Å; I421-Y423 HydrophobicContact CG2-CG 4.25Å; I421-Y423 VanDerWaalsContact CG2-CZ 3.45Å; I421-Y423 WeakPolarHBondContact O-CD2 3.42Å; I421-Y423 VanDerWaalsContact O-CE2 3.31Å; I421-Y423 WeakPolarHBondContact O-CE2 3.36Å; Y423-R429 HydrophobicContact CD1-CG 3.71Å; Y423-R429 HydrophobicContact CD2-CG 4.47Å; Y423-R429 HydrophobicContact CE1-CB 4.27Å; Y423-R429 HydrophobicContact CE1-CG 3.83Å; Y423-R429 HydrophobicContact CG-CG 4.04Å; Y423-F431 PolarHBondContact OH-O 2.9Å
424	N	72.4	Confident	83.8	Confident	116 Å²	116	78.7 Å²	78.7	62%	0.62	40%	0.402	S	S	*	.			trans	-68	158	166.7	-56.6	-73.4	0	0	0	109.5	E426 D427	N424-E426 PolarHBondContact O-N 2.97Å; N424-D427 HydrophobicContact CB-CB 4.49Å; N424-D427 VanDerWaalsContact CB-OD2 3.22Å; N424-D427 WeakPolarHBondContact CB-OD2 3.26Å; N424-D427 PolarHBondContact N-OD2 2.89Å; N424-D427 PolarHBondContact ND2-OD2 2.94Å; N424-D427 PolarHBondContact O-N 2.8Å
425	A	63	Low	85	Confident	115 Å²	115	74.2 Å²	74.2	95%	0.95	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.1	-176.9	0	0	0	0	0	114.3
426	E	64.7	Low	85.7	Confident	192 Å²	192	77.9 Å²	77.9	90%	0.897	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-8.9	178.2	-58.4	-177.5	173.5	0	0	112.5	N424	N424-E426 PolarHBondContact O-N 2.97Å
427	D	69.6	Low	86	Confident	79 Å²	79	75 Å²	75	42%	0.422	39%	0.39	S	S	.	.			trans	-78.1	129.5	-177.4	-70.9	-27.2	0	0	0	111.7	N424	N424-D427 HydrophobicContact CB-CB 4.49Å; N424-D427 VanDerWaalsContact CB-OD2 3.22Å; N424-D427 WeakPolarHBondContact CB-OD2 3.26Å; N424-D427 PolarHBondContact N-OD2 2.89Å; N424-D427 PolarHBondContact ND2-OD2 2.94Å; N424-D427 PolarHBondContact O-N 2.8Å
428	D	71.4	Confident	86	Confident	97 Å²	97	74 Å²	74	52%	0.519	38%	0.384	S	S	.	.			trans	-82.4	130	-178.4	-144.3	-13.5	0	0	0	111.5	F430 K444	D428-F430 HydrophobicContact CB-CD2 4.23Å; D428-F430 HydrophobicContact CB-CE2 3.81Å; D428-F430 WeakPolarHBondContact O-CD2 3.47Å; D428-F430 PolarHBondContact O-N 3.3Å; D428-K444 WeakPolarHBondContact OD1-CE 3.39Å; D428-K444 IonicContact OD1-NZ 3.72Å; D428-K444 PolarHBondContact OD1-NZ 2.74Å; D428-K444 IonicContact OD2-NZ 3.83Å; D428-K444 PolarHBondContact OD2-NZ 3.03Å
429	R	86.1	Confident	86.2	Confident	169 Å²	169	70.5 Å²	70.5	64%	0.638	37%	0.373	S	S	*	.			trans	-84.9	75.7	-165	-66.9	-178.6	-69.8	-179.4	-2.5	112.2	Y423 T443	Y423-R429 HydrophobicContact CD1-CG 3.71Å; Y423-R429 HydrophobicContact CD2-CG 4.47Å; Y423-R429 HydrophobicContact CE1-CB 4.27Å; Y423-R429 HydrophobicContact CE1-CG 3.83Å; Y423-R429 HydrophobicContact CG-CG 4.04Å; R429-T443 PolarHBondContact O-OG1 2.73Å
430	F	90.8	Very high	86.2	Confident	31 Å²	31	69.8 Å²	69.8	14%	0.136	37%	0.37	C	S	.	.			trans	-72.1	-27.1	177.7	-72.7	-81.7	0	0	0	114.6	D428 T443 K444 L446 Y454	D428-F430 HydrophobicContact CB-CD2 4.23Å; D428-F430 HydrophobicContact CB-CE2 3.81Å; D428-F430 WeakPolarHBondContact O-CD2 3.47Å; D428-F430 PolarHBondContact O-N 3.3Å; F430-T443 PolarHBondContact O-N 2.79Å; F430-T443 PolarHBondContact O-OG1 3.23Å; F430-T443 VanDerWaalsContact O-OG1 3.12Å; F430-K444 HydrophobicContact CD1-CB 3.81Å; F430-K444 HydrophobicContact CD1-CD 3.78Å; F430-K444 HydrophobicContact CD1-CG 4.27Å; F430-K444 HydrophobicContact CE1-CB 4.33Å; F430-K444 HydrophobicContact CE1-CD 3.8Å; F430-K444 HydrophobicContact CG-CD 4.32Å; F430-K444 HydrophobicContact CZ-CD 4.37Å; F430-K444 PolarHBondContact O-N 2.91Å; F430-L446 HydrophobicContact CB-CD2 4.13Å; F430-L446 HydrophobicContact CD1-CD2 3.83Å; F430-L446 HydrophobicContact CG-CD2 4.35Å; F430-Y454 HydrophobicContact CB-CE1 4.22Å; F430-Y454 HydrophobicContact CD1-CE1 4.23Å; F430-Y454 WeakPolarHBondContact CD1-OH 3.14Å; F430-Y454 HydrophobicContact CD2-CD1 4.21Å; F430-Y454 AromaticContact CD2-CE1 3.4Å; F430-Y454 HydrophobicContact CD2-CE1 3.4Å; F430-Y454 VanDerWaalsContact CD2-CE1 3.4Å; F430-Y454 HydrophobicContact CE1-CE1 4.47Å; F430-Y454 VanDerWaalsContact CE1-OH 3.29Å; F430-Y454 WeakPolarHBondContact CE1-OH 3.3Å; F430-Y454 AromaticContact CE2-CE1 3.69Å; F430-Y454 HydrophobicContact CE2-CE1 3.69Å; F430-Y454 AromaticContact CG-CE1 3.7Å; F430-Y454 HydrophobicContact CG-CE1 3.7Å; F430-Y454 AromaticContact CG-CZ 3.92Å; F430-Y454 HydrophobicContact CZ-CE1 4.23Å
431	F	93.6	Very high	86.3	Confident	4 Å²	4	69.6 Å²	69.6	2%	0.018	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	160.5	179.3	-52.1	-81.6	0	0	0	111.5	V402 Y423 I440 K441 T442 T443 L446 Y454 I456 I476	V402-F431 HydrophobicContact CG2-CD1 4.02Å; V402-F431 HydrophobicContact CG2-CE1 4.04Å; Y423-F431 PolarHBondContact OH-O 2.9Å; F431-I440 HydrophobicContact CB-CG2 4.11Å; F431-I440 HydrophobicContact CD1-CG2 4.35Å; F431-I440 HydrophobicContact CG-CG2 4.49Å; F431-K441 CarbonylContact C-O 3.45Å; F431-K441 VanDerWaalsContact CA-O 3.31Å; F431-K441 WeakPolarHBondContact CA-O 2.96Å; F431-T442 HydrophobicContact CD1-CG2 4.34Å; F431-T442 HydrophobicContact CE1-CG2 4.14Å; F431-T443 WeakPolarHBondContact CA-OG1 3.47Å; F431-T443 PolarHBondContact N-OG1 2.65Å; F431-L446 HydrophobicContact CE1-CD1 4.06Å; F431-L446 HydrophobicContact CE1-CD2 4.22Å; F431-L446 HydrophobicContact CE2-CD2 4.49Å; F431-L446 HydrophobicContact CZ-CD1 4.09Å; F431-L446 HydrophobicContact CZ-CD2 3.81Å; F431-Y454 HydrophobicContact CE2-CD1 4.06Å; F431-Y454 AromaticContact CE2-CD2 3.8Å; F431-Y454 HydrophobicContact CE2-CD2 3.8Å; F431-Y454 HydrophobicContact CE2-CE2 4.39Å; F431-Y454 AromaticContact CE2-CG 3.6Å; F431-Y454 HydrophobicContact CE2-CG 3.6Å; F431-Y454 AromaticContact CZ-CD2 3.85Å; F431-Y454 HydrophobicContact CZ-CD2 3.85Å; F431-Y454 HydrophobicContact CZ-CE2 4.32Å; F431-Y454 HydrophobicContact CZ-CG 4.14Å; F431-I456 HydrophobicContact CD2-CG2 4.29Å; F431-I476 HydrophobicContact CD1-CD1 3.72Å; F431-I476 HydrophobicContact CD2-CD1 3.86Å; F431-I476 HydrophobicContact CE1-CD1 3.73Å; F431-I476 HydrophobicContact CE1-CG2 3.91Å; F431-I476 HydrophobicContact CE2-CD1 3.89Å; F431-I476 HydrophobicContact CG-CD1 3.79Å; F431-I476 HydrophobicContact CZ-CB 4.22Å; F431-I476 HydrophobicContact CZ-CD1 3.83Å; F431-I476 HydrophobicContact CZ-CG2 3.76Å
432	N	93.9	Very high	86.5	Confident	86 Å²	86	69 Å²	69	46%	0.46	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	156.3	167.6	-178.5	37	0	0	0	110.4	I440 K441 T443	N432-I440 WeakPolarHBondContact O-CA 3.29Å; N432-K441 PolarHBondContact N-O 2.74Å; N432-K441 PolarHBondContact O-N 3.41Å; N432-T443 HydrophobicContact CB-CG2 3.53Å
433	I	95.8	Very high	86.9	Confident	12 Å²	12	66.2 Å²	66.2	6%	0.062	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	143.8	179.4	-166.1	162.1	0	0	0	111.7	V405 Y419 I421 A435 T439 I440 V458	V405-I433 HydrophobicContact CG2-CD1 3.94Å; Y419-I433 HydrophobicContact CG-CD1 4.5Å; I421-I433 HydrophobicContact CD1-CB 3.85Å; I421-I433 HydrophobicContact CD1-CG2 4.06Å; I421-I433 HydrophobicContact CG1-CB 4.11Å; I421-I433 HydrophobicContact CG1-CG2 3.88Å; I433-A435 PolarHBondContact O-N 2.86Å; I433-T439 WeakPolarHBondContact CA-O 3.25Å; I433-I440 HydrophobicContact CB-CG1 4.38Å; I433-I440 HydrophobicContact CD1-CG1 3.89Å; I433-I440 HydrophobicContact CG1-CG1 4.05Å; I433-V458 HydrophobicContact CD1-CG1 3.54Å; I433-V458 HydrophobicContact CD1-CG2 4.19Å
434	D	95.1	Very high	87.4	Confident	53 Å²	53	66.6 Å²	66.6	28%	0.283	36%	0.356	S	S	.	.			trans	-78.3	115.9	169.8	-173	-72	0	0	0	110.3	N436 T437 G438 T439 K441	D434-N436 PolarHBondContact O-N 2.83Å; D434-N436 PolarHBondContact OD1-N 3.42Å; D434-N436 VanDerWaalsContact OD1-N 3.15Å; D434-T437 VanDerWaalsContact CB-OG1 3.24Å; D434-T437 WeakPolarHBondContact CB-OG1 3.36Å; D434-T437 PolarHBondContact O-N 3.18Å; D434-T437 PolarHBondContact OD1-N 3.39Å; D434-T437 PolarHBondContact OD1-OG1 3.47Å; D434-G438 PolarHBondContact O-N 2.82Å; D434-T439 PolarHBondContact N-O 2.8Å; D434-K441 IonicContact OD2-NZ 2.74Å
435	A	93.6	Very high	88.3	Confident	43 Å²	43	65.7 Å²	65.7	36%	0.355	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-11.1	-170.5	0	0	0	0	0	115.4	R418 Y419 I433	R418-A435 WeakPolarHBondContact CA-O 3.3Å; Y419-A435 PolarHBondContact N-O 3.25Å; Y419-A435 WeakPolarHBondContact O-CA 3.47Å; Y419-A435 WeakPolarHBondContact O-CB 3.31Å; I433-A435 PolarHBondContact O-N 2.86Å
436	N	92.7	Very high	89.8	Confident	105 Å²	105	60.6 Å²	60.6	56%	0.561	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-27.7	178.6	-56.3	-31.9	0	0	0	112.8	R418 D434	R418-N436 PolarHBondContact NH1-OD1 2.89Å; D434-N436 PolarHBondContact O-N 2.83Å; D434-N436 PolarHBondContact OD1-N 3.42Å; D434-N436 VanDerWaalsContact OD1-N 3.15Å
437	T	93	Very high	91.1	Very high	75 Å²	75	55 Å²	55	46%	0.46	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	1.8	-170.7	62.1	0	0	0	0	114.1	D434 T439	D434-T437 VanDerWaalsContact CB-OG1 3.24Å; D434-T437 WeakPolarHBondContact CB-OG1 3.36Å; D434-T437 PolarHBondContact O-N 3.18Å; D434-T437 PolarHBondContact OD1-N 3.39Å; D434-T437 PolarHBondContact OD1-OG1 3.47Å; T437-T439 PolarHBondContact O-N 2.87Å; T437-T439 PolarHBondContact O-OG1 2.73Å; T437-T439 PolarHBondContact OG1-OG1 2.83Å
438	G	93.4	Very high	92.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.275	C	S	.	.			trans	62.5	13.6	-179	0	0	0	0	0	114.1	T404 V405 D434 I440	T404-G438 WeakPolarHBondContact CA-O 3.22Å; V405-G438 PolarHBondContact N-O 3.37Å; D434-G438 PolarHBondContact O-N 2.82Å; G438-I440 PolarHBondContact O-N 3.17Å
439	T	96.6	Very high	93.1	Very high	20 Å²	20	51.3 Å²	51.3	12%	0.123	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	114.5	-170.5	-53.4	0	0	0	0	110.9	V401 G403 T404 I433 D434 T437 K441	V401-T439 HydrophobicContact CB-CG2 4.44Å; V401-T439 HydrophobicContact CG1-CG2 3.66Å; V401-T439 HydrophobicContact CG2-CG2 3.96Å; G403-T439 WeakPolarHBondContact O-CA 3.33Å; T404-T439 HydrophobicContact CG2-CG2 4.13Å; I433-T439 WeakPolarHBondContact CA-O 3.25Å; D434-T439 PolarHBondContact N-O 2.8Å; T437-T439 PolarHBondContact O-N 2.87Å; T437-T439 PolarHBondContact O-OG1 2.73Å; T437-T439 PolarHBondContact OG1-OG1 2.83Å; T439-K441 HydrophobicContact CG2-CG 4.44Å
440	I	96.4	Very high	93.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	133	179.4	-61	163.2	0	0	0	109.4	M390 V402 G403 V405 F431 N432 I433 G438 I456 V458 V474 I476	M390-I440 HydrophobicContact CE-CD1 4.02Å; M390-I440 HydrophobicContact SD-CD1 4.01Å; V402-I440 HydrophobicContact CB-CG2 4.22Å; V402-I440 HydrophobicContact CG2-CG2 4.42Å; V402-I440 PolarHBondContact N-O 3.32Å; G403-I440 PolarHBondContact O-N 3.45Å; V405-I440 HydrophobicContact CG1-CD1 4.19Å; F431-I440 HydrophobicContact CB-CG2 4.11Å; F431-I440 HydrophobicContact CD1-CG2 4.35Å; F431-I440 HydrophobicContact CG-CG2 4.49Å; N432-I440 WeakPolarHBondContact O-CA 3.29Å; I433-I440 HydrophobicContact CB-CG1 4.38Å; I433-I440 HydrophobicContact CD1-CG1 3.89Å; I433-I440 HydrophobicContact CG1-CG1 4.05Å; G438-I440 PolarHBondContact O-N 3.17Å; I440-I456 HydrophobicContact CD1-CD1 4.3Å; I440-I456 HydrophobicContact CG2-CD1 4.4Å; I440-V458 HydrophobicContact CD1-CG2 4.2Å; I440-V474 HydrophobicContact CD1-CG1 4.1Å; I440-V474 HydrophobicContact CD1-CG2 4.34Å; I440-I476 HydrophobicContact CG2-CD1 4.16Å
441	K	95.3	Very high	93.4	Very high	72 Å²	72	50.3 Å²	50.3	31%	0.313	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	148.9	-178.3	-66.4	164.5	-171.1	157.2	0	111.1	T400 V401 F431 N432 D434 T439	T400-K441 CarbonylContact O-C 3.51Å; T400-K441 WeakPolarHBondContact O-CA 3.35Å; V401-K441 HydrophobicContact CG2-CD 4.48Å; V401-K441 HydrophobicContact CG2-CG 3.95Å; F431-K441 CarbonylContact C-O 3.45Å; F431-K441 VanDerWaalsContact CA-O 3.31Å; F431-K441 WeakPolarHBondContact CA-O 2.96Å; N432-K441 PolarHBondContact N-O 2.74Å; N432-K441 PolarHBondContact O-N 3.41Å; D434-K441 IonicContact OD2-NZ 2.74Å; T439-K441 HydrophobicContact CG2-CG 4.44Å
442	T	95.5	Very high	93.3	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.012	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	138.3	172.5	57.5	0	0	0	0	111.4	V392 K397 G399 T400 V402 F431 L446	V392-T442 HydrophobicContact CG2-CG2 4.27Å; K397-T442 PolarHBondContact O-OG1 2.83Å; G399-T442 WeakPolarHBondContact CA-O 3.48Å; G399-T442 PolarHBondContact N-O 2.88Å; G399-T442 PolarHBondContact N-OG1 2.87Å; T400-T442 PolarHBondContact N-OG1 3.27Å; T400-T442 PolarHBondContact O-N 3.3Å; V402-T442 HydrophobicContact CG2-CG2 3.96Å; F431-T442 HydrophobicContact CD1-CG2 4.34Å; F431-T442 HydrophobicContact CE1-CG2 4.14Å; T442-L446 HydrophobicContact CG2-CD1 4.04Å
443	T	92.5	Very high	93.3	Very high	55 Å²	55	56.4 Å²	56.4	34%	0.337	29%	0.294	S	S	.	.	S	Bend	trans	-115.1	-18.3	173.5	38.1	0	0	0	0	113.6	R429 F430 F431 N432	R429-T443 PolarHBondContact O-OG1 2.73Å; F430-T443 PolarHBondContact O-N 2.79Å; F430-T443 PolarHBondContact O-OG1 3.23Å; F430-T443 VanDerWaalsContact O-OG1 3.12Å; F431-T443 WeakPolarHBondContact CA-OG1 3.47Å; F431-T443 PolarHBondContact N-OG1 2.65Å; N432-T443 HydrophobicContact CB-CG2 3.53Å
444	K	91.1	Very high	93.1	Very high	72 Å²	72	57 Å²	57	31%	0.313	30%	0.296	S	S	.	.	S	Bend	trans	-116.3	173.1	166.9	-67.1	-168.2	175.8	-160.3	0	110.5	D428 F430	D428-K444 WeakPolarHBondContact OD1-CE 3.39Å; D428-K444 IonicContact OD1-NZ 3.72Å; D428-K444 PolarHBondContact OD1-NZ 2.74Å; D428-K444 IonicContact OD2-NZ 3.83Å; D428-K444 PolarHBondContact OD2-NZ 3.03Å; F430-K444 HydrophobicContact CD1-CB 3.81Å; F430-K444 HydrophobicContact CD1-CD 3.78Å; F430-K444 HydrophobicContact CD1-CG 4.27Å; F430-K444 HydrophobicContact CE1-CB 4.33Å; F430-K444 HydrophobicContact CE1-CD 3.8Å; F430-K444 HydrophobicContact CG-CD 4.32Å; F430-K444 HydrophobicContact CZ-CD 4.37Å; F430-K444 PolarHBondContact O-N 2.91Å
445	V	91.4	Very high	93	Very high	98 Å²	98	60.3 Å²	60.3	59%	0.594	31%	0.313	S	S	*	.			trans	-68.4	150	155.1	-177.5	0	0	0	0	107.6
446	L	93.2	Very high	92.9	Very high	7 Å²	7	59.4 Å²	59.4	4%	0.037	30%	0.302	C	S	.	.			trans	-108.3	157.1	174.6	-56.1	174.7	0	0	0	108.6	V392 E394 F430 F431 T442 Y454 V478	V392-L446 HydrophobicContact CG1-CD1 3.59Å; V392-L446 HydrophobicContact CG2-CD1 4.32Å; E394-L446 HydrophobicContact CB-CB 4.34Å; F430-L446 HydrophobicContact CB-CD2 4.13Å; F430-L446 HydrophobicContact CD1-CD2 3.83Å; F430-L446 HydrophobicContact CG-CD2 4.35Å; F431-L446 HydrophobicContact CE1-CD1 4.06Å; F431-L446 HydrophobicContact CE1-CD2 4.22Å; F431-L446 HydrophobicContact CE2-CD2 4.49Å; F431-L446 HydrophobicContact CZ-CD1 4.09Å; F431-L446 HydrophobicContact CZ-CD2 3.81Å; T442-L446 HydrophobicContact CG2-CD1 4.04Å; L446-Y454 HydrophobicContact CD2-CE2 3.89Å; L446-V478 HydrophobicContact CB-CG1 4.49Å; L446-V478 HydrophobicContact CD1-CG2 4.48Å
447	D	92.3	Very high	93	Very high	75 Å²	75	57.3 Å²	57.3	40%	0.401	29%	0.294	S	S	.	.			trans	-142.5	114.5	-179.2	177.2	-42	0	0	0	105.5	E449 E450 T451	D447-E449 PolarHBondContact OD1-N 3.1Å; D447-E449 VanDerWaalsContact OD1-N 3.12Å; D447-E450 HydrophobicContact CB-CB 4.14Å; D447-E450 WeakPolarHBondContact OD1-CB 3.4Å; D447-E450 PolarHBondContact OD1-N 2.83Å; D447-T451 PolarHBondContact O-N 3.46Å
448	R	92.6	Very high	93.1	Very high	43 Å²	43	53.8 Å²	53.8	16%	0.162	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-35.1	-175.4	177.2	-171.5	165.3	-85.1	5.1	111.2	E394 E450 T451 P452 V478 D480 D516	E394-R448 WeakPolarHBondContact OE2-CB 3.42Å; E394-R448 PolarHBondContact OE2-N 3.19Å; R448-E450 VanDerWaalsContact C-N 3.32Å; R448-T451 CarbonylContact O-C 3.52Å; R448-T451 PolarHBondContact O-N 3.21Å; R448-P452 HydrophobicContact CG-CB 3.94Å; R448-P452 WeakPolarHBondContact O-CA 3.06Å; R448-P452 VanDerWaalsContact O-CD 3.23Å; R448-P452 WeakPolarHBondContact O-CD 3.44Å; R448-P452 VanDerWaalsContact O-N 3.13Å; R448-V478 HydrophobicContact CB-CB 4.31Å; R448-V478 HydrophobicContact CB-CG1 3.84Å; R448-V478 HydrophobicContact CG-CG1 4.47Å; R448-D480 WeakPolarHBondContact CD-OD1 3.42Å; R448-D480 IonicContact CZ-OD1 3.72Å; R448-D480 IonicContact NE-OD1 2.7Å; R448-D480 PolarHBondContact NE-OD1 2.79Å; R448-D480 VanDerWaalsContact NE-OD1 3.12Å; R448-D480 IonicContact NH1-OD1 2.73Å; R448-D480 PolarHBondContact NH1-OD1 3.35Å; R448-D480 VanDerWaalsContact NH1-OD1 3.07Å; R448-D480 IonicContact NH2-OD1 2.65Å; R448-D516 IonicContact CZ-OD2 3.63Å; R448-D516 IonicContact NE-OD2 3.14Å; R448-D516 IonicContact NH2-OD1 3.83Å; R448-D516 IonicContact NH2-OD2 3.53Å; R448-D516 PolarHBondContact NH2-OD2 3.2Å
449	E	91.1	Very high	93.1	Very high	56 Å²	56	53.8 Å²	53.8	26%	0.262	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-29.2	-176.6	-72.7	54.5	-108.6	0	0	111.3	D447 K514	D447-E449 PolarHBondContact OD1-N 3.1Å; D447-E449 VanDerWaalsContact OD1-N 3.12Å; E449-K514 HydrophobicContact CG-CB 3.57Å; E449-K514 HydrophobicContact CG-CD 4.22Å
450	E	90.9	Very high	93	Very high	138 Å²	138	52.9 Å²	52.9	65%	0.645	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-50.7	165.8	-177	171.2	-127.5	0	0	112.1	D447 R448	D447-E450 HydrophobicContact CB-CB 4.14Å; D447-E450 WeakPolarHBondContact OD1-CB 3.4Å; D447-E450 PolarHBondContact OD1-N 2.83Å; R448-E450 VanDerWaalsContact C-N 3.32Å
451	T	91.2	Very high	92.9	Very high	41 Å²	41	53.3 Å²	53.3	25%	0.252	27%	0.269	S	S	.	.			trans	-147.1	97.5	-177.2	-62.2	0	0	0	0	112.8	D447 R448 W453 Y454 V478	D447-T451 PolarHBondContact O-N 3.46Å; R448-T451 CarbonylContact O-C 3.52Å; R448-T451 PolarHBondContact O-N 3.21Å; T451-W453 PolarHBondContact O-N 3.5Å; T451-Y454 HydrophobicContact CG2-CD1 3.82Å; T451-Y454 HydrophobicContact CG2-CD2 4.05Å; T451-Y454 HydrophobicContact CG2-CE1 3.52Å; T451-Y454 HydrophobicContact CG2-CE2 3.78Å; T451-Y454 HydrophobicContact CG2-CG 4.08Å; T451-Y454 WeakPolarHBondContact O-CE2 3.23Å; T451-V478 WeakPolarHBondContact O-CG2 3.47Å
452	P	92.1	Very high	92.7	Very high	67 Å²	67	50.1 Å²	50.1	44%	0.435	26%	0.255	S	S	.	.	S	Bend	trans	-78	-18.9	-175.5	29.7	-34.9	0	0	0	113.8	R448 V478	R448-P452 HydrophobicContact CG-CB 3.94Å; R448-P452 WeakPolarHBondContact O-CA 3.06Å; R448-P452 VanDerWaalsContact O-CD 3.23Å; R448-P452 WeakPolarHBondContact O-CD 3.44Å; R448-P452 VanDerWaalsContact O-N 3.13Å; P452-V478 WeakPolarHBondContact O-CB 3.36Å; P452-V478 PolarHBondContact O-N 2.95Å
453	W	93.8	Very high	92.3	Very high	151 Å²	151	53.4 Å²	53.4	57%	0.572	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.5	124.2	-176.1	-106.3	38.3	0	0	0	110.5	T451	T451-W453 PolarHBondContact O-N 3.5Å
454	Y	92.2	Very high	92	Very high	25 Å²	25	56.8 Å²	56.8	10%	0.098	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.5	172.2	-65.1	-91	0	0	0	110.2	F430 F431 L446 T451 I476 V478	F430-Y454 HydrophobicContact CB-CE1 4.22Å; F430-Y454 HydrophobicContact CD1-CE1 4.23Å; F430-Y454 WeakPolarHBondContact CD1-OH 3.14Å; F430-Y454 HydrophobicContact CD2-CD1 4.21Å; F430-Y454 AromaticContact CD2-CE1 3.4Å; F430-Y454 HydrophobicContact CD2-CE1 3.4Å; F430-Y454 VanDerWaalsContact CD2-CE1 3.4Å; F430-Y454 HydrophobicContact CE1-CE1 4.47Å; F430-Y454 VanDerWaalsContact CE1-OH 3.29Å; F430-Y454 WeakPolarHBondContact CE1-OH 3.3Å; F430-Y454 AromaticContact CE2-CE1 3.69Å; F430-Y454 HydrophobicContact CE2-CE1 3.69Å; F430-Y454 AromaticContact CG-CE1 3.7Å; F430-Y454 HydrophobicContact CG-CE1 3.7Å; F430-Y454 AromaticContact CG-CZ 3.92Å; F430-Y454 HydrophobicContact CZ-CE1 4.23Å; F431-Y454 HydrophobicContact CE2-CD1 4.06Å; F431-Y454 AromaticContact CE2-CD2 3.8Å; F431-Y454 HydrophobicContact CE2-CD2 3.8Å; F431-Y454 HydrophobicContact CE2-CE2 4.39Å; F431-Y454 AromaticContact CE2-CG 3.6Å; F431-Y454 HydrophobicContact CE2-CG 3.6Å; F431-Y454 AromaticContact CZ-CD2 3.85Å; F431-Y454 HydrophobicContact CZ-CD2 3.85Å; F431-Y454 HydrophobicContact CZ-CE2 4.32Å; F431-Y454 HydrophobicContact CZ-CG 4.14Å; L446-Y454 HydrophobicContact CD2-CE2 3.89Å; T451-Y454 HydrophobicContact CG2-CD1 3.82Å; T451-Y454 HydrophobicContact CG2-CD2 4.05Å; T451-Y454 HydrophobicContact CG2-CE1 3.52Å; T451-Y454 HydrophobicContact CG2-CE2 3.78Å; T451-Y454 HydrophobicContact CG2-CG 4.08Å; T451-Y454 WeakPolarHBondContact O-CE2 3.23Å; Y454-I476 PolarHBondContact N-O 3.2Å; Y454-I476 PolarHBondContact O-N 3.5Å; Y454-V478 HydrophobicContact CD2-CG2 3.94Å; Y454-V478 HydrophobicContact CE2-CG2 3.75Å
455	N	92.3	Very high	91.8	Very high	121 Å²	121	55.4 Å²	55.4	65%	0.647	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	114.7	171.1	-67.9	-53.2	0	0	0	108.9
456	I	92.1	Very high	91.7	Very high	24 Å²	24	54.4 Å²	54.4	12%	0.123	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	145.5	175.8	66.2	174.5	0	0	0	110.8	I421 F431 I440 V458 V474 I476	I421-I456 HydrophobicContact CD1-CD1 3.84Å; I421-I456 HydrophobicContact CG1-CD1 4.27Å; F431-I456 HydrophobicContact CD2-CG2 4.29Å; I440-I456 HydrophobicContact CD1-CD1 4.3Å; I440-I456 HydrophobicContact CG2-CD1 4.4Å; I456-V458 HydrophobicContact CD1-CG2 4.42Å; I456-V474 HydrophobicContact CG1-CB 3.87Å; I456-V474 PolarHBondContact N-O 2.72Å; I456-V474 PolarHBondContact O-N 2.85Å; I456-I476 HydrophobicContact CD1-CD1 3.75Å; I456-I476 HydrophobicContact CG1-CD1 4.27Å
457	T	93.4	Very high	91.5	Very high	62 Å²	62	61.1 Å²	61.1	38%	0.38	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	115.8	171.8	-56.8	0	0	0	0	108.8	H471	T457-H471 HydrophobicContact CG2-CB 3.98Å
458	V	94.8	Very high	91.4	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	131.9	170.6	-177.2	0	0	0	0	108.5	F383 V405 I421 I433 I440 I456 H471 V472 V474	F383-V458 HydrophobicContact CE1-CG1 4.44Å; F383-V458 HydrophobicContact CZ-CG1 4.21Å; V405-V458 HydrophobicContact CG2-CG1 4.02Å; I421-V458 HydrophobicContact CG1-CG2 4.07Å; I433-V458 HydrophobicContact CD1-CG1 3.54Å; I433-V458 HydrophobicContact CD1-CG2 4.19Å; I440-V458 HydrophobicContact CD1-CG2 4.2Å; I456-V458 HydrophobicContact CD1-CG2 4.42Å; V458-H471 CarbonylContact O-C 3.42Å; V458-H471 WeakPolarHBondContact O-CA 3.2Å; V458-V472 HydrophobicContact CB-CG1 4.08Å; V458-V472 PolarHBondContact N-O 3.32Å; V458-V472 PolarHBondContact O-N 3.04Å; V458-V474 HydrophobicContact CB-CG2 4.45Å; V458-V474 HydrophobicContact CG2-CG2 3.7Å
459	T	95.1	Very high	91.5	Very high	1 Å²	1	61 Å²	61	1%	0.006	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	141.5	171.5	-51.7	0	0	0	0	109.6	Y419 F420 L469 S470 H471	Y419-T459 WeakPolarHBondContact CA-O 3.46Å; F420-T459 HydrophobicContact CD1-CG2 4.35Å; F420-T459 HydrophobicContact CD2-CG2 4.42Å; F420-T459 HydrophobicContact CE1-CG2 3.61Å; F420-T459 HydrophobicContact CE2-CG2 3.69Å; F420-T459 HydrophobicContact CZ-CG2 3.24Å; F420-T459 PolarHBondContact N-O 3.46Å; F420-T459 PolarHBondContact O-N 3.41Å; T459-L469 HydrophobicContact CG2-CB 4.11Å; T459-L469 HydrophobicContact CG2-CD1 4.49Å; T459-L469 HydrophobicContact CG2-CD2 4.05Å; T459-L469 HydrophobicContact CG2-CG 4.45Å; T459-S470 CarbonylContact C-O 3.5Å; T459-S470 VanDerWaalsContact CA-O 3.23Å; T459-S470 WeakPolarHBondContact CA-O 3.31Å; T459-S470 WeakPolarHBondContact CG2-O 3.41Å; T459-H471 WeakPolarHBondContact CG2-ND1 3.16Å; T459-H471 PolarHBondContact OG1-CE1 3.3Å; T459-H471 PolarHBondContact OG1-ND1 2.94Å
460	A	94.6	Very high	91.6	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	146.7	162.2	0	0	0	0	0	109.8	P381 F383 A407 V417 R418 Y419 L469 S470	P381-A460 HydrophobicContact CB-CB 4.42Å; F383-A460 HydrophobicContact CE1-CB 4.26Å; F383-A460 HydrophobicContact CE2-CB 3.77Å; F383-A460 HydrophobicContact CZ-CB 3.51Å; A407-A460 HydrophobicContact CB-CB 3.88Å; V417-A460 HydrophobicContact CG1-CB 3.85Å; R418-A460 VanDerWaalsContact O-CA 3.29Å; R418-A460 WeakPolarHBondContact O-CA 3.27Å; Y419-A460 HydrophobicContact CD1-CB 4.28Å; Y419-A460 HydrophobicContact CE1-CB 4.36Å; A460-L469 WeakPolarHBondContact O-CA 3.34Å; A460-S470 PolarHBondContact N-O 2.62Å; A460-S470 PolarHBondContact O-N 2.63Å
461	S	93.4	Very high	91.8	Very high	9 Å²	9	58.1 Å²	58.1	6%	0.063	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	169.2	170.8	76.7	0	0	0	0	108.9	V417 R418 L468	V417-S461 CarbonylContact C-O 3.59Å; V417-S461 WeakPolarHBondContact CA-O 3.19Å; R418-S461 PolarHBondContact N-O 3.32Å; R418-S461 PolarHBondContact O-N 3.39Å; S461-L468 WeakPolarHBondContact CA-O 3.38Å; S461-L468 WeakPolarHBondContact CB-O 3.32Å
462	E	91.8	Very high	92	Very high	5 Å²	5	56.4 Å²	56.4	2%	0.023	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	167.1	167.4	-67	162.6	-105	0	0	111.6	P381 S415	P381-E462 HydrophobicContact CG-CG 3.65Å; S415-E462 WeakPolarHBondContact CB-OE2 3.41Å; S415-E462 PolarHBondContact OG-OE2 3.13Å
463	N	87	Confident	92.1	Very high	72 Å²	72	57 Å²	57	39%	0.385	30%	0.299	S	S	.	.	S	Bend	trans	-77.4	-30.3	168.8	-173.3	95.8	0	0	0	112.1	L416 R418	L416-N463 HydrophobicContact CB-CB 4.25Å; L416-N463 VanDerWaalsContact O-CB 3.29Å; L416-N463 WeakPolarHBondContact O-CB 3.37Å; L416-N463 PolarHBondContact O-N 3.01Å; R418-N463 HydrophobicContact CG-CB 4.37Å; R418-N463 PolarHBondContact NE-OD1 2.89Å; R418-N463 PolarHBondContact NH2-OD1 2.71Å
464	D	86.1	Confident	92.2	Very high	126 Å²	126	49.8 Å²	49.8	67%	0.674	27%	0.272	S	S	*	.	S	Bend	trans	-104.4	-32.3	-168.2	-68.8	16.8	0	0	0	111.8
465	N	86.9	Confident	92.3	Very high	43 Å²	43	49.1 Å²	49.1	23%	0.23	27%	0.272	C	S	.	.			trans	-116.4	88.1	162.6	-168.5	-11.3	0	0	0	112	D378 D467 L468	D378-N465 PolarHBondContact OD2-ND2 2.76Å; N465-D467 VanDerWaalsContact C-N 3.3Å; N465-D467 PolarHBondContact O-N 3.15Å; N465-D467 PolarHBondContact OD1-N 2.71Å; N465-L468 HydrophobicContact CB-CD1 4.4Å; N465-L468 WeakPolarHBondContact ND2-CD1 3.24Å; N465-L468 WeakPolarHBondContact ND2-CG 3.28Å
466	P	88.3	Confident	92.4	Very high	77 Å²	77	43.4 Å²	43.4	50%	0.5	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.1	-177	32.9	-37.1	0	0	0	114.5	L468 L469	P466-L468 VanDerWaalsContact C-N 3.34Å; P466-L469 WeakPolarHBondContact O-CD2 3.3Å
467	D	89.9	Confident	92.6	Very high	148 Å²	148	46.9 Å²	46.9	79%	0.791	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-17.9	177.3	-71.1	-32.3	0	0	0	111.9	N465 L469	N465-D467 VanDerWaalsContact C-N 3.3Å; N465-D467 PolarHBondContact O-N 3.15Å; N465-D467 PolarHBondContact OD1-N 2.71Å; D467-L469 PolarHBondContact O-N 3.47Å
468	L	90.9	Very high	92.7	Very high	40 Å²	40	44.1 Å²	44.1	21%	0.209	24%	0.236	C	C	.	.			trans	-82.4	109.6	171.5	-69.5	-177.4	0	0	0	110.6	D378 P380 S461 N465 P466	D378-L468 HydrophobicContact CB-CD1 3.92Å; D378-L468 WeakPolarHBondContact O-CD1 3.38Å; P380-L468 HydrophobicContact CB-CB 4.06Å; S461-L468 WeakPolarHBondContact CA-O 3.38Å; S461-L468 WeakPolarHBondContact CB-O 3.32Å; N465-L468 HydrophobicContact CB-CD1 4.4Å; N465-L468 WeakPolarHBondContact ND2-CD1 3.24Å; N465-L468 WeakPolarHBondContact ND2-CG 3.28Å; P466-L468 VanDerWaalsContact C-N 3.34Å
469	L	93	Very high	92.6	Very high	75 Å²	75	45.2 Å²	45.2	39%	0.393	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.6	-176.6	-56.8	-175.5	0	0	0	111.4	F420 T459 A460 P466 D467	F420-L469 HydrophobicContact CE1-CD2 4.26Å; F420-L469 HydrophobicContact CZ-CD2 3.93Å; T459-L469 HydrophobicContact CG2-CB 4.11Å; T459-L469 HydrophobicContact CG2-CD1 4.49Å; T459-L469 HydrophobicContact CG2-CD2 4.05Å; T459-L469 HydrophobicContact CG2-CG 4.45Å; A460-L469 WeakPolarHBondContact O-CA 3.34Å; P466-L469 WeakPolarHBondContact O-CD2 3.3Å; D467-L469 PolarHBondContact O-N 3.47Å
470	S	94	Very high	92.3	Very high	19 Å²	19	46.2 Å²	46.2	13%	0.133	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	153.3	165.1	75.8	0	0	0	0	110.7	P381 F383 T459 A460	P381-S470 WeakPolarHBondContact O-CB 3.27Å; P381-S470 PolarHBondContact O-OG 3.44Å; F383-S470 WeakPolarHBondContact CD2-OG 3.48Å; F383-S470 VanDerWaalsContact CE2-OG 3.27Å; F383-S470 WeakPolarHBondContact CE2-OG 3.49Å; T459-S470 CarbonylContact C-O 3.5Å; T459-S470 VanDerWaalsContact CA-O 3.23Å; T459-S470 WeakPolarHBondContact CA-O 3.31Å; T459-S470 WeakPolarHBondContact CG2-O 3.41Å; A460-S470 PolarHBondContact N-O 2.62Å; A460-S470 PolarHBondContact O-N 2.63Å
471	H	94.4	Very high	92.1	Very high	114 Å²	114	47.5 Å²	47.5	53%	0.528	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	141.5	-176.7	-53.9	-67.5	0	0	0	111.4	T457 V458 T459	T457-H471 HydrophobicContact CG2-CB 3.98Å; V458-H471 CarbonylContact O-C 3.42Å; V458-H471 WeakPolarHBondContact O-CA 3.2Å; T459-H471 WeakPolarHBondContact CG2-ND1 3.16Å; T459-H471 PolarHBondContact OG1-CE1 3.3Å; T459-H471 PolarHBondContact OG1-ND1 2.94Å
472	V	95.6	Very high	91.9	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.03	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144.2	171.9	72.5	0	0	0	0	111.1	F383 Y388 V458 V474	F383-V472 HydrophobicContact CB-CB 4.26Å; F383-V472 HydrophobicContact CB-CG2 4.45Å; F383-V472 HydrophobicContact CD1-CB 4.06Å; F383-V472 HydrophobicContact CD1-CG1 3.54Å; F383-V472 HydrophobicContact CD2-CB 3.7Å; F383-V472 HydrophobicContact CD2-CG1 3.93Å; F383-V472 HydrophobicContact CE1-CB 4.32Å; F383-V472 HydrophobicContact CE1-CG1 3.46Å; F383-V472 VanDerWaalsContact CE1-CG1 3.46Å; F383-V472 HydrophobicContact CE2-CB 3.97Å; F383-V472 HydrophobicContact CE2-CG1 3.84Å; F383-V472 HydrophobicContact CG-CB 3.74Å; F383-V472 HydrophobicContact CG-CG1 3.77Å; F383-V472 HydrophobicContact CG-CG2 4.4Å; F383-V472 HydrophobicContact CZ-CB 4.26Å; F383-V472 HydrophobicContact CZ-CG1 3.61Å; Y388-V472 HydrophobicContact CD2-CG1 4.17Å; Y388-V472 HydrophobicContact CD2-CG2 3.79Å; Y388-V472 HydrophobicContact CE2-CG1 4.11Å; Y388-V472 HydrophobicContact CE2-CG2 3.91Å; V458-V472 HydrophobicContact CB-CG1 4.08Å; V458-V472 PolarHBondContact N-O 3.32Å; V458-V472 PolarHBondContact O-N 3.04Å; V472-V474 HydrophobicContact CG1-CG2 4.34Å
473	T	94.2	Very high	91.7	Very high	80 Å²	80	52 Å²	52	49%	0.491	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	132	172.8	50.5	0	0	0	0	110.7	S387 Y388	S387-T473 WeakPolarHBondContact CA-O 3.34Å; Y388-T473 PolarHBondContact N-O 2.93Å
474	V	95.6	Very high	91.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	111.4	174.9	-173.8	0	0	0	0	108.2	Y388 M390 V405 I440 I456 V458 V472 I476	Y388-V474 HydrophobicContact CD2-CG2 4.38Å; Y388-V474 WeakPolarHBondContact O-CA 3.47Å; M390-V474 HydrophobicContact CE-CG1 3.96Å; M390-V474 HydrophobicContact CG-CG1 4.11Å; M390-V474 HydrophobicContact SD-CG1 3.92Å; V405-V474 HydrophobicContact CG1-CG2 3.8Å; I440-V474 HydrophobicContact CD1-CG1 4.1Å; I440-V474 HydrophobicContact CD1-CG2 4.34Å; I456-V474 HydrophobicContact CG1-CB 3.87Å; I456-V474 PolarHBondContact N-O 2.72Å; I456-V474 PolarHBondContact O-N 2.85Å; V458-V474 HydrophobicContact CB-CG2 4.45Å; V458-V474 HydrophobicContact CG2-CG2 3.7Å; V472-V474 HydrophobicContact CG1-CG2 4.34Å; V474-I476 HydrophobicContact CG1-CG1 4.08Å
475	G	94.8	Very high	92	Very high	11 Å²	11	45.9 Å²	45.9	11%	0.113	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	113.5	170.9	0	0	0	0	0	109.9	Y388 V389 M390	Y388-G475 PolarHBondContact O-N 2.84Å; V389-G475 VanDerWaalsContact CA-O 3.32Å; V389-G475 WeakPolarHBondContact CA-O 3.33Å; M390-G475 PolarHBondContact N-O 2.93Å
476	I	95.6	Very high	92.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	112.4	175.6	-57.5	174.1	0	0	0	107.9	M390 V392 V402 F431 I440 Y454 I456 V474	M390-I476 WeakPolarHBondContact O-CA 3.16Å; V392-I476 HydrophobicContact CG1-CG2 3.61Å; V402-I476 HydrophobicContact CG1-CD1 4.22Å; V402-I476 HydrophobicContact CG1-CG1 4.23Å; V402-I476 HydrophobicContact CG1-CG2 3.82Å; F431-I476 HydrophobicContact CD1-CD1 3.72Å; F431-I476 HydrophobicContact CD2-CD1 3.86Å; F431-I476 HydrophobicContact CE1-CD1 3.73Å; F431-I476 HydrophobicContact CE1-CG2 3.91Å; F431-I476 HydrophobicContact CE2-CD1 3.89Å; F431-I476 HydrophobicContact CG-CD1 3.79Å; F431-I476 HydrophobicContact CZ-CB 4.22Å; F431-I476 HydrophobicContact CZ-CD1 3.83Å; F431-I476 HydrophobicContact CZ-CG2 3.76Å; I440-I476 HydrophobicContact CG2-CD1 4.16Å; Y454-I476 PolarHBondContact N-O 3.2Å; Y454-I476 PolarHBondContact O-N 3.5Å; I456-I476 HydrophobicContact CD1-CD1 3.75Å; I456-I476 HydrophobicContact CG1-CD1 4.27Å; V474-I476 HydrophobicContact CG1-CG1 4.08Å
477	R	95.4	Very high	92.2	Very high	98 Å²	98	46.2 Å²	46.2	37%	0.37	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124	174.3	177.9	171.1	178.6	-127.4	-2.3	109.7	M390 E391 V392 L479	M390-R477 PolarHBondContact O-N 3.04Å; E391-R477 WeakPolarHBondContact CA-O 3.29Å; E391-R477 HydrophobicContact CG-CB 4.32Å; E391-R477 WeakPolarHBondContact OE1-CD 3.29Å; E391-R477 IonicContact OE1-CZ 3.74Å; E391-R477 IonicContact OE1-NE 2.87Å; E391-R477 IonicContact OE1-NH1 3.39Å; E391-R477 PolarHBondContact OE1-NH1 2.64Å; V392-R477 PolarHBondContact N-O 3.29Å; R477-L479 HydrophobicContact CG-CD2 4.31Å
478	V	94.8	Very high	92.2	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	133.3	167.8	-168.8	0	0	0	0	108.5	V392 E394 L446 R448 T451 P452 Y454	V392-V478 CarbonylContact O-C 3.52Å; V392-V478 VanDerWaalsContact O-CA 3.31Å; V392-V478 WeakPolarHBondContact O-CA 3.29Å; E394-V478 HydrophobicContact CB-CG1 3.64Å; L446-V478 HydrophobicContact CB-CG1 4.49Å; L446-V478 HydrophobicContact CD1-CG2 4.48Å; R448-V478 HydrophobicContact CB-CB 4.31Å; R448-V478 HydrophobicContact CB-CG1 3.84Å; R448-V478 HydrophobicContact CG-CG1 4.47Å; T451-V478 WeakPolarHBondContact O-CG2 3.47Å; P452-V478 WeakPolarHBondContact O-CB 3.36Å; P452-V478 PolarHBondContact O-N 2.95Å; Y454-V478 HydrophobicContact CD2-CG2 3.94Å; Y454-V478 HydrophobicContact CE2-CG2 3.75Å
479	L	92.8	Very high	92	Very high	24 Å²	24	40.8 Å²	40.8	13%	0.126	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133	176.5	-64.9	-177.1	0	0	0	110.5	E391 V392 Y393 E394 R477	E391-L479 HydrophobicContact CB-CD1 3.82Å; E391-L479 HydrophobicContact CB-CD2 4.27Å; E391-L479 HydrophobicContact CB-CG 3.96Å; V392-L479 PolarHBondContact O-N 2.79Å; Y393-L479 WeakPolarHBondContact CA-O 3.22Å; Y393-L479 HydrophobicContact CD1-CB 3.53Å; Y393-L479 HydrophobicContact CD1-CD1 4.36Å; Y393-L479 HydrophobicContact CD2-CD1 4.47Å; Y393-L479 HydrophobicContact CE1-CB 3.73Å; Y393-L479 HydrophobicContact CE1-CD1 4Å; Y393-L479 HydrophobicContact CE2-CD1 4.1Å; Y393-L479 HydrophobicContact CG-CB 4.08Å; E394-L479 PolarHBondContact N-O 3.34Å; R477-L479 HydrophobicContact CG-CD2 4.31Å
480	D	90.2	Very high	91.9	Very high	22 Å²	22	44.7 Å²	44.7	12%	0.118	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-65.1	135.8	-174.1	-164.6	79.4	0	0	0	113.6	E394 R448 D516 N519	E394-D480 VanDerWaalsContact OE1-CA 3.29Å; E394-D480 WeakPolarHBondContact OE1-CA 3.06Å; R448-D480 WeakPolarHBondContact CD-OD1 3.42Å; R448-D480 IonicContact CZ-OD1 3.72Å; R448-D480 IonicContact NE-OD1 2.7Å; R448-D480 PolarHBondContact NE-OD1 2.79Å; R448-D480 VanDerWaalsContact NE-OD1 3.12Å; R448-D480 IonicContact NH1-OD1 2.73Å; R448-D480 PolarHBondContact NH1-OD1 3.35Å; R448-D480 VanDerWaalsContact NH1-OD1 3.07Å; R448-D480 IonicContact NH2-OD1 2.65Å; D480-D516 HydrophobicContact CB-CB 3.87Å; D480-D516 WeakPolarHBondContact OD1-CB 3.42Å; D480-D516 PolarHBondContact OD1-N 3.24Å; D480-D516 WeakPolarHBondContact OD2-CB 3.25Å; D480-D516 PolarHBondContact OD2-N 2.79Å; D480-N519 PolarHBondContact O-ND2 2.76Å; D480-N519 VanDerWaalsContact O-ND2 3.16Å; D480-N519 WeakPolarHBondContact OD2-CB 3.41Å; D480-N519 PolarHBondContact OD2-ND2 2.83Å
481	V	89.6	Confident	91.5	Very high	26 Å²	26	53 Å²	53	16%	0.158	27%	0.265	C	S	.	.			trans	-132.3	131.3	175.6	178.2	0	0	0	0	108.2	Y393 E394 N395 D483	Y393-V481 HydrophobicContact CD1-CG2 3.8Å; Y393-V481 HydrophobicContact CG-CG2 4.34Å; E394-V481 HydrophobicContact CG-CB 4.14Å; E394-V481 HydrophobicContact CG-CG2 4.12Å; E394-V481 PolarHBondContact OE1-N 2.84Å; N395-V481 HydrophobicContact CB-CG1 4.4Å; N395-V481 HydrophobicContact CB-CG2 4.32Å; N395-V481 WeakPolarHBondContact ND2-CG1 3.49Å; V481-D483 VanDerWaalsContact O-CB 3.3Å; V481-D483 WeakPolarHBondContact O-CB 3.15Å; V481-D483 PolarHBondContact O-N 3.34Å
482	N	88.8	Confident	91.1	Very high	9 Å²	9	48.4 Å²	48.4	5%	0.048	24%	0.243	C	C	.	.	S	Bend	trans	-64.4	101.4	179	-158.3	111.8	0	0	0	111.2	D515 N519 D572 G574 P576	N482-D515 WeakPolarHBondContact CA-OD2 3.36Å; N482-N519 HydrophobicContact CB-CB 4.44Å; N482-N519 PolarHBondContact N-ND2 2.91Å; N482-D572 PolarHBondContact ND2-OD2 2.98Å; N482-G574 VanDerWaalsContact OD1-CA 3.28Å; N482-G574 WeakPolarHBondContact OD1-CA 3.27Å; N482-P576 PolarHBondContact ND2-O 3.33Å
483	D	88.5	Confident	90.5	Very high	101 Å²	101	54.1 Å²	54.1	54%	0.54	27%	0.274	S	S	.	.			trans	-134.3	-34.6	-163.6	168.9	-76.8	0	0	0	111.1	V481 D515 L578	V481-D483 VanDerWaalsContact O-CB 3.3Å; V481-D483 WeakPolarHBondContact O-CB 3.15Å; V481-D483 PolarHBondContact O-N 3.34Å; D483-D515 PolarHBondContact N-OD2 2.8Å; D483-L578 WeakPolarHBondContact O-CD1 3.27Å
484	N	88.9	Confident	90.2	Very high	20 Å²	20	50.4 Å²	50.4	11%	0.107	25%	0.251	C	S	.	.	S	Bend	trans	-87.9	140.1	170.4	-64.7	-90.6	0	0	0	111	K514 D515	N484-K514 HydrophobicContact CB-CB 4.33Å; N484-K514 HydrophobicContact CB-CG 4.45Å; N484-K514 WeakPolarHBondContact OD1-CD 3.45Å; N484-K514 WeakPolarHBondContact OD1-CE 3.28Å; N484-K514 PolarHBondContact OD1-NZ 3.42Å; N484-D515 VanDerWaalsContact CB-OD1 3.24Å; N484-D515 WeakPolarHBondContact CB-OD1 3.33Å; N484-D515 PolarHBondContact N-OD1 3.26Å; N484-D515 PolarHBondContact N-OD2 3.19Å; N484-D515 VanDerWaalsContact N-OD2 3.09Å; N484-D515 PolarHBondContact ND2-OD1 2.97Å
485	P	89.4	Confident	89.8	Confident	49 Å²	49	52.4 Å²	52.4	32%	0.318	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-86.3	145.4	169	33.2	-32.1	0	0	0	110.9	E487 L578	P485-E487 PolarHBondContact O-N 3.15Å; P485-L578 HydrophobicContact CB-CB 4.05Å
486	P	90.3	Very high	89.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-68	126.5	-177.4	23.4	-33	0	0	0	112	D513 F523 I570 D572 S580	P486-D513 VanDerWaalsContact CA-OD2 3.29Å; P486-D513 WeakPolarHBondContact CA-OD2 3.3Å; P486-D513 VanDerWaalsContact CB-OD2 3.28Å; P486-D513 WeakPolarHBondContact CB-OD2 3.42Å; P486-D513 WeakPolarHBondContact CD-OD2 3.4Å; P486-F523 HydrophobicContact CB-CD1 3.59Å; P486-F523 HydrophobicContact CB-CE1 3.63Å; P486-F523 HydrophobicContact CB-CG 4.43Å; P486-F523 HydrophobicContact CB-CZ 4.46Å; P486-F523 HydrophobicContact CG-CD1 4.03Å; P486-F523 HydrophobicContact CG-CE1 4.38Å; P486-I570 HydrophobicContact CB-CG2 4Å; P486-I570 HydrophobicContact CG-CB 4.44Å; P486-I570 HydrophobicContact CG-CG2 3.88Å; P486-D572 HydrophobicContact CG-CB 4.1Å; P486-S580 VanDerWaalsContact O-CB 3.28Å; P486-S580 WeakPolarHBondContact O-CB 3.5Å; P486-S580 PolarHBondContact O-OG 2.86Å
487	E	89.1	Confident	89	Confident	126 Å²	126	52.3 Å²	52.3	59%	0.589	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	166.1	179.4	-62.8	-162.1	147.5	0	0	111.8	P485 A489 A511 T512	P485-E487 PolarHBondContact O-N 3.15Å; E487-A489 PolarHBondContact O-N 3.44Å; E487-A511 CarbonylContact O-C 3.58Å; E487-A511 WeakPolarHBondContact O-CA 3.41Å; E487-A511 VanDerWaalsContact O-CB 3.3Å; E487-A511 WeakPolarHBondContact O-CB 3.42Å; E487-T512 PolarHBondContact N-O 3.03Å; E487-T512 PolarHBondContact O-N 3.36Å
488	L	89.7	Confident	88.4	Confident	32 Å²	32	50.7 Å²	50.7	17%	0.168	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	131.5	170.1	-77.8	172.3	0	0	0	110.2	R490 Y492 I509 I568 I570 L584	L488-R490 PolarHBondContact O-N 2.74Å; L488-Y492 HydrophobicContact CB-CE2 4.34Å; L488-Y492 HydrophobicContact CD1-CD2 4.4Å; L488-Y492 HydrophobicContact CD2-CD2 4.31Å; L488-Y492 HydrophobicContact CD2-CE2 3.97Å; L488-I509 HydrophobicContact CD2-CB 4.17Å; L488-I509 HydrophobicContact CD2-CD1 4.22Å; L488-I568 HydrophobicContact CD1-CD1 4.3Å; L488-I568 HydrophobicContact CD2-CD1 3.97Å; L488-I568 HydrophobicContact CG-CD1 4.4Å; L488-I570 HydrophobicContact CD2-CD1 3.86Å; L488-I570 HydrophobicContact CG-CD1 3.94Å; L488-L584 HydrophobicContact CD1-CD2 3.59Å; L488-L584 HydrophobicContact CD1-CG 4.48Å
489	A	88.3	Confident	87.9	Confident	42 Å²	42	54.2 Å²	54.2	35%	0.347	28%	0.276	S	S	.	.	S	Bend	trans	-61.4	-7.5	-177.2	0	0	0	0	0	115.2	E487 S510 T512	E487-A489 PolarHBondContact O-N 3.44Å; A489-S510 WeakPolarHBondContact CB-O 3.26Å; A489-S510 PolarHBondContact N-O 2.82Å; A489-T512 WeakPolarHBondContact CA-OG1 3.45Å; A489-T512 HydrophobicContact CB-CG2 3.78Å
490	R	89.1	Confident	87.5	Confident	158 Å²	158	53.2 Å²	53.2	60%	0.596	27%	0.271	S	S	*	.	S	Bend	trans	-174.5	169.3	172.6	54.9	179.2	178.9	-138.4	-0.9	109.9	L488 Y492	L488-R490 PolarHBondContact O-N 2.74Å; R490-Y492 HydrophobicContact CG-CD1 4.44Å; R490-Y492 HydrophobicContact CG-CD2 4.17Å; R490-Y492 HydrophobicContact CG-CE1 4.08Å; R490-Y492 HydrophobicContact CG-CE2 3.73Å; R490-Y492 WeakPolarHBondContact O-CD2 3.49Å; R490-Y492 WeakPolarHBondContact O-CE2 3.18Å
491	E	86.7	Confident	87.2	Confident	193 Å²	193	59.5 Å²	59.5	90%	0.902	30%	0.297	S	S	*	.			trans	-67	146.3	160.8	-62.6	-173.9	167.9	0	0	111.3
492	Y	85.8	Confident	87.1	Confident	17 Å²	17	61.5 Å²	61.5	7%	0.067	31%	0.311	C	S	.	.			trans	-129.5	106.5	-177.2	-69.5	-91.7	0	0	0	112	L488 R490 I494 H507 I509 S510	L488-Y492 HydrophobicContact CB-CE2 4.34Å; L488-Y492 HydrophobicContact CD1-CD2 4.4Å; L488-Y492 HydrophobicContact CD2-CD2 4.31Å; L488-Y492 HydrophobicContact CD2-CE2 3.97Å; R490-Y492 HydrophobicContact CG-CD1 4.44Å; R490-Y492 HydrophobicContact CG-CD2 4.17Å; R490-Y492 HydrophobicContact CG-CE1 4.08Å; R490-Y492 HydrophobicContact CG-CE2 3.73Å; R490-Y492 WeakPolarHBondContact O-CD2 3.49Å; R490-Y492 WeakPolarHBondContact O-CE2 3.18Å; Y492-I494 PolarHBondContact O-N 3.25Å; Y492-I494 VanDerWaalsContact O-N 3.12Å; Y492-H507 AromaticContact CD1-CD2 3.54Å; Y492-H507 AromaticContact CD1-NE2 3.39Å; Y492-H507 WeakPolarHBondContact CD1-NE2 3.2Å; Y492-H507 AromaticContact CE1-NE2 3.78Å; Y492-I509 HydrophobicContact CD1-CG2 4.14Å; Y492-I509 HydrophobicContact CD2-CG2 4.02Å; Y492-I509 HydrophobicContact CE1-CG2 4.15Å; Y492-I509 HydrophobicContact CE2-CB 4.23Å; Y492-I509 HydrophobicContact CE2-CG2 4.07Å; Y492-I509 HydrophobicContact CG-CG2 4.06Å; Y492-S510 PolarHBondContact OH-N 3.37Å; Y492-S510 PolarHBondContact OH-O 3.49Å; Y492-S510 PolarHBondContact OH-OG 2.76Å
493	D	83.3	Confident	86.8	Confident	126 Å²	126	63.8 Å²	63.8	67%	0.674	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	90.9	167.1	-102.9	-46.5	0	0	0	109.9	R587	D493-R587 IonicContact OD1-NE 2.91Å; D493-R587 IonicContact OD1-NH2 3.05Å
494	I	87.9	Confident	86.8	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	137.9	-175.7	-63.3	151	0	0	0	110.7	Y492 I506 H507 I549 L584 T585 I586 R587	Y492-I494 PolarHBondContact O-N 3.25Å; Y492-I494 VanDerWaalsContact O-N 3.12Å; I494-I506 HydrophobicContact CG2-CD1 3.79Å; I494-I506 HydrophobicContact CG2-CG1 4.17Å; I494-H507 HydrophobicContact CG1-CB 4.05Å; I494-H507 HydrophobicContact CG2-CB 4.06Å; I494-I549 HydrophobicContact CD1-CD1 3.55Å; I494-I549 HydrophobicContact CG1-CD1 4.45Å; I494-L584 HydrophobicContact CD1-CB 3.99Å; I494-L584 HydrophobicContact CD1-CD1 3.77Å; I494-L584 HydrophobicContact CD1-CD2 3.87Å; I494-L584 HydrophobicContact CD1-CG 4.11Å; I494-T585 PolarHBondContact N-O 3.36Å; I494-I586 HydrophobicContact CB-CG1 4.04Å; I494-I586 HydrophobicContact CG2-CB 4.42Å; I494-I586 HydrophobicContact CG2-CG1 3.86Å; I494-I586 HydrophobicContact CG2-CG2 4.15Å; I494-I586 CarbonylContact O-C 3.6Å; I494-I586 WeakPolarHBondContact O-CA 3.11Å; I494-R587 PolarHBondContact O-N 2.95Å
495	V	86.8	Confident	86.8	Confident	42 Å²	42	64.7 Å²	64.7	26%	0.255	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.7	179.3	173.7	0	0	0	0	110.6	R587 C589 V597 C600	V495-R587 WeakPolarHBondContact CA-O 3.24Å; V495-C589 HydrophobicContact CG1-CB 3.84Å; V495-C589 VanDerWaalsContact CG1-SG 3.58Å; V495-V597 HydrophobicContact CB-CG2 4.46Å; V495-V597 HydrophobicContact CG1-CG2 3.7Å; V495-C600 WeakPolarHBondContact CG1-SG 3.46Å; V495-C600 WeakPolarHBondContact CG2-SG 3.3Å
496	V	88.6	Confident	86.8	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	138.7	166.8	65	0	0	0	0	110.2	I506 F537 T551 F556 I586 R587 V588 C589	V496-I506 HydrophobicContact CB-CD1 4.21Å; V496-I506 HydrophobicContact CB-CG2 4.42Å; V496-I506 HydrophobicContact CG2-CG2 4.09Å; V496-F537 HydrophobicContact CB-CE1 4.32Å; V496-F537 HydrophobicContact CG1-CE1 4.46Å; V496-F537 HydrophobicContact CG1-CZ 4.26Å; V496-F537 HydrophobicContact CG2-CE1 4.27Å; V496-T551 HydrophobicContact CG2-CG2 3.77Å; V496-F556 HydrophobicContact CG1-CD1 4.04Å; V496-F556 HydrophobicContact CG1-CE1 4.41Å; V496-F556 HydrophobicContact CG1-CG 4.17Å; V496-F556 HydrophobicContact CG2-CD1 4.35Å; V496-F556 HydrophobicContact CG2-CD2 3.64Å; V496-F556 HydrophobicContact CG2-CE1 4.4Å; V496-F556 HydrophobicContact CG2-CE2 3.71Å; V496-F556 HydrophobicContact CG2-CG 3.98Å; V496-F556 HydrophobicContact CG2-CZ 4.09Å; V496-I586 HydrophobicContact CB-CG2 4.01Å; V496-I586 HydrophobicContact CG1-CG2 3.78Å; V496-R587 PolarHBondContact N-O 3.42Å; V496-V588 HydrophobicContact CG1-CB 4.34Å; V496-V588 HydrophobicContact CG1-CG2 3.8Å; V496-V588 WeakPolarHBondContact O-CA 3.1Å; V496-C589 PolarHBondContact O-N 2.82Å
497	C	85.1	Confident	86.8	Confident	9 Å²	9	67 Å²	67	6%	0.061	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	143.1	177.8	-66.4	0	0	0	0	111.6	N499 S500 C589 C591	C497-N499 WeakPolarHBondContact CB-OD1 3.32Å; C497-N499 PolarHBondContact O-N 2.57Å; C497-N499 VanDerWaalsContact O-N 3.15Å; C497-S500 WeakPolarHBondContact CB-OG 3.25Å; C497-S500 PolarHBondContact N-OG 3.08Å; C497-S500 VanDerWaalsContact O-CB 3.29Å; C497-S500 WeakPolarHBondContact O-CB 3.36Å; C497-S500 PolarHBondContact O-N 3.05Å; C497-S500 PolarHBondContact O-OG 3.23Å; C497-C589 WeakPolarHBondContact CA-O 3.25Å; C497-C591 VanDerWaalsContact CA-SG 3.54Å; C497-C591 HydrophobicContact CB-CB 3.57Å; C497-C591 WeakPolarHBondContact CB-SG 3.31Å; C497-C591 WeakPolarHBondContact SG-CB 3.39Å; C497-C591 CovalentContact SG-SG 2.03Å; C497-C591 PolarHBondContact SG-SG 3.05Å
498	E	83.6	Confident	86.9	Confident	64 Å²	64	63.7 Å²	63.7	30%	0.299	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.7	174	-68	-172.2	125	0	0	113.2	S557 R558 V588 C589	E498-S557 WeakPolarHBondContact OE1-CA 3.49Å; E498-R558 PolarHBondContact OE1-N 2.89Å; E498-V588 HydrophobicContact CG-CG1 3.53Å; E498-C589 PolarHBondContact N-O 2.79Å; E498-C589 VanDerWaalsContact N-O 3.13Å
499	N	82.5	Confident	87	Confident	77 Å²	77	62.2 Å²	62.2	41%	0.412	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	4.3	177.1	68.8	-4.6	0	0	0	114.5	C497 K501 E592	C497-N499 WeakPolarHBondContact CB-OD1 3.32Å; C497-N499 PolarHBondContact O-N 2.57Å; C497-N499 VanDerWaalsContact O-N 3.15Å; N499-K501 PolarHBondContact O-N 3.39Å; N499-E592 PolarHBondContact ND2-O 2.91Å
500	S	84.7	Confident	87.1	Confident	3 Å²	3	62.1 Å²	62.1	2%	0.021	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-60.7	133.2	178.6	-72.7	0	0	0	0	111.8	C497 Q504	C497-S500 WeakPolarHBondContact CB-OG 3.25Å; C497-S500 PolarHBondContact N-OG 3.08Å; C497-S500 VanDerWaalsContact O-CB 3.29Å; C497-S500 WeakPolarHBondContact O-CB 3.36Å; C497-S500 PolarHBondContact O-N 3.05Å; C497-S500 PolarHBondContact O-OG 3.23Å; S500-Q504 VanDerWaalsContact CA-OE1 3.29Å
501	K	85	Confident	87.1	Confident	153 Å²	153	55 Å²	55	67%	0.665	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-82.9	155.6	176.9	-61.1	172.7	-173.9	169.6	0	109.8	N499 Q504 T551	N499-K501 PolarHBondContact O-N 3.39Å; K501-Q504 VanDerWaalsContact N-OE1 3.11Å; K501-Q504 VanDerWaalsContact O-CB 3.25Å; K501-Q504 WeakPolarHBondContact O-CB 3.15Å; K501-Q504 PolarHBondContact O-N 2.9Å; K501-T551 PolarHBondContact O-OG1 2.98Å
502	P	86.5	Confident	87.2	Confident	69 Å²	69	49.4 Å²	49.4	45%	0.448	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	144	165.9	-21.8	32.4	0	0	0	111.7	Q504 T551 R554	P502-Q504 VanDerWaalsContact C-N 3.29Å; P502-T551 CarbonylContact C-O 3.59Å; P502-T551 WeakPolarHBondContact CA-O 3.29Å; P502-R554 HydrophobicContact CG-CB 4.42Å; P502-R554 HydrophobicContact CG-CG 3.89Å
503	G	83.9	Confident	87.3	Confident	57 Å²	57	50.7 Å²	50.7	59%	0.588	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	13.1	-177.5	0	0	0	0	0	114.4	T551	G503-T551 PolarHBondContact N-O 2.78Å
504	Q	87.9	Confident	87.5	Confident	69 Å²	69	51 Å²	51	32%	0.322	28%	0.284	S	S	.	.			trans	-89.9	126	175.5	-179.4	176.9	-15.8	0	0	109.9	S500 K501 P502 L550 T551	S500-Q504 VanDerWaalsContact CA-OE1 3.29Å; K501-Q504 VanDerWaalsContact N-OE1 3.11Å; K501-Q504 VanDerWaalsContact O-CB 3.25Å; K501-Q504 WeakPolarHBondContact O-CB 3.15Å; K501-Q504 PolarHBondContact O-N 2.9Å; P502-Q504 VanDerWaalsContact C-N 3.29Å; Q504-L550 WeakPolarHBondContact O-CA 3.45Å; Q504-T551 PolarHBondContact N-OG1 2.78Å; Q504-T551 VanDerWaalsContact N-OG1 3.16Å; Q504-T551 PolarHBondContact O-N 3.38Å; Q504-T551 PolarHBondContact O-OG1 3.12Å
505	V	89.2	Confident	87.6	Confident	70 Å²	70	51.8 Å²	51.8	42%	0.424	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	130.1	168.2	-178.6	0	0	0	0	109	I549 L550	V505-I549 CarbonylContact C-O 3.59Å; V505-I549 WeakPolarHBondContact CA-O 3.2Å; V505-L550 HydrophobicContact CG2-CD2 3.93Å; V505-L550 HydrophobicContact CG2-CG 3.96Å
506	I	89.1	Confident	87.3	Confident	30 Å²	30	52.5 Å²	52.5	15%	0.154	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-33.7	176.6	60.6	173.1	0	0	0	112.5	I494 V496 F537 I549 T551 I586	I494-I506 HydrophobicContact CG2-CD1 3.79Å; I494-I506 HydrophobicContact CG2-CG1 4.17Å; V496-I506 HydrophobicContact CB-CD1 4.21Å; V496-I506 HydrophobicContact CB-CG2 4.42Å; V496-I506 HydrophobicContact CG2-CG2 4.09Å; I506-F537 HydrophobicContact CD1-CD1 3.95Å; I506-F537 HydrophobicContact CD1-CE1 3.72Å; I506-I549 HydrophobicContact CD1-CG2 3.94Å; I506-I549 HydrophobicContact CG1-CB 4Å; I506-I549 HydrophobicContact CG1-CG2 3.94Å; I506-I549 WeakPolarHBondContact CG1-O 3.49Å; I506-I549 PolarHBondContact N-O 2.82Å; I506-T551 HydrophobicContact CG2-CG2 3.75Å; I506-I586 HydrophobicContact CD1-CD1 4.34Å; I506-I586 HydrophobicContact CD1-CG2 4.03Å
507	H	90	Very high	86.5	Confident	69 Å²	69	60.1 Å²	60.1	32%	0.319	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	163.8	173.4	-149.7	60.7	0	0	0	110.8	Y492 I494 I549	Y492-H507 AromaticContact CD1-CD2 3.54Å; Y492-H507 AromaticContact CD1-NE2 3.39Å; Y492-H507 WeakPolarHBondContact CD1-NE2 3.2Å; Y492-H507 AromaticContact CE1-NE2 3.78Å; I494-H507 HydrophobicContact CG1-CB 4.05Å; I494-H507 HydrophobicContact CG2-CB 4.06Å; H507-I549 HydrophobicContact CB-CD1 4.48Å; H507-I549 PolarHBondContact O-N 3.01Å
508	T	91.8	Very high	85.5	Confident	56 Å²	56	63.7 Å²	63.7	34%	0.344	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	124.3	170.9	-64.4	0	0	0	0	108	T546 A547 S548	T508-T546 HydrophobicContact CG2-CG2 4.26Å; T508-T546 WeakPolarHBondContact CG2-OG1 3.37Å; T508-A547 CarbonylContact C-O 3.47Å; T508-A547 WeakPolarHBondContact CA-O 3.41Å; T508-S548 PolarHBondContact OG1-OG 3.01Å; T508-S548 VanDerWaalsContact OG1-OG 3.05Å
509	I	91.4	Very high	84.3	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	157.1	178.1	54.8	167.3	0	0	0	109.9	L488 Y492 F525 T546 A547 I549 I568 L584	L488-I509 HydrophobicContact CD2-CB 4.17Å; L488-I509 HydrophobicContact CD2-CD1 4.22Å; Y492-I509 HydrophobicContact CD1-CG2 4.14Å; Y492-I509 HydrophobicContact CD2-CG2 4.02Å; Y492-I509 HydrophobicContact CE1-CG2 4.15Å; Y492-I509 HydrophobicContact CE2-CB 4.23Å; Y492-I509 HydrophobicContact CE2-CG2 4.07Å; Y492-I509 HydrophobicContact CG-CG2 4.06Å; I509-F525 HydrophobicContact CD1-CD1 3.93Å; I509-F525 HydrophobicContact CD1-CE1 4.12Å; I509-F525 HydrophobicContact CG1-CE1 4.42Å; I509-T546 CarbonylContact O-C 3.58Å; I509-T546 WeakPolarHBondContact O-CA 3.45Å; I509-T546 VanDerWaalsContact O-CB 3.23Å; I509-T546 WeakPolarHBondContact O-CB 3.17Å; I509-A547 HydrophobicContact CD1-CB 4.29Å; I509-A547 HydrophobicContact CG1-CB 4Å; I509-A547 VanDerWaalsContact CG1-O 3.3Å; I509-A547 WeakPolarHBondContact CG1-O 3.4Å; I509-A547 PolarHBondContact N-O 2.87Å; I509-A547 PolarHBondContact O-N 3.02Å; I509-I549 HydrophobicContact CG2-CD1 4.03Å; I509-I568 HydrophobicContact CD1-CD1 3.44Å; I509-I568 VanDerWaalsContact CD1-CD1 3.44Å; I509-L584 HydrophobicContact CD1-CD1 4.21Å; I509-L584 HydrophobicContact CG2-CD1 4.17Å
510	S	90.9	Very high	83.1	Confident	39 Å²	39	60.1 Å²	60.1	27%	0.273	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	152.1	175.3	54	0	0	0	0	109.5	A489 Y492	A489-S510 WeakPolarHBondContact CB-O 3.26Å; A489-S510 PolarHBondContact N-O 2.82Å; Y492-S510 PolarHBondContact OH-N 3.37Å; Y492-S510 PolarHBondContact OH-O 3.49Å; Y492-S510 PolarHBondContact OH-OG 2.76Å
511	A	88.4	Confident	82.2	Confident	9 Å²	9	63 Å²	63	7%	0.074	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	163.3	176.6	0	0	0	0	0	111.4	E487 F523 F525 I570	E487-A511 CarbonylContact O-C 3.58Å; E487-A511 WeakPolarHBondContact O-CA 3.41Å; E487-A511 VanDerWaalsContact O-CB 3.3Å; E487-A511 WeakPolarHBondContact O-CB 3.42Å; A511-F523 HydrophobicContact CB-CB 4.34Å; A511-F523 HydrophobicContact CB-CD2 3.64Å; A511-F523 HydrophobicContact CB-CE2 4.07Å; A511-F523 HydrophobicContact CB-CG 3.94Å; A511-F523 WeakPolarHBondContact O-CE2 3.39Å; A511-F525 HydrophobicContact CB-CE1 3.98Å; A511-F525 HydrophobicContact CB-CZ 3.64Å; A511-I570 HydrophobicContact CB-CD1 4.24Å; A511-I570 HydrophobicContact CB-CG2 3.82Å
512	T	88.2	Confident	81.9	Confident	76 Å²	76	61 Å²	61	47%	0.466	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	140.4	171.8	41.6	0	0	0	0	108.5	E487 A489	E487-T512 PolarHBondContact N-O 3.03Å; E487-T512 PolarHBondContact O-N 3.36Å; A489-T512 WeakPolarHBondContact CA-OG1 3.45Å; A489-T512 HydrophobicContact CB-CG2 3.78Å
513	D	88.8	Confident	82	Confident	43 Å²	43	58.4 Å²	58.4	23%	0.23	33%	0.328	C	S	.	.			trans	-107.7	169.9	167.3	-132.3	-50.9	0	0	0	110.8	P486 F523	P486-D513 VanDerWaalsContact CA-OD2 3.29Å; P486-D513 WeakPolarHBondContact CA-OD2 3.3Å; P486-D513 VanDerWaalsContact CB-OD2 3.28Å; P486-D513 WeakPolarHBondContact CB-OD2 3.42Å; P486-D513 WeakPolarHBondContact CD-OD2 3.4Å; D513-F523 HydrophobicContact CB-CE1 3.96Å; D513-F523 HydrophobicContact CB-CZ 3.98Å
514	K	88.4	Confident	82.2	Confident	134 Å²	134	59 Å²	59	58%	0.583	32%	0.318	S	S	*	.	S	Bend	trans	-97.3	-33.5	169.7	-53.3	-172.8	-155.8	144.2	0	112.5	E449 N484	E449-K514 HydrophobicContact CG-CB 3.57Å; E449-K514 HydrophobicContact CG-CD 4.22Å; N484-K514 HydrophobicContact CB-CB 4.33Å; N484-K514 HydrophobicContact CB-CG 4.45Å; N484-K514 WeakPolarHBondContact OD1-CD 3.45Å; N484-K514 WeakPolarHBondContact OD1-CE 3.28Å; N484-K514 PolarHBondContact OD1-NZ 3.42Å
515	D	88.2	Confident	82.3	Confident	16 Å²	16	56.4 Å²	56.4	9%	0.086	31%	0.305	C	S	.	.	S	Bend	trans	-60.8	160.3	-177.6	-57.4	1.4	0	0	0	110.9	N482 D483 N484	N482-D515 WeakPolarHBondContact CA-OD2 3.36Å; D483-D515 PolarHBondContact N-OD2 2.8Å; N484-D515 VanDerWaalsContact CB-OD1 3.24Å; N484-D515 WeakPolarHBondContact CB-OD1 3.33Å; N484-D515 PolarHBondContact N-OD1 3.26Å; N484-D515 PolarHBondContact N-OD2 3.19Å; N484-D515 VanDerWaalsContact N-OD2 3.09Å; N484-D515 PolarHBondContact ND2-OD1 2.97Å
516	D	82.2	Confident	82.2	Confident	58 Å²	58	56.9 Å²	56.9	31%	0.31	30%	0.302	S	S	.	.			trans	-61.4	147.8	-176.2	-147.4	-34.2	0	0	0	112.2	R448 D480 A518 N519	R448-D516 IonicContact CZ-OD2 3.63Å; R448-D516 IonicContact NE-OD2 3.14Å; R448-D516 IonicContact NH2-OD1 3.83Å; R448-D516 IonicContact NH2-OD2 3.53Å; R448-D516 PolarHBondContact NH2-OD2 3.2Å; D480-D516 HydrophobicContact CB-CB 3.87Å; D480-D516 WeakPolarHBondContact OD1-CB 3.42Å; D480-D516 PolarHBondContact OD1-N 3.24Å; D480-D516 WeakPolarHBondContact OD2-CB 3.25Å; D480-D516 PolarHBondContact OD2-N 2.79Å; D516-A518 HydrophobicContact CB-CB 4.23Å; D516-A518 PolarHBondContact O-N 3.34Å; D516-N519 PolarHBondContact O-N 3.41Å
517	F	71.2	Confident	82.1	Confident	160 Å²	160	57.5 Å²	57.5	70%	0.702	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-16.7	172.1	-173.3	-96.3	0	0	0	112.5	P521	F517-P521 HydrophobicContact CD1-CB 4.37Å; F517-P521 HydrophobicContact CD2-CB 3.99Å; F517-P521 HydrophobicContact CE1-CB 3.94Å; F517-P521 HydrophobicContact CE2-CB 3.52Å; F517-P521 HydrophobicContact CG-CB 4.39Å; F517-P521 HydrophobicContact CZ-CB 3.5Å; F517-P521 VanDerWaalsContact CZ-CB 3.5Å
518	A	64.1	Low	81.8	Confident	84 Å²	84	56.6 Å²	56.6	69%	0.694	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-31.2	171.9	0	0	0	0	0	114.3	D516	D516-A518 HydrophobicContact CB-CB 4.23Å; D516-A518 PolarHBondContact O-N 3.34Å
519	N	57.3	Low	81.1	Confident	55 Å²	55	62.5 Å²	62.5	29%	0.294	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-21	-174.9	-89.6	-22	0	0	0	114.4	D480 N482 D516 G574	D480-N519 PolarHBondContact O-ND2 2.76Å; D480-N519 VanDerWaalsContact O-ND2 3.16Å; D480-N519 WeakPolarHBondContact OD2-CB 3.41Å; D480-N519 PolarHBondContact OD2-ND2 2.83Å; N482-N519 HydrophobicContact CB-CB 4.44Å; N482-N519 PolarHBondContact N-ND2 2.91Å; D516-N519 PolarHBondContact O-N 3.41Å; N519-G574 WeakPolarHBondContact O-CA 3.1Å
520	G	58.7	Low	80.4	Confident	12 Å²	12	70.9 Å²	70.9	12%	0.124	37%	0.365	C	S	.	.			trans	-163.4	67.8	-178.3	0	0	0	0	0	117.1	R522	G520-R522 PolarHBondContact O-N 2.98Å; G520-R522 VanDerWaalsContact O-N 3.08Å
521	P	65.5	Low	79.9	Confident	63 Å²	63	73.1 Å²	73.1	41%	0.409	37%	0.374	S	S	.	.	S	Bend	trans	-73.9	1.6	-177.5	32.9	-38.1	0	0	0	114.6	F517 N545	F517-P521 HydrophobicContact CD1-CB 4.37Å; F517-P521 HydrophobicContact CD2-CB 3.99Å; F517-P521 HydrophobicContact CE1-CB 3.94Å; F517-P521 HydrophobicContact CE2-CB 3.52Å; F517-P521 HydrophobicContact CG-CB 4.39Å; F517-P521 HydrophobicContact CZ-CB 3.5Å; F517-P521 VanDerWaalsContact CZ-CB 3.5Å; P521-N545 PolarHBondContact O-ND2 2.87Å; P521-N545 PolarHBondContact O-OD1 3.16Å
522	R	79.1	Confident	79.5	Confident	110 Å²	110	78.3 Å²	78.3	42%	0.415	41%	0.407	S	S	.	.			trans	-134.8	121.2	179.8	-148	-174.7	-146.4	-158.2	11.1	112.9	G520 E543 N545 D572 G573	G520-R522 PolarHBondContact O-N 2.98Å; G520-R522 VanDerWaalsContact O-N 3.08Å; R522-E543 IonicContact CZ-OE2 3.47Å; R522-E543 IonicContact NH1-OE2 3.64Å; R522-E543 PolarHBondContact NH1-OE2 2.97Å; R522-E543 PolarHBondContact NH2-O 2.89Å; R522-E543 IonicContact NH2-OE2 2.79Å; R522-E543 PolarHBondContact NH2-OE2 3.13Å; R522-N545 VanDerWaalsContact CA-OD1 3.27Å; R522-N545 WeakPolarHBondContact CA-OD1 3.35Å; R522-D572 CarbonylContact O-C 3.57Å; R522-G573 PolarHBondContact O-N 3.02Å
523	F	87.3	Confident	79.1	Confident	16 Å²	16	79.9 Å²	79.9	7%	0.07	42%	0.416	C	S	.	.			trans	-94.6	137.7	173.7	-51.5	-56.9	0	0	0	110.9	P486 A511 D513 F525 N545 I570 S571	P486-F523 HydrophobicContact CB-CD1 3.59Å; P486-F523 HydrophobicContact CB-CE1 3.63Å; P486-F523 HydrophobicContact CB-CG 4.43Å; P486-F523 HydrophobicContact CB-CZ 4.46Å; P486-F523 HydrophobicContact CG-CD1 4.03Å; P486-F523 HydrophobicContact CG-CE1 4.38Å; A511-F523 HydrophobicContact CB-CB 4.34Å; A511-F523 HydrophobicContact CB-CD2 3.64Å; A511-F523 HydrophobicContact CB-CE2 4.07Å; A511-F523 HydrophobicContact CB-CG 3.94Å; A511-F523 WeakPolarHBondContact O-CE2 3.39Å; D513-F523 HydrophobicContact CB-CE1 3.96Å; D513-F523 HydrophobicContact CB-CZ 3.98Å; F523-F525 HydrophobicContact CB-CE2 3.85Å; F523-F525 HydrophobicContact CB-CZ 4.19Å; F523-N545 HydrophobicContact CD2-CB 3.9Å; F523-N545 HydrophobicContact CE2-CB 4.44Å; F523-N545 PolarHBondContact N-OD1 2.85Å; F523-N545 VanDerWaalsContact N-OD1 3.12Å; F523-I570 HydrophobicContact CB-CG2 4.18Å; F523-S571 CarbonylContact C-O 3.47Å; F523-S571 VanDerWaalsContact CA-O 3.3Å; F523-S571 WeakPolarHBondContact CA-O 3.47Å
524	N	88.1	Confident	78.8	Confident	70 Å²	70	79.4 Å²	79.4	37%	0.374	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.2	176.4	-57.7	-78	0	0	0	109.7	S571 D572	N524-S571 PolarHBondContact N-O 2.75Å; N524-S571 PolarHBondContact O-N 3.22Å; N524-D572 PolarHBondContact ND2-O 2.91Å
525	F	89.6	Confident	78.7	Confident	13 Å²	13	77.3 Å²	77.3	6%	0.057	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	117.9	-177	-64.2	-97	0	0	0	112.4	I509 A511 F523 L539 D541 A547 I570	I509-F525 HydrophobicContact CD1-CD1 3.93Å; I509-F525 HydrophobicContact CD1-CE1 4.12Å; I509-F525 HydrophobicContact CG1-CE1 4.42Å; A511-F525 HydrophobicContact CB-CE1 3.98Å; A511-F525 HydrophobicContact CB-CZ 3.64Å; F523-F525 HydrophobicContact CB-CE2 3.85Å; F523-F525 HydrophobicContact CB-CZ 4.19Å; F525-L539 HydrophobicContact CB-CD1 4.39Å; F525-D541 PolarHBondContact N-OD2 3.44Å; F525-D541 VanDerWaalsContact N-OD2 3.15Å; F525-A547 HydrophobicContact CB-CB 3.48Å; F525-A547 VanDerWaalsContact CB-CB 3.48Å; F525-A547 HydrophobicContact CD1-CB 3.88Å; F525-A547 HydrophobicContact CD2-CB 3.77Å; F525-A547 HydrophobicContact CE2-CB 4.43Å; F525-A547 HydrophobicContact CG-CB 3.45Å; F525-A547 VanDerWaalsContact CG-CB 3.45Å; F525-I570 HydrophobicContact CD1-CD1 4.38Å; F525-I570 HydrophobicContact CD1-CG1 3.94Å; F525-I570 HydrophobicContact CD1-CG2 4.25Å; F525-I570 HydrophobicContact CE1-CD1 3.99Å; F525-I570 HydrophobicContact CE1-CG1 4.01Å; F525-I570 HydrophobicContact CE1-CG2 3.99Å; F525-I570 HydrophobicContact CZ-CG2 4.36Å
526	F	88.4	Confident	78.7	Confident	81 Å²	81	77.7 Å²	77.7	36%	0.355	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	167.9	-178.1	59.1	-76.6	0	0	0	113.2	L539 M569	F526-L539 WeakPolarHBondContact O-CD1 3.42Å; F526-M569 HydrophobicContact CD1-CB 3.98Å; F526-M569 HydrophobicContact CD2-CB 3.64Å; F526-M569 HydrophobicContact CD2-CG 4.1Å; F526-M569 HydrophobicContact CE1-CB 3.73Å; F526-M569 HydrophobicContact CE2-CB 3.36Å; F526-M569 HydrophobicContact CE2-CG 3.73Å; F526-M569 HydrophobicContact CG-CB 3.94Å; F526-M569 HydrophobicContact CZ-CB 3.41Å; F526-M569 VanDerWaalsContact CZ-CB 3.41Å; F526-M569 HydrophobicContact CZ-CG 4.16Å; F526-M569 PolarHBondContact N-O 3.31Å; F526-M569 PolarHBondContact O-N 3.25Å
527	L	87.6	Confident	79.1	Confident	43 Å²	43	75 Å²	75	23%	0.225	40%	0.401	C	S	.	.			trans	-100.2	140.9	168.8	-62	179.5	0	0	0	107.4	E529 N534 L539 L566 P567 I568	L527-E529 PolarHBondContact O-N 2.86Å; L527-E529 VanDerWaalsContact O-N 3.12Å; L527-N534 HydrophobicContact CD1-CB 4.24Å; L527-L539 HydrophobicContact CD2-CD1 3.74Å; L527-L539 HydrophobicContact CD2-CG 3.89Å; L527-L539 HydrophobicContact CG-CD1 4.06Å; L527-L539 HydrophobicContact CG-CG 4.13Å; L527-L566 HydrophobicContact CD1-CD1 4.44Å; L527-L566 HydrophobicContact CD2-CD1 3.71Å; L527-L566 HydrophobicContact CD2-CG 4.13Å; L527-P567 WeakPolarHBondContact CD2-O 3.32Å; L527-I568 HydrophobicContact CD2-CG2 4.03Å
528	D	81.9	Confident	80	Confident	50 Å²	50	69.9 Å²	69.9	27%	0.267	38%	0.383	S	S	.	.			trans	-52.3	116.1	179	177.9	4.3	0	0	0	111.5	H530 L531 M569	D528-H530 PolarHBondContact O-N 3.14Å; D528-H530 VanDerWaalsContact OD1-CB 3.3Å; D528-H530 WeakPolarHBondContact OD1-CB 3.3Å; D528-H530 IonicContact OD1-CD2 2.76Å; D528-H530 IonicContact OD1-CG 2.98Å; D528-H530 PolarHBondContact OD1-N 3.07Å; D528-L531 HydrophobicContact CB-CD1 4.06Å; D528-L531 HydrophobicContact CB-CG 4.11Å; D528-L531 PolarHBondContact O-N 2.67Å; D528-L531 VanDerWaalsContact O-N 3.15Å; D528-L531 WeakPolarHBondContact OD2-CG 3.3Å; D528-M569 HydrophobicContact CB-CG 4.24Å
529	E	77.2	Confident	81.2	Confident	180 Å²	180	66.9 Å²	66.9	84%	0.841	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-17	-178.8	-60.3	-161	147	0	0	113.2	L527 L531	L527-E529 PolarHBondContact O-N 2.86Å; L527-E529 VanDerWaalsContact O-N 3.12Å; E529-L531 VanDerWaalsContact C-N 3.28Å
530	H	78.1	Confident	82.7	Confident	177 Å²	177	69.5 Å²	69.5	82%	0.819	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.3	173.7	-56.6	-39.1	0	0	0	112.5	D528	D528-H530 PolarHBondContact O-N 3.14Å; D528-H530 VanDerWaalsContact OD1-CB 3.3Å; D528-H530 WeakPolarHBondContact OD1-CB 3.3Å; D528-H530 IonicContact OD1-CD2 2.76Å; D528-H530 IonicContact OD1-CG 2.98Å; D528-H530 PolarHBondContact OD1-N 3.07Å
531	L	79.3	Confident	84	Confident	86 Å²	86	71 Å²	71	45%	0.45	37%	0.369	S	S	.	.	S	Bend	trans	-91.3	147.3	174.3	-64.8	179.5	0	0	0	112.3	D528 E529 V533 P567	D528-L531 HydrophobicContact CB-CD1 4.06Å; D528-L531 HydrophobicContact CB-CG 4.11Å; D528-L531 PolarHBondContact O-N 2.67Å; D528-L531 VanDerWaalsContact O-N 3.15Å; D528-L531 WeakPolarHBondContact OD2-CG 3.3Å; E529-L531 VanDerWaalsContact C-N 3.28Å; L531-V533 PolarHBondContact O-N 2.85Å; L531-P567 HydrophobicContact CD1-CG 3.67Å
532	P	80.2	Confident	85	Confident	118 Å²	118	69.6 Å²	69.6	77%	0.766	36%	0.358	S	S	*	.			trans	-57.7	126.4	173	-24.3	34.2	0	0	0	111.9	N534	P532-N534 PolarHBondContact O-N 3.38Å; P532-N534 VanDerWaalsContact O-N 3.08Å
533	V	79.6	Confident	85	Confident	109 Å²	109	70.5 Å²	70.5	66%	0.661	37%	0.367	S	S	*	.			trans	-39.2	113.2	-177.5	178.6	0	0	0	0	112.1	L531 P535	L531-V533 PolarHBondContact O-N 2.85Å; V533-P535 WeakPolarHBondContact O-CD 3.23Å
534	N	83.6	Confident	84.8	Confident	33 Å²	33	74.5 Å²	74.5	18%	0.176	39%	0.389	C	S	.	.			trans	-57.5	120.5	-169.4	-166.3	-51.7	0	0	0	111.3	L527 P532 N536 F537 R552 L566	L527-N534 HydrophobicContact CD1-CB 4.24Å; P532-N534 PolarHBondContact O-N 3.38Å; P532-N534 VanDerWaalsContact O-N 3.08Å; N534-N536 VanDerWaalsContact C-N 3.29Å; N534-N536 PolarHBondContact O-N 3.49Å; N534-N536 WeakPolarHBondContact OD1-CA 3.37Å; N534-N536 WeakPolarHBondContact OD1-CB 3.44Å; N534-N536 PolarHBondContact OD1-N 2.91Å; N534-F537 PolarHBondContact OD1-N 2.78Å; N534-F537 VanDerWaalsContact OD1-N 3.15Å; N534-R552 WeakPolarHBondContact O-CD 3.34Å; N534-L566 VanDerWaalsContact ND2-CD1 3.33Å; N534-L566 WeakPolarHBondContact ND2-CD1 3.43Å
535	P	84.8	Confident	84.6	Confident	90 Å²	90	73.1 Å²	73.1	58%	0.584	38%	0.382	S	S	*	.	S	Bend	trans	-80.6	-12.6	-176.8	32.1	-35.5	0	0	0	112.8	V533	V533-P535 WeakPolarHBondContact O-CD 3.23Å
536	N	88.4	Confident	84.6	Confident	23 Å²	23	73.9 Å²	73.9	12%	0.123	39%	0.387	C	S	.	.	S	Bend	trans	-96.2	-44.9	-172.8	-57.4	-62.1	0	0	0	112.2	N534 R552 R553 F556 Y564	N534-N536 VanDerWaalsContact C-N 3.29Å; N534-N536 PolarHBondContact O-N 3.49Å; N534-N536 WeakPolarHBondContact OD1-CA 3.37Å; N534-N536 WeakPolarHBondContact OD1-CB 3.44Å; N534-N536 PolarHBondContact OD1-N 2.91Å; N536-R552 PolarHBondContact O-N 2.93Å; N536-R553 PolarHBondContact O-N 2.94Å; N536-R553 WeakPolarHBondContact OD1-CD 3.45Å; N536-R553 PolarHBondContact OD1-NH1 3.36Å; N536-F556 HydrophobicContact CB-CE1 4.31Å; N536-Y564 HydrophobicContact CB-CD1 4Å; N536-Y564 HydrophobicContact CB-CE1 4.03Å; N536-Y564 WeakPolarHBondContact OD1-CE1 3.41Å
537	F	90.5	Very high	84.7	Confident	2 Å²	2	70 Å²	70	1%	0.009	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	166.4	-174.8	-53.3	-77.6	0	0	0	112.2	V496 I506 N534 I549 L550 T551 F556 Y564 L566 I586	V496-F537 HydrophobicContact CB-CE1 4.32Å; V496-F537 HydrophobicContact CG1-CE1 4.46Å; V496-F537 HydrophobicContact CG1-CZ 4.26Å; V496-F537 HydrophobicContact CG2-CE1 4.27Å; I506-F537 HydrophobicContact CD1-CD1 3.95Å; I506-F537 HydrophobicContact CD1-CE1 3.72Å; N534-F537 PolarHBondContact OD1-N 2.78Å; N534-F537 VanDerWaalsContact OD1-N 3.15Å; F537-I549 HydrophobicContact CB-CG2 4.44Å; F537-I549 HydrophobicContact CD1-CG2 4.46Å; F537-L550 CarbonylContact C-O 3.49Å; F537-L550 VanDerWaalsContact CA-O 3.22Å; F537-L550 WeakPolarHBondContact CA-O 3.32Å; F537-T551 HydrophobicContact CE1-CG2 4.39Å; F537-F556 HydrophobicContact CD1-CZ 4.26Å; F537-F556 AromaticContact CE1-CE1 3.71Å; F537-F556 HydrophobicContact CE1-CE1 3.71Å; F537-F556 AromaticContact CE1-CZ 3.58Å; F537-F556 HydrophobicContact CE1-CZ 3.58Å; F537-F556 HydrophobicContact CE2-CE1 4.15Å; F537-F556 HydrophobicContact CZ-CD1 4.34Å; F537-F556 AromaticContact CZ-CE1 3.41Å; F537-F556 HydrophobicContact CZ-CE1 3.41Å; F537-F556 VanDerWaalsContact CZ-CE1 3.41Å; F537-F556 AromaticContact CZ-CZ 3.81Å; F537-F556 HydrophobicContact CZ-CZ 3.81Å; F537-Y564 AromaticContact CE2-CD1 3.95Å; F537-Y564 HydrophobicContact CE2-CD1 3.95Å; F537-Y564 HydrophobicContact CE2-CD2 4.49Å; F537-Y564 AromaticContact CE2-CG 3.79Å; F537-Y564 HydrophobicContact CE2-CG 3.79Å; F537-Y564 HydrophobicContact CZ-CG 4.26Å; F537-L566 HydrophobicContact CB-CD1 4.3Å; F537-L566 HydrophobicContact CB-CD2 4.15Å; F537-I586 HydrophobicContact CD1-CD1 4.22Å; F537-I586 HydrophobicContact CD2-CD1 3.87Å; F537-I586 HydrophobicContact CE1-CD1 4.16Å; F537-I586 HydrophobicContact CE1-CG2 3.99Å; F537-I586 HydrophobicContact CE2-CB 4.44Å; F537-I586 HydrophobicContact CE2-CD1 3.8Å; F537-I586 HydrophobicContact CE2-CG2 4.27Å; F537-I586 HydrophobicContact CG-CD1 4.09Å; F537-I586 HydrophobicContact CZ-CB 4.22Å; F537-I586 HydrophobicContact CZ-CD1 3.96Å; F537-I586 HydrophobicContact CZ-CG2 3.57Å
538	T	89.9	Confident	84.9	Confident	52 Å²	52	68.5 Å²	68.5	32%	0.319	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	151.3	166.7	-170.5	0	0	0	0	108.4	L550	T538-L550 HydrophobicContact CG2-CB 3.92Å; T538-L550 PolarHBondContact N-O 2.88Å; T538-L550 PolarHBondContact O-N 3.4Å
539	L	90.6	Very high	85.4	Confident	22 Å²	22	66.1 Å²	66.1	12%	0.115	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	159.9	164.1	-66.9	174.2	0	0	0	110	F525 F526 L527 I549 I568	F525-L539 HydrophobicContact CB-CD1 4.39Å; F526-L539 WeakPolarHBondContact O-CD1 3.42Å; L527-L539 HydrophobicContact CD2-CD1 3.74Å; L527-L539 HydrophobicContact CD2-CG 3.89Å; L527-L539 HydrophobicContact CG-CD1 4.06Å; L527-L539 HydrophobicContact CG-CG 4.13Å; L539-I549 HydrophobicContact CD2-CG1 3.86Å; L539-I568 HydrophobicContact CD1-CB 4.29Å; L539-I568 HydrophobicContact CD1-CG2 3.93Å; L539-I568 HydrophobicContact CD2-CG2 4.31Å; L539-I568 HydrophobicContact CG-CG2 4.49Å
540	K	89	Confident	86.1	Confident	109 Å²	109	58.8 Å²	58.8	47%	0.474	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	117.3	158.9	177.1	-108.9	168	-157.5	0	106.6	N542 S548 L550	K540-N542 WeakPolarHBondContact CD-OD1 3.33Å; K540-N542 PolarHBondContact NZ-OD1 3.43Å; K540-S548 PolarHBondContact N-O 3.38Å; K540-S548 PolarHBondContact O-N 3.4Å; K540-L550 HydrophobicContact CB-CD1 3.44Å; K540-L550 VanDerWaalsContact CB-CD1 3.44Å
541	D	85.4	Confident	86.7	Confident	43 Å²	43	50.5 Å²	50.5	23%	0.23	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	139.5	170.7	-154.9	-61.3	0	0	0	109.6	F525 E543	F525-D541 PolarHBondContact N-OD2 3.44Å; F525-D541 VanDerWaalsContact N-OD2 3.15Å; D541-E543 WeakPolarHBondContact OD1-CA 3.24Å; D541-E543 PolarHBondContact OD1-N 3.32Å
542	N	86.6	Confident	87.1	Confident	34 Å²	34	52.6 Å²	52.6	18%	0.182	28%	0.281	C	S	.	.			trans	-99	0.3	177.5	-66.8	-37.4	0	0	0	113.3	K540 D544 T546 S548	K540-N542 WeakPolarHBondContact CD-OD1 3.33Å; K540-N542 PolarHBondContact NZ-OD1 3.43Å; N542-D544 WeakPolarHBondContact CB-OD1 3.36Å; N542-D544 PolarHBondContact O-N 3.49Å; N542-T546 WeakPolarHBondContact CB-O 3.5Å; N542-T546 WeakPolarHBondContact CB-OG1 3.46Å; N542-T546 PolarHBondContact N-O 2.87Å; N542-T546 PolarHBondContact ND2-OG1 3.38Å; N542-S548 PolarHBondContact ND2-N 3.07Å; N542-S548 PolarHBondContact ND2-OG 2.78Å; N542-S548 PolarHBondContact OD1-OG 3.34Å
543	E	79.6	Confident	87.3	Confident	130 Å²	130	50.6 Å²	50.6	61%	0.607	26%	0.258	S	S	*	.	S	Bend	trans	66.8	9.7	177.4	-75.8	-155.6	-108.2	0	0	114.9	R522 D541	R522-E543 IonicContact CZ-OE2 3.47Å; R522-E543 IonicContact NH1-OE2 3.64Å; R522-E543 PolarHBondContact NH1-OE2 2.97Å; R522-E543 PolarHBondContact NH2-O 2.89Å; R522-E543 IonicContact NH2-OE2 2.79Å; R522-E543 PolarHBondContact NH2-OE2 3.13Å; D541-E543 WeakPolarHBondContact OD1-CA 3.24Å; D541-E543 PolarHBondContact OD1-N 3.32Å
544	D	82.8	Confident	87.2	Confident	99 Å²	99	55.7 Å²	55.7	53%	0.529	27%	0.265	S	S	.	.	S	Bend	trans	-126.4	26.3	-173.1	67.2	-1.2	0	0	0	113.5	N542 T546	N542-D544 WeakPolarHBondContact CB-OD1 3.36Å; N542-D544 PolarHBondContact O-N 3.49Å; D544-T546 PolarHBondContact O-N 3.15Å; D544-T546 WeakPolarHBondContact OD1-CA 3.37Å; D544-T546 VanDerWaalsContact OD1-CB 3.27Å; D544-T546 WeakPolarHBondContact OD1-CB 3.44Å; D544-T546 WeakPolarHBondContact OD1-CG2 3.36Å; D544-T546 PolarHBondContact OD1-N 2.87Å; D544-T546 PolarHBondContact OD1-OG1 2.85Å
545	N	83.3	Confident	87.1	Confident	42 Å²	42	63.9 Å²	63.9	23%	0.225	29%	0.294	C	S	.	.	S	Bend	trans	63.2	16.4	-170.8	-65.7	-10.1	0	0	0	115	P521 R522 F523	P521-N545 PolarHBondContact O-ND2 2.87Å; P521-N545 PolarHBondContact O-OD1 3.16Å; R522-N545 VanDerWaalsContact CA-OD1 3.27Å; R522-N545 WeakPolarHBondContact CA-OD1 3.35Å; F523-N545 HydrophobicContact CD2-CB 3.9Å; F523-N545 HydrophobicContact CE2-CB 4.44Å; F523-N545 PolarHBondContact N-OD1 2.85Å; F523-N545 VanDerWaalsContact N-OD1 3.12Å
546	T	88.8	Confident	87.1	Confident	29 Å²	29	59.9 Å²	59.9	18%	0.178	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	155.6	167.7	83.1	0	0	0	0	111.9	T508 I509 N542 D544	T508-T546 HydrophobicContact CG2-CG2 4.26Å; T508-T546 WeakPolarHBondContact CG2-OG1 3.37Å; I509-T546 CarbonylContact O-C 3.58Å; I509-T546 WeakPolarHBondContact O-CA 3.45Å; I509-T546 VanDerWaalsContact O-CB 3.23Å; I509-T546 WeakPolarHBondContact O-CB 3.17Å; N542-T546 WeakPolarHBondContact CB-O 3.5Å; N542-T546 WeakPolarHBondContact CB-OG1 3.46Å; N542-T546 PolarHBondContact N-O 2.87Å; N542-T546 PolarHBondContact ND2-OG1 3.38Å; D544-T546 PolarHBondContact O-N 3.15Å; D544-T546 WeakPolarHBondContact OD1-CA 3.37Å; D544-T546 VanDerWaalsContact OD1-CB 3.27Å; D544-T546 WeakPolarHBondContact OD1-CB 3.44Å; D544-T546 WeakPolarHBondContact OD1-CG2 3.36Å; D544-T546 PolarHBondContact OD1-N 2.87Å; D544-T546 PolarHBondContact OD1-OG1 2.85Å
547	A	91.3	Very high	86.8	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.6	169.1	0	0	0	0	0	111	T508 I509 F525	T508-A547 CarbonylContact C-O 3.47Å; T508-A547 WeakPolarHBondContact CA-O 3.41Å; I509-A547 HydrophobicContact CD1-CB 4.29Å; I509-A547 HydrophobicContact CG1-CB 4Å; I509-A547 VanDerWaalsContact CG1-O 3.3Å; I509-A547 WeakPolarHBondContact CG1-O 3.4Å; I509-A547 PolarHBondContact N-O 2.87Å; I509-A547 PolarHBondContact O-N 3.02Å; F525-A547 HydrophobicContact CB-CB 3.48Å; F525-A547 VanDerWaalsContact CB-CB 3.48Å; F525-A547 HydrophobicContact CD1-CB 3.88Å; F525-A547 HydrophobicContact CD2-CB 3.77Å; F525-A547 HydrophobicContact CE2-CB 4.43Å; F525-A547 HydrophobicContact CG-CB 3.45Å; F525-A547 VanDerWaalsContact CG-CB 3.45Å
548	S	92.4	Very high	86.2	Confident	10 Å²	10	64.3 Å²	64.3	7%	0.07	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.8	172	-75.9	0	0	0	0	110.3	T508 K540 N542 L550	T508-S548 PolarHBondContact OG1-OG 3.01Å; T508-S548 VanDerWaalsContact OG1-OG 3.05Å; K540-S548 PolarHBondContact N-O 3.38Å; K540-S548 PolarHBondContact O-N 3.4Å; N542-S548 PolarHBondContact ND2-N 3.07Å; N542-S548 PolarHBondContact ND2-OG 2.78Å; N542-S548 PolarHBondContact OD1-OG 3.34Å; S548-L550 VanDerWaalsContact O-CD1 3.26Å; S548-L550 WeakPolarHBondContact O-CD1 3.5Å
549	I	92.3	Very high	85.6	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	125.1	173	-51.7	169.7	0	0	0	107.7	I494 V505 I506 H507 I509 F537 L539 L566 L584 I586	I494-I549 HydrophobicContact CD1-CD1 3.55Å; I494-I549 HydrophobicContact CG1-CD1 4.45Å; V505-I549 CarbonylContact C-O 3.59Å; V505-I549 WeakPolarHBondContact CA-O 3.2Å; I506-I549 HydrophobicContact CD1-CG2 3.94Å; I506-I549 HydrophobicContact CG1-CB 4Å; I506-I549 HydrophobicContact CG1-CG2 3.94Å; I506-I549 WeakPolarHBondContact CG1-O 3.49Å; I506-I549 PolarHBondContact N-O 2.82Å; H507-I549 HydrophobicContact CB-CD1 4.48Å; H507-I549 PolarHBondContact O-N 3.01Å; I509-I549 HydrophobicContact CG2-CD1 4.03Å; F537-I549 HydrophobicContact CB-CG2 4.44Å; F537-I549 HydrophobicContact CD1-CG2 4.46Å; L539-I549 HydrophobicContact CD2-CG1 3.86Å; I549-L566 HydrophobicContact CG2-CD2 3.91Å; I549-L584 HydrophobicContact CD1-CD1 3.55Å; I549-I586 HydrophobicContact CG2-CD1 4.4Å
550	L	91	Very high	85.2	Confident	27 Å²	27	72 Å²	72	14%	0.141	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145.9	-179	-57.5	93.5	0	0	0	112.2	Q504 V505 F537 T538 K540 S548	Q504-L550 WeakPolarHBondContact O-CA 3.45Å; V505-L550 HydrophobicContact CG2-CD2 3.93Å; V505-L550 HydrophobicContact CG2-CG 3.96Å; F537-L550 CarbonylContact C-O 3.49Å; F537-L550 VanDerWaalsContact CA-O 3.22Å; F537-L550 WeakPolarHBondContact CA-O 3.32Å; T538-L550 HydrophobicContact CG2-CB 3.92Å; T538-L550 PolarHBondContact N-O 2.88Å; T538-L550 PolarHBondContact O-N 3.4Å; K540-L550 HydrophobicContact CB-CD1 3.44Å; K540-L550 VanDerWaalsContact CB-CD1 3.44Å; S548-L550 VanDerWaalsContact O-CD1 3.26Å; S548-L550 WeakPolarHBondContact O-CD1 3.5Å
551	T	90.5	Very high	84.9	Confident	2 Å²	2	70.4 Å²	70.4	1%	0.012	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	131.4	171	45.7	0	0	0	0	112.2	V496 K501 P502 G503 Q504 I506 F537 F556	V496-T551 HydrophobicContact CG2-CG2 3.77Å; K501-T551 PolarHBondContact O-OG1 2.98Å; P502-T551 CarbonylContact C-O 3.59Å; P502-T551 WeakPolarHBondContact CA-O 3.29Å; G503-T551 PolarHBondContact N-O 2.78Å; Q504-T551 PolarHBondContact N-OG1 2.78Å; Q504-T551 VanDerWaalsContact N-OG1 3.16Å; Q504-T551 PolarHBondContact O-N 3.38Å; Q504-T551 PolarHBondContact O-OG1 3.12Å; I506-T551 HydrophobicContact CG2-CG2 3.75Å; F537-T551 HydrophobicContact CE1-CG2 4.39Å; T551-F556 HydrophobicContact CG2-CD2 4.49Å; T551-F556 HydrophobicContact CG2-CE2 3.5Å; T551-F556 VanDerWaalsContact CG2-CE2 3.5Å; T551-F556 HydrophobicContact CG2-CZ 3.9Å
552	R	87.6	Confident	84.8	Confident	131 Å²	131	72.1 Å²	72.1	49%	0.494	34%	0.339	S	S	.	.			trans	-103.8	-32.2	170.7	-164.2	179.5	-171.8	141.8	-0.4	112	N534 N536	N534-R552 WeakPolarHBondContact O-CD 3.34Å; N536-R552 PolarHBondContact O-N 2.93Å
553	R	85.6	Confident	84.8	Confident	75 Å²	75	71.9 Å²	71.9	28%	0.283	34%	0.339	S	S	.	.	S	Bend	trans	-70.1	146.2	179.2	-160.3	176.8	176.7	137.5	-10.3	112.1	N536 R555 F556 Y564	N536-R553 PolarHBondContact O-N 2.94Å; N536-R553 WeakPolarHBondContact OD1-CD 3.45Å; N536-R553 PolarHBondContact OD1-NH1 3.36Å; R553-R555 WeakPolarHBondContact CD-O 3.32Å; R553-R555 WeakPolarHBondContact CG-O 3.34Å; R553-R555 PolarHBondContact NE-O 2.9Å; R553-F556 HydrophobicContact CB-CE1 4.12Å; R553-F556 HydrophobicContact CB-CE2 3.91Å; R553-F556 HydrophobicContact CB-CZ 3.65Å; R553-Y564 PolarHBondContact NH1-OH 2.87Å; R553-Y564 VanDerWaalsContact NH1-OH 3.1Å
554	R	78.3	Confident	85.2	Confident	217 Å²	217	65.9 Å²	65.9	82%	0.819	31%	0.311	S	S	*	.	S	Bend	trans	-78.5	-22.2	179.9	-71.3	-176.6	176.1	-177.2	-0.9	115.4	P502	P502-R554 HydrophobicContact CG-CB 4.42Å; P502-R554 HydrophobicContact CG-CG 3.89Å
555	R	80.8	Confident	85.5	Confident	205 Å²	205	68.3 Å²	68.3	77%	0.774	31%	0.313	S	S	*	.			trans	-155.4	136	174	-68.2	-167.9	-178.8	-171.1	0.3	109.6	R553	R553-R555 WeakPolarHBondContact CD-O 3.32Å; R553-R555 WeakPolarHBondContact CG-O 3.34Å; R553-R555 PolarHBondContact NE-O 2.9Å
556	F	85.2	Confident	85.8	Confident	5 Å²	5	66.3 Å²	66.3	2%	0.022	30%	0.303	C	S	.	.			trans	-97.8	153.7	164.2	-63.1	-93.7	0	0	0	108.5	V496 N536 F537 T551 R553 Y564 V588	V496-F556 HydrophobicContact CG1-CD1 4.04Å; V496-F556 HydrophobicContact CG1-CE1 4.41Å; V496-F556 HydrophobicContact CG1-CG 4.17Å; V496-F556 HydrophobicContact CG2-CD1 4.35Å; V496-F556 HydrophobicContact CG2-CD2 3.64Å; V496-F556 HydrophobicContact CG2-CE1 4.4Å; V496-F556 HydrophobicContact CG2-CE2 3.71Å; V496-F556 HydrophobicContact CG2-CG 3.98Å; V496-F556 HydrophobicContact CG2-CZ 4.09Å; N536-F556 HydrophobicContact CB-CE1 4.31Å; F537-F556 HydrophobicContact CD1-CZ 4.26Å; F537-F556 AromaticContact CE1-CE1 3.71Å; F537-F556 HydrophobicContact CE1-CE1 3.71Å; F537-F556 AromaticContact CE1-CZ 3.58Å; F537-F556 HydrophobicContact CE1-CZ 3.58Å; F537-F556 HydrophobicContact CE2-CE1 4.15Å; F537-F556 HydrophobicContact CZ-CD1 4.34Å; F537-F556 AromaticContact CZ-CE1 3.41Å; F537-F556 HydrophobicContact CZ-CE1 3.41Å; F537-F556 VanDerWaalsContact CZ-CE1 3.41Å; F537-F556 AromaticContact CZ-CZ 3.81Å; F537-F556 HydrophobicContact CZ-CZ 3.81Å; T551-F556 HydrophobicContact CG2-CD2 4.49Å; T551-F556 HydrophobicContact CG2-CE2 3.5Å; T551-F556 VanDerWaalsContact CG2-CE2 3.5Å; T551-F556 HydrophobicContact CG2-CZ 3.9Å; R553-F556 HydrophobicContact CB-CE1 4.12Å; R553-F556 HydrophobicContact CB-CE2 3.91Å; R553-F556 HydrophobicContact CB-CZ 3.65Å; F556-Y564 HydrophobicContact CD1-CE2 4.05Å; F556-V588 HydrophobicContact CB-CG1 3.87Å; F556-V588 HydrophobicContact CB-CG2 4.21Å; F556-V588 HydrophobicContact CD1-CG2 4.39Å
557	S	81.4	Confident	85.8	Confident	38 Å²	38	66.7 Å²	66.7	27%	0.266	31%	0.305	S	S	.	.			trans	-151.7	115.6	178.7	-172.9	0	0	0	0	109.5	E498 T559 V560 Q561	E498-S557 WeakPolarHBondContact OE1-CA 3.49Å; S557-T559 PolarHBondContact O-N 2.93Å; S557-T559 PolarHBondContact OG-OG1 2.77Å; S557-V560 PolarHBondContact O-N 2.8Å; S557-Q561 PolarHBondContact O-N 2.95Å; S557-Q561 VanDerWaalsContact O-N 3.1Å
558	R	78.4	Confident	85.7	Confident	80 Å²	80	66.7 Å²	66.7	30%	0.302	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-24.4	-173.1	-174.9	-179.1	160.2	-177.6	-12.2	112.5	E498 V560 D562 V588 H601 A602	E498-R558 PolarHBondContact OE1-N 2.89Å; R558-V560 VanDerWaalsContact C-N 3.32Å; R558-D562 HydrophobicContact CG-CB 3.82Å; R558-V588 HydrophobicContact CB-CB 4.25Å; R558-V588 HydrophobicContact CB-CG1 4.04Å; R558-V588 WeakPolarHBondContact CD-O 3.26Å; R558-H601 VanDerWaalsContact CZ-O 3.27Å; R558-H601 PolarHBondContact NH1-O 3.38Å; R558-H601 PolarHBondContact NH2-O 2.7Å; R558-A602 VanDerWaalsContact NH2-CA 3.32Å
559	T	76.4	Confident	85.6	Confident	133 Å²	133	67.6 Å²	67.6	82%	0.816	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-10.9	174.9	53.6	0	0	0	0	114.3	S557	S557-T559 PolarHBondContact O-N 2.93Å; S557-T559 PolarHBondContact OG-OG1 2.77Å
560	V	82.3	Confident	85.5	Confident	104 Å²	104	67.6 Å²	67.6	63%	0.63	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-42.3	177.5	179.8	0	0	0	0	110.8	S557 R558	S557-V560 PolarHBondContact O-N 2.8Å; R558-V560 VanDerWaalsContact C-N 3.32Å
561	Q	83.4	Confident	85.4	Confident	74 Å²	74	67.1 Å²	67.1	35%	0.346	31%	0.308	S	S	.	.			trans	-160	119.9	172.6	178.9	173.6	4.3	0	0	107.9	S557 V563 Y564 V588	S557-Q561 PolarHBondContact O-N 2.95Å; S557-Q561 VanDerWaalsContact O-N 3.1Å; Q561-V563 VanDerWaalsContact CG-O 3.25Å; Q561-V563 WeakPolarHBondContact CG-O 3.25Å; Q561-V563 PolarHBondContact NE2-O 2.95Å; Q561-Y564 HydrophobicContact CB-CE2 4.01Å; Q561-Y564 VanDerWaalsContact CD-CZ 3.48Å; Q561-Y564 HydrophobicContact CG-CD2 4.11Å; Q561-Y564 HydrophobicContact CG-CE1 4.14Å; Q561-Y564 HydrophobicContact CG-CE2 3.66Å; Q561-Y564 HydrophobicContact CG-CG 4.49Å; Q561-Y564 WeakPolarHBondContact O-CE2 3.35Å; Q561-V588 WeakPolarHBondContact O-CG2 3.22Å
562	D	82.6	Confident	85.3	Confident	80 Å²	80	67.1 Å²	67.1	43%	0.428	31%	0.308	S	S	.	.	S	Bend	trans	-94.1	-31.1	-176.5	65.8	-32	0	0	0	113.1	R558 R587 V588	R558-D562 HydrophobicContact CG-CB 3.82Å; D562-R587 CarbonylContact O-C 3.25Å; D562-R587 WeakPolarHBondContact O-CA 3.26Å; D562-V588 PolarHBondContact O-N 2.59Å
563	V	87.6	Confident	85	Confident	28 Å²	28	63.1 Å²	63.1	17%	0.17	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.3	174.9	-173.9	0	0	0	0	111.1	Q561 Y565	Q561-V563 VanDerWaalsContact CG-O 3.25Å; Q561-V563 WeakPolarHBondContact CG-O 3.25Å; Q561-V563 PolarHBondContact NE2-O 2.95Å; V563-Y565 HydrophobicContact CG1-CE1 4.18Å; V563-Y565 HydrophobicContact CG1-CE2 4.06Å
564	Y	88.4	Confident	84.8	Confident	5 Å²	5	60 Å²	60	2%	0.02	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.6	169.1	-65.5	-105.5	0	0	0	109.1	N536 F537 R553 F556 Q561 I586 V588	N536-Y564 HydrophobicContact CB-CD1 4Å; N536-Y564 HydrophobicContact CB-CE1 4.03Å; N536-Y564 WeakPolarHBondContact OD1-CE1 3.41Å; F537-Y564 AromaticContact CE2-CD1 3.95Å; F537-Y564 HydrophobicContact CE2-CD1 3.95Å; F537-Y564 HydrophobicContact CE2-CD2 4.49Å; F537-Y564 AromaticContact CE2-CG 3.79Å; F537-Y564 HydrophobicContact CE2-CG 3.79Å; F537-Y564 HydrophobicContact CZ-CG 4.26Å; R553-Y564 PolarHBondContact NH1-OH 2.87Å; R553-Y564 VanDerWaalsContact NH1-OH 3.1Å; F556-Y564 HydrophobicContact CD1-CE2 4.05Å; Q561-Y564 HydrophobicContact CB-CE2 4.01Å; Q561-Y564 VanDerWaalsContact CD-CZ 3.48Å; Q561-Y564 HydrophobicContact CG-CD2 4.11Å; Q561-Y564 HydrophobicContact CG-CE1 4.14Å; Q561-Y564 HydrophobicContact CG-CE2 3.66Å; Q561-Y564 HydrophobicContact CG-CG 4.49Å; Q561-Y564 WeakPolarHBondContact O-CE2 3.35Å; Y564-I586 PolarHBondContact N-O 3.21Å; Y564-I586 PolarHBondContact O-N 2.86Å; Y564-V588 HydrophobicContact CD2-CG2 3.9Å; Y564-V588 HydrophobicContact CE2-CG2 3.47Å; Y564-V588 VanDerWaalsContact CE2-CG2 3.47Å
565	Y	88.1	Confident	84.7	Confident	150 Å²	150	57.3 Å²	57.3	59%	0.588	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.8	170.4	-59.6	-79.8	0	0	0	108.3	V563 T583 L584 T585	V563-Y565 HydrophobicContact CG1-CE1 4.18Å; V563-Y565 HydrophobicContact CG1-CE2 4.06Å; Y565-T583 HydrophobicContact CD1-CG2 4.12Å; Y565-T583 HydrophobicContact CG-CG2 4.47Å; Y565-L584 WeakPolarHBondContact CA-O 3.24Å; Y565-T585 HydrophobicContact CD1-CG2 4.05Å; Y565-T585 HydrophobicContact CE1-CG2 3.88Å
566	L	88.8	Confident	85	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	96.3	177.4	-176.3	65.6	0	0	0	108	L527 N534 F537 I549 I568 L584 I586	L527-L566 HydrophobicContact CD1-CD1 4.44Å; L527-L566 HydrophobicContact CD2-CD1 3.71Å; L527-L566 HydrophobicContact CD2-CG 4.13Å; N534-L566 VanDerWaalsContact ND2-CD1 3.33Å; N534-L566 WeakPolarHBondContact ND2-CD1 3.43Å; F537-L566 HydrophobicContact CB-CD1 4.3Å; F537-L566 HydrophobicContact CB-CD2 4.15Å; I549-L566 HydrophobicContact CG2-CD2 3.91Å; L566-I568 HydrophobicContact CD2-CG2 4.24Å; L566-I568 HydrophobicContact CG-CG2 4.02Å; L566-I568 PolarHBondContact O-N 2.85Å; L566-L584 HydrophobicContact CB-CB 4.37Å; L566-L584 PolarHBondContact N-O 2.69Å; L566-L584 PolarHBondContact O-N 2.94Å; L566-I586 HydrophobicContact CB-CD1 3.88Å; L566-I586 HydrophobicContact CD2-CD1 3.87Å
567	P	88.7	Confident	85.1	Confident	36 Å²	36	54.6 Å²	54.6	23%	0.234	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	129.5	166.6	28.3	-32.6	0	0	0	108.4	L527 L531 S582	L527-P567 WeakPolarHBondContact CD2-O 3.32Å; L531-P567 HydrophobicContact CD1-CG 3.67Å; P567-S582 WeakPolarHBondContact CA-O 3.44Å
568	I	90.1	Very high	85.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144.2	173.7	62.9	165.4	0	0	0	108.1	L488 I509 L527 L539 L566 I570 S582 L584	L488-I568 HydrophobicContact CD1-CD1 4.3Å; L488-I568 HydrophobicContact CD2-CD1 3.97Å; L488-I568 HydrophobicContact CG-CD1 4.4Å; I509-I568 HydrophobicContact CD1-CD1 3.44Å; I509-I568 VanDerWaalsContact CD1-CD1 3.44Å; L527-I568 HydrophobicContact CD2-CG2 4.03Å; L539-I568 HydrophobicContact CD1-CB 4.29Å; L539-I568 HydrophobicContact CD1-CG2 3.93Å; L539-I568 HydrophobicContact CD2-CG2 4.31Å; L539-I568 HydrophobicContact CG-CG2 4.49Å; L566-I568 HydrophobicContact CD2-CG2 4.24Å; L566-I568 HydrophobicContact CG-CG2 4.02Å; L566-I568 PolarHBondContact O-N 2.85Å; I568-I570 HydrophobicContact CD1-CD1 4.21Å; I568-I570 HydrophobicContact CD1-CG1 4.25Å; I568-S582 VanDerWaalsContact CG1-O 3.28Å; I568-S582 WeakPolarHBondContact CG1-O 2.78Å; I568-S582 PolarHBondContact N-O 2.91Å; I568-S582 PolarHBondContact O-N 2.67Å; I568-L584 HydrophobicContact CD1-CD1 3.87Å; I568-L584 HydrophobicContact CD1-CG 4.08Å; I568-L584 HydrophobicContact CG1-CD1 4.4Å; I568-L584 HydrophobicContact CG1-CG 4.37Å; I568-L584 HydrophobicContact CG2-CD1 4Å
569	M	90	Very high	86	Confident	30 Å²	30	54.4 Å²	54.4	15%	0.148	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	137.2	169.2	-60.7	-56.3	-60	0	0	108.3	F526 D528 S580 S581	F526-M569 HydrophobicContact CD1-CB 3.98Å; F526-M569 HydrophobicContact CD2-CB 3.64Å; F526-M569 HydrophobicContact CD2-CG 4.1Å; F526-M569 HydrophobicContact CE1-CB 3.73Å; F526-M569 HydrophobicContact CE2-CB 3.36Å; F526-M569 HydrophobicContact CE2-CG 3.73Å; F526-M569 HydrophobicContact CG-CB 3.94Å; F526-M569 HydrophobicContact CZ-CB 3.41Å; F526-M569 VanDerWaalsContact CZ-CB 3.41Å; F526-M569 HydrophobicContact CZ-CG 4.16Å; F526-M569 PolarHBondContact N-O 3.31Å; F526-M569 PolarHBondContact O-N 3.25Å; D528-M569 HydrophobicContact CB-CG 4.24Å; M569-S580 WeakPolarHBondContact CA-O 3.26Å; M569-S580 WeakPolarHBondContact CE-O 3.27Å; M569-S581 VanDerWaalsContact SD-CB 3.56Å
570	I	90.6	Very high	86.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	124.1	173.6	-47.3	175.3	0	0	0	105.3	P486 L488 A511 F523 F525 I568 S579 S580	P486-I570 HydrophobicContact CB-CG2 4Å; P486-I570 HydrophobicContact CG-CB 4.44Å; P486-I570 HydrophobicContact CG-CG2 3.88Å; L488-I570 HydrophobicContact CD2-CD1 3.86Å; L488-I570 HydrophobicContact CG-CD1 3.94Å; A511-I570 HydrophobicContact CB-CD1 4.24Å; A511-I570 HydrophobicContact CB-CG2 3.82Å; F523-I570 HydrophobicContact CB-CG2 4.18Å; F525-I570 HydrophobicContact CD1-CD1 4.38Å; F525-I570 HydrophobicContact CD1-CG1 3.94Å; F525-I570 HydrophobicContact CD1-CG2 4.25Å; F525-I570 HydrophobicContact CE1-CD1 3.99Å; F525-I570 HydrophobicContact CE1-CG1 4.01Å; F525-I570 HydrophobicContact CE1-CG2 3.99Å; F525-I570 HydrophobicContact CZ-CG2 4.36Å; I568-I570 HydrophobicContact CD1-CD1 4.21Å; I568-I570 HydrophobicContact CD1-CG1 4.25Å; I570-S579 CarbonylContact O-C 3.58Å; I570-S579 WeakPolarHBondContact O-CA 3.35Å; I570-S579 VanDerWaalsContact O-CB 3.3Å; I570-S579 WeakPolarHBondContact O-CB 3.36Å; I570-S580 PolarHBondContact N-O 3.17Å; I570-S580 VanDerWaalsContact N-O 3.11Å; I570-S580 PolarHBondContact O-N 3.13Å
571	S	89.4	Confident	87.1	Confident	17 Å²	17	47.7 Å²	47.7	12%	0.119	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	154.4	167.8	82.2	0	0	0	0	111.1	F523 N524 L578	F523-S571 CarbonylContact C-O 3.47Å; F523-S571 VanDerWaalsContact CA-O 3.3Å; F523-S571 WeakPolarHBondContact CA-O 3.47Å; N524-S571 PolarHBondContact N-O 2.75Å; N524-S571 PolarHBondContact O-N 3.22Å; S571-L578 VanDerWaalsContact CA-O 3.26Å; S571-L578 WeakPolarHBondContact CA-O 3.33Å; S571-L578 WeakPolarHBondContact CB-O 3.42Å
572	D	88.6	Confident	87.4	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	27%	0.272	C	S	.	.			trans	-77.3	-164.6	172.4	57.9	41.3	0	0	0	111.6	N482 P486 R522 N524 G574 S577 L578	N482-D572 PolarHBondContact ND2-OD2 2.98Å; P486-D572 HydrophobicContact CG-CB 4.1Å; R522-D572 CarbonylContact O-C 3.57Å; N524-D572 PolarHBondContact ND2-O 2.91Å; D572-G574 PolarHBondContact OD1-N 3.42Å; D572-S577 WeakPolarHBondContact OD1-CA 3.37Å; D572-S577 WeakPolarHBondContact OD1-CB 3.21Å; D572-S577 PolarHBondContact OD1-OG 2.99Å; D572-L578 PolarHBondContact N-O 3.18Å; D572-L578 PolarHBondContact OD1-N 2.89Å; D572-L578 WeakPolarHBondContact OD2-CA 3.34Å; D572-L578 VanDerWaalsContact OD2-CB 3.32Å; D572-L578 WeakPolarHBondContact OD2-CB 3.19Å; D572-L578 PolarHBondContact OD2-N 2.93Å
573	G	80.9	Confident	87.6	Confident	48 Å²	48	45.5 Å²	45.5	50%	0.495	28%	0.276	S	S	.	.	S	Bend	trans	-114	18.7	166.1	0	0	0	0	0	113.5	R522	R522-G573 PolarHBondContact O-N 3.02Å
574	G	80.4	Confident	87.8	Confident	8 Å²	8	44.5 Å²	44.5	8%	0.082	27%	0.269	C	S	.	.			trans	-78.3	176.3	-169.8	0	0	0	0	0	115.5	N482 N519 D572 P576 S577	N482-G574 VanDerWaalsContact OD1-CA 3.28Å; N482-G574 WeakPolarHBondContact OD1-CA 3.27Å; N519-G574 WeakPolarHBondContact O-CA 3.1Å; D572-G574 PolarHBondContact OD1-N 3.42Å; G574-P576 CarbonylContact C-O 3.51Å; G574-P576 CarbonylContact O-C 3.56Å; G574-S577 WeakPolarHBondContact O-CA 3.21Å; G574-S577 WeakPolarHBondContact O-CB 3.2Å; G574-S577 PolarHBondContact O-N 2.79Å; G574-S577 VanDerWaalsContact O-N 3.15Å
575	I	77.6	Confident	87.9	Confident	161 Å²	161	46.3 Å²	46.3	83%	0.826	28%	0.281	S	S	*	.	S	Bend	trans	-136.6	103	176.9	-54.4	-179.9	0	0	0	109.8
576	P	85.6	Confident	88	Confident	88 Å²	88	39.1 Å²	39.1	57%	0.571	25%	0.253	S	S	*	.	S	Bend	cis	-66.8	149.5	-3.2	32.2	-36.3	0	0	0	111.6	N482 G574	N482-P576 PolarHBondContact ND2-O 3.33Å; G574-P576 CarbonylContact C-O 3.51Å; G574-P576 CarbonylContact O-C 3.56Å
577	S	87.1	Confident	87.9	Confident	66 Å²	66	44.2 Å²	44.2	46%	0.462	27%	0.272	S	S	.	.			trans	-77.9	131.3	173.3	-179.7	0	0	0	0	110.2	D572 G574	D572-S577 WeakPolarHBondContact OD1-CA 3.37Å; D572-S577 WeakPolarHBondContact OD1-CB 3.21Å; D572-S577 PolarHBondContact OD1-OG 2.99Å; G574-S577 WeakPolarHBondContact O-CA 3.21Å; G574-S577 WeakPolarHBondContact O-CB 3.2Å; G574-S577 PolarHBondContact O-N 2.79Å; G574-S577 VanDerWaalsContact O-N 3.15Å
578	L	89.6	Confident	87.8	Confident	49 Å²	49	42.6 Å²	42.6	26%	0.257	26%	0.261	S	S	.	.			trans	-104.2	161.4	177.2	-55.9	178.5	0	0	0	110.1	D483 P485 S571 D572	D483-L578 WeakPolarHBondContact O-CD1 3.27Å; P485-L578 HydrophobicContact CB-CB 4.05Å; S571-L578 VanDerWaalsContact CA-O 3.26Å; S571-L578 WeakPolarHBondContact CA-O 3.33Å; S571-L578 WeakPolarHBondContact CB-O 3.42Å; D572-L578 PolarHBondContact N-O 3.18Å; D572-L578 PolarHBondContact OD1-N 2.89Å; D572-L578 WeakPolarHBondContact OD2-CA 3.34Å; D572-L578 VanDerWaalsContact OD2-CB 3.32Å; D572-L578 WeakPolarHBondContact OD2-CB 3.19Å; D572-L578 PolarHBondContact OD2-N 2.93Å
579	S	90.4	Very high	87.5	Confident	64 Å²	64	42.7 Å²	42.7	45%	0.448	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	135.1	179.9	67	0	0	0	0	113.2	I570	I570-S579 CarbonylContact O-C 3.58Å; I570-S579 WeakPolarHBondContact O-CA 3.35Å; I570-S579 VanDerWaalsContact O-CB 3.3Å; I570-S579 WeakPolarHBondContact O-CB 3.36Å
580	S	91	Very high	86.9	Confident	15 Å²	15	42.8 Å²	42.8	11%	0.105	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	154.7	172.7	79.5	0	0	0	0	111.7	P486 M569 I570	P486-S580 VanDerWaalsContact O-CB 3.28Å; P486-S580 WeakPolarHBondContact O-CB 3.5Å; P486-S580 PolarHBondContact O-OG 2.86Å; M569-S580 WeakPolarHBondContact CA-O 3.26Å; M569-S580 WeakPolarHBondContact CE-O 3.27Å; I570-S580 PolarHBondContact N-O 3.17Å; I570-S580 VanDerWaalsContact N-O 3.11Å; I570-S580 PolarHBondContact O-N 3.13Å
581	S	90.3	Very high	86.1	Confident	82 Å²	82	43.9 Å²	43.9	57%	0.573	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	99.6	173.6	172.1	0	0	0	0	109.7	M569	M569-S581 VanDerWaalsContact SD-CB 3.56Å
582	S	88.9	Confident	85	Confident	25 Å²	25	46.7 Å²	46.7	18%	0.175	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	137.9	178.3	-75.9	0	0	0	0	111.2	P567 I568	P567-S582 WeakPolarHBondContact CA-O 3.44Å; I568-S582 VanDerWaalsContact CG1-O 3.28Å; I568-S582 WeakPolarHBondContact CG1-O 2.78Å; I568-S582 PolarHBondContact N-O 2.91Å; I568-S582 PolarHBondContact O-N 2.67Å
583	T	88.6	Confident	83.7	Confident	83 Å²	83	58.2 Å²	58.2	51%	0.509	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	106.1	175.6	-62.4	0	0	0	0	111.1	Y565	Y565-T583 HydrophobicContact CD1-CG2 4.12Å; Y565-T583 HydrophobicContact CG-CG2 4.47Å
584	L	90.1	Very high	82.7	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.031	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	138.4	176.1	-66.1	175.8	0	0	0	111.3	L488 I494 I509 I549 Y565 L566 I568	L488-L584 HydrophobicContact CD1-CD2 3.59Å; L488-L584 HydrophobicContact CD1-CG 4.48Å; I494-L584 HydrophobicContact CD1-CB 3.99Å; I494-L584 HydrophobicContact CD1-CD1 3.77Å; I494-L584 HydrophobicContact CD1-CD2 3.87Å; I494-L584 HydrophobicContact CD1-CG 4.11Å; I509-L584 HydrophobicContact CD1-CD1 4.21Å; I509-L584 HydrophobicContact CG2-CD1 4.17Å; I549-L584 HydrophobicContact CD1-CD1 3.55Å; Y565-L584 WeakPolarHBondContact CA-O 3.24Å; L566-L584 HydrophobicContact CB-CB 4.37Å; L566-L584 PolarHBondContact N-O 2.69Å; L566-L584 PolarHBondContact O-N 2.94Å; I568-L584 HydrophobicContact CD1-CD1 3.87Å; I568-L584 HydrophobicContact CD1-CG 4.08Å; I568-L584 HydrophobicContact CG1-CD1 4.4Å; I568-L584 HydrophobicContact CG1-CG 4.37Å; I568-L584 HydrophobicContact CG2-CD1 4Å
585	T	90.3	Very high	81.7	Confident	43 Å²	43	63.9 Å²	63.9	26%	0.264	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	128.2	171.5	82.9	0	0	0	0	110	I494 Y565	I494-T585 PolarHBondContact N-O 3.36Å; Y565-T585 HydrophobicContact CD1-CG2 4.05Å; Y565-T585 HydrophobicContact CE1-CG2 3.88Å
586	I	90.2	Very high	81	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	111.4	-177.1	-58.8	170.9	0	0	0	108.4	I494 V496 I506 F537 I549 Y564 L566	I494-I586 HydrophobicContact CB-CG1 4.04Å; I494-I586 HydrophobicContact CG2-CB 4.42Å; I494-I586 HydrophobicContact CG2-CG1 3.86Å; I494-I586 HydrophobicContact CG2-CG2 4.15Å; I494-I586 CarbonylContact O-C 3.6Å; I494-I586 WeakPolarHBondContact O-CA 3.11Å; V496-I586 HydrophobicContact CB-CG2 4.01Å; V496-I586 HydrophobicContact CG1-CG2 3.78Å; I506-I586 HydrophobicContact CD1-CD1 4.34Å; I506-I586 HydrophobicContact CD1-CG2 4.03Å; F537-I586 HydrophobicContact CD1-CD1 4.22Å; F537-I586 HydrophobicContact CD2-CD1 3.87Å; F537-I586 HydrophobicContact CE1-CD1 4.16Å; F537-I586 HydrophobicContact CE1-CG2 3.99Å; F537-I586 HydrophobicContact CE2-CB 4.44Å; F537-I586 HydrophobicContact CE2-CD1 3.8Å; F537-I586 HydrophobicContact CE2-CG2 4.27Å; F537-I586 HydrophobicContact CG-CD1 4.09Å; F537-I586 HydrophobicContact CZ-CB 4.22Å; F537-I586 HydrophobicContact CZ-CD1 3.96Å; F537-I586 HydrophobicContact CZ-CG2 3.57Å; I549-I586 HydrophobicContact CG2-CD1 4.4Å; Y564-I586 PolarHBondContact N-O 3.21Å; Y564-I586 PolarHBondContact O-N 2.86Å; L566-I586 HydrophobicContact CB-CD1 3.88Å; L566-I586 HydrophobicContact CD2-CD1 3.87Å
587	R	88.1	Confident	79.9	Confident	106 Å²	106	64.5 Å²	64.5	40%	0.4	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	136	-178.2	-56.1	-175.4	-167.9	-111.3	6.2	111.3	D493 I494 V495 V496 D562	D493-R587 IonicContact OD1-NE 2.91Å; D493-R587 IonicContact OD1-NH2 3.05Å; I494-R587 PolarHBondContact O-N 2.95Å; V495-R587 WeakPolarHBondContact CA-O 3.24Å; V496-R587 PolarHBondContact N-O 3.42Å; D562-R587 CarbonylContact O-C 3.25Å; D562-R587 WeakPolarHBondContact O-CA 3.26Å
588	V	87	Confident	78.7	Confident	3 Å²	3	69.5 Å²	69.5	2%	0.018	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.5	175	-174.1	0	0	0	0	110.2	V496 E498 F556 R558 Q561 D562 Y564	V496-V588 HydrophobicContact CG1-CB 4.34Å; V496-V588 HydrophobicContact CG1-CG2 3.8Å; V496-V588 WeakPolarHBondContact O-CA 3.1Å; E498-V588 HydrophobicContact CG-CG1 3.53Å; F556-V588 HydrophobicContact CB-CG1 3.87Å; F556-V588 HydrophobicContact CB-CG2 4.21Å; F556-V588 HydrophobicContact CD1-CG2 4.39Å; R558-V588 HydrophobicContact CB-CB 4.25Å; R558-V588 HydrophobicContact CB-CG1 4.04Å; R558-V588 WeakPolarHBondContact CD-O 3.26Å; Q561-V588 WeakPolarHBondContact O-CG2 3.22Å; D562-V588 PolarHBondContact O-N 2.59Å; Y564-V588 HydrophobicContact CD2-CG2 3.9Å; Y564-V588 HydrophobicContact CE2-CG2 3.47Å; Y564-V588 VanDerWaalsContact CE2-CG2 3.47Å
589	C	82.7	Confident	77.2	Confident	2 Å²	2	70.7 Å²	70.7	1%	0.014	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	153.8	-179.9	-53.1	0	0	0	0	112.7	V495 V496 C497 E498 V597 C600	V495-C589 HydrophobicContact CG1-CB 3.84Å; V495-C589 VanDerWaalsContact CG1-SG 3.58Å; V496-C589 PolarHBondContact O-N 2.82Å; C497-C589 WeakPolarHBondContact CA-O 3.25Å; E498-C589 PolarHBondContact N-O 2.79Å; E498-C589 VanDerWaalsContact N-O 3.13Å; C589-V597 HydrophobicContact CB-CG1 4.21Å; C589-C600 HydrophobicContact CB-CB 4.11Å; C589-C600 WeakPolarHBondContact CB-SG 3.15Å; C589-C600 WeakPolarHBondContact SG-CA 3.48Å; C589-C600 WeakPolarHBondContact SG-CB 3.45Å; C589-C600 CovalentContact SG-SG 2.03Å; C589-C600 PolarHBondContact SG-SG 3.25Å
590	A	77.3	Confident	75.7	Confident	32 Å²	32	69.7 Å²	69.7	26%	0.264	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	134.9	168.5	0	0	0	0	0	109.4	R598 T599	A590-R598 WeakPolarHBondContact O-CA 3.38Å; A590-R598 VanDerWaalsContact O-CB 3.29Å; A590-R598 WeakPolarHBondContact O-CB 3.19Å; A590-R598 PolarHBondContact O-N 2.79Å; A590-T599 PolarHBondContact O-N 3.28Å
591	C	73.1	Confident	73.8	Confident	22 Å²	22	75.9 Å²	75.9	15%	0.149	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	158.5	-176.1	-59.9	0	0	0	0	111.6	C497 R596	C497-C591 VanDerWaalsContact CA-SG 3.54Å; C497-C591 HydrophobicContact CB-CB 3.57Å; C497-C591 WeakPolarHBondContact CB-SG 3.31Å; C497-C591 WeakPolarHBondContact SG-CB 3.39Å; C497-C591 CovalentContact SG-SG 2.03Å; C497-C591 PolarHBondContact SG-SG 3.05Å; C591-R596 CarbonylContact C-O 3.55Å; C591-R596 VanDerWaalsContact CA-O 3.26Å; C591-R596 WeakPolarHBondContact CA-O 3.31Å; C591-R596 VanDerWaalsContact CB-O 3.31Å; C591-R596 WeakPolarHBondContact CB-O 3.24Å
592	E	67	Low	71.6	Confident	77 Å²	77	74 Å²	74	36%	0.36	37%	0.37	S	S	.	.			trans	-77.9	175.4	173.5	-63	-162.6	139.7	0	0	112.2	N499 D594 G595 R596 R598	N499-E592 PolarHBondContact ND2-O 2.91Å; E592-D594 PolarHBondContact O-N 3.31Å; E592-G595 PolarHBondContact O-N 2.85Å; E592-R596 PolarHBondContact N-O 3.39Å; E592-R598 HydrophobicContact CG-CB 4.33Å; E592-R598 HydrophobicContact CG-CG 3.88Å; E592-R598 VanDerWaalsContact CG-NE 3.35Å; E592-R598 IonicContact OE1-CZ 3.33Å; E592-R598 IonicContact OE1-NE 3.63Å; E592-R598 PolarHBondContact OE1-NE 3.41Å; E592-R598 IonicContact OE1-NH2 3.63Å; E592-R598 PolarHBondContact OE1-NH2 2.88Å
593	R	61.8	Low	69.2	Low	243 Å²	243	80.2 Å²	80.2	92%	0.917	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-25.5	-177.9	-68.6	-176.7	178.1	175.8	0.3	112.9	G595	R593-G595 VanDerWaalsContact C-N 3.26Å; R593-G595 PolarHBondContact O-N 2.83Å
594	D	59.3	Low	66.6	Low	141 Å²	141	79.8 Å²	79.8	75%	0.754	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	16.5	-179.5	-52.1	-21.3	0	0	0	112.3	E592 R596	E592-D594 PolarHBondContact O-N 3.31Å; D594-R596 PolarHBondContact O-N 3.16Å; D594-R596 VanDerWaalsContact O-N 3.17Å
595	G	60.4	Low	63.8	Low	33 Å²	33	87.3 Å²	87.3	34%	0.34	43%	0.434	S	S	.	.	S	Bend	trans	75.4	-3.9	177.6	0	0	0	0	0	115.5	E592 R593	E592-G595 PolarHBondContact O-N 2.85Å; R593-G595 VanDerWaalsContact C-N 3.26Å; R593-G595 PolarHBondContact O-N 2.83Å
596	R	61.5	Low	61.2	Low	189 Å²	189	91.8 Å²	91.8	71%	0.713	46%	0.455	S	S	*	.			trans	-69.9	133.3	176.1	-68.3	-177.6	174.5	-178	-2.4	111.3	C591 E592 D594	C591-R596 CarbonylContact C-O 3.55Å; C591-R596 VanDerWaalsContact CA-O 3.26Å; C591-R596 WeakPolarHBondContact CA-O 3.31Å; C591-R596 VanDerWaalsContact CB-O 3.31Å; C591-R596 WeakPolarHBondContact CB-O 3.24Å; E592-R596 PolarHBondContact N-O 3.39Å; D594-R596 PolarHBondContact O-N 3.16Å; D594-R596 VanDerWaalsContact O-N 3.17Å
597	V	63.9	Low	58.6	Low	74 Å²	74	96.5 Å²	96.5	45%	0.448	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	133.6	176.6	176.1	0	0	0	0	110.3	V495 C589 C600	V495-V597 HydrophobicContact CB-CG2 4.46Å; V495-V597 HydrophobicContact CG1-CG2 3.7Å; C589-V597 HydrophobicContact CB-CG1 4.21Å; V597-C600 HydrophobicContact CG1-CB 4.1Å; V597-C600 WeakPolarHBondContact CG1-SG 3.21Å
598	R	60.5	Low	56.4	Low	171 Å²	171	95.6 Å²	95.6	65%	0.645	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	-46.2	-178	-145.2	179.4	-151.2	-154.7	7	112.3	A590 E592	A590-R598 WeakPolarHBondContact O-CA 3.38Å; A590-R598 VanDerWaalsContact O-CB 3.29Å; A590-R598 WeakPolarHBondContact O-CB 3.19Å; A590-R598 PolarHBondContact O-N 2.79Å; E592-R598 HydrophobicContact CG-CB 4.33Å; E592-R598 HydrophobicContact CG-CG 3.88Å; E592-R598 VanDerWaalsContact CG-NE 3.35Å; E592-R598 IonicContact OE1-CZ 3.33Å; E592-R598 IonicContact OE1-NE 3.63Å; E592-R598 PolarHBondContact OE1-NE 3.41Å; E592-R598 IonicContact OE1-NH2 3.63Å; E592-R598 PolarHBondContact OE1-NH2 2.88Å
599	T	57.9	Low	54.3	Low	74 Å²	74	99.3 Å²	99.3	45%	0.454	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	99.7	176.1	41	0	0	0	0	111.5	A590 H601	A590-T599 PolarHBondContact O-N 3.28Å; T599-H601 VanDerWaalsContact C-N 3.34Å
600	C	60.1	Low	52.7	Low	43 Å²	43	102.2 Å²	102.2	29%	0.291	56%	0.56	S	S	.	*			trans	-88.5	2.9	167.6	-84.8	0	0	0	0	114.6	V495 C589 V597 A602	V495-C600 WeakPolarHBondContact CG1-SG 3.46Å; V495-C600 WeakPolarHBondContact CG2-SG 3.3Å; C589-C600 HydrophobicContact CB-CB 4.11Å; C589-C600 WeakPolarHBondContact CB-SG 3.15Å; C589-C600 WeakPolarHBondContact SG-CA 3.48Å; C589-C600 WeakPolarHBondContact SG-CB 3.45Å; C589-C600 CovalentContact SG-SG 2.03Å; C589-C600 PolarHBondContact SG-SG 3.25Å; V597-C600 HydrophobicContact CG1-CB 4.1Å; V597-C600 WeakPolarHBondContact CG1-SG 3.21Å; C600-A602 VanDerWaalsContact C-N 3.31Å; C600-A602 PolarHBondContact O-N 2.59Å
601	H	51.4	Low	51.4	Low	145 Å²	145	103.6 Å²	103.6	67%	0.671	56%	0.562	S	S	*	*			trans	-65.1	94.3	167.8	-69.4	-62.6	0	0	0	110	R558 T599	R558-H601 VanDerWaalsContact CZ-O 3.27Å; R558-H601 PolarHBondContact NH1-O 3.38Å; R558-H601 PolarHBondContact NH2-O 2.7Å; T599-H601 VanDerWaalsContact C-N 3.34Å
602	A	43.2	Very low	50.8	Low	42 Å²	42	106.1 Å²	106.1	35%	0.347	58%	0.58	S	S	.	*				-41.9	137.6	119	0	0	0	0	0	107.6	R558 C600 A604	R558-A602 VanDerWaalsContact NH2-CA 3.32Å; C600-A602 VanDerWaalsContact C-N 3.31Å; C600-A602 PolarHBondContact O-N 2.59Å; A602-A604 PolarHBondContact O-N 2.74Å; A602-A604 VanDerWaalsContact O-N 3.14Å
603	E	38.1	Very low	50.7	Low	156 Å²	156	107.9 Å²	107.9	73%	0.729	60%	0.596	S	S	*	*			trans	-49	132.5	-178.2	-68.2	-178.4	138.3	0	0	108.6	F605	E603-F605 PolarHBondContact O-N 3.1Å
604	A	34.4	Very low	51	Low	74 Å²	74	98.2 Å²	98.2	61%	0.612	57%	0.572	S	S	*	*			trans	-64.2	79.7	145.9	0	0	0	0	0	106.3	A602 L606	A602-A604 PolarHBondContact O-N 2.74Å; A602-A604 VanDerWaalsContact O-N 3.14Å; A604-L606 PolarHBondContact O-N 2.83Å
605	F	32.1	Very low	51.4	Low	163 Å²	163	93.1 Å²	93.1	72%	0.715	55%	0.55	S	S	*	.				-44.9	82.8	112.3	-93.8	-87.1	0	0	0	107.2	E603 S607	E603-F605 PolarHBondContact O-N 3.1Å; F605-S607 VanDerWaalsContact CA-N 3.34Å; F605-S607 PolarHBondContact O-N 3.41Å
606	L	36.2	Very low	51.8	Low	137 Å²	137	96.6 Å²	96.6	72%	0.717	56%	0.56	S	S	*	*				-16.3	64.2	88	-62.2	172.1	0	0	0	112.8	A604 S608	A604-L606 PolarHBondContact O-N 2.83Å; L606-S608 VanDerWaalsContact CA-N 3.3Å; L606-S608 PolarHBondContact O-N 3.5Å
607	S	34.3	Very low	52.5	Low	99 Å²	99	92.4 Å²	92.4	69%	0.692	55%	0.551	S	S	*	*				-32.4	81.6	93.8	-70.1	0	0	0	0	107.7	F605 A609	F605-S607 VanDerWaalsContact CA-N 3.34Å; F605-S607 PolarHBondContact O-N 3.41Å; S607-A609 PolarHBondContact O-N 3.46Å
608	S	41.7	Very low	53.1	Low	87 Å²	87	91 Å²	91	61%	0.608	55%	0.547	S	S	*	.			trans	-35.1	135.6	147.9	40.8	0	0	0	0	105.4	L606 G610	L606-S608 VanDerWaalsContact CA-N 3.3Å; L606-S608 PolarHBondContact O-N 3.5Å; S608-G610 PolarHBondContact O-N 3.32Å
609	A	44.1	Very low	54	Low	82 Å²	82	87.6 Å²	87.6	68%	0.678	54%	0.54	S	S	*	.			trans	-65.7	76.3	160.3	0	0	0	0	0	106.2	S607 L611	S607-A609 PolarHBondContact O-N 3.46Å; A609-L611 HydrophobicContact CB-CD1 3.67Å; A609-L611 PolarHBondContact O-N 3.45Å
610	G	49.1	Very low	55.1	Low	63 Å²	63	89.3 Å²	89.3	65%	0.649	55%	0.546	S	S	*	.			trans	-62.6	59.9	147.3	0	0	0	0	0	107.8	S608 S612	S608-G610 PolarHBondContact O-N 3.32Å; G610-S612 PolarHBondContact O-N 3.25Å
611	L	50.3	Low	56.3	Low	61 Å²	61	91.5 Å²	91.5	32%	0.319	56%	0.555	S	S	.	*				-35.2	103.2	118.1	-81.2	68.2	0	0	0	105.8	A609 A615 L616 I619	A609-L611 HydrophobicContact CB-CD1 3.67Å; A609-L611 PolarHBondContact O-N 3.45Å; L611-A615 HydrophobicContact CB-CB 3.81Å; L611-A615 HydrophobicContact CG-CB 3.96Å; L611-L616 HydrophobicContact CB-CB 4.47Å; L611-L616 HydrophobicContact CB-CG 3.92Å; L611-L616 HydrophobicContact CD2-CD2 4.2Å; L611-L616 HydrophobicContact CD2-CG 3.97Å; L611-I619 HydrophobicContact CD2-CD1 3.64Å; L611-I619 HydrophobicContact CD2-CG1 4.31Å
612	S	59.3	Low	57.9	Low	74 Å²	74	88.1 Å²	88.1	52%	0.517	55%	0.546	S	S	.	.			trans	-40.8	155	164.1	168.6	0	0	0	0	108.7	G610 G614 A615 L616	G610-S612 PolarHBondContact O-N 3.25Å; S612-G614 PolarHBondContact O-N 2.84Å; S612-G614 PolarHBondContact OG-N 2.83Å; S612-A615 WeakPolarHBondContact O-CA 3.04Å; S612-A615 PolarHBondContact O-N 2.75Å; S612-L616 PolarHBondContact O-N 2.99Å
613	T	65.6	Low	59.9	Low	114 Å²	114	89.7 Å²	89.7	70%	0.699	55%	0.552	S	S	*	*	H	α-helix	trans	-49.3	-34.7	168.8	46.6	0	0	0	0	110.7	A615 I617	T613-A615 PolarHBondContact O-N 3.24Å; T613-I617 WeakPolarHBondContact O-CB 3.27Å; T613-I617 VanDerWaalsContact O-CD1 3.29Å; T613-I617 WeakPolarHBondContact O-CD1 3.39Å; T613-I617 WeakPolarHBondContact O-CG1 3.26Å; T613-I617 PolarHBondContact O-N 3.23Å
614	G	68.6	Low	62.1	Low	40 Å²	40	87 Å²	87	41%	0.412	54%	0.542	S	S	.	.	H	α-helix	trans	-63.6	-31	170.8	0	0	0	0	0	116.2	S612 A618	S612-G614 PolarHBondContact O-N 2.84Å; S612-G614 PolarHBondContact OG-N 2.83Å; G614-A618 VanDerWaalsContact O-CB 3.27Å; G614-A618 WeakPolarHBondContact O-CB 3.25Å; G614-A618 PolarHBondContact O-N 2.9Å
615	A	65.9	Low	64.5	Low	35 Å²	35	87.5 Å²	87.5	29%	0.289	53%	0.533	S	S	.	.	H	α-helix	trans	-87.9	-32.7	178.1	0	0	0	0	0	113	L611 S612 T613 I617 A618 I619	L611-A615 HydrophobicContact CB-CB 3.81Å; L611-A615 HydrophobicContact CG-CB 3.96Å; S612-A615 WeakPolarHBondContact O-CA 3.04Å; S612-A615 PolarHBondContact O-N 2.75Å; T613-A615 PolarHBondContact O-N 3.24Å; A615-I617 VanDerWaalsContact C-N 3.34Å; A615-A618 PolarHBondContact O-N 2.97Å; A615-I619 PolarHBondContact O-N 3.1Å
616	L	70.7	Confident	67	Low	106 Å²	106	85 Å²	85	56%	0.555	53%	0.527	S	S	*	.	H	α-helix	trans	-64.8	-41.9	165.5	-98.4	166	0	0	0	110.4	L611 S612 L620	L611-L616 HydrophobicContact CB-CB 4.47Å; L611-L616 HydrophobicContact CB-CG 3.92Å; L611-L616 HydrophobicContact CD2-CD2 4.2Å; L611-L616 HydrophobicContact CD2-CG 3.97Å; S612-L616 PolarHBondContact O-N 2.99Å; L616-L620 VanDerWaalsContact O-CB 3.29Å; L616-L620 WeakPolarHBondContact O-CB 3.45Å; L616-L620 PolarHBondContact O-N 2.87Å
617	I	76.1	Confident	69.4	Low	100 Å²	100	83.2 Å²	83.2	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-58.9	-47.2	167.9	-73.7	164.5	0	0	0	110	T613 A615 I619 L620 L621	T613-I617 WeakPolarHBondContact O-CB 3.27Å; T613-I617 VanDerWaalsContact O-CD1 3.29Å; T613-I617 WeakPolarHBondContact O-CD1 3.39Å; T613-I617 WeakPolarHBondContact O-CG1 3.26Å; T613-I617 PolarHBondContact O-N 3.23Å; A615-I617 VanDerWaalsContact C-N 3.34Å; I617-I619 PolarHBondContact O-N 3.03Å; I617-L620 CarbonylContact O-C 3.24Å; I617-L620 PolarHBondContact O-N 3.4Å; I617-L621 HydrophobicContact CG2-CD1 4.29Å; I617-L621 WeakPolarHBondContact O-CB 3.41Å; I617-L621 PolarHBondContact O-N 3.47Å
618	A	75.2	Confident	71.6	Confident	44 Å²	44	80.6 Å²	80.6	36%	0.364	50%	0.502	S	S	.	.	H	α-helix	trans	-61.7	-44	-178.6	0	0	0	0	0	113.2	G614 A615 L620 L621 C622	G614-A618 VanDerWaalsContact O-CB 3.27Å; G614-A618 WeakPolarHBondContact O-CB 3.25Å; G614-A618 PolarHBondContact O-N 2.9Å; A615-A618 PolarHBondContact O-N 2.97Å; A618-L620 VanDerWaalsContact C-N 3.35Å; A618-L621 CarbonylContact O-C 3.57Å; A618-L621 WeakPolarHBondContact O-CB 3.38Å; A618-L621 PolarHBondContact O-N 2.89Å; A618-C622 WeakPolarHBondContact O-CB 3.3Å; A618-C622 PolarHBondContact O-N 3.48Å; A618-C622 PolarHBondContact O-SG 2.76Å
619	I	79	Confident	73.5	Confident	100 Å²	100	80.9 Å²	80.9	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-63.7	-42.4	173.9	-67.6	-170	0	0	0	110.6	L611 A615 I617 L621 C622 V623	L611-I619 HydrophobicContact CD2-CD1 3.64Å; L611-I619 HydrophobicContact CD2-CG1 4.31Å; A615-I619 PolarHBondContact O-N 3.1Å; I617-I619 PolarHBondContact O-N 3.03Å; I619-L621 VanDerWaalsContact C-N 3.28Å; I619-L621 PolarHBondContact O-N 3.03Å; I619-C622 PolarHBondContact O-N 3.41Å; I619-V623 HydrophobicContact CG2-CG2 4.39Å; I619-V623 WeakPolarHBondContact O-CB 3.38Å; I619-V623 WeakPolarHBondContact O-CG2 3.34Å; I619-V623 PolarHBondContact O-N 2.96Å
620	L	82.4	Confident	75.3	Confident	110 Å²	110	80.8 Å²	80.8	58%	0.576	49%	0.486	S	S	*	.	H	α-helix	trans	-66.3	-31.8	177.5	-161.4	146.4	0	0	0	111.7	L616 I617 A618 L624	L616-L620 VanDerWaalsContact O-CB 3.29Å; L616-L620 WeakPolarHBondContact O-CB 3.45Å; L616-L620 PolarHBondContact O-N 2.87Å; I617-L620 CarbonylContact O-C 3.24Å; I617-L620 PolarHBondContact O-N 3.4Å; A618-L620 VanDerWaalsContact C-N 3.35Å; L620-L624 HydrophobicContact CD2-CD1 3.68Å; L620-L624 HydrophobicContact CD2-CG 4.22Å; L620-L624 WeakPolarHBondContact O-CB 3.24Å; L620-L624 VanDerWaalsContact O-CG 3.25Å; L620-L624 WeakPolarHBondContact O-CG 3.25Å; L620-L624 PolarHBondContact O-N 3.08Å
621	L	85.3	Confident	76.7	Confident	90 Å²	90	81.8 Å²	81.8	47%	0.471	48%	0.479	S	S	.	.	H	α-helix	trans	-69.3	-43.7	171.4	-122.8	164.8	0	0	0	111.4	I617 A618 I619 L624 I625	I617-L621 HydrophobicContact CG2-CD1 4.29Å; I617-L621 WeakPolarHBondContact O-CB 3.41Å; I617-L621 PolarHBondContact O-N 3.47Å; A618-L621 CarbonylContact O-C 3.57Å; A618-L621 WeakPolarHBondContact O-CB 3.38Å; A618-L621 PolarHBondContact O-N 2.89Å; I619-L621 VanDerWaalsContact C-N 3.28Å; I619-L621 PolarHBondContact O-N 3.03Å; L621-L624 CarbonylContact O-C 3.6Å; L621-L624 PolarHBondContact O-N 2.99Å; L621-I625 HydrophobicContact CD2-CD1 3.64Å; L621-I625 HydrophobicContact CD2-CG1 4.09Å; L621-I625 VanDerWaalsContact O-CB 3.3Å; L621-I625 WeakPolarHBondContact O-CB 3.37Å; L621-I625 WeakPolarHBondContact O-CD1 3.35Å; L621-I625 VanDerWaalsContact O-CG1 3.22Å; L621-I625 WeakPolarHBondContact O-CG1 2.84Å; L621-I625 PolarHBondContact O-N 2.75Å
622	C	83.9	Confident	78	Confident	73 Å²	73	83.3 Å²	83.3	49%	0.493	49%	0.487	S	S	.	.	H	α-helix	trans	-63.8	-39.6	174.4	-71.8	0	0	0	0	111.8	A618 I619 I625 L626	A618-C622 WeakPolarHBondContact O-CB 3.3Å; A618-C622 PolarHBondContact O-N 3.48Å; A618-C622 PolarHBondContact O-SG 2.76Å; I619-C622 PolarHBondContact O-N 3.41Å; C622-I625 PolarHBondContact O-N 2.95Å; C622-L626 WeakPolarHBondContact O-CB 3.23Å; C622-L626 VanDerWaalsContact O-CG 3.31Å; C622-L626 WeakPolarHBondContact O-CG 3.43Å; C622-L626 PolarHBondContact O-N 2.86Å
623	V	85.5	Confident	78.7	Confident	76 Å²	76	85.6 Å²	85.6	46%	0.461	49%	0.488	S	S	.	.	H	α-helix	trans	-67.1	-41.1	173.6	171	0	0	0	0	111.1	I619 L626 L627	I619-V623 HydrophobicContact CG2-CG2 4.39Å; I619-V623 WeakPolarHBondContact O-CB 3.38Å; I619-V623 WeakPolarHBondContact O-CG2 3.34Å; I619-V623 PolarHBondContact O-N 2.96Å; V623-L626 PolarHBondContact O-N 2.93Å; V623-L627 HydrophobicContact CG1-CD1 4.04Å; V623-L627 WeakPolarHBondContact O-CB 3.45Å; V623-L627 VanDerWaalsContact O-CG 3.29Å; V623-L627 WeakPolarHBondContact O-CG 3.43Å; V623-L627 PolarHBondContact O-N 3.23Å
624	L	83.8	Confident	79.1	Confident	99 Å²	99	84.3 Å²	84.3	52%	0.518	48%	0.476	S	S	.	.	H	α-helix	trans	-66.7	-36.2	173.3	-76.9	174.2	0	0	0	112.8	L620 L621 A628	L620-L624 HydrophobicContact CD2-CD1 3.68Å; L620-L624 HydrophobicContact CD2-CG 4.22Å; L620-L624 WeakPolarHBondContact O-CB 3.24Å; L620-L624 VanDerWaalsContact O-CG 3.25Å; L620-L624 WeakPolarHBondContact O-CG 3.25Å; L620-L624 PolarHBondContact O-N 3.08Å; L621-L624 CarbonylContact O-C 3.6Å; L621-L624 PolarHBondContact O-N 2.99Å; L624-A628 WeakPolarHBondContact O-CB 3.5Å; L624-A628 PolarHBondContact O-N 2.96Å
625	I	85.9	Confident	79.2	Confident	84 Å²	84	86 Å²	86	43%	0.431	48%	0.478	S	S	.	.	H	α-helix	trans	-68.7	-43	174.7	-75.4	162.1	0	0	0	110.3	L621 C622 A628 I629	L621-I625 HydrophobicContact CD2-CD1 3.64Å; L621-I625 HydrophobicContact CD2-CG1 4.09Å; L621-I625 VanDerWaalsContact O-CB 3.3Å; L621-I625 WeakPolarHBondContact O-CB 3.37Å; L621-I625 WeakPolarHBondContact O-CD1 3.35Å; L621-I625 VanDerWaalsContact O-CG1 3.22Å; L621-I625 WeakPolarHBondContact O-CG1 2.84Å; L621-I625 PolarHBondContact O-N 2.75Å; C622-I625 PolarHBondContact O-N 2.95Å; I625-A628 CarbonylContact O-C 3.57Å; I625-A628 PolarHBondContact O-N 2.92Å; I625-I629 HydrophobicContact CG2-CD1 3.7Å; I625-I629 HydrophobicContact CG2-CG1 4.37Å; I625-I629 WeakPolarHBondContact O-CB 3.45Å; I625-I629 VanDerWaalsContact O-CG1 3.24Å; I625-I629 WeakPolarHBondContact O-CG1 3.29Å; I625-I629 PolarHBondContact O-N 3.27Å
626	L	84.6	Confident	79.2	Confident	111 Å²	111	89.2 Å²	89.2	58%	0.581	49%	0.49	S	S	*	.	H	α-helix	trans	-65.1	-41.8	175	-76	167.7	0	0	0	111.5	C622 V623 A628 I629 V630	C622-L626 WeakPolarHBondContact O-CB 3.23Å; C622-L626 VanDerWaalsContact O-CG 3.31Å; C622-L626 WeakPolarHBondContact O-CG 3.43Å; C622-L626 PolarHBondContact O-N 2.86Å; V623-L626 PolarHBondContact O-N 2.93Å; L626-A628 VanDerWaalsContact C-N 3.35Å; L626-I629 PolarHBondContact O-N 2.93Å; L626-V630 WeakPolarHBondContact O-CB 3.19Å; L626-V630 VanDerWaalsContact O-CG2 3.29Å; L626-V630 WeakPolarHBondContact O-CG2 3.43Å; L626-V630 PolarHBondContact O-N 3.27Å
627	L	85.4	Confident	78.7	Confident	100 Å²	100	93.5 Å²	93.5	52%	0.524	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-39.6	171.7	-75	169	0	0	0	111.8	V623 V630 V631	V623-L627 HydrophobicContact CG1-CD1 4.04Å; V623-L627 WeakPolarHBondContact O-CB 3.45Å; V623-L627 VanDerWaalsContact O-CG 3.29Å; V623-L627 WeakPolarHBondContact O-CG 3.43Å; V623-L627 PolarHBondContact O-N 3.23Å; L627-V630 PolarHBondContact O-N 2.79Å; L627-V631 WeakPolarHBondContact O-CB 3.37Å; L627-V631 VanDerWaalsContact O-CG2 3.25Å; L627-V631 WeakPolarHBondContact O-CG2 3.4Å; L627-V631 PolarHBondContact O-N 3.26Å
628	A	80.6	Confident	78	Confident	44 Å²	44	99.1 Å²	99.1	36%	0.364	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-41.1	174.9	0	0	0	0	0	111.8	L624 I625 L626 V631 I632	L624-A628 WeakPolarHBondContact O-CB 3.5Å; L624-A628 PolarHBondContact O-N 2.96Å; I625-A628 CarbonylContact O-C 3.57Å; I625-A628 PolarHBondContact O-N 2.92Å; L626-A628 VanDerWaalsContact C-N 3.35Å; A628-V631 PolarHBondContact O-N 2.76Å; A628-I632 VanDerWaalsContact O-CB 3.26Å; A628-I632 WeakPolarHBondContact O-CB 3.26Å; A628-I632 WeakPolarHBondContact O-CD1 3.42Å; A628-I632 WeakPolarHBondContact O-CG1 3.39Å; A628-I632 PolarHBondContact O-N 2.78Å
629	I	81.8	Confident	77.1	Confident	93 Å²	93	101 Å²	101	48%	0.477	52%	0.524	S	S	.	.	H	α-helix	trans	-64.2	-43.2	174.6	-71.6	165.8	0	0	0	110.4	I625 L626 I632 F633	I625-I629 HydrophobicContact CG2-CD1 3.7Å; I625-I629 HydrophobicContact CG2-CG1 4.37Å; I625-I629 WeakPolarHBondContact O-CB 3.45Å; I625-I629 VanDerWaalsContact O-CG1 3.24Å; I625-I629 WeakPolarHBondContact O-CG1 3.29Å; I625-I629 PolarHBondContact O-N 3.27Å; L626-I629 PolarHBondContact O-N 2.93Å; I629-I632 PolarHBondContact O-N 2.88Å; I629-F633 VanDerWaalsContact O-CB 3.31Å; I629-F633 WeakPolarHBondContact O-CB 3.49Å; I629-F633 PolarHBondContact O-N 2.86Å
630	V	82.1	Confident	75.8	Confident	79 Å²	79	105 Å²	105	48%	0.479	54%	0.538	S	S	.	.	H	α-helix	trans	-63.8	-43	175	167.9	0	0	0	0	111.1	L626 L627 F633 I634	L626-V630 WeakPolarHBondContact O-CB 3.19Å; L626-V630 VanDerWaalsContact O-CG2 3.29Å; L626-V630 WeakPolarHBondContact O-CG2 3.43Å; L626-V630 PolarHBondContact O-N 3.27Å; L627-V630 PolarHBondContact O-N 2.79Å; V630-F633 PolarHBondContact O-N 3.43Å; V630-I634 HydrophobicContact CG1-CD1 3.8Å; V630-I634 WeakPolarHBondContact O-CB 3.31Å; V630-I634 WeakPolarHBondContact O-CD1 3.46Å; V630-I634 VanDerWaalsContact O-CG1 3.22Å; V630-I634 WeakPolarHBondContact O-CG1 3.49Å; V630-I634 PolarHBondContact O-N 2.97Å
631	V	78.9	Confident	73.8	Confident	84 Å²	84	108.8 Å²	108.8	51%	0.509	55%	0.549	S	S	.	.	H	α-helix	trans	-64.8	-41.5	174.7	168	0	0	0	0	111.4	L627 A628 I634 T635	L627-V631 WeakPolarHBondContact O-CB 3.37Å; L627-V631 VanDerWaalsContact O-CG2 3.25Å; L627-V631 WeakPolarHBondContact O-CG2 3.4Å; L627-V631 PolarHBondContact O-N 3.26Å; A628-V631 PolarHBondContact O-N 2.76Å; V631-I634 CarbonylContact O-C 3.49Å; V631-I634 PolarHBondContact O-N 2.88Å; V631-T635 HydrophobicContact CG1-CG2 4.44Å; V631-T635 WeakPolarHBondContact O-CG2 3.37Å; V631-T635 PolarHBondContact O-N 2.83Å; V631-T635 PolarHBondContact O-OG1 2.8Å
632	I	77.1	Confident	71.7	Confident	93 Å²	93	113 Å²	113	48%	0.477	57%	0.567	S	S	.	*	H	α-helix	trans	-63.4	-40.7	174.7	-74.4	164.4	0	0	0	110.8	A628 I629 I634 T635 L636	A628-I632 VanDerWaalsContact O-CB 3.26Å; A628-I632 WeakPolarHBondContact O-CB 3.26Å; A628-I632 WeakPolarHBondContact O-CD1 3.42Å; A628-I632 WeakPolarHBondContact O-CG1 3.39Å; A628-I632 PolarHBondContact O-N 2.78Å; I629-I632 PolarHBondContact O-N 2.88Å; I632-I634 VanDerWaalsContact C-N 3.33Å; I632-I634 PolarHBondContact O-N 3.22Å; I632-T635 WeakPolarHBondContact CA-OG1 3.24Å; I632-T635 PolarHBondContact O-N 2.96Å; I632-T635 PolarHBondContact O-OG1 2.61Å; I632-T635 VanDerWaalsContact O-OG1 3.12Å; I632-L636 HydrophobicContact CG2-CD1 3.7Å; I632-L636 HydrophobicContact CG2-CG 4.24Å; I632-L636 VanDerWaalsContact O-CB 3.25Å; I632-L636 WeakPolarHBondContact O-CB 3.48Å; I632-L636 WeakPolarHBondContact O-CG 3.42Å; I632-L636 PolarHBondContact O-N 2.85Å
633	F	74.3	Confident	70.1	Confident	122 Å²	122	114.5 Å²	114.5	54%	0.535	58%	0.575	S	S	.	*	H	α-helix	trans	-66.8	-36.4	176.1	-163	-99.6	0	0	0	111.6	I629 V630 R637	I629-F633 VanDerWaalsContact O-CB 3.31Å; I629-F633 WeakPolarHBondContact O-CB 3.49Å; I629-F633 PolarHBondContact O-N 2.86Å; V630-F633 PolarHBondContact O-N 3.43Å; F633-R637 HydrophobicContact CE1-CG 4.46Å; F633-R637 VanDerWaalsContact O-CB 3.3Å; F633-R637 WeakPolarHBondContact O-CB 3.43Å; F633-R637 WeakPolarHBondContact O-CG 3.16Å; F633-R637 PolarHBondContact O-N 3.41Å
634	I	74.1	Confident	67.6	Low	87 Å²	87	117.6 Å²	117.6	45%	0.446	59%	0.589	S	S	.	*	H	α-helix	trans	-70.8	-38.3	174.3	-70.6	165.8	0	0	0	111.8	V630 V631 I632 R638	V630-I634 HydrophobicContact CG1-CD1 3.8Å; V630-I634 WeakPolarHBondContact O-CB 3.31Å; V630-I634 WeakPolarHBondContact O-CD1 3.46Å; V630-I634 VanDerWaalsContact O-CG1 3.22Å; V630-I634 WeakPolarHBondContact O-CG1 3.49Å; V630-I634 PolarHBondContact O-N 2.97Å; V631-I634 CarbonylContact O-C 3.49Å; V631-I634 PolarHBondContact O-N 2.88Å; I632-I634 VanDerWaalsContact C-N 3.33Å; I632-I634 PolarHBondContact O-N 3.22Å; I634-R638 WeakPolarHBondContact O-CB 3.26Å; I634-R638 WeakPolarHBondContact O-CG 3.21Å; I634-R638 PolarHBondContact O-N 3.4Å; I634-R638 VanDerWaalsContact O-N 3.13Å
635	T	71	Confident	65.2	Low	75 Å²	75	119.9 Å²	119.9	46%	0.46	60%	0.6	S	S	.	*	H	α-helix	trans	-74	-39.6	176.1	55.7	0	0	0	0	111.8	V631 I632 R637 R638 S639	V631-T635 HydrophobicContact CG1-CG2 4.44Å; V631-T635 WeakPolarHBondContact O-CG2 3.37Å; V631-T635 PolarHBondContact O-N 2.83Å; V631-T635 PolarHBondContact O-OG1 2.8Å; I632-T635 WeakPolarHBondContact CA-OG1 3.24Å; I632-T635 PolarHBondContact O-N 2.96Å; I632-T635 PolarHBondContact O-OG1 2.61Å; I632-T635 VanDerWaalsContact O-OG1 3.12Å; T635-R637 PolarHBondContact O-N 3.32Å; T635-R638 CarbonylContact O-C 3.6Å; T635-R638 WeakPolarHBondContact O-CA 3.28Å; T635-R638 PolarHBondContact O-N 3.18Å; T635-S639 WeakPolarHBondContact O-CB 3.31Å; T635-S639 PolarHBondContact O-N 2.87Å; T635-S639 PolarHBondContact O-OG 3.12Å
636	L	65.9	Low	62.7	Low	104 Å²	104	122.6 Å²	122.6	55%	0.545	61%	0.614	S	S	.	*	H	α-helix	trans	-62.4	-39.9	172.2	-72.4	171.2	0	0	0	112	I632 R638 S639	I632-L636 HydrophobicContact CG2-CD1 3.7Å; I632-L636 HydrophobicContact CG2-CG 4.24Å; I632-L636 VanDerWaalsContact O-CB 3.25Å; I632-L636 WeakPolarHBondContact O-CB 3.48Å; I632-L636 WeakPolarHBondContact O-CG 3.42Å; I632-L636 PolarHBondContact O-N 2.85Å; L636-R638 PolarHBondContact O-N 2.87Å; L636-S639 PolarHBondContact O-N 2.85Å; L636-S639 PolarHBondContact O-OG 2.83Å
637	R	60.8	Low	60.3	Low	196 Å²	196	121.8 Å²	121.8	74%	0.74	62%	0.618	S	S	*	*	H	α-helix	trans	-68.1	-15.2	170.3	-83.3	-172	163.1	-157.2	-4.4	114.1	F633 T635	F633-R637 HydrophobicContact CE1-CG 4.46Å; F633-R637 VanDerWaalsContact O-CB 3.3Å; F633-R637 WeakPolarHBondContact O-CB 3.43Å; F633-R637 WeakPolarHBondContact O-CG 3.16Å; F633-R637 PolarHBondContact O-N 3.41Å; T635-R637 PolarHBondContact O-N 3.32Å
638	R	60.2	Low	58.2	Low	218 Å²	218	124.9 Å²	124.9	82%	0.823	63%	0.629	S	S	*	*	H	α-helix	trans	-101	-18.6	174.7	-80.4	-177.2	165.9	-171.6	-3.8	114.1	I634 T635 L636	I634-R638 WeakPolarHBondContact O-CB 3.26Å; I634-R638 WeakPolarHBondContact O-CG 3.21Å; I634-R638 PolarHBondContact O-N 3.4Å; I634-R638 VanDerWaalsContact O-N 3.13Å; T635-R638 CarbonylContact O-C 3.6Å; T635-R638 WeakPolarHBondContact O-CA 3.28Å; T635-R638 PolarHBondContact O-N 3.18Å; L636-R638 PolarHBondContact O-N 2.87Å
639	S	55.7	Low	56.2	Low	84 Å²	84	131.7 Å²	131.7	59%	0.587	65%	0.654	S	S	*	*	H	α-helix	trans	-93.7	-6.6	-176.2	70.1	0	0	0	0	114.3	T635 L636	T635-S639 WeakPolarHBondContact O-CB 3.31Å; T635-S639 PolarHBondContact O-N 2.87Å; T635-S639 PolarHBondContact O-OG 3.12Å; L636-S639 PolarHBondContact O-N 2.85Å; L636-S639 PolarHBondContact O-OG 2.83Å
640	K	52.6	Low	54.1	Low	183 Å²	183	133.7 Å²	133.7	80%	0.796	67%	0.665	S	S	*	*			trans	-113.7	86.2	173	-75.8	-165.4	172.1	-171.3	0	112
641	K	40	Very low	51.8	Low	189 Å²	189	133.8 Å²	133.8	82%	0.822	67%	0.666	S	S	*	*			trans	-131.1	79.2	150.8	-84.9	-155.7	168.6	-157.1	0	109.6
642	E	41.7	Very low	49.5	Very low	180 Å²	180	139.1 Å²	139.1	84%	0.841	68%	0.677	S	S	*	*			trans	64.2	176.3	152.1	-67.5	163.1	-139.8	0	0	116.7
643	P	50.3	Low	47.6	Very low	103 Å²	103	142.9 Å²	142.9	67%	0.669	69%	0.692	S	S	*	*			cis	-129	-168.1	-4.5	22.8	2.8	0	0	0	114.7
644	L	33.2	Very low	45.4	Very low	142 Å²	142	143.9 Å²	143.9	74%	0.743	70%	0.703	S	S	*	*			trans	105.5	108.3	147.5	-53.9	-178.3	0	0	0	120.7
645	I	33.6	Very low	43.4	Very low	147 Å²	147	145 Å²	145	75%	0.754	71%	0.714	S	S	*	*				29.6	143.4	120.7	4.1	-176.5	0	0	0	118.4
646	I	32.2	Very low	41.4	Very low	141 Å²	141	148.1 Å²	148.1	72%	0.723	73%	0.732	S	S	*	*			cis	-145.4	156.1	43.8	-69.5	-179.8	0	0	0	108.3	E648	I646-E648 WeakPolarHBondContact CG2-OE2 3.49Å
647	S	35.9	Very low	39.8	Very low	94 Å²	94	148 Å²	148	66%	0.657	74%	0.736	S	S	*	*			cis	-126.3	-166.7	18.6	7.5	0	0	0	0	111.7
648	E	41.1	Very low	38.4	Very low	165 Å²	165	148.3 Å²	148.3	77%	0.771	74%	0.739	S	S	*	*			cis	69.6	140.3	31.5	-44.8	149.5	117	0	0	112.6	I646	I646-E648 WeakPolarHBondContact CG2-OE2 3.49Å
649	E	37.6	Very low	37.2	Very low	187 Å²	187	143.8 Å²	143.8	87%	0.874	73%	0.731	S	S	*	*			cis	-129.8	163.1	4.9	-85.9	173	80.9	0	0	108.3
650	D	37.1	Very low	36	Very low	135 Å²	135	146.8 Å²	146.8	72%	0.722	74%	0.741	S	S	*	*			cis	-167.5	167	-22.6	-149.5	20.4	0	0	0	105
651	V	35.5	Very low	35.5	Very low	80 Å²	80	147.3 Å²	147.3	49%	0.485	75%	0.746	S	S	.	*			cis	-164.9	162	7.8	75.9	0	0	0	0	111.7
652	R	30.7	Very low	35.3	Very low	196 Å²	196	142.1 Å²	142.1	74%	0.74	75%	0.746	S	S	*	*			trans	58.1	107.9	158.2	-84.4	166.7	-80.2	-109.2	-3.8	121.5
653	E	35.3	Very low	35	Very low	172 Å²	172	137.7 Å²	137.7	80%	0.804	75%	0.749	S	S	*	*				-79.5	167	127.3	-66.7	-173.7	140.4	0	0	111.3
654	N	29.1	Very low	34.4	Very low	143 Å²	143	136.2 Å²	136.2	77%	0.765	75%	0.752	S	S	*	*			trans	-152.6	114.3	146.8	-84.8	-35.8	0	0	0	104.8
655	V	31.4	Very low	35	Very low	111 Å²	111	138.2 Å²	138.2	67%	0.673	76%	0.758	S	S	*	*				65.8	108.8	55.8	-175	0	0	0	0	113.4
656	V	30.1	Very low	35.7	Very low	140 Å²	140	139 Å²	139	85%	0.848	76%	0.758	S	S	*	*				-169.8	154.1	126.9	145.4	0	0	0	0	107.9
657	T	30.9	Very low	36.1	Very low	102 Å²	102	138.3 Å²	138.3	63%	0.626	76%	0.756	S	S	*	*			trans	-145.6	157.1	-165	53.5	0	0	0	0	112.6
658	Y	33.2	Very low	36.2	Very low	202 Å²	202	139.3 Å²	139.3	79%	0.792	76%	0.758	S	S	*	*			trans	69.9	154.7	162.9	-63.3	-59.3	0	0	0	116.5
659	D	33.6	Very low	36.2	Very low	124 Å²	124	140.1 Å²	140.1	66%	0.663	76%	0.762	S	S	*	*			cis	-154.6	168.8	2.4	-120.8	-26.8	0	0	0	111.9
660	D	31.7	Very low	36	Very low	147 Å²	147	134.8 Å²	134.8	79%	0.786	75%	0.75	S	S	*	*			trans	52.9	148.1	158	-71.8	-37.7	0	0	0	121.1
661	E	42.2	Very low	35.8	Very low	193 Å²	193	138.4 Å²	138.4	90%	0.902	76%	0.76	S	S	*	*			cis	-139.8	153.2	19.9	-64.6	179.2	135.9	0	0	113.6
662	G	34	Very low	35.7	Very low	80 Å²	80	141.4 Å²	141.4	83%	0.825	77%	0.773	S	S	*	*				97.8	71.9	125.7	0	0	0	0	0	124.2
663	G	37.3	Very low	36.2	Very low	88 Å²	88	139 Å²	139	91%	0.907	77%	0.773	S	S	*	*				81.4	139	119.1	0	0	0	0	0	124.2
664	G	37.3	Very low	36	Very low	71 Å²	71	137.5 Å²	137.5	73%	0.732	78%	0.776	S	S	*	*			trans	118.2	107.5	145	0	0	0	0	0	119.6
665	E	45.8	Very low	36.1	Very low	185 Å²	185	135.4 Å²	135.4	86%	0.864	78%	0.779	S	S	*	*				48.1	142.4	128.9	-72.2	162.8	-160.7	0	0	122
666	E	46.8	Very low	36.4	Very low	162 Å²	162	138.6 Å²	138.6	76%	0.757	79%	0.791	S	S	*	*			cis	-165.3	175.9	-14.7	-144.1	168.8	-164.2	0	0	110.1
667	D	41.3	Very low	36.5	Very low	127 Å²	127	143.1 Å²	143.1	68%	0.679	79%	0.793	S	S	*	*			trans	62.2	122.4	166.4	-71.4	-28.3	0	0	0	121.3
668	T	37.3	Very low	36.6	Very low	116 Å²	116	145.2 Å²	145.2	71%	0.712	80%	0.8	S	S	*	*				74.9	144.7	51.8	79	0	0	0	0	114.2
669	E	41.4	Very low	37.6	Very low	182 Å²	182	140.7 Å²	140.7	85%	0.85	80%	0.796	S	S	*	*			cis	-157.2	173.4	-12.7	-126.4	-170.7	-151.6	0	0	107.7
670	A	34.3	Very low	37.5	Very low	75 Å²	75	140.5 Å²	140.5	62%	0.62	80%	0.804	S	S	*	*			cis	-158.3	-170.4	0.7	0	0	0	0	0	110
671	F	33.4	Very low	37.4	Very low	210 Å²	210	138.1 Å²	138.1	92%	0.921	81%	0.805	S	S	*	*			trans	-132	153.2	160.3	-92.9	-97.8	0	0	0	109.5
672	D	33.1	Very low	36.9	Very low	143 Å²	143	133.1 Å²	133.1	77%	0.765	80%	0.796	S	S	*	*			trans	-138.9	159.3	166.4	-166.1	19.1	0	0	0	112.3
673	I	40.3	Very low	36.8	Very low	146 Å²	146	138 Å²	138	75%	0.749	80%	0.798	S	S	*	*			trans	-136.9	103.6	-157.5	40.5	159.9	0	0	0	112.3
674	T	31	Very low	36.6	Very low	140 Å²	140	140.9 Å²	140.9	86%	0.859	79%	0.788	S	S	*	*			trans	-160.9	100.8	164	8.9	0	0	0	0	113.8
675	A	32.4	Very low	36.4	Very low	100 Å²	100	143 Å²	143	83%	0.826	78%	0.782	S	S	*	*			trans	-163	84	162.9	0	0	0	0	0	113
676	L	36.5	Very low	35.7	Very low	178 Å²	178	141.8 Å²	141.8	93%	0.932	77%	0.774	S	S	*	*			trans	-140.3	151.8	162	-89.2	179.6	0	0	0	111.4
677	R	32.9	Very low	35	Very low	234 Å²	234	143.4 Å²	143.4	88%	0.883	77%	0.774	S	S	*	*			trans	74.2	96.9	172.4	-86.9	-173.7	163.3	-178.7	-4	119.7
678	N	33.1	Very low	34.5	Very low	146 Å²	146	147.2 Å²	147.2	78%	0.781	78%	0.779	S	S	*	*				105.1	128.7	105.8	-143	57.2	0	0	0	117.6
679	P	54.7	Low	34.3	Very low	108 Å²	108	151.7 Å²	151.7	70%	0.701	78%	0.783	S	S	*	*			trans	-99.1	157.3	-177.7	38.5	-35.1	0	0	0	113.9
680	S	31	Very low	33.8	Very low	119 Å²	119	148.9 Å²	148.9	83%	0.832	77%	0.774	S	S	*	*			trans	-179.1	157.3	146.1	36.5	0	0	0	0	113.6
681	A	30.1	Very low	33.8	Very low	97 Å²	97	153.7 Å²	153.7	80%	0.802	79%	0.787	S	S	*	*			trans	75.3	144.1	158.8	0	0	0	0	0	121.5
682	A	30.7	Very low	33.7	Very low	88 Å²	88	154.2 Å²	154.2	73%	0.727	78%	0.783	S	S	*	*			trans	56.3	121	165.1	0	0	0	0	0	118.5
683	E	32.7	Very low	34	Very low	184 Å²	184	152.5 Å²	152.5	86%	0.86	78%	0.78	S	S	*	*			cis	96.7	142	33.1	-71.3	-168.7	115.6	0	0	116.3
684	E	32.5	Very low	33.5	Very low	147 Å²	147	153.4 Å²	153.4	69%	0.687	78%	0.781	S	S	*	*			trans	78.5	122.7	149.6	-79.6	-113.8	101.9	0	0	122.5
685	L	32.4	Very low	33.5	Very low	116 Å²	116	153 Å²	153	61%	0.607	78%	0.778	S	S	*	*			trans	70.8	155	144.9	-55.4	168.8	0	0	0	119.7
686	K	31.7	Very low	33.3	Very low	160 Å²	160	157.7 Å²	157.7	70%	0.696	78%	0.78	S	S	*	*			cis	-173	164.3	-43.6	-114.6	-178.2	-156.8	138.3	0	107.5
687	Y	32.5	Very low	33	Very low	195 Å²	195	157.2 Å²	157.2	77%	0.765	78%	0.777	S	S	*	*			trans	69.7	88	163.6	-73.4	-68.8	0	0	0	122
688	R	30.3	Very low	33	Very low	207 Å²	207	152.3 Å²	152.3	78%	0.781	77%	0.773	S	S	*	*				48.1	110.7	106	-166.8	-165	-155.4	174.1	10	119.7
689	R	33.3	Very low	33.2	Very low	211 Å²	211	151.2 Å²	151.2	80%	0.796	77%	0.774	S	S	*	*				-177.2	132.2	112.6	-99.9	-169	172.4	133.4	-1.6	115
690	D	30.7	Very low	32	Very low	123 Å²	123	156.3 Å²	156.3	66%	0.658	78%	0.779	S	S	*	*			trans	35.2	111.1	136	-37.1	-28.4	0	0	0	121.2
691	I	34.1	Very low	32.3	Very low	176 Å²	176	157.5 Å²	157.5	90%	0.903	77%	0.771	S	S	*	*				176	155.6	116.5	-88.8	159.6	0	0	0	111.6
692	R	32.4	Very low	32.2	Very low	221 Å²	221	162.3 Å²	162.3	83%	0.834	78%	0.777	S	S	*	*			trans	-82.3	165.3	-176.7	-89	-174.8	-173	-170.5	3.6	112.8
693	P	37.8	Very low	32.3	Very low	107 Å²	107	163.6 Å²	163.6	70%	0.695	78%	0.776	S	S	*	*			cis	-142.8	-158.3	39.8	44.5	-24	0	0	0	117.6
694	E	31	Very low	32.1	Very low	164 Å²	164	162.2 Å²	162.2	77%	0.766	77%	0.774	S	S	*	*			trans	-36	153.1	178.9	-70.4	98.7	-155.5	0	0	116.3
695	V	30.2	Very low	32.1	Very low	133 Å²	133	159.6 Å²	159.6	81%	0.806	77%	0.772	S	S	*	*			cis	-137.6	146.6	41.3	173.3	0	0	0	0	113
696	K	28.7	Very low	32.1	Very low	198 Å²	198	160.9 Å²	160.9	86%	0.861	79%	0.785	S	S	*	*			trans	-84.9	108.8	169	-85.4	-172.1	172.5	-176	0	111.8
697	L	31.1	Very low	32.7	Very low	167 Å²	167	161.4 Å²	161.4	87%	0.874	79%	0.794	S	S	*	*			trans	-82.3	139.7	147.8	-87	159.1	0	0	0	109
698	T	32.5	Very low	33	Very low	131 Å²	131	161 Å²	161	80%	0.804	80%	0.8	S	S	*	*			trans	-93.5	139.5	177.8	42.5	0	0	0	0	111.5
699	P	36.8	Very low	33.7	Very low	123 Å²	123	156.7 Å²	156.7	80%	0.799	80%	0.801	S	S	*	*			trans	-133.8	140.3	144.1	35.1	-23.3	0	0	0	114.2
700	R	30.1	Very low	34.6	Very low	215 Å²	215	153.5 Å²	153.5	81%	0.811	80%	0.798	S	S	*	*			trans	16.9	131.9	154.8	-83.1	-178.4	132.4	144.9	-0.9	122.6
701	H	36.9	Very low	36.3	Very low	144 Å²	144	151.8 Å²	151.8	67%	0.667	79%	0.789	S	S	*	*			trans	60.6	121.3	139.2	-59.4	-54.5	0	0	0	120.9
702	Q	27.5	Very low	37.6	Very low	198 Å²	198	148 Å²	148	93%	0.925	77%	0.774	S	S	*	*				-148.5	171.6	106.9	-111.5	174.1	6.3	0	0	111.2
703	T	32.1	Very low	39	Very low	115 Å²	115	143.6 Å²	143.6	71%	0.706	76%	0.763	S	S	*	*			trans	-117.7	143.7	-160.8	50.4	0	0	0	0	113.1
704	L	30.2	Very low	40.7	Very low	155 Å²	155	145 Å²	145	81%	0.812	76%	0.76	S	S	*	*				-168.1	148.1	117	-131.8	72.4	0	0	0	113.9
705	S	32.5	Very low	42.7	Very low	93 Å²	93	142.2 Å²	142.2	65%	0.65	75%	0.745	S	S	*	*			trans	27.3	114.1	150.1	61.2	0	0	0	0	121.3
706	T	31.8	Very low	44.4	Very low	143 Å²	143	140.7 Å²	140.7	88%	0.877	73%	0.732	S	S	*	*				-155.2	156.8	99.2	25.4	0	0	0	0	110
707	L	44.2	Very low	46.5	Very low	170 Å²	170	137.6 Å²	137.6	89%	0.89	72%	0.718	S	S	*	*			trans	-80.1	135.7	164.6	-84.3	75.2	0	0	0	108.9
708	E	39.3	Very low	48.7	Very low	188 Å²	188	135 Å²	135	88%	0.879	70%	0.702	S	S	*	*			trans	-149.7	147.3	148.1	-126.1	161	-154.6	0	0	108.9
709	S	44.3	Very low	50.5	Low	115 Å²	115	135.3 Å²	135.3	80%	0.804	69%	0.688	S	S	*	*			trans	-80.5	120.1	-171.4	50	0	0	0	0	111.3	D711	S709-D711 PolarHBondContact O-N 2.97Å
710	I	52.3	Low	52.3	Low	145 Å²	145	134.5 Å²	134.5	74%	0.744	68%	0.677	S	S	*	*			trans	-68.4	113.1	169.7	-60.5	174.3	0	0	0	108.2	V712	I710-V712 PolarHBondContact O-N 2.65Å
711	D	66.8	Low	54.3	Low	86 Å²	86	126.6 Å²	126.6	46%	0.46	66%	0.657	S	S	.	*			trans	-69	110.9	168.2	-179.2	9.9	0	0	0	109.2	S709 Q713 E714 F715	S709-D711 PolarHBondContact O-N 2.97Å; D711-Q713 PolarHBondContact O-N 2.67Å; D711-Q713 VanDerWaalsContact OD1-CB 3.25Å; D711-Q713 WeakPolarHBondContact OD1-CB 3.25Å; D711-Q713 PolarHBondContact OD1-N 3.14Å; D711-E714 HydrophobicContact CB-CB 4.09Å; D711-E714 PolarHBondContact O-N 3.02Å; D711-E714 VanDerWaalsContact O-N 3.1Å; D711-F715 PolarHBondContact O-N 2.82Å
712	V	60.2	Low	56.1	Low	96 Å²	96	123.8 Å²	123.8	58%	0.582	64%	0.644	S	S	*	*	H	α-helix	trans	-58.5	-30	176.3	-178.2	0	0	0	0	110.8	I710 F715 I716	I710-V712 PolarHBondContact O-N 2.65Å; V712-F715 PolarHBondContact O-N 2.96Å; V712-I716 HydrophobicContact CG1-CD1 3.91Å; V712-I716 HydrophobicContact CG1-CG1 4.43Å; V712-I716 WeakPolarHBondContact O-CB 3.43Å; V712-I716 VanDerWaalsContact O-CG1 3.24Å; V712-I716 WeakPolarHBondContact O-CG1 3.46Å; V712-I716 PolarHBondContact O-N 2.89Å
713	Q	62.9	Low	57.8	Low	129 Å²	129	117.3 Å²	117.3	60%	0.603	63%	0.625	S	S	*	*	H	α-helix	trans	-76.8	-24.7	179.9	-155.6	166.1	10	0	0	112.7	D711 K717	D711-Q713 PolarHBondContact O-N 2.67Å; D711-Q713 VanDerWaalsContact OD1-CB 3.25Å; D711-Q713 WeakPolarHBondContact OD1-CB 3.25Å; D711-Q713 PolarHBondContact OD1-N 3.14Å; Q713-K717 WeakPolarHBondContact O-CD 3.45Å; Q713-K717 VanDerWaalsContact O-CG 3.24Å; Q713-K717 WeakPolarHBondContact O-CG 3.19Å; Q713-K717 PolarHBondContact O-N 3.32Å
714	E	73.7	Confident	59.3	Low	136 Å²	136	118 Å²	118	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-78.2	-42	168.6	-169.9	163.8	-129.2	0	0	111.2	D711 I716 K717 Q718	D711-E714 HydrophobicContact CB-CB 4.09Å; D711-E714 PolarHBondContact O-N 3.02Å; D711-E714 VanDerWaalsContact O-N 3.1Å; E714-I716 VanDerWaalsContact C-N 3.34Å; E714-I716 PolarHBondContact O-N 2.81Å; E714-K717 PolarHBondContact O-N 3.37Å; E714-Q718 PolarHBondContact O-N 3.36Å
715	F	72.5	Confident	61.2	Low	106 Å²	106	117.5 Å²	117.5	47%	0.465	62%	0.622	S	S	.	*	H	α-helix	trans	-58.1	-43.2	173	178.8	-97.6	0	0	0	112.5	D711 V712 Q718 R719	D711-F715 PolarHBondContact O-N 2.82Å; V712-F715 PolarHBondContact O-N 2.96Å; F715-Q718 PolarHBondContact O-N 3.26Å; F715-R719 HydrophobicContact CE1-CG 4.14Å; F715-R719 HydrophobicContact CZ-CG 4.15Å; F715-R719 WeakPolarHBondContact O-CG 3.43Å; F715-R719 PolarHBondContact O-N 3.41Å
716	I	66	Low	62.7	Low	102 Å²	102	116.8 Å²	116.8	52%	0.523	61%	0.61	S	S	.	*	H	α-helix	trans	-64	-43.1	175.8	-72.3	167.1	0	0	0	111.2	V712 E714 Q718 R719 L720	V712-I716 HydrophobicContact CG1-CD1 3.91Å; V712-I716 HydrophobicContact CG1-CG1 4.43Å; V712-I716 WeakPolarHBondContact O-CB 3.43Å; V712-I716 VanDerWaalsContact O-CG1 3.24Å; V712-I716 WeakPolarHBondContact O-CG1 3.46Å; V712-I716 PolarHBondContact O-N 2.89Å; E714-I716 VanDerWaalsContact C-N 3.34Å; E714-I716 PolarHBondContact O-N 2.81Å; I716-Q718 VanDerWaalsContact C-N 3.34Å; I716-Q718 PolarHBondContact O-N 2.88Å; I716-R719 PolarHBondContact O-N 2.87Å; I716-L720 WeakPolarHBondContact O-CB 3.29Å; I716-L720 PolarHBondContact O-N 2.91Å
717	K	73.5	Confident	64.2	Low	132 Å²	132	116.3 Å²	116.3	57%	0.574	61%	0.61	S	S	*	*	H	α-helix	trans	-62	-40.4	175.5	-75	166.5	-173.3	165	0	112.1	Q713 E714 L720 A721	Q713-K717 WeakPolarHBondContact O-CD 3.45Å; Q713-K717 VanDerWaalsContact O-CG 3.24Å; Q713-K717 WeakPolarHBondContact O-CG 3.19Å; Q713-K717 PolarHBondContact O-N 3.32Å; E714-K717 PolarHBondContact O-N 3.37Å; K717-L720 PolarHBondContact O-N 2.85Å; K717-A721 WeakPolarHBondContact O-CB 3.19Å; K717-A721 PolarHBondContact O-N 2.65Å
718	Q	76.1	Confident	65.1	Low	112 Å²	112	112.8 Å²	112.8	52%	0.523	60%	0.599	S	S	.	*	H	α-helix	trans	-63.3	-44.7	176.4	-174.8	178.3	-14.3	0	0	111.3	E714 F715 I716 L720 A721 E722	E714-Q718 PolarHBondContact O-N 3.36Å; F715-Q718 PolarHBondContact O-N 3.26Å; I716-Q718 VanDerWaalsContact C-N 3.34Å; I716-Q718 PolarHBondContact O-N 2.88Å; Q718-L720 PolarHBondContact O-N 2.93Å; Q718-A721 PolarHBondContact O-N 2.72Å; Q718-E722 PolarHBondContact NE2-OE1 3.02Å; Q718-E722 WeakPolarHBondContact O-CG 3.46Å; Q718-E722 PolarHBondContact O-N 3.39Å
719	R	70.9	Confident	65.7	Low	139 Å²	139	108.1 Å²	108.1	53%	0.525	58%	0.583	S	S	.	*	H	α-helix	trans	-67.3	-32.8	176.7	-68.4	-52.5	-166	173.9	5.1	113.6	F715 I716 E722 A723	F715-R719 HydrophobicContact CE1-CG 4.14Å; F715-R719 HydrophobicContact CZ-CG 4.15Å; F715-R719 WeakPolarHBondContact O-CG 3.43Å; F715-R719 PolarHBondContact O-N 3.41Å; I716-R719 PolarHBondContact O-N 2.87Å; R719-E722 VanDerWaalsContact CD-OE2 3.23Å; R719-E722 WeakPolarHBondContact CD-OE2 3.4Å; R719-E722 IonicContact CZ-OE2 3.93Å; R719-E722 IonicContact NE-OE2 3.98Å; R719-E722 IonicContact NH1-OE2 3.38Å; R719-E722 PolarHBondContact NH1-OE2 2.85Å; R719-A723 PolarHBondContact O-N 2.82Å; R719-A723 VanDerWaalsContact O-N 3.11Å
720	L	73.9	Confident	65.7	Low	106 Å²	106	107.6 Å²	107.6	56%	0.555	58%	0.577	S	S	*	*	H	α-helix	trans	-65.6	-47	173	-170.6	65.8	0	0	0	110.9	I716 K717 Q718 E722 A723 D724	I716-L720 WeakPolarHBondContact O-CB 3.29Å; I716-L720 PolarHBondContact O-N 2.91Å; K717-L720 PolarHBondContact O-N 2.85Å; Q718-L720 PolarHBondContact O-N 2.93Å; L720-E722 VanDerWaalsContact C-N 3.31Å; L720-E722 PolarHBondContact O-N 2.98Å; L720-A723 WeakPolarHBondContact O-CB 3.4Å; L720-A723 PolarHBondContact O-N 3.19Å; L720-A723 VanDerWaalsContact O-N 3.07Å; L720-D724 PolarHBondContact O-N 3.02Å
721	A	73.5	Confident	65.2	Low	49 Å²	49	106.8 Å²	106.8	41%	0.405	58%	0.582	S	S	.	*	H	α-helix	trans	-65.3	-30.9	177	0	0	0	0	0	113.6	K717 Q718 L725	K717-A721 WeakPolarHBondContact O-CB 3.19Å; K717-A721 PolarHBondContact O-N 2.65Å; Q718-A721 PolarHBondContact O-N 2.72Å; A721-L725 WeakPolarHBondContact O-CD1 3.28Å; A721-L725 WeakPolarHBondContact O-CG 3.48Å
722	E	72.9	Confident	64	Low	85 Å²	85	113.6 Å²	113.6	40%	0.397	60%	0.602	S	S	.	*	H	α-helix	trans	-69.2	-33.3	171.2	-75.1	171.6	-174.5	0	0	112.2	Q718 R719 L720	Q718-E722 PolarHBondContact NE2-OE1 3.02Å; Q718-E722 WeakPolarHBondContact O-CG 3.46Å; Q718-E722 PolarHBondContact O-N 3.39Å; R719-E722 VanDerWaalsContact CD-OE2 3.23Å; R719-E722 WeakPolarHBondContact CD-OE2 3.4Å; R719-E722 IonicContact CZ-OE2 3.93Å; R719-E722 IonicContact NE-OE2 3.98Å; R719-E722 IonicContact NH1-OE2 3.38Å; R719-E722 PolarHBondContact NH1-OE2 2.85Å; L720-E722 VanDerWaalsContact C-N 3.31Å; L720-E722 PolarHBondContact O-N 2.98Å
723	A	64.4	Low	62.7	Low	62 Å²	62	116 Å²	116	51%	0.512	61%	0.612	S	S	.	*	H	α-helix	trans	-76.6	-40	176.3	0	0	0	0	0	112.9	R719 L720 L725 D726	R719-A723 PolarHBondContact O-N 2.82Å; R719-A723 VanDerWaalsContact O-N 3.11Å; L720-A723 WeakPolarHBondContact O-CB 3.4Å; L720-A723 PolarHBondContact O-N 3.19Å; L720-A723 VanDerWaalsContact O-N 3.07Å; A723-L725 PolarHBondContact O-N 2.64Å; A723-L725 VanDerWaalsContact O-N 3.11Å; A723-D726 WeakPolarHBondContact O-CB 3.29Å; A723-D726 PolarHBondContact O-N 2.8Å; A723-D726 VanDerWaalsContact O-N 3.1Å
724	D	62.8	Low	61.4	Low	129 Å²	129	114.7 Å²	114.7	69%	0.69	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-12.7	175	-70.8	-28.5	0	0	0	113.1	L720	L720-D724 PolarHBondContact O-N 3.02Å
725	L	70.1	Confident	59.6	Low	145 Å²	145	116.8 Å²	116.8	76%	0.759	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	2.5	177.1	-74.2	171.7	0	0	0	114	A721 A723 P727	A721-L725 WeakPolarHBondContact O-CD1 3.28Å; A721-L725 WeakPolarHBondContact O-CG 3.48Å; A723-L725 PolarHBondContact O-N 2.64Å; A723-L725 VanDerWaalsContact O-N 3.11Å; L725-P727 VanDerWaalsContact O-CD 3.3Å; L725-P727 WeakPolarHBondContact O-CD 3.3Å
726	D	65.2	Low	57.7	Low	78 Å²	78	120.3 Å²	120.3	42%	0.417	65%	0.649	S	S	.	*			trans	-79.2	113.4	178.6	-169.9	-23.5	0	0	0	111.7	A723 S728 V729	A723-D726 WeakPolarHBondContact O-CB 3.29Å; A723-D726 PolarHBondContact O-N 2.8Å; A723-D726 VanDerWaalsContact O-N 3.1Å; D726-S728 VanDerWaalsContact CG-OG 3.28Å; D726-S728 PolarHBondContact O-N 3.42Å; D726-S728 VanDerWaalsContact OD1-CB 3.23Å; D726-S728 WeakPolarHBondContact OD1-CB 3.17Å; D726-S728 PolarHBondContact OD1-N 3.11Å; D726-S728 PolarHBondContact OD1-OG 3.46Å; D726-S728 PolarHBondContact OD2-OG 3.5Å; D726-V729 HydrophobicContact CB-CG2 4.47Å
727	P	62.8	Low	56.1	Low	133 Å²	133	121.2 Å²	121.2	86%	0.864	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	3	-178.9	35.9	-37.6	0	0	0	113.9	L725	L725-P727 VanDerWaalsContact O-CD 3.3Å; L725-P727 WeakPolarHBondContact O-CD 3.3Å
728	S	63.2	Low	54	Low	95 Å²	95	125.8 Å²	125.8	66%	0.664	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-9.3	-177.1	73	0	0	0	0	114.7	D726	D726-S728 VanDerWaalsContact CG-OG 3.28Å; D726-S728 PolarHBondContact O-N 3.42Å; D726-S728 VanDerWaalsContact OD1-CB 3.23Å; D726-S728 WeakPolarHBondContact OD1-CB 3.17Å; D726-S728 PolarHBondContact OD1-N 3.11Å; D726-S728 PolarHBondContact OD1-OG 3.46Å; D726-S728 PolarHBondContact OD2-OG 3.5Å
729	V	52.5	Low	52.1	Low	90 Å²	90	125.2 Å²	125.2	55%	0.545	69%	0.689	S	S	.	*	S	Bend	trans	-96.1	133.1	-177.4	-171.6	0	0	0	0	110.8	D726	D726-V729 HydrophobicContact CB-CG2 4.47Å
730	P	44.1	Very low	50.3	Low	105 Å²	105	129.6 Å²	129.6	68%	0.682	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-69.2	144.5	174.8	28.9	-34.6	0	0	0	111.6
731	P	42.2	Very low	48.6	Very low	128 Å²	128	132.9 Å²	132.9	83%	0.831	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-68.5	140.3	-175.1	28.2	-35.3	0	0	0	112.3
732	Y	40.4	Very low	46.6	Very low	228 Å²	228	134.3 Å²	134.3	89%	0.894	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-70.6	150.1	178.3	-103.9	-92	0	0	0	113.2
733	D	34.1	Very low	44.9	Very low	148 Å²	148	139.1 Å²	139.1	79%	0.791	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-73	146.6	-175.8	-161.9	3.2	0	0	0	113	L735	D733-L735 PolarHBondContact O-N 3.2Å
734	S	35.2	Very low	43.3	Very low	101 Å²	101	147.7 Å²	147.7	71%	0.706	78%	0.781	S	S	*	*			trans	-102.6	80.1	-161.9	57.7	0	0	0	0	113.5	Q736	S734-Q736 VanDerWaalsContact C-N 3.27Å; S734-Q736 PolarHBondContact O-N 3.24Å
735	L	35.1	Very low	41.9	Very low	180 Å²	180	146.9 Å²	146.9	94%	0.942	79%	0.786	S	S	*	*			trans	-74	77	171.1	-76.6	176.1	0	0	0	112.1	D733	D733-L735 PolarHBondContact O-N 3.2Å
736	Q	33.8	Very low	40.3	Very low	179 Å²	179	148.9 Å²	148.9	84%	0.836	79%	0.791	S	S	*	*			trans	-128.5	75.2	171	-160.4	-178	49.4	0	0	112.2	S734	S734-Q736 VanDerWaalsContact C-N 3.27Å; S734-Q736 PolarHBondContact O-N 3.24Å
737	T	30.7	Very low	38.8	Very low	121 Å²	121	150.3 Å²	150.3	74%	0.742	81%	0.814	S	S	*	*			trans	-140.1	99.3	155.6	-42.3	0	0	0	0	110.8
738	Y	30.8	Very low	37.5	Very low	229 Å²	229	147 Å²	147	90%	0.898	80%	0.804	S	S	*	*				-174	109.1	126.2	-91.8	-57.3	0	0	0	109.1
739	A	35.2	Very low	36.2	Very low	99 Å²	99	148.3 Å²	148.3	82%	0.818	81%	0.813	S	S	*	*			trans	-142.2	114.6	169.9	0	0	0	0	0	109.1
740	Y	32.8	Very low	35.2	Very low	232 Å²	232	151.5 Å²	151.5	91%	0.91	83%	0.826	S	S	*	*			trans	-156.2	139.1	148.3	-152.3	-100.7	0	0	0	111.2
741	E	38	Very low	34.6	Very low	175 Å²	175	151.9 Å²	151.9	82%	0.818	83%	0.831	S	S	*	*			trans	-93.4	140.1	-175.2	-61.1	176.6	126.1	0	0	111.8
742	G	33	Very low	34.1	Very low	79 Å²	79	150.6 Å²	150.6	81%	0.814	83%	0.825	S	S	*	*			trans	-101.6	116.5	169.7	0	0	0	0	0	110.8	R744	G742-R744 PolarHBondContact O-N 2.98Å
743	Q	37.1	Very low	33.6	Very low	185 Å²	185	147 Å²	147	86%	0.864	82%	0.82	S	S	*	*			trans	-72.9	114.6	-174.1	-65.3	176	-21	0	0	113.4
744	R	31.1	Very low	33.5	Very low	242 Å²	242	147 Å²	147	91%	0.913	82%	0.821	S	S	*	*				178.4	152.9	125.5	-96.2	159.9	-167.4	-145.9	1.7	112.7	G742	G742-R744 PolarHBondContact O-N 2.98Å
745	S	33	Very low	33.3	Very low	113 Å²	113	147.8 Å²	147.8	79%	0.79	83%	0.826	S	S	*	*			trans	-62.9	167.9	171.4	-45.2	0	0	0	0	111.5
746	E	35.8	Very low	33.6	Very low	186 Å²	186	144 Å²	144	87%	0.869	82%	0.82	S	S	*	*			cis	-143.2	170.6	30.7	-64.1	178.1	144.7	0	0	114
747	A	34.7	Very low	33.7	Very low	109 Å²	109	141.3 Å²	141.3	90%	0.901	82%	0.816	S	S	*	*			trans	64.4	145.8	-175.1	0	0	0	0	0	115.5
748	G	35.7	Very low	34.1	Very low	64 Å²	64	141 Å²	141	66%	0.66	82%	0.815	S	S	*	*			cis	157.7	69.4	-2.2	0	0	0	0	0	111.2	I750	G748-I750 PolarHBondContact O-N 3.1Å
749	S	34.3	Very low	34.8	Very low	122 Å²	122	139.9 Å²	139.9	85%	0.853	82%	0.817	S	S	*	*			trans	-69.2	123.9	-178.7	-173.2	0	0	0	0	111.5
750	I	33	Very low	35.4	Very low	157 Å²	157	139.7 Å²	139.7	81%	0.805	81%	0.81	S	S	*	*			trans	-143.3	98.7	167.9	5.6	173.4	0	0	0	109.4	G748	G748-I750 PolarHBondContact O-N 3.1Å
751	S	29.7	Very low	35.9	Very low	113 Å²	113	135.9 Å²	135.9	79%	0.79	81%	0.805	S	S	*	*			trans	-85.6	122.1	156.9	-60.6	0	0	0	0	108.3
752	S	32.3	Very low	36.7	Very low	101 Å²	101	134.8 Å²	134.8	71%	0.706	80%	0.801	S	S	*	*			trans	-160	125.5	164.2	-71	0	0	0	0	112.5
753	L	29.8	Very low	37.7	Very low	151 Å²	151	136.6 Å²	136.6	79%	0.791	79%	0.792	S	S	*	*			trans	66.8	114.1	144.2	-65.3	164	0	0	0	120.7
754	D	33.2	Very low	39	Very low	150 Å²	150	131.2 Å²	131.2	80%	0.802	76%	0.764	S	S	*	*				28.7	117.2	118.9	-56.7	-31.9	0	0	0	119.6
755	S	31.4	Very low	40.3	Very low	116 Å²	116	127.1 Å²	127.1	81%	0.811	76%	0.755	S	S	*	*			trans	-150.7	141.1	132.2	70.7	0	0	0	0	110.4
756	A	41.3	Very low	42	Very low	100 Å²	100	127.8 Å²	127.8	83%	0.826	74%	0.741	S	S	*	*			trans	-118.6	117.8	166.9	0	0	0	0	0	108.1
757	T	34.4	Very low	43.3	Very low	123 Å²	123	120.4 Å²	120.4	76%	0.755	71%	0.707	S	S	*	*			trans	-155	135.7	169.7	-0.1	0	0	0	0	113
758	T	38.8	Very low	44.6	Very low	116 Å²	116	117.2 Å²	117.2	71%	0.712	68%	0.684	S	S	*	*			trans	-13.5	154.6	156.9	47.8	0	0	0	0	121.1	S760	T758-S760 PolarHBondContact O-N 3.09Å
759	Q	45.7	Very low	46.2	Very low	204 Å²	204	121.3 Å²	121.3	95%	0.953	69%	0.691	S	S	*	*	S	Bend	trans	-58.4	104.8	165.4	-59.2	159.1	-87.6	0	0	112.7
760	S	47.7	Very low	47.7	Very low	96 Å²	96	123.8 Å²	123.8	67%	0.671	68%	0.682	S	S	*	*			trans	-165.9	22	157.6	62.1	0	0	0	0	116.1	T758	T758-S760 PolarHBondContact O-N 3.09Å
761	D	44.8	Very low	49.3	Very low	151 Å²	151	117.5 Å²	117.5	81%	0.807	66%	0.656	S	S	*	*			trans	-133.9	88.3	-177.9	-80.1	-62.7	0	0	0	112.5
762	Q	53.6	Low	51.2	Low	153 Å²	153	118 Å²	118	72%	0.715	66%	0.657	S	S	*	*			trans	-138	51.2	165.9	-73.8	-163.8	-10.5	0	0	111	Y764	Q762-Y764 HydrophobicContact CB-CE2 3.93Å; Q762-Y764 VanDerWaalsContact O-CD2 3.29Å; Q762-Y764 WeakPolarHBondContact O-CD2 3.25Å; Q762-Y764 PolarHBondContact O-N 3.01Å
763	D	54.6	Low	52.8	Low	117 Å²	117	121.3 Å²	121.3	63%	0.626	66%	0.661	S	S	*	*			trans	-82.3	101.4	175.7	-167.5	-10.4	0	0	0	111.3	H765	D763-H765 VanDerWaalsContact C-N 3.25Å; D763-H765 PolarHBondContact O-N 3.33Å; D763-H765 WeakPolarHBondContact OD1-CB 3.38Å; D763-H765 IonicContact OD1-CD2 3.69Å; D763-H765 PolarHBondContact OD1-CD2 2.86Å; D763-H765 IonicContact OD1-CG 2.71Å; D763-H765 PolarHBondContact OD1-N 2.88Å; D763-H765 VanDerWaalsContact OD1-N 3.12Å
764	Y	63.9	Low	54.4	Low	72 Å²	72	118.1 Å²	118.1	28%	0.282	64%	0.641	S	S	.	*	G	3₁₀ helix	trans	-80.1	4.6	-177.8	-68.4	-71.3	0	0	0	114.5	Q762 Y766 L767	Q762-Y764 HydrophobicContact CB-CE2 3.93Å; Q762-Y764 VanDerWaalsContact O-CD2 3.29Å; Q762-Y764 WeakPolarHBondContact O-CD2 3.25Å; Q762-Y764 PolarHBondContact O-N 3.01Å; Y764-Y766 PolarHBondContact O-N 3.31Å; Y764-L767 HydrophobicContact CD1-CD1 4.14Å; Y764-L767 PolarHBondContact O-N 2.68Å; Y764-L767 VanDerWaalsContact O-N 3.13Å
765	H	59.5	Low	56	Low	156 Å²	156	116.8 Å²	116.8	72%	0.722	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-55	-30.3	-175.9	-106.9	-72.9	0	0	0	114.9	D763 L767 G768	D763-H765 VanDerWaalsContact C-N 3.25Å; D763-H765 PolarHBondContact O-N 3.33Å; D763-H765 WeakPolarHBondContact OD1-CB 3.38Å; D763-H765 IonicContact OD1-CD2 3.69Å; D763-H765 PolarHBondContact OD1-CD2 2.86Å; D763-H765 IonicContact OD1-CG 2.71Å; D763-H765 PolarHBondContact OD1-N 2.88Å; D763-H765 VanDerWaalsContact OD1-N 3.12Å; H765-L767 PolarHBondContact O-N 3.03Å; H765-L767 VanDerWaalsContact O-N 3.15Å; H765-G768 PolarHBondContact O-N 2.69Å; H765-G768 VanDerWaalsContact O-N 3.14Å
766	Y	67	Low	57.7	Low	127 Å²	127	118.8 Å²	118.8	50%	0.498	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-62	-21.2	-178.9	75.5	-89.9	0	0	0	113.9	Y764 G768 D769	Y764-Y766 PolarHBondContact O-N 3.31Å; Y766-G768 PolarHBondContact O-N 2.78Å; Y766-D769 PolarHBondContact O-N 3.46Å
767	L	63.3	Low	58.8	Low	31 Å²	31	117.8 Å²	117.8	16%	0.162	60%	0.602	C	S	.	*	G	3₁₀ helix	trans	-68.4	-17.3	177.6	-66.9	174.9	0	0	0	113	Y764 H765 D769 A778	Y764-L767 HydrophobicContact CD1-CD1 4.14Å; Y764-L767 PolarHBondContact O-N 2.68Å; Y764-L767 VanDerWaalsContact O-N 3.13Å; H765-L767 PolarHBondContact O-N 3.03Å; H765-L767 VanDerWaalsContact O-N 3.15Å; L767-D769 VanDerWaalsContact C-N 3.33Å; L767-A778 HydrophobicContact CB-CB 4.09Å
768	G	62.1	Low	60.4	Low	41 Å²	41	113 Å²	113	42%	0.423	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-67.1	-30.8	174.7	0	0	0	0	0	113.9	H765 Y766 W770	H765-G768 PolarHBondContact O-N 2.69Å; H765-G768 VanDerWaalsContact O-N 3.14Å; Y766-G768 PolarHBondContact O-N 2.78Å; G768-W770 VanDerWaalsContact C-N 3.28Å; G768-W770 PolarHBondContact O-N 2.89Å
769	D	69.7	Low	61.7	Low	151 Å²	151	112.1 Å²	112.1	81%	0.807	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-77.6	-13.1	-177.1	-68.7	-30.8	0	0	0	113.2	Y766 L767 G771	Y766-D769 PolarHBondContact O-N 3.46Å; L767-D769 VanDerWaalsContact C-N 3.33Å; D769-G771 VanDerWaalsContact C-N 3.26Å; D769-G771 PolarHBondContact O-N 2.95Å
770	W	65.6	Low	62.6	Low	173 Å²	173	107.6 Å²	107.6	66%	0.655	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-82.2	-2	-175.5	-72.2	52	0	0	0	113.4	G768 F774	G768-W770 VanDerWaalsContact C-N 3.28Å; G768-W770 PolarHBondContact O-N 2.89Å; W770-F774 HydrophobicContact CB-CB 4.33Å; W770-F774 HydrophobicContact CB-CD2 3.9Å; W770-F774 HydrophobicContact CB-CG 4.18Å; W770-F774 WeakPolarHBondContact O-CD2 3.37Å
771	G	67.2	Low	63.2	Low	26 Å²	26	109.2 Å²	109.2	27%	0.268	54%	0.538	S	S	.	.			trans	113.8	168.2	174	0	0	0	0	0	114.1	D769 E773 F774	D769-G771 VanDerWaalsContact C-N 3.26Å; D769-G771 PolarHBondContact O-N 2.95Å; G771-E773 PolarHBondContact O-N 3.13Å; G771-E773 VanDerWaalsContact O-N 3.09Å; G771-F774 PolarHBondContact O-N 3.04Å; G771-F774 VanDerWaalsContact O-N 3.12Å
772	P	70.4	Confident	64	Low	124 Å²	124	104.6 Å²	104.6	81%	0.805	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-21.8	-166.8	25.4	-35.3	0	0	0	114.5
773	E	64.5	Low	63.8	Low	169 Å²	169	104.1 Å²	104.1	79%	0.79	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-29.3	179.2	-62	-178	-172.8	0	0	112.4	G771	G771-E773 PolarHBondContact O-N 3.13Å; G771-E773 VanDerWaalsContact O-N 3.09Å
774	F	64.4	Low	63.5	Low	84 Å²	84	104.6 Å²	104.6	37%	0.368	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-14.6	-179.1	-62.6	-79.1	0	0	0	113.6	W770 G771 K776 L777 A778	W770-F774 HydrophobicContact CB-CB 4.33Å; W770-F774 HydrophobicContact CB-CD2 3.9Å; W770-F774 HydrophobicContact CB-CG 4.18Å; W770-F774 WeakPolarHBondContact O-CD2 3.37Å; G771-F774 PolarHBondContact O-N 3.04Å; G771-F774 VanDerWaalsContact O-N 3.12Å; F774-K776 PolarHBondContact O-N 2.89Å; F774-K776 VanDerWaalsContact O-N 3.15Å; F774-L777 HydrophobicContact CD1-CD1 4.11Å; F774-L777 WeakPolarHBondContact O-CB 3.19Å; F774-L777 PolarHBondContact O-N 3.39Å; F774-A778 PolarHBondContact O-N 3.21Å
775	K	66.9	Low	62.7	Low	123 Å²	123	110 Å²	110	54%	0.535	55%	0.552	S	S	.	*	H	α-helix	trans	-55.3	-37	-179.6	-168.4	-178.6	179.5	-160.4	0	112.8	L777 A778 E779	K775-L777 VanDerWaalsContact C-N 3.26Å; K775-L777 PolarHBondContact O-N 2.9Å; K775-A778 PolarHBondContact O-N 2.82Å; K775-E779 WeakPolarHBondContact CE-OE1 3.27Å; K775-E779 IonicContact NZ-OE1 3.12Å; K775-E779 PolarHBondContact O-N 3.35Å; K775-E779 VanDerWaalsContact O-N 3.12Å
776	K	67.1	Low	62.1	Low	157 Å²	157	106.6 Å²	106.6	68%	0.683	55%	0.547	S	S	*	.	H	α-helix	trans	-70.4	-18.7	179.4	-158.9	176	-177	-176.5	0	113.7	F774 L780	F774-K776 PolarHBondContact O-N 2.89Å; F774-K776 VanDerWaalsContact O-N 3.15Å; K776-L780 WeakPolarHBondContact O-CB 3.36Å; K776-L780 PolarHBondContact O-N 3.36Å
777	L	62.8	Low	61.1	Low	79 Å²	79	109.4 Å²	109.4	41%	0.414	56%	0.564	S	S	.	*	H	α-helix	trans	-80.2	-40	171.1	-78.7	158.1	0	0	0	111.2	F774 K775 E779 L780 Y781	F774-L777 HydrophobicContact CD1-CD1 4.11Å; F774-L777 WeakPolarHBondContact O-CB 3.19Å; F774-L777 PolarHBondContact O-N 3.39Å; K775-L777 VanDerWaalsContact C-N 3.26Å; K775-L777 PolarHBondContact O-N 2.9Å; L777-E779 VanDerWaalsContact C-N 3.3Å; L777-E779 PolarHBondContact O-N 2.91Å; L777-L780 PolarHBondContact O-N 2.73Å; L777-Y781 HydrophobicContact CD2-CE2 4.18Å; L777-Y781 WeakPolarHBondContact O-CD2 3.38Å; L777-Y781 PolarHBondContact O-N 2.73Å
778	A	68.3	Low	60.5	Low	24 Å²	24	118.9 Å²	118.9	20%	0.198	60%	0.598	C	S	.	*	H	α-helix	trans	-60	-41.9	174.1	0	0	0	0	0	111.6	L767 F774 K775 G782	L767-A778 HydrophobicContact CB-CB 4.09Å; F774-A778 PolarHBondContact O-N 3.21Å; K775-A778 PolarHBondContact O-N 2.82Å; A778-G782 PolarHBondContact O-N 3.09Å
779	E	67.5	Low	59.6	Low	96 Å²	96	123.1 Å²	123.1	45%	0.449	62%	0.616	S	S	.	*	H	α-helix	trans	-62.4	-45.9	174.2	-70.4	164.2	179.2	0	0	111.3	K775 L777 Y781 G782 E783	K775-E779 WeakPolarHBondContact CE-OE1 3.27Å; K775-E779 IonicContact NZ-OE1 3.12Å; K775-E779 PolarHBondContact O-N 3.35Å; K775-E779 VanDerWaalsContact O-N 3.12Å; L777-E779 VanDerWaalsContact C-N 3.3Å; L777-E779 PolarHBondContact O-N 2.91Å; E779-Y781 PolarHBondContact O-N 2.57Å; E779-G782 PolarHBondContact O-N 2.87Å; E779-E783 PolarHBondContact O-N 3.06Å
780	L	64.3	Low	58.3	Low	110 Å²	110	126.3 Å²	126.3	58%	0.576	64%	0.641	S	S	*	*	H	α-helix	trans	-65.5	-31.7	-175.5	-146.1	88	0	0	0	114.8	K776 L777	K776-L780 WeakPolarHBondContact O-CB 3.36Å; K776-L780 PolarHBondContact O-N 3.36Å; L777-L780 PolarHBondContact O-N 2.73Å
781	Y	60.8	Low	57.9	Low	130 Å²	130	124 Å²	124	51%	0.51	64%	0.64	S	S	.	*	H	α-helix	trans	-92.4	-16.3	178.4	-75.7	-79.9	0	0	0	113.2	L777 E779	L777-Y781 HydrophobicContact CD2-CE2 4.18Å; L777-Y781 WeakPolarHBondContact O-CD2 3.38Å; L777-Y781 PolarHBondContact O-N 2.73Å; E779-Y781 PolarHBondContact O-N 2.57Å
782	G	60.3	Low	57.4	Low	54 Å²	54	129.2 Å²	129.2	56%	0.557	66%	0.66	S	S	*	*	H	α-helix	trans	-81.4	-28.8	179.3	0	0	0	0	0	115.3	A778 E779 I784	A778-G782 PolarHBondContact O-N 3.09Å; E779-G782 PolarHBondContact O-N 2.87Å; G782-I784 PolarHBondContact O-N 2.62Å
783	E	49.9	Very low	56.7	Low	143 Å²	143	129.4 Å²	129.4	67%	0.668	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-78.1	-19.4	-173.7	-69.3	-173.6	140.1	0	0	114.2	E779 E785 S786	E779-E783 PolarHBondContact O-N 3.06Å; E783-E785 VanDerWaalsContact C-N 3.32Å; E783-E785 PolarHBondContact O-N 2.77Å; E783-S786 PolarHBondContact O-N 3.29Å; E783-S786 VanDerWaalsContact O-N 3.07Å; E783-S786 PolarHBondContact O-OG 3.16Å
784	I	48.9	Very low	56.3	Low	126 Å²	126	127.1 Å²	127.1	65%	0.646	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-65.4	-25.9	-165.3	-64.7	176.7	0	0	0	114.1	G782	G782-I784 PolarHBondContact O-N 2.62Å
785	E	46.6	Very low	55.8	Low	185 Å²	185	129.8 Å²	129.8	86%	0.864	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-85	-7.2	177	-66.7	-155.5	127	0	0	114.4	E783	E783-E785 VanDerWaalsContact C-N 3.32Å; E783-E785 PolarHBondContact O-N 2.77Å
786	S	46.5	Very low	55	Low	86 Å²	86	130.3 Å²	130.3	60%	0.601	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-23.8	-170.8	69.2	0	0	0	0	116	E783 R788	E783-S786 PolarHBondContact O-N 3.29Å; E783-S786 VanDerWaalsContact O-N 3.07Å; E783-S786 PolarHBondContact O-OG 3.16Å; S786-R788 VanDerWaalsContact C-N 3.32Å; S786-R788 PolarHBondContact O-N 2.76Å
787	E	46.8	Very low	54.1	Low	185 Å²	185	128.4 Å²	128.4	86%	0.864	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	25.9	-177.9	-69.1	-157.2	134	0	0	114.5
788	R	49.3	Very low	53.5	Low	231 Å²	231	132.2 Å²	132.2	87%	0.872	69%	0.688	S	S	*	*	S	Bend	trans	-128.2	36.7	177.3	-84.6	-169.5	169.8	-175.2	-0.8	114.9	S786	S786-R788 VanDerWaalsContact C-N 3.32Å; S786-R788 PolarHBondContact O-N 2.76Å
789	T	44.6	Very low	52.2	Low	130 Å²	130	141.2 Å²	141.2	80%	0.798	73%	0.729	S	S	*	*			trans	-152.5	55.7	171.5	-4	0	0	0	0	116.6
790	T	41.5	Very low	50.9	Low	218 Å²	218	145.3 Å²	145.3	100%	1.337	75%	0.754	S	S	*	*			trans	-143.5	0	155.2	56.5	0	0	0	0	111.4

Retrieved 790 of 790 residues in 120.4 ms (Link to these results)

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